USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=26 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 -155:sc= 1.11 USER MOD Set 1.2: B 200 THR OG1 : rot -2:sc= 0.733 USER MOD Set 2.1: A 7 THR OG1 : rot 125:sc= 1.12 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.892 USER MOD Single : A 0 HIS : no HE2:sc= -0.413 K(o=-0.41,f=-1.2) USER MOD Single : A 1 MET CE :methyl -170:sc= 0 (180deg=-0.088) USER MOD Single : A 2 GLN : amide:sc= -0.191 K(o=-0.19,f=-4.9!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 GLY N :NH3+ 144:sc= 0.111 (180deg=-0.203) USER MOD Single : A 11 LYS NZ :NH3+ -164:sc= -1.87 (180deg=-1.88!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -62:sc= 0.0259 USER MOD Single : A 20 SER OG : rot -35:sc= 0.396 USER MOD Single : A 22 THR OG1 : rot 31:sc= 0.636 USER MOD Single : A 25 ASN : amide:sc= -0.0855 K(o=-0.086,f=-2.5) USER MOD Single : A 27 LYS NZ :NH3+ -119:sc= 0.0865 (180deg=-0.41) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.754 X(o=-0.75,f=-0.48) USER MOD Single : A 33 LYS NZ :NH3+ -166:sc= 0.322 (180deg=0.25) USER MOD Single : A 40 GLN : amide:sc= -1.85 X(o=-1.9,f=-2.3!) USER MOD Single : A 41 GLN : amide:sc= -5.6! C(o=-5.6!,f=-8.3!) USER MOD Single : A 48 LYS NZ :NH3+ -162:sc= 0.251 (180deg=0.134) USER MOD Single : A 49 GLN : amide:sc= 1.01 K(o=1,f=-6!) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0499 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -83:sc= -0.263 USER MOD Single : A 60 ASN :FLIP amide:sc= -0.0798 F(o=-2.1!,f=-0.08) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -130:sc= 0.333 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.174 X(o=-0.17,f=-0.061) USER MOD Single : B 198 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : B 201 LYS NZ :NH3+ 165:sc= 1.21 (180deg=1.01) 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= -0.672 K(o=-0.67,f=-1.9) USER MOD Single : B 217 ASN : amide:sc= -0.486 K(o=-0.49,f=-5.4!) USER MOD Single : B 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 SER OG : rot 98:sc= 0.387 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 0.411 5.113 -3.871 1.00 0.00 N ATOM 2 CA GLY A -2 1.037 5.722 -5.065 1.00 0.00 C ATOM 3 C GLY A -2 2.389 6.338 -4.742 1.00 0.00 C ATOM 4 O GLY A -2 3.140 5.788 -3.927 1.00 0.00 O ATOM 0 H1 GLY A -2 -0.618 5.256 -3.908 1.00 0.00 H new ATOM 0 H2 GLY A -2 0.619 4.094 -3.852 1.00 0.00 H new ATOM 0 H3 GLY A -2 0.792 5.560 -3.013 1.00 0.00 H new ATOM 0 HA2 GLY A -2 1.159 4.964 -5.838 1.00 0.00 H new ATOM 0 HA3 GLY A -2 0.376 6.488 -5.471 1.00 0.00 H new ATOM 10 N SER A -1 2.698 7.484 -5.373 1.00 0.00 N ATOM 11 CA SER A -1 3.989 8.171 -5.220 1.00 0.00 C ATOM 12 C SER A -1 4.056 8.920 -3.871 1.00 0.00 C ATOM 13 O SER A -1 3.356 9.924 -3.666 1.00 0.00 O ATOM 14 CB SER A -1 4.209 9.141 -6.404 1.00 0.00 C ATOM 15 OG SER A -1 4.125 8.458 -7.648 1.00 0.00 O ATOM 0 H SER A -1 2.055 7.961 -6.006 1.00 0.00 H new ATOM 0 HA SER A -1 4.787 7.428 -5.224 1.00 0.00 H new ATOM 0 HB2 SER A -1 3.463 9.935 -6.371 1.00 0.00 H new ATOM 0 HB3 SER A -1 5.185 9.616 -6.312 1.00 0.00 H new ATOM 0 HG SER A -1 4.266 9.094 -8.380 1.00 0.00 H new ATOM 21 N HIS A 0 4.886 8.399 -2.953 1.00 0.00 N ATOM 22 CA HIS A 0 5.109 8.990 -1.628 1.00 0.00 C ATOM 23 C HIS A 0 6.125 10.139 -1.742 1.00 0.00 C ATOM 24 O HIS A 0 7.340 9.915 -1.858 1.00 0.00 O ATOM 25 CB HIS A 0 5.574 7.909 -0.616 1.00 0.00 C ATOM 26 CG HIS A 0 4.479 6.948 -0.227 1.00 0.00 C ATOM 27 ND1 HIS A 0 3.885 6.085 -1.121 1.00 0.00 N ATOM 28 CD2 HIS A 0 3.839 6.751 0.951 1.00 0.00 C ATOM 29 CE1 HIS A 0 2.932 5.410 -0.516 1.00 0.00 C ATOM 30 NE2 HIS A 0 2.886 5.791 0.741 1.00 0.00 N ATOM 0 H HIS A 0 5.425 7.548 -3.113 1.00 0.00 H new ATOM 0 HA HIS A 0 4.171 9.398 -1.251 1.00 0.00 H new ATOM 0 HB2 HIS A 0 6.403 7.349 -1.048 1.00 0.00 H new ATOM 0 HB3 HIS A 0 5.953 8.399 0.281 1.00 0.00 H new ATOM 0 HD1 HIS A 0 4.144 5.985 -2.102 1.00 0.00 H new ATOM 0 HD2 HIS A 0 4.043 7.257 1.883 1.00 0.00 H new ATOM 0 HE1 HIS A 0 2.295 4.668 -0.975 1.00 0.00 H new ATOM 39 N MET A 1 5.586 11.365 -1.753 1.00 0.00 N ATOM 40 CA MET A 1 6.356 12.612 -1.880 1.00 0.00 C ATOM 41 C MET A 1 7.004 12.980 -0.537 1.00 0.00 C ATOM 42 O MET A 1 6.711 12.375 0.490 1.00 0.00 O ATOM 43 CB MET A 1 5.416 13.754 -2.352 1.00 0.00 C ATOM 44 CG MET A 1 4.675 13.459 -3.661 1.00 0.00 C ATOM 45 SD MET A 1 5.794 13.123 -5.038 1.00 0.00 S ATOM 46 CE MET A 1 4.637 12.932 -6.394 1.00 0.00 C ATOM 0 H MET A 1 4.581 11.522 -1.672 1.00 0.00 H new ATOM 0 HA MET A 1 7.148 12.469 -2.615 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.683 13.953 -1.570 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.003 14.664 -2.477 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.017 12.602 -3.516 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.040 14.309 -3.913 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.162 12.548 -7.269 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.851 12.233 -6.106 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.193 13.899 -6.633 1.00 0.00 H new ATOM 56 N GLN A 2 7.890 13.968 -0.552 1.00 0.00 N ATOM 57 CA GLN A 2 8.486 14.512 0.675 1.00 0.00 C ATOM 58 C GLN A 2 7.765 15.792 1.099 1.00 0.00 C ATOM 59 O GLN A 2 7.163 16.473 0.269 1.00 0.00 O ATOM 60 CB GLN A 2 10.006 14.771 0.513 1.00 0.00 C ATOM 61 CG GLN A 2 10.880 13.504 0.331 1.00 0.00 C ATOM 62 CD GLN A 2 11.071 13.058 -1.123 1.00 0.00 C ATOM 63 OE1 GLN A 2 10.202 13.233 -1.983 1.00 0.00 O ATOM 64 NE2 GLN A 2 12.225 12.488 -1.406 1.00 0.00 N ATOM 0 H GLN A 2 8.218 14.417 -1.407 1.00 0.00 H new ATOM 0 HA GLN A 2 8.364 13.763 1.458 1.00 0.00 H new ATOM 0 HB2 GLN A 2 10.157 15.423 -0.348 1.00 0.00 H new ATOM 0 HB3 GLN A 2 10.360 15.314 1.389 1.00 0.00 H new ATOM 0 HG2 GLN A 2 11.860 13.689 0.771 1.00 0.00 H new ATOM 0 HG3 GLN A 2 10.429 12.685 0.891 1.00 0.00 H new ATOM 0 HE21 GLN A 2 12.923 12.358 -0.673 1.00 0.00 H new ATOM 0 HE22 GLN A 2 12.421 12.177 -2.358 1.00 0.00 H new ATOM 73 N ILE A 3 7.797 16.067 2.415 1.00 0.00 N ATOM 74 CA ILE A 3 7.315 17.331 3.016 1.00 0.00 C ATOM 75 C ILE A 3 8.228 17.695 4.199 1.00 0.00 C ATOM 76 O ILE A 3 8.801 16.807 4.851 1.00 0.00 O ATOM 77 CB ILE A 3 5.795 17.300 3.508 1.00 0.00 C ATOM 78 CG1 ILE A 3 5.464 16.050 4.412 1.00 0.00 C ATOM 79 CG2 ILE A 3 4.810 17.418 2.319 1.00 0.00 C ATOM 80 CD1 ILE A 3 5.307 14.716 3.673 1.00 0.00 C ATOM 0 H ILE A 3 8.163 15.410 3.104 1.00 0.00 H new ATOM 0 HA ILE A 3 7.353 18.081 2.226 1.00 0.00 H new ATOM 0 HB ILE A 3 5.662 18.177 4.141 1.00 0.00 H new ATOM 0 HG12 ILE A 3 6.255 15.942 5.154 1.00 0.00 H new ATOM 0 HG13 ILE A 3 4.542 16.253 4.957 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.786 17.393 2.691 1.00 0.00 H new ATOM 0 HG22 ILE A 3 4.983 18.358 1.795 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.967 16.586 1.633 1.00 0.00 H new ATOM 0 HD11 ILE A 3 5.081 13.927 4.390 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.494 14.793 2.951 1.00 0.00 H new ATOM 0 HD13 ILE A 3 6.234 14.478 3.151 1.00 0.00 H new ATOM 92 N PHE A 4 8.356 19.005 4.464 1.00 0.00 N ATOM 93 CA PHE A 4 9.250 19.539 5.511 1.00 0.00 C ATOM 94 C PHE A 4 8.421 19.988 6.723 1.00 0.00 C ATOM 95 O PHE A 4 7.797 21.048 6.701 1.00 0.00 O ATOM 96 CB PHE A 4 10.091 20.725 4.960 1.00 0.00 C ATOM 97 CG PHE A 4 10.974 20.361 3.768 1.00 0.00 C ATOM 98 CD1 PHE A 4 12.194 19.714 3.961 1.00 0.00 C ATOM 99 CD2 PHE A 4 10.590 20.662 2.462 1.00 0.00 C ATOM 100 CE1 PHE A 4 13.000 19.385 2.891 1.00 0.00 C ATOM 101 CE2 PHE A 4 11.398 20.330 1.395 1.00 0.00 C ATOM 102 CZ PHE A 4 12.603 19.691 1.609 1.00 0.00 C ATOM 0 H PHE A 4 7.843 19.727 3.959 1.00 0.00 H new ATOM 0 HA PHE A 4 9.936 18.751 5.822 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.417 21.530 4.667 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.721 21.113 5.760 1.00 0.00 H new ATOM 0 HD1 PHE A 4 12.513 19.467 4.963 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.649 21.161 2.284 1.00 0.00 H new ATOM 0 HE1 PHE A 4 13.943 18.887 3.059 1.00 0.00 H new ATOM 0 HE2 PHE A 4 11.087 20.571 0.389 1.00 0.00 H new ATOM 0 HZ PHE A 4 13.233 19.431 0.771 1.00 0.00 H new ATOM 112 N VAL A 5 8.400 19.161 7.770 1.00 0.00 N ATOM 113 CA VAL A 5 7.737 19.480 9.039 1.00 0.00 C ATOM 114 C VAL A 5 8.821 19.973 10.007 1.00 0.00 C ATOM 115 O VAL A 5 9.613 19.188 10.501 1.00 0.00 O ATOM 116 CB VAL A 5 6.978 18.227 9.613 1.00 0.00 C ATOM 117 CG1 VAL A 5 6.378 18.512 11.000 1.00 0.00 C ATOM 118 CG2 VAL A 5 5.862 17.764 8.641 1.00 0.00 C ATOM 0 H VAL A 5 8.846 18.244 7.762 1.00 0.00 H new ATOM 0 HA VAL A 5 6.983 20.253 8.893 1.00 0.00 H new ATOM 0 HB VAL A 5 7.712 17.428 9.718 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.862 17.623 11.363 1.00 0.00 H new ATOM 0 HG12 VAL A 5 7.176 18.777 11.694 1.00 0.00 H new ATOM 0 HG13 VAL A 5 5.670 19.338 10.928 1.00 0.00 H new ATOM 0 HG21 VAL A 5 5.352 16.897 9.060 1.00 0.00 H new ATOM 0 HG22 VAL A 5 5.145 18.573 8.498 1.00 0.00 H new ATOM 0 HG23 VAL A 5 6.304 17.497 7.681 1.00 0.00 H new ATOM 128 N LYS A 6 8.885 21.288 10.214 1.00 0.00 N ATOM 129 CA LYS A 6 9.963 21.937 10.975 1.00 0.00 C ATOM 130 C LYS A 6 9.499 22.281 12.397 1.00 0.00 C ATOM 131 O LYS A 6 8.504 22.985 12.558 1.00 0.00 O ATOM 132 CB LYS A 6 10.392 23.222 10.227 1.00 0.00 C ATOM 133 CG LYS A 6 11.725 23.815 10.714 1.00 0.00 C ATOM 134 CD LYS A 6 12.208 24.983 9.838 1.00 0.00 C ATOM 135 CE LYS A 6 13.644 25.394 10.171 1.00 0.00 C ATOM 136 NZ LYS A 6 14.098 26.534 9.335 1.00 0.00 N ATOM 0 H LYS A 6 8.187 21.941 9.858 1.00 0.00 H new ATOM 0 HA LYS A 6 10.808 21.254 11.058 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.472 23.001 9.163 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.610 23.973 10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.611 24.160 11.742 1.00 0.00 H new ATOM 0 HG3 LYS A 6 12.485 23.033 10.722 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.147 24.698 8.788 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.545 25.837 9.975 1.00 0.00 H new ATOM 0 HE2 LYS A 6 13.709 25.667 11.224 1.00 0.00 H new ATOM 0 HE3 LYS A 6 14.310 24.544 10.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 15.075 26.784 9.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.060 26.265 8.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 13.478 27.353 9.498 1.00 0.00 H new ATOM 150 N THR A 7 10.244 21.802 13.415 1.00 0.00 N ATOM 151 CA THR A 7 9.970 22.102 14.825 1.00 0.00 C ATOM 152 C THR A 7 10.170 23.589 15.139 1.00 0.00 C ATOM 153 O THR A 7 10.913 24.297 14.440 1.00 0.00 O ATOM 154 CB THR A 7 10.860 21.262 15.805 1.00 0.00 C ATOM 155 OG1 THR A 7 12.249 21.473 15.515 1.00 0.00 O ATOM 156 CG2 THR A 7 10.542 19.767 15.745 1.00 0.00 C ATOM 0 H THR A 7 11.053 21.196 13.276 1.00 0.00 H new ATOM 0 HA THR A 7 8.926 21.831 14.980 1.00 0.00 H new ATOM 0 HB THR A 7 10.635 21.605 16.815 1.00 0.00 H new ATOM 0 HG1 THR A 7 12.712 21.765 16.328 1.00 0.00 H new ATOM 0 HG21 THR A 7 11.185 19.230 16.442 1.00 0.00 H new ATOM 0 HG22 THR A 7 9.499 19.606 16.016 1.00 0.00 H new ATOM 0 HG23 THR A 7 10.715 19.398 14.734 1.00 0.00 H new ATOM 164 N LEU A 8 9.519 24.036 16.224 1.00 0.00 N ATOM 165 CA LEU A 8 9.638 25.415 16.735 1.00 0.00 C ATOM 166 C LEU A 8 11.063 25.707 17.268 1.00 0.00 C ATOM 167 O LEU A 8 11.441 26.873 17.440 1.00 0.00 O ATOM 168 CB LEU A 8 8.613 25.644 17.862 1.00 0.00 C ATOM 169 CG LEU A 8 7.117 25.404 17.526 1.00 0.00 C ATOM 170 CD1 LEU A 8 6.253 25.596 18.789 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.636 26.304 16.359 1.00 0.00 C ATOM 0 H LEU A 8 8.892 23.450 16.776 1.00 0.00 H new ATOM 0 HA LEU A 8 9.440 26.094 15.906 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.879 24.995 18.696 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.719 26.671 18.211 1.00 0.00 H new ATOM 0 HG LEU A 8 7.005 24.374 17.187 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.205 25.425 18.542 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.566 24.886 19.555 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.377 26.612 19.163 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.584 26.105 16.156 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.761 27.352 16.632 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.225 26.089 15.467 1.00 0.00 H new ATOM 183 N THR A 9 11.833 24.637 17.538 1.00 0.00 N ATOM 184 CA THR A 9 13.226 24.739 17.996 1.00 0.00 C ATOM 185 C THR A 9 14.180 25.017 16.808 1.00 0.00 C ATOM 186 O THR A 9 15.351 25.341 17.016 1.00 0.00 O ATOM 187 CB THR A 9 13.651 23.437 18.750 1.00 0.00 C ATOM 188 OG1 THR A 9 13.532 22.305 17.876 1.00 0.00 O ATOM 189 CG2 THR A 9 12.796 23.196 20.014 1.00 0.00 C ATOM 0 H THR A 9 11.504 23.676 17.444 1.00 0.00 H new ATOM 0 HA THR A 9 13.296 25.578 18.688 1.00 0.00 H new ATOM 0 HB THR A 9 14.688 23.565 19.062 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.801 21.493 18.354 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.125 22.281 20.507 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.911 24.038 20.697 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.748 23.099 19.731 1.00 0.00 H new ATOM 197 N GLY A 10 13.658 24.886 15.566 1.00 0.00 N ATOM 198 CA GLY A 10 14.378 25.277 14.342 1.00 0.00 C ATOM 199 C GLY A 10 14.929 24.100 13.549 1.00 0.00 C ATOM 200 O GLY A 10 15.660 24.300 12.570 1.00 0.00 O ATOM 0 H GLY A 10 12.728 24.507 15.390 1.00 0.00 H new ATOM 0 HA2 GLY A 10 13.705 25.850 13.704 1.00 0.00 H new ATOM 0 HA3 GLY A 10 15.201 25.938 14.612 1.00 0.00 H new ATOM 204 N LYS A 11 14.575 22.876 13.957 1.00 0.00 N ATOM 205 CA LYS A 11 15.029 21.631 13.301 1.00 0.00 C ATOM 206 C LYS A 11 13.983 21.199 12.255 1.00 0.00 C ATOM 207 O LYS A 11 12.796 21.350 12.487 1.00 0.00 O ATOM 208 CB LYS A 11 15.276 20.527 14.390 1.00 0.00 C ATOM 209 CG LYS A 11 14.591 19.163 14.145 1.00 0.00 C ATOM 210 CD LYS A 11 14.779 18.191 15.316 1.00 0.00 C ATOM 211 CE LYS A 11 14.043 16.877 15.091 1.00 0.00 C ATOM 212 NZ LYS A 11 14.527 16.171 13.883 1.00 0.00 N ATOM 0 H LYS A 11 13.962 22.714 14.756 1.00 0.00 H new ATOM 0 HA LYS A 11 15.972 21.792 12.779 1.00 0.00 H new ATOM 0 HB2 LYS A 11 16.350 20.361 14.473 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.938 20.913 15.352 1.00 0.00 H new ATOM 0 HG2 LYS A 11 13.526 19.321 13.976 1.00 0.00 H new ATOM 0 HG3 LYS A 11 14.995 18.715 13.237 1.00 0.00 H new ATOM 0 HD2 LYS A 11 15.842 17.992 15.455 1.00 0.00 H new ATOM 0 HD3 LYS A 11 14.419 18.656 16.234 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.172 16.235 15.962 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.975 17.072 14.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 13.840 15.439 13.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.636 16.851 13.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.445 15.726 14.085 1.00 0.00 H new ATOM 226 N THR A 12 14.437 20.657 11.115 1.00 0.00 N ATOM 227 CA THR A 12 13.538 20.187 10.034 1.00 0.00 C ATOM 228 C THR A 12 13.433 18.643 10.043 1.00 0.00 C ATOM 229 O THR A 12 14.418 17.936 10.308 1.00 0.00 O ATOM 230 CB THR A 12 14.032 20.681 8.634 1.00 0.00 C ATOM 231 OG1 THR A 12 14.225 22.104 8.664 1.00 0.00 O ATOM 232 CG2 THR A 12 13.031 20.342 7.507 1.00 0.00 C ATOM 0 H THR A 12 15.428 20.530 10.911 1.00 0.00 H new ATOM 0 HA THR A 12 12.550 20.609 10.219 1.00 0.00 H new ATOM 0 HB THR A 12 14.969 20.166 8.424 1.00 0.00 H new ATOM 0 HG1 THR A 12 14.536 22.411 7.787 1.00 0.00 H new ATOM 0 HG21 THR A 12 13.418 20.705 6.555 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.894 19.262 7.455 1.00 0.00 H new ATOM 0 HG23 THR A 12 12.074 20.820 7.715 1.00 0.00 H new ATOM 240 N ILE A 13 12.209 18.144 9.781 1.00 0.00 N ATOM 241 CA ILE A 13 11.904 16.706 9.654 1.00 0.00 C ATOM 242 C ILE A 13 11.324 16.451 8.248 1.00 0.00 C ATOM 243 O ILE A 13 10.251 16.955 7.929 1.00 0.00 O ATOM 244 CB ILE A 13 10.897 16.198 10.772 1.00 0.00 C ATOM 245 CG1 ILE A 13 11.466 16.455 12.216 1.00 0.00 C ATOM 246 CG2 ILE A 13 10.571 14.704 10.588 1.00 0.00 C ATOM 247 CD1 ILE A 13 11.208 17.844 12.776 1.00 0.00 C ATOM 0 H ILE A 13 11.391 18.739 9.650 1.00 0.00 H new ATOM 0 HA ILE A 13 12.827 16.144 9.794 1.00 0.00 H new ATOM 0 HB ILE A 13 9.976 16.770 10.661 1.00 0.00 H new ATOM 0 HG12 ILE A 13 11.033 15.721 12.896 1.00 0.00 H new ATOM 0 HG13 ILE A 13 12.542 16.281 12.201 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.880 14.384 11.367 1.00 0.00 H new ATOM 0 HG22 ILE A 13 10.113 14.549 9.611 1.00 0.00 H new ATOM 0 HG23 ILE A 13 11.489 14.120 10.655 1.00 0.00 H new ATOM 0 HD11 ILE A 13 11.639 17.920 13.774 1.00 0.00 H new ATOM 0 HD12 ILE A 13 11.666 18.589 12.126 1.00 0.00 H new ATOM 0 HD13 ILE A 13 10.134 18.021 12.830 1.00 0.00 H new ATOM 259 N THR A 14 12.061 15.709 7.402 1.00 0.00 N ATOM 260 CA THR A 14 11.595 15.329 6.053 1.00 0.00 C ATOM 261 C THR A 14 10.875 13.970 6.116 1.00 0.00 C ATOM 262 O THR A 14 11.468 12.969 6.527 1.00 0.00 O ATOM 263 CB THR A 14 12.777 15.252 5.026 1.00 0.00 C ATOM 264 OG1 THR A 14 13.426 16.529 4.940 1.00 0.00 O ATOM 265 CG2 THR A 14 12.309 14.819 3.612 1.00 0.00 C ATOM 0 H THR A 14 12.991 15.357 7.631 1.00 0.00 H new ATOM 0 HA THR A 14 10.906 16.101 5.711 1.00 0.00 H new ATOM 0 HB THR A 14 13.470 14.494 5.390 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.789 17.199 4.614 1.00 0.00 H new ATOM 0 HG21 THR A 14 13.167 14.782 2.940 1.00 0.00 H new ATOM 0 HG22 THR A 14 11.848 13.833 3.667 1.00 0.00 H new ATOM 0 HG23 THR A 14 11.582 15.538 3.233 1.00 0.00 H new ATOM 273 N LEU A 15 9.592 13.955 5.716 1.00 0.00 N ATOM 274 CA LEU A 15 8.748 12.736 5.681 1.00 0.00 C ATOM 275 C LEU A 15 8.562 12.297 4.240 1.00 0.00 C ATOM 276 O LEU A 15 8.797 13.080 3.328 1.00 0.00 O ATOM 277 CB LEU A 15 7.348 12.972 6.330 1.00 0.00 C ATOM 278 CG LEU A 15 7.345 13.548 7.776 1.00 0.00 C ATOM 279 CD1 LEU A 15 8.327 12.804 8.683 1.00 0.00 C ATOM 280 CD2 LEU A 15 7.624 15.055 7.782 1.00 0.00 C ATOM 0 H LEU A 15 9.102 14.793 5.404 1.00 0.00 H new ATOM 0 HA LEU A 15 9.257 11.963 6.257 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.785 13.651 5.690 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.811 12.024 6.339 1.00 0.00 H new ATOM 0 HG LEU A 15 6.344 13.394 8.179 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.296 13.235 9.684 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.050 11.751 8.733 1.00 0.00 H new ATOM 0 HD13 LEU A 15 9.336 12.895 8.280 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.614 15.423 8.808 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.601 15.246 7.337 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.856 15.570 7.205 1.00 0.00 H new ATOM 292 N GLU A 16 8.115 11.045 4.050 1.00 0.00 N ATOM 293 CA GLU A 16 7.922 10.447 2.718 1.00 0.00 C ATOM 294 C GLU A 16 6.525 9.804 2.639 1.00 0.00 C ATOM 295 O GLU A 16 6.358 8.599 2.885 1.00 0.00 O ATOM 296 CB GLU A 16 9.058 9.426 2.423 1.00 0.00 C ATOM 297 CG GLU A 16 10.466 10.060 2.375 1.00 0.00 C ATOM 298 CD GLU A 16 11.595 9.026 2.350 1.00 0.00 C ATOM 299 OE1 GLU A 16 11.998 8.591 1.247 1.00 0.00 O ATOM 300 OE2 GLU A 16 12.083 8.639 3.439 1.00 0.00 O ATOM 0 H GLU A 16 7.877 10.417 4.818 1.00 0.00 H new ATOM 0 HA GLU A 16 7.975 11.219 1.951 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.045 8.650 3.188 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.857 8.937 1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 16 10.542 10.692 1.490 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.595 10.708 3.242 1.00 0.00 H new ATOM 307 N VAL A 17 5.510 10.652 2.357 1.00 0.00 N ATOM 308 CA VAL A 17 4.097 10.238 2.203 1.00 0.00 C ATOM 309 C VAL A 17 3.464 11.032 1.052 1.00 0.00 C ATOM 310 O VAL A 17 4.037 11.994 0.540 1.00 0.00 O ATOM 311 CB VAL A 17 3.212 10.452 3.499 1.00 0.00 C ATOM 312 CG1 VAL A 17 3.805 9.766 4.746 1.00 0.00 C ATOM 313 CG2 VAL A 17 2.946 11.949 3.748 1.00 0.00 C ATOM 0 H VAL A 17 5.651 11.654 2.229 1.00 0.00 H new ATOM 0 HA VAL A 17 4.116 9.166 2.005 1.00 0.00 H new ATOM 0 HB VAL A 17 2.255 9.966 3.310 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.157 9.946 5.603 1.00 0.00 H new ATOM 0 HG12 VAL A 17 3.882 8.693 4.569 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.796 10.173 4.948 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.336 12.066 4.644 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.894 12.469 3.884 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.419 12.372 2.893 1.00 0.00 H new ATOM 323 N GLU A 18 2.248 10.652 0.689 1.00 0.00 N ATOM 324 CA GLU A 18 1.508 11.309 -0.392 1.00 0.00 C ATOM 325 C GLU A 18 0.747 12.532 0.165 1.00 0.00 C ATOM 326 O GLU A 18 0.387 12.548 1.350 1.00 0.00 O ATOM 327 CB GLU A 18 0.524 10.287 -1.026 1.00 0.00 C ATOM 328 CG GLU A 18 1.133 8.885 -1.191 1.00 0.00 C ATOM 329 CD GLU A 18 0.243 7.907 -1.967 1.00 0.00 C ATOM 330 OE1 GLU A 18 -0.108 8.211 -3.124 1.00 0.00 O ATOM 331 OE2 GLU A 18 -0.086 6.820 -1.447 1.00 0.00 O ATOM 0 H GLU A 18 1.743 9.883 1.130 1.00 0.00 H new ATOM 0 HA GLU A 18 2.199 11.658 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.369 10.218 -0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.206 10.655 -2.001 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.091 8.974 -1.704 1.00 0.00 H new ATOM 0 HG3 GLU A 18 1.337 8.470 -0.204 1.00 0.00 H new ATOM 338 N PRO A 19 0.509 13.599 -0.664 1.00 0.00 N ATOM 339 CA PRO A 19 -0.455 14.670 -0.310 1.00 0.00 C ATOM 340 C PRO A 19 -1.889 14.103 -0.133 1.00 0.00 C ATOM 341 O PRO A 19 -2.697 14.644 0.621 1.00 0.00 O ATOM 342 CB PRO A 19 -0.351 15.680 -1.491 1.00 0.00 C ATOM 343 CG PRO A 19 0.295 14.907 -2.609 1.00 0.00 C ATOM 344 CD PRO A 19 1.195 13.883 -1.952 1.00 0.00 C ATOM 0 HA PRO A 19 -0.231 15.145 0.645 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -1.334 16.049 -1.783 1.00 0.00 H new ATOM 0 HB3 PRO A 19 0.246 16.549 -1.216 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -0.457 14.422 -3.231 1.00 0.00 H new ATOM 0 HG3 PRO A 19 0.868 15.568 -3.259 1.00 0.00 H new ATOM 0 HD2 PRO A 19 1.294 12.985 -2.561 1.00 0.00 H new ATOM 0 HD3 PRO A 19 2.200 14.274 -1.794 1.00 0.00 H new ATOM 352 N SER A 20 -2.156 12.964 -0.797 1.00 0.00 N ATOM 353 CA SER A 20 -3.458 12.272 -0.759 1.00 0.00 C ATOM 354 C SER A 20 -3.473 11.149 0.313 1.00 0.00 C ATOM 355 O SER A 20 -4.463 10.417 0.419 1.00 0.00 O ATOM 356 CB SER A 20 -3.754 11.694 -2.173 1.00 0.00 C ATOM 357 OG SER A 20 -5.054 11.120 -2.268 1.00 0.00 O ATOM 0 H SER A 20 -1.466 12.492 -1.382 1.00 0.00 H new ATOM 0 HA SER A 20 -4.235 12.984 -0.481 1.00 0.00 H new ATOM 0 HB2 SER A 20 -3.656 12.488 -2.914 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.008 10.937 -2.416 1.00 0.00 H new ATOM 0 HG SER A 20 -5.288 10.698 -1.415 1.00 0.00 H new ATOM 363 N ASP A 21 -2.383 11.034 1.123 1.00 0.00 N ATOM 364 CA ASP A 21 -2.210 9.927 2.101 1.00 0.00 C ATOM 365 C ASP A 21 -3.152 10.140 3.324 1.00 0.00 C ATOM 366 O ASP A 21 -4.332 9.787 3.242 1.00 0.00 O ATOM 367 CB ASP A 21 -0.702 9.801 2.504 1.00 0.00 C ATOM 368 CG ASP A 21 -0.310 8.455 3.147 1.00 0.00 C ATOM 369 OD1 ASP A 21 -0.834 8.124 4.227 1.00 0.00 O ATOM 370 OD2 ASP A 21 0.539 7.731 2.571 1.00 0.00 O ATOM 0 H ASP A 21 -1.609 11.699 1.115 1.00 0.00 H new ATOM 0 HA ASP A 21 -2.497 8.979 1.646 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -0.090 9.954 1.615 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -0.459 10.604 3.200 1.00 0.00 H new ATOM 375 N THR A 22 -2.627 10.731 4.427 1.00 0.00 N ATOM 376 CA THR A 22 -3.411 11.153 5.611 1.00 0.00 C ATOM 377 C THR A 22 -2.456 11.733 6.675 1.00 0.00 C ATOM 378 O THR A 22 -1.320 11.264 6.815 1.00 0.00 O ATOM 379 CB THR A 22 -4.293 10.008 6.256 1.00 0.00 C ATOM 380 OG1 THR A 22 -5.092 10.540 7.325 1.00 0.00 O ATOM 381 CG2 THR A 22 -3.459 8.833 6.796 1.00 0.00 C ATOM 0 H THR A 22 -1.631 10.930 4.518 1.00 0.00 H new ATOM 0 HA THR A 22 -4.115 11.906 5.256 1.00 0.00 H new ATOM 0 HB THR A 22 -4.925 9.624 5.456 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.316 11.474 7.132 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.123 8.082 7.225 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.887 8.389 5.982 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.776 9.195 7.564 1.00 0.00 H new ATOM 389 N ILE A 23 -2.938 12.741 7.427 1.00 0.00 N ATOM 390 CA ILE A 23 -2.163 13.464 8.459 1.00 0.00 C ATOM 391 C ILE A 23 -1.726 12.523 9.604 1.00 0.00 C ATOM 392 O ILE A 23 -0.629 12.674 10.157 1.00 0.00 O ATOM 393 CB ILE A 23 -3.005 14.656 9.063 1.00 0.00 C ATOM 394 CG1 ILE A 23 -3.411 15.699 7.964 1.00 0.00 C ATOM 395 CG2 ILE A 23 -2.269 15.353 10.237 1.00 0.00 C ATOM 396 CD1 ILE A 23 -2.248 16.421 7.299 1.00 0.00 C ATOM 0 H ILE A 23 -3.894 13.083 7.334 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.273 13.859 7.969 1.00 0.00 H new ATOM 0 HB ILE A 23 -3.920 14.217 9.461 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.988 15.187 7.194 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.069 16.441 8.415 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.885 16.166 10.621 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.085 14.630 11.032 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.319 15.753 9.884 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.631 17.120 6.555 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.681 16.968 8.052 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.598 15.693 6.813 1.00 0.00 H new ATOM 408 N GLU A 24 -2.607 11.565 9.944 1.00 0.00 N ATOM 409 CA GLU A 24 -2.351 10.555 10.995 1.00 0.00 C ATOM 410 C GLU A 24 -1.074 9.755 10.687 1.00 0.00 C ATOM 411 O GLU A 24 -0.292 9.401 11.586 1.00 0.00 O ATOM 412 CB GLU A 24 -3.565 9.605 11.098 1.00 0.00 C ATOM 413 CG GLU A 24 -3.531 8.632 12.291 1.00 0.00 C ATOM 414 CD GLU A 24 -4.769 7.720 12.340 1.00 0.00 C ATOM 415 OE1 GLU A 24 -5.857 8.202 12.717 1.00 0.00 O ATOM 416 OE2 GLU A 24 -4.666 6.531 11.977 1.00 0.00 O ATOM 0 H GLU A 24 -3.519 11.466 9.499 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.206 11.066 11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -4.472 10.205 11.164 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.633 9.025 10.177 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -2.633 8.018 12.230 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -3.465 9.201 13.218 1.00 0.00 H new ATOM 423 N ASN A 25 -0.868 9.498 9.390 1.00 0.00 N ATOM 424 CA ASN A 25 0.298 8.765 8.892 1.00 0.00 C ATOM 425 C ASN A 25 1.535 9.661 8.908 1.00 0.00 C ATOM 426 O ASN A 25 2.612 9.215 9.295 1.00 0.00 O ATOM 427 CB ASN A 25 0.031 8.264 7.466 1.00 0.00 C ATOM 428 CG ASN A 25 1.070 7.258 6.982 1.00 0.00 C ATOM 429 OD1 ASN A 25 2.030 7.612 6.310 1.00 0.00 O ATOM 430 ND2 ASN A 25 0.914 6.006 7.376 1.00 0.00 N ATOM 0 H ASN A 25 -1.509 9.795 8.654 1.00 0.00 H new ATOM 0 HA ASN A 25 0.478 7.909 9.543 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.957 7.804 7.428 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.013 9.115 6.785 1.00 0.00 H new ATOM 0 HD21 ASN A 25 1.606 5.301 7.121 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.102 5.745 7.935 1.00 0.00 H new ATOM 437 N VAL A 26 1.343 10.928 8.488 1.00 0.00 N ATOM 438 CA VAL A 26 2.420 11.949 8.431 1.00 0.00 C ATOM 439 C VAL A 26 3.084 12.104 9.809 1.00 0.00 C ATOM 440 O VAL A 26 4.303 12.059 9.919 1.00 0.00 O ATOM 441 CB VAL A 26 1.897 13.363 7.953 1.00 0.00 C ATOM 442 CG1 VAL A 26 3.041 14.414 7.854 1.00 0.00 C ATOM 443 CG2 VAL A 26 1.144 13.253 6.614 1.00 0.00 C ATOM 0 H VAL A 26 0.436 11.277 8.177 1.00 0.00 H new ATOM 0 HA VAL A 26 3.143 11.593 7.698 1.00 0.00 H new ATOM 0 HB VAL A 26 1.201 13.714 8.715 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.631 15.368 7.522 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.506 14.539 8.832 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.789 14.072 7.139 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.796 14.240 6.310 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.813 12.854 5.852 1.00 0.00 H new ATOM 0 HG23 VAL A 26 0.289 12.587 6.731 1.00 0.00 H new ATOM 453 N LYS A 27 2.252 12.243 10.858 1.00 0.00 N ATOM 454 CA LYS A 27 2.727 12.458 12.234 1.00 0.00 C ATOM 455 C LYS A 27 3.401 11.186 12.790 1.00 0.00 C ATOM 456 O LYS A 27 4.380 11.278 13.538 1.00 0.00 O ATOM 457 CB LYS A 27 1.574 12.946 13.146 1.00 0.00 C ATOM 458 CG LYS A 27 0.424 11.957 13.376 1.00 0.00 C ATOM 459 CD LYS A 27 -0.712 12.564 14.226 1.00 0.00 C ATOM 460 CE LYS A 27 -1.421 13.740 13.533 1.00 0.00 C ATOM 461 NZ LYS A 27 -2.401 14.413 14.434 1.00 0.00 N ATOM 0 H LYS A 27 1.236 12.209 10.774 1.00 0.00 H new ATOM 0 HA LYS A 27 3.483 13.243 12.217 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.994 13.213 14.116 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.160 13.858 12.716 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.024 11.639 12.413 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.809 11.066 13.872 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.444 11.788 14.451 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.304 12.903 15.178 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -0.678 14.465 13.199 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.936 13.379 12.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -3.354 14.343 14.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.390 13.951 15.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.143 15.415 14.541 1.00 0.00 H new ATOM 475 N ALA A 28 2.877 10.002 12.402 1.00 0.00 N ATOM 476 CA ALA A 28 3.543 8.710 12.670 1.00 0.00 C ATOM 477 C ALA A 28 4.966 8.690 12.075 1.00 0.00 C ATOM 478 O ALA A 28 5.882 8.118 12.674 1.00 0.00 O ATOM 479 CB ALA A 28 2.704 7.544 12.119 1.00 0.00 C ATOM 0 H ALA A 28 1.993 9.916 11.901 1.00 0.00 H new ATOM 0 HA ALA A 28 3.629 8.589 13.750 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.211 6.601 12.326 1.00 0.00 H new ATOM 0 HB2 ALA A 28 1.725 7.542 12.598 1.00 0.00 H new ATOM 0 HB3 ALA A 28 2.581 7.661 11.042 1.00 0.00 H new ATOM 485 N LYS A 29 5.134 9.334 10.898 1.00 0.00 N ATOM 486 CA LYS A 29 6.440 9.462 10.239 1.00 0.00 C ATOM 487 C LYS A 29 7.395 10.403 11.004 1.00 0.00 C ATOM 488 O LYS A 29 8.591 10.166 10.980 1.00 0.00 O ATOM 489 CB LYS A 29 6.293 9.920 8.764 1.00 0.00 C ATOM 490 CG LYS A 29 5.431 9.012 7.887 1.00 0.00 C ATOM 491 CD LYS A 29 5.913 7.551 7.880 1.00 0.00 C ATOM 492 CE LYS A 29 4.995 6.653 7.053 1.00 0.00 C ATOM 493 NZ LYS A 29 5.494 5.261 7.001 1.00 0.00 N ATOM 0 H LYS A 29 4.369 9.775 10.386 1.00 0.00 H new ATOM 0 HA LYS A 29 6.885 8.467 10.247 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.866 10.923 8.752 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.286 9.991 8.321 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.400 9.047 8.240 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.432 9.394 6.866 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.925 7.504 7.478 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.959 7.179 8.903 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.993 6.665 7.481 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.914 7.049 6.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.846 4.681 6.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.440 5.247 6.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.547 4.875 7.965 1.00 0.00 H new ATOM 507 N ILE A 30 6.887 11.477 11.663 1.00 0.00 N ATOM 508 CA ILE A 30 7.743 12.319 12.556 1.00 0.00 C ATOM 509 C ILE A 30 8.323 11.443 13.703 1.00 0.00 C ATOM 510 O ILE A 30 9.511 11.534 14.038 1.00 0.00 O ATOM 511 CB ILE A 30 6.990 13.599 13.139 1.00 0.00 C ATOM 512 CG1 ILE A 30 6.806 14.728 12.059 1.00 0.00 C ATOM 513 CG2 ILE A 30 7.713 14.185 14.375 1.00 0.00 C ATOM 514 CD1 ILE A 30 5.674 14.528 11.076 1.00 0.00 C ATOM 0 H ILE A 30 5.915 11.779 11.600 1.00 0.00 H new ATOM 0 HA ILE A 30 8.555 12.711 11.944 1.00 0.00 H new ATOM 0 HB ILE A 30 6.004 13.246 13.442 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.649 15.675 12.575 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.736 14.821 11.498 1.00 0.00 H new ATOM 0 HG21 ILE A 30 7.165 15.055 14.738 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.759 13.431 15.161 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.724 14.483 14.098 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.643 15.367 10.381 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.833 13.603 10.522 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.729 14.470 11.616 1.00 0.00 H new ATOM 526 N GLN A 31 7.471 10.557 14.245 1.00 0.00 N ATOM 527 CA GLN A 31 7.863 9.573 15.280 1.00 0.00 C ATOM 528 C GLN A 31 8.831 8.503 14.704 1.00 0.00 C ATOM 529 O GLN A 31 9.604 7.884 15.438 1.00 0.00 O ATOM 530 CB GLN A 31 6.585 8.912 15.875 1.00 0.00 C ATOM 531 CG GLN A 31 6.851 7.952 17.056 1.00 0.00 C ATOM 532 CD GLN A 31 5.596 7.359 17.708 1.00 0.00 C ATOM 533 OE1 GLN A 31 5.587 7.094 18.909 1.00 0.00 O ATOM 534 NE2 GLN A 31 4.542 7.121 16.937 1.00 0.00 N ATOM 0 H GLN A 31 6.488 10.499 13.980 1.00 0.00 H new ATOM 0 HA GLN A 31 8.398 10.092 16.075 1.00 0.00 H new ATOM 0 HB2 GLN A 31 5.906 9.697 16.207 1.00 0.00 H new ATOM 0 HB3 GLN A 31 6.074 8.362 15.085 1.00 0.00 H new ATOM 0 HG2 GLN A 31 7.480 7.134 16.704 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.419 8.486 17.817 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.575 7.350 15.944 1.00 0.00 H new ATOM 0 HE22 GLN A 31 3.699 6.709 17.338 1.00 0.00 H new ATOM 543 N ASP A 32 8.763 8.293 13.385 1.00 0.00 N ATOM 544 CA ASP A 32 9.678 7.396 12.645 1.00 0.00 C ATOM 545 C ASP A 32 11.052 8.073 12.412 1.00 0.00 C ATOM 546 O ASP A 32 12.084 7.388 12.373 1.00 0.00 O ATOM 547 CB ASP A 32 9.005 6.983 11.302 1.00 0.00 C ATOM 548 CG ASP A 32 9.899 6.173 10.341 1.00 0.00 C ATOM 549 OD1 ASP A 32 10.081 4.961 10.565 1.00 0.00 O ATOM 550 OD2 ASP A 32 10.425 6.752 9.360 1.00 0.00 O ATOM 0 H ASP A 32 8.067 8.742 12.789 1.00 0.00 H new ATOM 0 HA ASP A 32 9.866 6.499 13.235 1.00 0.00 H new ATOM 0 HB2 ASP A 32 8.114 6.396 11.526 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.671 7.885 10.789 1.00 0.00 H new ATOM 555 N LYS A 33 11.063 9.423 12.291 1.00 0.00 N ATOM 556 CA LYS A 33 12.280 10.188 11.918 1.00 0.00 C ATOM 557 C LYS A 33 13.026 10.695 13.175 1.00 0.00 C ATOM 558 O LYS A 33 14.132 10.229 13.463 1.00 0.00 O ATOM 559 CB LYS A 33 11.913 11.385 10.994 1.00 0.00 C ATOM 560 CG LYS A 33 11.259 11.008 9.648 1.00 0.00 C ATOM 561 CD LYS A 33 12.204 10.301 8.658 1.00 0.00 C ATOM 562 CE LYS A 33 11.477 9.881 7.361 1.00 0.00 C ATOM 563 NZ LYS A 33 12.403 9.241 6.385 1.00 0.00 N ATOM 0 H LYS A 33 10.241 10.006 12.447 1.00 0.00 H new ATOM 0 HA LYS A 33 12.943 9.515 11.374 1.00 0.00 H new ATOM 0 HB2 LYS A 33 11.235 12.045 11.535 1.00 0.00 H new ATOM 0 HB3 LYS A 33 12.819 11.956 10.791 1.00 0.00 H new ATOM 0 HG2 LYS A 33 10.404 10.360 9.842 1.00 0.00 H new ATOM 0 HG3 LYS A 33 10.873 11.913 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 33 13.032 10.965 8.410 1.00 0.00 H new ATOM 0 HD3 LYS A 33 12.634 9.420 9.134 1.00 0.00 H new ATOM 0 HE2 LYS A 33 10.672 9.188 7.605 1.00 0.00 H new ATOM 0 HE3 LYS A 33 11.017 10.757 6.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 11.944 9.190 5.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 13.274 9.805 6.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 12.638 8.281 6.708 1.00 0.00 H new ATOM 577 N GLU A 34 12.411 11.648 13.930 1.00 0.00 N ATOM 578 CA GLU A 34 13.047 12.234 15.134 1.00 0.00 C ATOM 579 C GLU A 34 12.808 11.352 16.372 1.00 0.00 C ATOM 580 O GLU A 34 13.619 11.357 17.310 1.00 0.00 O ATOM 581 CB GLU A 34 12.603 13.705 15.397 1.00 0.00 C ATOM 582 CG GLU A 34 11.126 13.950 15.773 1.00 0.00 C ATOM 583 CD GLU A 34 10.853 15.429 16.179 1.00 0.00 C ATOM 584 OE1 GLU A 34 11.436 15.898 17.188 1.00 0.00 O ATOM 585 OE2 GLU A 34 10.093 16.130 15.484 1.00 0.00 O ATOM 0 H GLU A 34 11.484 12.021 13.725 1.00 0.00 H new ATOM 0 HA GLU A 34 14.118 12.265 14.935 1.00 0.00 H new ATOM 0 HB2 GLU A 34 13.224 14.105 16.198 1.00 0.00 H new ATOM 0 HB3 GLU A 34 12.823 14.287 14.502 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.490 13.685 14.928 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.850 13.293 16.598 1.00 0.00 H new ATOM 592 N GLY A 35 11.704 10.587 16.360 1.00 0.00 N ATOM 593 CA GLY A 35 11.428 9.590 17.401 1.00 0.00 C ATOM 594 C GLY A 35 10.562 10.133 18.522 1.00 0.00 C ATOM 595 O GLY A 35 10.597 9.619 19.644 1.00 0.00 O ATOM 0 H GLY A 35 10.987 10.642 15.637 1.00 0.00 H new ATOM 0 HA2 GLY A 35 10.934 8.729 16.951 1.00 0.00 H new ATOM 0 HA3 GLY A 35 12.371 9.235 17.816 1.00 0.00 H new ATOM 599 N ILE A 36 9.783 11.188 18.219 1.00 0.00 N ATOM 600 CA ILE A 36 8.896 11.852 19.198 1.00 0.00 C ATOM 601 C ILE A 36 7.430 11.437 18.908 1.00 0.00 C ATOM 602 O ILE A 36 6.992 11.537 17.758 1.00 0.00 O ATOM 603 CB ILE A 36 9.085 13.438 19.176 1.00 0.00 C ATOM 604 CG1 ILE A 36 10.380 13.889 19.947 1.00 0.00 C ATOM 605 CG2 ILE A 36 7.859 14.175 19.778 1.00 0.00 C ATOM 606 CD1 ILE A 36 11.705 13.359 19.426 1.00 0.00 C ATOM 0 H ILE A 36 9.749 11.606 17.289 1.00 0.00 H new ATOM 0 HA ILE A 36 9.161 11.530 20.205 1.00 0.00 H new ATOM 0 HB ILE A 36 9.185 13.711 18.125 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.421 14.978 19.935 1.00 0.00 H new ATOM 0 HG13 ILE A 36 10.278 13.586 20.989 1.00 0.00 H new ATOM 0 HG21 ILE A 36 8.029 15.251 19.744 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.968 13.930 19.201 1.00 0.00 H new ATOM 0 HG23 ILE A 36 7.719 13.863 20.813 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.518 13.742 20.043 1.00 0.00 H new ATOM 0 HD12 ILE A 36 11.702 12.270 19.466 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.847 13.684 18.395 1.00 0.00 H new ATOM 618 N PRO A 37 6.653 10.957 19.943 1.00 0.00 N ATOM 619 CA PRO A 37 5.276 10.415 19.747 1.00 0.00 C ATOM 620 C PRO A 37 4.254 11.507 19.336 1.00 0.00 C ATOM 621 O PRO A 37 4.462 12.672 19.678 1.00 0.00 O ATOM 622 CB PRO A 37 4.943 9.810 21.139 1.00 0.00 C ATOM 623 CG PRO A 37 5.738 10.630 22.098 1.00 0.00 C ATOM 624 CD PRO A 37 7.041 10.928 21.385 1.00 0.00 C ATOM 0 HA PRO A 37 5.223 9.692 18.933 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.876 9.870 21.354 1.00 0.00 H new ATOM 0 HB3 PRO A 37 5.220 8.757 21.191 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.213 11.549 22.359 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.913 10.088 23.028 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.465 11.880 21.705 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.791 10.162 21.583 1.00 0.00 H new ATOM 632 N PRO A 38 3.117 11.137 18.634 1.00 0.00 N ATOM 633 CA PRO A 38 2.102 12.113 18.123 1.00 0.00 C ATOM 634 C PRO A 38 1.415 12.941 19.226 1.00 0.00 C ATOM 635 O PRO A 38 0.788 13.968 18.941 1.00 0.00 O ATOM 636 CB PRO A 38 1.082 11.213 17.368 1.00 0.00 C ATOM 637 CG PRO A 38 1.254 9.860 17.988 1.00 0.00 C ATOM 638 CD PRO A 38 2.731 9.743 18.283 1.00 0.00 C ATOM 0 HA PRO A 38 2.567 12.873 17.496 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.063 11.579 17.489 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.288 11.189 16.298 1.00 0.00 H new ATOM 0 HG2 PRO A 38 0.662 9.766 18.899 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.924 9.072 17.311 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.925 9.052 19.104 1.00 0.00 H new ATOM 0 HD3 PRO A 38 3.287 9.376 17.420 1.00 0.00 H new ATOM 646 N ASP A 39 1.546 12.469 20.470 1.00 0.00 N ATOM 647 CA ASP A 39 0.987 13.129 21.659 1.00 0.00 C ATOM 648 C ASP A 39 1.879 14.315 22.095 1.00 0.00 C ATOM 649 O ASP A 39 1.411 15.252 22.747 1.00 0.00 O ATOM 650 CB ASP A 39 0.852 12.069 22.781 1.00 0.00 C ATOM 651 CG ASP A 39 0.229 12.586 24.083 1.00 0.00 C ATOM 652 OD1 ASP A 39 -0.960 12.969 24.071 1.00 0.00 O ATOM 653 OD2 ASP A 39 0.919 12.601 25.124 1.00 0.00 O ATOM 0 H ASP A 39 2.049 11.608 20.684 1.00 0.00 H new ATOM 0 HA ASP A 39 0.004 13.543 21.436 1.00 0.00 H new ATOM 0 HB2 ASP A 39 0.248 11.242 22.409 1.00 0.00 H new ATOM 0 HB3 ASP A 39 1.841 11.667 23.002 1.00 0.00 H new ATOM 658 N GLN A 40 3.177 14.249 21.725 1.00 0.00 N ATOM 659 CA GLN A 40 4.186 15.293 22.031 1.00 0.00 C ATOM 660 C GLN A 40 4.438 16.218 20.830 1.00 0.00 C ATOM 661 O GLN A 40 4.759 17.388 21.013 1.00 0.00 O ATOM 662 CB GLN A 40 5.525 14.641 22.516 1.00 0.00 C ATOM 663 CG GLN A 40 5.633 14.418 24.033 1.00 0.00 C ATOM 664 CD GLN A 40 4.467 13.627 24.629 1.00 0.00 C ATOM 665 OE1 GLN A 40 3.458 14.196 25.026 1.00 0.00 O ATOM 666 NE2 GLN A 40 4.607 12.326 24.708 1.00 0.00 N ATOM 0 H GLN A 40 3.560 13.463 21.200 1.00 0.00 H new ATOM 0 HA GLN A 40 3.784 15.908 22.836 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.645 13.681 22.014 1.00 0.00 H new ATOM 0 HB3 GLN A 40 6.354 15.273 22.198 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.563 13.892 24.247 1.00 0.00 H new ATOM 0 HG3 GLN A 40 5.693 15.387 24.529 1.00 0.00 H new ATOM 0 HE21 GLN A 40 5.461 11.883 24.368 1.00 0.00 H new ATOM 0 HE22 GLN A 40 3.862 11.756 25.110 1.00 0.00 H new ATOM 675 N GLN A 41 4.320 15.694 19.609 1.00 0.00 N ATOM 676 CA GLN A 41 4.537 16.486 18.377 1.00 0.00 C ATOM 677 C GLN A 41 3.189 16.838 17.720 1.00 0.00 C ATOM 678 O GLN A 41 2.372 15.960 17.424 1.00 0.00 O ATOM 679 CB GLN A 41 5.524 15.747 17.426 1.00 0.00 C ATOM 680 CG GLN A 41 5.213 14.274 17.076 1.00 0.00 C ATOM 681 CD GLN A 41 4.403 14.056 15.806 1.00 0.00 C ATOM 682 OE1 GLN A 41 4.372 14.889 14.911 1.00 0.00 O ATOM 683 NE2 GLN A 41 3.852 12.880 15.676 1.00 0.00 N ATOM 0 H GLN A 41 4.074 14.719 19.437 1.00 0.00 H new ATOM 0 HA GLN A 41 5.009 17.436 18.627 1.00 0.00 H new ATOM 0 HB2 GLN A 41 5.577 16.310 16.494 1.00 0.00 H new ATOM 0 HB3 GLN A 41 6.516 15.783 17.877 1.00 0.00 H new ATOM 0 HG2 GLN A 41 6.156 13.735 16.981 1.00 0.00 H new ATOM 0 HG3 GLN A 41 4.673 13.827 17.911 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.896 12.209 16.443 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.377 12.632 14.808 1.00 0.00 H new ATOM 692 N ARG A 42 2.966 18.151 17.520 1.00 0.00 N ATOM 693 CA ARG A 42 1.672 18.722 17.107 1.00 0.00 C ATOM 694 C ARG A 42 1.801 19.352 15.711 1.00 0.00 C ATOM 695 O ARG A 42 2.683 20.183 15.480 1.00 0.00 O ATOM 696 CB ARG A 42 1.251 19.788 18.151 1.00 0.00 C ATOM 697 CG ARG A 42 -0.212 20.250 18.085 1.00 0.00 C ATOM 698 CD ARG A 42 -0.537 21.227 19.225 1.00 0.00 C ATOM 699 NE ARG A 42 -1.955 21.607 19.248 1.00 0.00 N ATOM 700 CZ ARG A 42 -2.564 22.281 20.239 1.00 0.00 C ATOM 701 NH1 ARG A 42 -1.895 22.697 21.316 1.00 0.00 N ATOM 702 NH2 ARG A 42 -3.854 22.549 20.138 1.00 0.00 N ATOM 0 H ARG A 42 3.693 18.856 17.643 1.00 0.00 H new ATOM 0 HA ARG A 42 0.913 17.941 17.057 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.441 19.388 19.147 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.893 20.660 18.030 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.402 20.731 17.125 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -0.873 19.385 18.144 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -0.270 20.771 20.178 1.00 0.00 H new ATOM 0 HD3 ARG A 42 0.075 22.123 19.118 1.00 0.00 H new ATOM 0 HE ARG A 42 -2.525 21.337 18.446 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -0.897 22.505 21.402 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.382 23.207 22.053 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.375 22.245 19.315 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -4.329 23.060 20.883 1.00 0.00 H new ATOM 716 N LEU A 43 0.897 18.977 14.803 1.00 0.00 N ATOM 717 CA LEU A 43 0.974 19.344 13.375 1.00 0.00 C ATOM 718 C LEU A 43 0.158 20.610 13.100 1.00 0.00 C ATOM 719 O LEU A 43 -1.038 20.637 13.382 1.00 0.00 O ATOM 720 CB LEU A 43 0.463 18.156 12.500 1.00 0.00 C ATOM 721 CG LEU A 43 1.504 17.051 12.159 1.00 0.00 C ATOM 722 CD1 LEU A 43 2.642 17.639 11.300 1.00 0.00 C ATOM 723 CD2 LEU A 43 2.037 16.376 13.439 1.00 0.00 C ATOM 0 H LEU A 43 0.083 18.406 15.033 1.00 0.00 H new ATOM 0 HA LEU A 43 2.012 19.552 13.116 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.376 17.688 13.015 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.076 18.562 11.565 1.00 0.00 H new ATOM 0 HG LEU A 43 1.012 16.274 11.574 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.364 16.856 11.068 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.229 18.038 10.374 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.138 18.438 11.851 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.763 15.608 13.170 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.517 17.123 14.072 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.209 15.919 13.981 1.00 0.00 H new ATOM 735 N ILE A 44 0.830 21.667 12.579 1.00 0.00 N ATOM 736 CA ILE A 44 0.194 22.952 12.208 1.00 0.00 C ATOM 737 C ILE A 44 0.846 23.513 10.920 1.00 0.00 C ATOM 738 O ILE A 44 2.063 23.673 10.858 1.00 0.00 O ATOM 739 CB ILE A 44 0.294 24.008 13.392 1.00 0.00 C ATOM 740 CG1 ILE A 44 -0.514 23.502 14.636 1.00 0.00 C ATOM 741 CG2 ILE A 44 -0.196 25.422 12.958 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.255 24.234 15.922 1.00 0.00 C ATOM 0 H ILE A 44 1.835 21.649 12.404 1.00 0.00 H new ATOM 0 HA ILE A 44 -0.864 22.768 12.018 1.00 0.00 H new ATOM 0 HB ILE A 44 1.346 24.102 13.662 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.578 23.571 14.408 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.288 22.447 14.788 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.110 26.111 13.798 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.416 25.781 12.130 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.237 25.365 12.641 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -0.865 23.803 16.715 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.799 24.145 16.185 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.511 25.287 15.799 1.00 0.00 H new ATOM 754 N PHE A 45 0.015 23.811 9.905 1.00 0.00 N ATOM 755 CA PHE A 45 0.444 24.404 8.616 1.00 0.00 C ATOM 756 C PHE A 45 -0.297 25.727 8.406 1.00 0.00 C ATOM 757 O PHE A 45 -1.517 25.735 8.430 1.00 0.00 O ATOM 758 CB PHE A 45 0.129 23.424 7.453 1.00 0.00 C ATOM 759 CG PHE A 45 0.389 23.972 6.037 1.00 0.00 C ATOM 760 CD1 PHE A 45 1.680 24.023 5.512 1.00 0.00 C ATOM 761 CD2 PHE A 45 -0.663 24.406 5.220 1.00 0.00 C ATOM 762 CE1 PHE A 45 1.919 24.486 4.233 1.00 0.00 C ATOM 763 CE2 PHE A 45 -0.420 24.870 3.942 1.00 0.00 C ATOM 764 CZ PHE A 45 0.869 24.907 3.447 1.00 0.00 C ATOM 0 H PHE A 45 -0.990 23.646 9.954 1.00 0.00 H new ATOM 0 HA PHE A 45 1.518 24.588 8.634 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.725 22.522 7.590 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.918 23.129 7.523 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.511 23.693 6.119 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.676 24.377 5.594 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.928 24.518 3.849 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.242 25.206 3.327 1.00 0.00 H new ATOM 0 HZ PHE A 45 1.053 25.266 2.445 1.00 0.00 H new ATOM 774 N ALA A 46 0.443 26.835 8.229 1.00 0.00 N ATOM 775 CA ALA A 46 -0.132 28.169 7.904 1.00 0.00 C ATOM 776 C ALA A 46 -1.140 28.666 8.976 1.00 0.00 C ATOM 777 O ALA A 46 -1.989 29.517 8.692 1.00 0.00 O ATOM 778 CB ALA A 46 -0.772 28.155 6.493 1.00 0.00 C ATOM 0 H ALA A 46 1.460 26.840 8.306 1.00 0.00 H new ATOM 0 HA ALA A 46 0.692 28.883 7.907 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.187 29.138 6.272 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.013 27.907 5.751 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.567 27.410 6.461 1.00 0.00 H new ATOM 784 N GLY A 47 -1.019 28.134 10.214 1.00 0.00 N ATOM 785 CA GLY A 47 -1.873 28.532 11.339 1.00 0.00 C ATOM 786 C GLY A 47 -3.021 27.561 11.635 1.00 0.00 C ATOM 787 O GLY A 47 -3.653 27.661 12.695 1.00 0.00 O ATOM 0 H GLY A 47 -0.329 27.422 10.453 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.255 28.629 12.232 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.291 29.517 11.132 1.00 0.00 H new ATOM 791 N LYS A 48 -3.299 26.622 10.710 1.00 0.00 N ATOM 792 CA LYS A 48 -4.379 25.617 10.879 1.00 0.00 C ATOM 793 C LYS A 48 -3.787 24.330 11.499 1.00 0.00 C ATOM 794 O LYS A 48 -2.713 23.873 11.084 1.00 0.00 O ATOM 795 CB LYS A 48 -5.080 25.330 9.501 1.00 0.00 C ATOM 796 CG LYS A 48 -4.287 24.431 8.507 1.00 0.00 C ATOM 797 CD LYS A 48 -4.672 24.625 7.021 1.00 0.00 C ATOM 798 CE LYS A 48 -4.257 25.984 6.451 1.00 0.00 C ATOM 799 NZ LYS A 48 -4.540 26.069 4.996 1.00 0.00 N ATOM 0 H LYS A 48 -2.789 26.534 9.831 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.141 26.005 11.555 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.043 24.859 9.697 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.284 26.284 9.014 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.222 24.634 8.623 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.444 23.387 8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.209 23.836 6.429 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.751 24.511 6.916 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.790 26.778 6.974 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.193 26.145 6.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -3.989 26.847 4.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.275 25.174 4.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.554 26.246 4.849 1.00 0.00 H new ATOM 813 N GLN A 49 -4.456 23.780 12.531 1.00 0.00 N ATOM 814 CA GLN A 49 -4.052 22.495 13.137 1.00 0.00 C ATOM 815 C GLN A 49 -4.477 21.340 12.217 1.00 0.00 C ATOM 816 O GLN A 49 -5.589 21.348 11.672 1.00 0.00 O ATOM 817 CB GLN A 49 -4.664 22.316 14.554 1.00 0.00 C ATOM 818 CG GLN A 49 -4.268 20.997 15.258 1.00 0.00 C ATOM 819 CD GLN A 49 -4.928 20.816 16.629 1.00 0.00 C ATOM 820 OE1 GLN A 49 -4.371 21.201 17.650 1.00 0.00 O ATOM 821 NE2 GLN A 49 -6.133 20.265 16.654 1.00 0.00 N ATOM 0 H GLN A 49 -5.277 24.204 12.962 1.00 0.00 H new ATOM 0 HA GLN A 49 -2.968 22.491 13.249 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -4.355 23.154 15.179 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.750 22.360 14.476 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -4.540 20.157 14.619 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.185 20.969 15.378 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -6.570 19.955 15.786 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.624 20.151 17.541 1.00 0.00 H new ATOM 830 N LEU A 50 -3.589 20.356 12.030 1.00 0.00 N ATOM 831 CA LEU A 50 -3.819 19.256 11.099 1.00 0.00 C ATOM 832 C LEU A 50 -4.478 18.048 11.812 1.00 0.00 C ATOM 833 O LEU A 50 -3.910 17.470 12.751 1.00 0.00 O ATOM 834 CB LEU A 50 -2.495 18.860 10.417 1.00 0.00 C ATOM 835 CG LEU A 50 -1.631 20.020 9.812 1.00 0.00 C ATOM 836 CD1 LEU A 50 -0.435 19.449 9.037 1.00 0.00 C ATOM 837 CD2 LEU A 50 -2.463 20.988 8.939 1.00 0.00 C ATOM 0 H LEU A 50 -2.696 20.304 12.520 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.515 19.588 10.328 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.884 18.328 11.146 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -2.723 18.155 9.617 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.253 20.612 10.645 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.155 20.267 8.623 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.186 18.858 9.710 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.796 18.816 8.226 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.815 21.771 8.546 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.911 20.438 8.111 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.250 21.438 9.544 1.00 0.00 H new ATOM 849 N GLU A 51 -5.681 17.695 11.333 1.00 0.00 N ATOM 850 CA GLU A 51 -6.535 16.631 11.883 1.00 0.00 C ATOM 851 C GLU A 51 -6.173 15.266 11.272 1.00 0.00 C ATOM 852 O GLU A 51 -5.976 15.168 10.057 1.00 0.00 O ATOM 853 CB GLU A 51 -8.006 17.010 11.571 1.00 0.00 C ATOM 854 CG GLU A 51 -9.081 15.990 11.992 1.00 0.00 C ATOM 855 CD GLU A 51 -10.499 16.556 11.836 1.00 0.00 C ATOM 856 OE1 GLU A 51 -11.082 16.432 10.740 1.00 0.00 O ATOM 857 OE2 GLU A 51 -11.020 17.161 12.800 1.00 0.00 O ATOM 0 H GLU A 51 -6.100 18.157 10.526 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.388 16.542 12.959 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.225 17.959 12.060 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.095 17.177 10.498 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.982 15.088 11.388 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -8.918 15.699 13.030 1.00 0.00 H new ATOM 864 N ASP A 52 -6.169 14.227 12.127 1.00 0.00 N ATOM 865 CA ASP A 52 -5.689 12.866 11.800 1.00 0.00 C ATOM 866 C ASP A 52 -6.414 12.252 10.592 1.00 0.00 C ATOM 867 O ASP A 52 -5.768 11.680 9.705 1.00 0.00 O ATOM 868 CB ASP A 52 -5.867 11.941 13.036 1.00 0.00 C ATOM 869 CG ASP A 52 -4.918 12.294 14.192 1.00 0.00 C ATOM 870 OD1 ASP A 52 -5.110 13.350 14.835 1.00 0.00 O ATOM 871 OD2 ASP A 52 -3.953 11.544 14.440 1.00 0.00 O ATOM 0 H ASP A 52 -6.506 14.309 13.086 1.00 0.00 H new ATOM 0 HA ASP A 52 -4.636 12.953 11.534 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -6.897 12.006 13.386 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.697 10.907 12.736 1.00 0.00 H new ATOM 876 N GLY A 53 -7.752 12.388 10.581 1.00 0.00 N ATOM 877 CA GLY A 53 -8.607 11.780 9.555 1.00 0.00 C ATOM 878 C GLY A 53 -8.420 12.389 8.169 1.00 0.00 C ATOM 879 O GLY A 53 -8.633 11.715 7.152 1.00 0.00 O ATOM 0 H GLY A 53 -8.266 12.921 11.282 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -8.397 10.711 9.505 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.650 11.887 9.852 1.00 0.00 H new ATOM 883 N ARG A 54 -7.999 13.666 8.136 1.00 0.00 N ATOM 884 CA ARG A 54 -7.818 14.441 6.890 1.00 0.00 C ATOM 885 C ARG A 54 -6.483 14.121 6.205 1.00 0.00 C ATOM 886 O ARG A 54 -5.690 13.333 6.714 1.00 0.00 O ATOM 887 CB ARG A 54 -7.912 15.951 7.194 1.00 0.00 C ATOM 888 CG ARG A 54 -9.283 16.399 7.741 1.00 0.00 C ATOM 889 CD ARG A 54 -9.366 17.914 7.876 1.00 0.00 C ATOM 890 NE ARG A 54 -10.694 18.398 8.277 1.00 0.00 N ATOM 891 CZ ARG A 54 -11.188 19.606 7.957 1.00 0.00 C ATOM 892 NH1 ARG A 54 -10.537 20.410 7.114 1.00 0.00 N ATOM 893 NH2 ARG A 54 -12.362 19.985 8.433 1.00 0.00 N ATOM 0 H ARG A 54 -7.773 14.195 8.978 1.00 0.00 H new ATOM 0 HA ARG A 54 -8.614 14.156 6.202 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.141 16.214 7.918 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -7.697 16.508 6.282 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.073 16.049 7.076 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -9.456 15.937 8.713 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -8.631 18.246 8.610 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.095 18.370 6.924 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.279 17.776 8.835 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -9.653 20.110 6.704 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -10.924 21.324 6.880 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -12.891 19.361 9.042 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -12.739 20.902 8.191 1.00 0.00 H new ATOM 907 N THR A 55 -6.258 14.744 5.038 1.00 0.00 N ATOM 908 CA THR A 55 -5.027 14.577 4.242 1.00 0.00 C ATOM 909 C THR A 55 -4.244 15.892 4.199 1.00 0.00 C ATOM 910 O THR A 55 -4.769 16.953 4.576 1.00 0.00 O ATOM 911 CB THR A 55 -5.351 14.123 2.778 1.00 0.00 C ATOM 912 OG1 THR A 55 -6.258 15.054 2.168 1.00 0.00 O ATOM 913 CG2 THR A 55 -5.957 12.716 2.731 1.00 0.00 C ATOM 0 H THR A 55 -6.930 15.384 4.615 1.00 0.00 H new ATOM 0 HA THR A 55 -4.427 13.804 4.721 1.00 0.00 H new ATOM 0 HB THR A 55 -4.410 14.100 2.229 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.456 14.766 1.252 1.00 0.00 H new ATOM 0 HG21 THR A 55 -6.165 12.444 1.696 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.253 12.002 3.159 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.884 12.700 3.304 1.00 0.00 H new ATOM 921 N LEU A 56 -2.987 15.806 3.724 1.00 0.00 N ATOM 922 CA LEU A 56 -2.138 16.988 3.481 1.00 0.00 C ATOM 923 C LEU A 56 -2.854 17.949 2.510 1.00 0.00 C ATOM 924 O LEU A 56 -3.074 19.120 2.828 1.00 0.00 O ATOM 925 CB LEU A 56 -0.755 16.564 2.899 1.00 0.00 C ATOM 926 CG LEU A 56 0.214 15.796 3.854 1.00 0.00 C ATOM 927 CD1 LEU A 56 1.458 15.279 3.088 1.00 0.00 C ATOM 928 CD2 LEU A 56 0.644 16.683 5.052 1.00 0.00 C ATOM 0 H LEU A 56 -2.533 14.921 3.499 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.965 17.497 4.429 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -0.934 15.939 2.024 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.245 17.462 2.550 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.328 14.936 4.247 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.115 14.748 3.777 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.141 14.602 2.295 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.994 16.123 2.653 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.318 16.120 5.698 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.155 17.572 4.682 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.238 16.981 5.619 1.00 0.00 H new ATOM 940 N SER A 57 -3.286 17.389 1.366 1.00 0.00 N ATOM 941 CA SER A 57 -3.918 18.133 0.267 1.00 0.00 C ATOM 942 C SER A 57 -5.254 18.758 0.703 1.00 0.00 C ATOM 943 O SER A 57 -5.688 19.750 0.111 1.00 0.00 O ATOM 944 CB SER A 57 -4.114 17.204 -0.953 1.00 0.00 C ATOM 945 OG SER A 57 -4.613 17.910 -2.082 1.00 0.00 O ATOM 0 H SER A 57 -3.203 16.390 1.178 1.00 0.00 H new ATOM 0 HA SER A 57 -3.257 18.952 -0.016 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.164 16.735 -1.209 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.805 16.402 -0.692 1.00 0.00 H new ATOM 0 HG SER A 57 -4.722 17.290 -2.833 1.00 0.00 H new ATOM 951 N ASP A 58 -5.887 18.196 1.766 1.00 0.00 N ATOM 952 CA ASP A 58 -7.140 18.750 2.324 1.00 0.00 C ATOM 953 C ASP A 58 -6.862 20.132 2.935 1.00 0.00 C ATOM 954 O ASP A 58 -7.619 21.092 2.734 1.00 0.00 O ATOM 955 CB ASP A 58 -7.734 17.801 3.398 1.00 0.00 C ATOM 956 CG ASP A 58 -9.099 18.275 3.933 1.00 0.00 C ATOM 957 OD1 ASP A 58 -9.142 19.115 4.858 1.00 0.00 O ATOM 958 OD2 ASP A 58 -10.141 17.818 3.415 1.00 0.00 O ATOM 0 H ASP A 58 -5.549 17.364 2.249 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.868 18.848 1.519 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -7.843 16.803 2.973 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.033 17.718 4.229 1.00 0.00 H new ATOM 963 N TYR A 59 -5.731 20.215 3.653 1.00 0.00 N ATOM 964 CA TYR A 59 -5.284 21.442 4.323 1.00 0.00 C ATOM 965 C TYR A 59 -4.400 22.321 3.403 1.00 0.00 C ATOM 966 O TYR A 59 -3.707 23.229 3.892 1.00 0.00 O ATOM 967 CB TYR A 59 -4.527 21.066 5.613 1.00 0.00 C ATOM 968 CG TYR A 59 -5.437 20.706 6.788 1.00 0.00 C ATOM 969 CD1 TYR A 59 -6.335 21.650 7.298 1.00 0.00 C ATOM 970 CD2 TYR A 59 -5.384 19.464 7.412 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.138 21.375 8.377 1.00 0.00 C ATOM 972 CE2 TYR A 59 -6.183 19.192 8.493 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.054 20.155 8.977 1.00 0.00 C ATOM 974 OH TYR A 59 -7.851 19.881 10.064 1.00 0.00 O ATOM 0 H TYR A 59 -5.098 19.426 3.785 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.163 22.037 4.571 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -3.871 20.221 5.403 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -3.889 21.901 5.904 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.398 22.621 6.830 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -4.708 18.707 7.042 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -7.829 22.118 8.746 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -6.133 18.224 8.969 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.435 20.244 10.874 1.00 0.00 H new ATOM 984 N ASN A 60 -4.439 22.030 2.079 1.00 0.00 N ATOM 985 CA ASN A 60 -3.745 22.803 1.014 1.00 0.00 C ATOM 986 C ASN A 60 -2.223 22.564 1.020 1.00 0.00 C ATOM 987 O ASN A 60 -1.471 23.278 0.349 1.00 0.00 O ATOM 988 CB ASN A 60 -4.085 24.332 1.075 1.00 0.00 C ATOM 989 CG ASN A 60 -5.565 24.675 0.812 1.00 0.00 C ATOM 990 OD1 ASN A 60 -6.493 23.881 1.326 1.00 0.00 O flip ATOM 991 ND2 ASN A 60 -5.872 25.692 0.199 1.00 0.00 N flip ATOM 0 H ASN A 60 -4.964 21.236 1.712 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.126 22.427 0.065 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -3.807 24.713 2.058 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -3.469 24.856 0.344 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.145 26.292 -0.190 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.855 25.938 0.078 1.00 0.00 H new ATOM 998 N ILE A 61 -1.786 21.519 1.741 1.00 0.00 N ATOM 999 CA ILE A 61 -0.375 21.099 1.806 1.00 0.00 C ATOM 1000 C ILE A 61 -0.076 20.192 0.595 1.00 0.00 C ATOM 1001 O ILE A 61 -0.880 19.316 0.251 1.00 0.00 O ATOM 1002 CB ILE A 61 -0.077 20.295 3.127 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -0.741 20.983 4.356 1.00 0.00 C ATOM 1004 CG2 ILE A 61 1.450 20.101 3.354 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -0.966 20.075 5.547 1.00 0.00 C ATOM 0 H ILE A 61 -2.408 20.936 2.301 1.00 0.00 H new ATOM 0 HA ILE A 61 0.254 21.989 1.796 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.515 19.304 3.012 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.116 21.820 4.668 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.700 21.399 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.613 19.542 4.275 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.875 19.550 2.515 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.933 21.075 3.431 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.432 20.641 6.353 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.618 19.251 5.258 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.010 19.678 5.888 1.00 0.00 H new ATOM 1017 N GLN A 62 1.080 20.396 -0.021 1.00 0.00 N ATOM 1018 CA GLN A 62 1.542 19.587 -1.161 1.00 0.00 C ATOM 1019 C GLN A 62 2.983 19.131 -0.900 1.00 0.00 C ATOM 1020 O GLN A 62 3.527 19.354 0.191 1.00 0.00 O ATOM 1021 CB GLN A 62 1.439 20.410 -2.478 1.00 0.00 C ATOM 1022 CG GLN A 62 2.333 21.664 -2.531 1.00 0.00 C ATOM 1023 CD GLN A 62 2.279 22.385 -3.876 1.00 0.00 C ATOM 1024 OE1 GLN A 62 1.475 23.298 -4.075 1.00 0.00 O ATOM 1025 NE2 GLN A 62 3.125 21.965 -4.807 1.00 0.00 N ATOM 0 H GLN A 62 1.734 21.130 0.251 1.00 0.00 H new ATOM 0 HA GLN A 62 0.910 18.706 -1.272 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.697 19.762 -3.315 1.00 0.00 H new ATOM 0 HB3 GLN A 62 0.402 20.715 -2.619 1.00 0.00 H new ATOM 0 HG2 GLN A 62 2.028 22.354 -1.744 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.363 21.377 -2.321 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.774 21.206 -4.601 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.126 22.401 -5.729 1.00 0.00 H new ATOM 1034 N LYS A 63 3.593 18.488 -1.904 1.00 0.00 N ATOM 1035 CA LYS A 63 5.015 18.109 -1.863 1.00 0.00 C ATOM 1036 C LYS A 63 5.918 19.338 -1.620 1.00 0.00 C ATOM 1037 O LYS A 63 5.628 20.436 -2.105 1.00 0.00 O ATOM 1038 CB LYS A 63 5.426 17.401 -3.179 1.00 0.00 C ATOM 1039 CG LYS A 63 5.129 18.199 -4.473 1.00 0.00 C ATOM 1040 CD LYS A 63 5.774 17.565 -5.729 1.00 0.00 C ATOM 1041 CE LYS A 63 7.312 17.554 -5.660 1.00 0.00 C ATOM 1042 NZ LYS A 63 7.925 16.930 -6.861 1.00 0.00 N ATOM 0 H LYS A 63 3.119 18.216 -2.765 1.00 0.00 H new ATOM 0 HA LYS A 63 5.149 17.419 -1.030 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.494 17.186 -3.140 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.910 16.443 -3.235 1.00 0.00 H new ATOM 0 HG2 LYS A 63 4.050 18.262 -4.616 1.00 0.00 H new ATOM 0 HG3 LYS A 63 5.495 19.219 -4.358 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.411 16.543 -5.843 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.457 18.117 -6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.676 18.576 -5.558 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.630 17.012 -4.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.961 16.945 -6.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.599 15.946 -6.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.645 17.461 -7.710 1.00 0.00 H new ATOM 1056 N GLU A 64 6.968 19.124 -0.808 1.00 0.00 N ATOM 1057 CA GLU A 64 8.005 20.115 -0.467 1.00 0.00 C ATOM 1058 C GLU A 64 7.472 21.287 0.382 1.00 0.00 C ATOM 1059 O GLU A 64 8.230 22.213 0.672 1.00 0.00 O ATOM 1060 CB GLU A 64 8.751 20.616 -1.745 1.00 0.00 C ATOM 1061 CG GLU A 64 9.405 19.490 -2.580 1.00 0.00 C ATOM 1062 CD GLU A 64 10.503 18.722 -1.821 1.00 0.00 C ATOM 1063 OE1 GLU A 64 11.680 19.149 -1.862 1.00 0.00 O ATOM 1064 OE2 GLU A 64 10.199 17.689 -1.184 1.00 0.00 O ATOM 0 H GLU A 64 7.124 18.224 -0.355 1.00 0.00 H new ATOM 0 HA GLU A 64 8.728 19.598 0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 64 8.045 21.157 -2.375 1.00 0.00 H new ATOM 0 HB3 GLU A 64 9.522 21.327 -1.447 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.634 18.788 -2.896 1.00 0.00 H new ATOM 0 HG3 GLU A 64 9.833 19.921 -3.485 1.00 0.00 H new ATOM 1071 N SER A 65 6.190 21.231 0.818 1.00 0.00 N ATOM 1072 CA SER A 65 5.606 22.287 1.661 1.00 0.00 C ATOM 1073 C SER A 65 6.214 22.254 3.073 1.00 0.00 C ATOM 1074 O SER A 65 6.338 21.179 3.684 1.00 0.00 O ATOM 1075 CB SER A 65 4.075 22.129 1.738 1.00 0.00 C ATOM 1076 OG SER A 65 3.486 22.223 0.453 1.00 0.00 O ATOM 0 H SER A 65 5.549 20.468 0.598 1.00 0.00 H new ATOM 0 HA SER A 65 5.837 23.251 1.208 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.828 21.166 2.185 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.659 22.898 2.389 1.00 0.00 H new ATOM 0 HG SER A 65 2.744 22.862 0.479 1.00 0.00 H new ATOM 1082 N THR A 66 6.602 23.436 3.569 1.00 0.00 N ATOM 1083 CA THR A 66 7.165 23.600 4.909 1.00 0.00 C ATOM 1084 C THR A 66 6.056 24.046 5.874 1.00 0.00 C ATOM 1085 O THR A 66 5.401 25.073 5.658 1.00 0.00 O ATOM 1086 CB THR A 66 8.347 24.625 4.926 1.00 0.00 C ATOM 1087 OG1 THR A 66 9.334 24.242 3.948 1.00 0.00 O ATOM 1088 CG2 THR A 66 9.021 24.715 6.317 1.00 0.00 C ATOM 0 H THR A 66 6.532 24.309 3.046 1.00 0.00 H new ATOM 0 HA THR A 66 7.570 22.640 5.228 1.00 0.00 H new ATOM 0 HB THR A 66 7.933 25.605 4.689 1.00 0.00 H new ATOM 0 HG1 THR A 66 10.073 24.886 3.959 1.00 0.00 H new ATOM 0 HG21 THR A 66 9.835 25.438 6.281 1.00 0.00 H new ATOM 0 HG22 THR A 66 8.287 25.032 7.057 1.00 0.00 H new ATOM 0 HG23 THR A 66 9.416 23.738 6.594 1.00 0.00 H new ATOM 1096 N LEU A 67 5.844 23.238 6.909 1.00 0.00 N ATOM 1097 CA LEU A 67 4.900 23.499 7.994 1.00 0.00 C ATOM 1098 C LEU A 67 5.641 23.471 9.330 1.00 0.00 C ATOM 1099 O LEU A 67 6.841 23.193 9.384 1.00 0.00 O ATOM 1100 CB LEU A 67 3.722 22.484 7.996 1.00 0.00 C ATOM 1101 CG LEU A 67 4.073 20.957 7.953 1.00 0.00 C ATOM 1102 CD1 LEU A 67 2.934 20.112 8.558 1.00 0.00 C ATOM 1103 CD2 LEU A 67 4.388 20.478 6.507 1.00 0.00 C ATOM 0 H LEU A 67 6.341 22.354 7.020 1.00 0.00 H new ATOM 0 HA LEU A 67 4.466 24.487 7.839 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.125 22.665 8.890 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.087 22.706 7.138 1.00 0.00 H new ATOM 0 HG LEU A 67 4.971 20.817 8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 67 3.202 19.056 8.516 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.775 20.405 9.596 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.018 20.276 7.990 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.626 19.414 6.520 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.520 20.648 5.870 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.239 21.036 6.116 1.00 0.00 H new ATOM 1115 N HIS A 68 4.914 23.797 10.401 1.00 0.00 N ATOM 1116 CA HIS A 68 5.471 23.923 11.758 1.00 0.00 C ATOM 1117 C HIS A 68 5.065 22.720 12.625 1.00 0.00 C ATOM 1118 O HIS A 68 3.986 22.131 12.446 1.00 0.00 O ATOM 1119 CB HIS A 68 5.000 25.252 12.394 1.00 0.00 C ATOM 1120 CG HIS A 68 5.428 26.481 11.620 1.00 0.00 C ATOM 1121 ND1 HIS A 68 6.331 27.402 12.101 1.00 0.00 N ATOM 1122 CD2 HIS A 68 5.073 26.928 10.387 1.00 0.00 C ATOM 1123 CE1 HIS A 68 6.507 28.349 11.205 1.00 0.00 C ATOM 1124 NE2 HIS A 68 5.758 28.087 10.159 1.00 0.00 N ATOM 0 H HIS A 68 3.912 23.984 10.355 1.00 0.00 H new ATOM 0 HA HIS A 68 6.559 23.933 11.697 1.00 0.00 H new ATOM 0 HB2 HIS A 68 3.913 25.242 12.472 1.00 0.00 H new ATOM 0 HB3 HIS A 68 5.391 25.318 13.409 1.00 0.00 H new ATOM 0 HD2 HIS A 68 4.377 26.454 9.711 1.00 0.00 H new ATOM 0 HE1 HIS A 68 7.160 29.202 11.312 1.00 0.00 H new ATOM 0 HE2 HIS A 68 5.698 28.656 9.315 1.00 0.00 H new ATOM 1133 N LEU A 69 5.951 22.378 13.569 1.00 0.00 N ATOM 1134 CA LEU A 69 5.793 21.248 14.482 1.00 0.00 C ATOM 1135 C LEU A 69 5.989 21.778 15.901 1.00 0.00 C ATOM 1136 O LEU A 69 7.041 22.348 16.219 1.00 0.00 O ATOM 1137 CB LEU A 69 6.833 20.139 14.121 1.00 0.00 C ATOM 1138 CG LEU A 69 6.662 18.711 14.755 1.00 0.00 C ATOM 1139 CD1 LEU A 69 7.032 18.675 16.250 1.00 0.00 C ATOM 1140 CD2 LEU A 69 5.238 18.159 14.510 1.00 0.00 C ATOM 0 H LEU A 69 6.818 22.895 13.719 1.00 0.00 H new ATOM 0 HA LEU A 69 4.804 20.798 14.402 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.830 20.022 13.037 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.820 20.508 14.399 1.00 0.00 H new ATOM 0 HG LEU A 69 7.371 18.056 14.248 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.895 17.664 16.635 1.00 0.00 H new ATOM 0 HD12 LEU A 69 8.073 18.972 16.374 1.00 0.00 H new ATOM 0 HD13 LEU A 69 6.390 19.363 16.800 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.149 17.170 14.960 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.506 18.829 14.960 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.055 18.088 13.438 1.00 0.00 H new ATOM 1152 N VAL A 70 4.976 21.587 16.742 1.00 0.00 N ATOM 1153 CA VAL A 70 4.986 22.045 18.132 1.00 0.00 C ATOM 1154 C VAL A 70 5.303 20.871 19.062 1.00 0.00 C ATOM 1155 O VAL A 70 4.515 19.925 19.169 1.00 0.00 O ATOM 1156 CB VAL A 70 3.609 22.694 18.521 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.613 23.210 19.983 1.00 0.00 C ATOM 1158 CG2 VAL A 70 3.225 23.809 17.514 1.00 0.00 C ATOM 0 H VAL A 70 4.116 21.106 16.477 1.00 0.00 H new ATOM 0 HA VAL A 70 5.758 22.807 18.240 1.00 0.00 H new ATOM 0 HB VAL A 70 2.844 21.920 18.465 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.644 23.652 20.215 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.805 22.379 20.662 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.393 23.962 20.101 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.268 24.245 17.802 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.993 24.583 17.518 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.144 23.384 16.514 1.00 0.00 H new ATOM 1168 N LEU A 71 6.474 20.935 19.702 1.00 0.00 N ATOM 1169 CA LEU A 71 6.872 19.966 20.727 1.00 0.00 C ATOM 1170 C LEU A 71 6.158 20.289 22.053 1.00 0.00 C ATOM 1171 O LEU A 71 5.895 21.460 22.359 1.00 0.00 O ATOM 1172 CB LEU A 71 8.401 19.980 20.924 1.00 0.00 C ATOM 1173 CG LEU A 71 9.269 19.577 19.693 1.00 0.00 C ATOM 1174 CD1 LEU A 71 10.768 19.771 20.003 1.00 0.00 C ATOM 1175 CD2 LEU A 71 8.973 18.124 19.240 1.00 0.00 C ATOM 0 H LEU A 71 7.171 21.658 19.525 1.00 0.00 H new ATOM 0 HA LEU A 71 6.581 18.968 20.399 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.695 20.983 21.234 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.644 19.308 21.747 1.00 0.00 H new ATOM 0 HG LEU A 71 9.003 20.233 18.864 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.359 19.485 19.133 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.958 20.817 20.243 1.00 0.00 H new ATOM 0 HD13 LEU A 71 11.047 19.148 20.853 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.596 17.877 18.380 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.193 17.436 20.057 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.922 18.036 18.964 1.00 0.00 H new ATOM 1187 N ARG A 72 5.827 19.234 22.810 1.00 0.00 N ATOM 1188 CA ARG A 72 5.072 19.339 24.078 1.00 0.00 C ATOM 1189 C ARG A 72 5.865 18.729 25.248 1.00 0.00 C ATOM 1190 O ARG A 72 5.674 19.123 26.391 1.00 0.00 O ATOM 1191 CB ARG A 72 3.696 18.644 23.903 1.00 0.00 C ATOM 1192 CG ARG A 72 2.812 19.298 22.811 1.00 0.00 C ATOM 1193 CD ARG A 72 1.601 18.443 22.406 1.00 0.00 C ATOM 1194 NE ARG A 72 0.769 18.064 23.560 1.00 0.00 N ATOM 1195 CZ ARG A 72 -0.288 18.749 24.017 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -0.651 19.896 23.458 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -0.969 18.285 25.051 1.00 0.00 N ATOM 0 H ARG A 72 6.074 18.276 22.563 1.00 0.00 H new ATOM 0 HA ARG A 72 4.913 20.390 24.319 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.856 17.596 23.651 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.163 18.666 24.853 1.00 0.00 H new ATOM 0 HG2 ARG A 72 2.460 20.264 23.171 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.422 19.490 21.928 1.00 0.00 H new ATOM 0 HD2 ARG A 72 0.993 18.996 21.689 1.00 0.00 H new ATOM 0 HD3 ARG A 72 1.949 17.542 21.901 1.00 0.00 H new ATOM 0 HE ARG A 72 1.018 17.207 24.054 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.123 20.268 22.669 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -1.458 20.406 23.817 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -0.689 17.411 25.496 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.775 18.801 25.404 1.00 0.00 H new ATOM 1211 N LEU A 73 6.730 17.739 24.938 1.00 0.00 N ATOM 1212 CA LEU A 73 7.635 17.068 25.918 1.00 0.00 C ATOM 1213 C LEU A 73 6.899 16.564 27.183 1.00 0.00 C ATOM 1214 O LEU A 73 7.502 16.441 28.258 1.00 0.00 O ATOM 1215 CB LEU A 73 8.854 17.978 26.323 1.00 0.00 C ATOM 1216 CG LEU A 73 9.862 18.409 25.198 1.00 0.00 C ATOM 1217 CD1 LEU A 73 10.292 17.216 24.312 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.328 19.598 24.367 1.00 0.00 C ATOM 0 H LEU A 73 6.826 17.373 23.991 1.00 0.00 H new ATOM 0 HA LEU A 73 8.019 16.192 25.396 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.456 18.884 26.779 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.419 17.455 27.094 1.00 0.00 H new ATOM 0 HG LEU A 73 10.764 18.760 25.699 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.989 17.562 23.549 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.777 16.460 24.930 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.414 16.784 23.832 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.057 19.863 23.601 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.388 19.317 23.892 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.162 20.454 25.021 1.00 0.00 H new ATOM 1230 N ARG A 74 5.606 16.226 27.032 1.00 0.00 N ATOM 1231 CA ARG A 74 4.779 15.678 28.138 1.00 0.00 C ATOM 1232 C ARG A 74 5.195 14.212 28.436 1.00 0.00 C ATOM 1233 O ARG A 74 4.825 13.639 29.461 1.00 0.00 O ATOM 1234 CB ARG A 74 3.260 15.763 27.790 1.00 0.00 C ATOM 1235 CG ARG A 74 2.746 17.163 27.386 1.00 0.00 C ATOM 1236 CD ARG A 74 2.841 18.217 28.507 1.00 0.00 C ATOM 1237 NE ARG A 74 2.258 19.508 28.074 1.00 0.00 N ATOM 1238 CZ ARG A 74 2.952 20.619 27.776 1.00 0.00 C ATOM 1239 NH1 ARG A 74 4.245 20.697 28.034 1.00 0.00 N ATOM 1240 NH2 ARG A 74 2.334 21.672 27.260 1.00 0.00 N ATOM 0 H ARG A 74 5.102 16.321 26.150 1.00 0.00 H new ATOM 0 HA ARG A 74 4.950 16.278 29.032 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.053 15.070 26.974 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.688 15.420 28.652 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.315 17.512 26.525 1.00 0.00 H new ATOM 0 HG3 ARG A 74 1.707 17.079 27.068 1.00 0.00 H new ATOM 0 HD2 ARG A 74 2.319 17.858 29.394 1.00 0.00 H new ATOM 0 HD3 ARG A 74 3.884 18.361 28.788 1.00 0.00 H new ATOM 0 HE ARG A 74 1.242 19.558 27.995 1.00 0.00 H new ATOM 0 HH11 ARG A 74 4.728 19.908 28.464 1.00 0.00 H new ATOM 0 HH12 ARG A 74 4.761 21.546 27.803 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.329 21.640 27.088 1.00 0.00 H new ATOM 0 HH22 ARG A 74 2.863 22.514 27.035 1.00 0.00 H new ATOM 1254 N GLY A 75 5.952 13.625 27.495 1.00 0.00 N ATOM 1255 CA GLY A 75 6.587 12.321 27.653 1.00 0.00 C ATOM 1256 C GLY A 75 7.907 12.264 26.895 1.00 0.00 C ATOM 1257 O GLY A 75 8.362 11.186 26.499 1.00 0.00 O ATOM 0 H GLY A 75 6.139 14.057 26.590 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.761 12.123 28.711 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.919 11.540 27.288 1.00 0.00 H new ATOM 1261 N GLY A 76 8.523 13.458 26.716 1.00 0.00 N ATOM 1262 CA GLY A 76 9.786 13.618 25.996 1.00 0.00 C ATOM 1263 C GLY A 76 9.709 13.188 24.529 1.00 0.00 C ATOM 1264 O GLY A 76 8.991 13.805 23.732 1.00 0.00 O ATOM 0 H GLY A 76 8.146 14.335 27.074 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.094 14.663 26.045 1.00 0.00 H new ATOM 0 HA3 GLY A 76 10.558 13.035 26.498 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 14.506 16.658 21.449 1.00 0.00 N ATOM 1270 CA GLY B 195 14.422 16.559 22.906 1.00 0.00 C ATOM 1271 C GLY B 195 14.650 17.897 23.596 1.00 0.00 C ATOM 1272 O GLY B 195 15.385 18.748 23.084 1.00 0.00 O ATOM 0 HA2 GLY B 195 13.442 16.173 23.185 1.00 0.00 H new ATOM 0 HA3 GLY B 195 15.161 15.840 23.261 1.00 0.00 H new ATOM 1276 N SER B 196 14.034 18.061 24.775 1.00 0.00 N ATOM 1277 CA SER B 196 14.162 19.268 25.609 1.00 0.00 C ATOM 1278 C SER B 196 13.785 18.921 27.061 1.00 0.00 C ATOM 1279 O SER B 196 12.900 18.083 27.295 1.00 0.00 O ATOM 1280 CB SER B 196 13.275 20.415 25.066 1.00 0.00 C ATOM 1281 OG SER B 196 13.428 21.605 25.825 1.00 0.00 O ATOM 0 H SER B 196 13.425 17.352 25.183 1.00 0.00 H new ATOM 0 HA SER B 196 15.195 19.615 25.579 1.00 0.00 H new ATOM 0 HB2 SER B 196 13.533 20.612 24.025 1.00 0.00 H new ATOM 0 HB3 SER B 196 12.230 20.105 25.083 1.00 0.00 H new ATOM 0 HG SER B 196 12.619 22.152 25.743 1.00 0.00 H new ATOM 1287 N ARG B 197 14.478 19.556 28.025 1.00 0.00 N ATOM 1288 CA ARG B 197 14.316 19.292 29.474 1.00 0.00 C ATOM 1289 C ARG B 197 13.723 20.524 30.183 1.00 0.00 C ATOM 1290 O ARG B 197 12.739 20.423 30.921 1.00 0.00 O ATOM 1291 CB ARG B 197 15.703 18.927 30.098 1.00 0.00 C ATOM 1292 CG ARG B 197 16.420 17.690 29.487 1.00 0.00 C ATOM 1293 CD ARG B 197 15.722 16.344 29.788 1.00 0.00 C ATOM 1294 NE ARG B 197 14.442 16.187 29.073 1.00 0.00 N ATOM 1295 CZ ARG B 197 13.356 15.556 29.546 1.00 0.00 C ATOM 1296 NH1 ARG B 197 13.365 14.982 30.741 1.00 0.00 N ATOM 1297 NH2 ARG B 197 12.257 15.518 28.805 1.00 0.00 N ATOM 0 H ARG B 197 15.173 20.274 27.822 1.00 0.00 H new ATOM 0 HA ARG B 197 13.630 18.456 29.607 1.00 0.00 H new ATOM 0 HB2 ARG B 197 16.362 19.790 29.999 1.00 0.00 H new ATOM 0 HB3 ARG B 197 15.565 18.752 31.165 1.00 0.00 H new ATOM 0 HG2 ARG B 197 16.487 17.819 28.407 1.00 0.00 H new ATOM 0 HG3 ARG B 197 17.441 17.651 29.867 1.00 0.00 H new ATOM 0 HD2 ARG B 197 16.388 15.526 29.513 1.00 0.00 H new ATOM 0 HD3 ARG B 197 15.545 16.265 30.861 1.00 0.00 H new ATOM 0 HE ARG B 197 14.376 16.593 28.139 1.00 0.00 H new ATOM 0 HH11 ARG B 197 14.206 15.016 31.317 1.00 0.00 H new ATOM 0 HH12 ARG B 197 12.531 14.507 31.085 1.00 0.00 H new ATOM 0 HH21 ARG B 197 12.244 15.965 27.888 1.00 0.00 H new ATOM 0 HH22 ARG B 197 11.424 15.042 29.152 1.00 0.00 H new ATOM 1311 N GLN B 198 14.351 21.682 29.944 1.00 0.00 N ATOM 1312 CA GLN B 198 13.996 22.959 30.595 1.00 0.00 C ATOM 1313 C GLN B 198 12.864 23.686 29.838 1.00 0.00 C ATOM 1314 O GLN B 198 12.422 23.229 28.773 1.00 0.00 O ATOM 1315 CB GLN B 198 15.261 23.859 30.679 1.00 0.00 C ATOM 1316 CG GLN B 198 16.435 23.236 31.473 1.00 0.00 C ATOM 1317 CD GLN B 198 17.676 24.134 31.546 1.00 0.00 C ATOM 1318 OE1 GLN B 198 17.578 25.357 31.542 1.00 0.00 O ATOM 1319 NE2 GLN B 198 18.853 23.532 31.627 1.00 0.00 N ATOM 0 H GLN B 198 15.128 21.765 29.288 1.00 0.00 H new ATOM 0 HA GLN B 198 13.629 22.747 31.599 1.00 0.00 H new ATOM 0 HB2 GLN B 198 15.600 24.084 29.668 1.00 0.00 H new ATOM 0 HB3 GLN B 198 14.988 24.807 31.142 1.00 0.00 H new ATOM 0 HG2 GLN B 198 16.099 23.013 32.486 1.00 0.00 H new ATOM 0 HG3 GLN B 198 16.711 22.287 31.012 1.00 0.00 H new ATOM 0 HE21 GLN B 198 18.906 22.513 31.628 1.00 0.00 H new ATOM 0 HE22 GLN B 198 19.707 24.087 31.688 1.00 0.00 H new ATOM 1328 N VAL B 199 12.410 24.818 30.421 1.00 0.00 N ATOM 1329 CA VAL B 199 11.388 25.700 29.829 1.00 0.00 C ATOM 1330 C VAL B 199 11.812 26.160 28.408 1.00 0.00 C ATOM 1331 O VAL B 199 12.831 26.840 28.236 1.00 0.00 O ATOM 1332 CB VAL B 199 11.098 26.929 30.780 1.00 0.00 C ATOM 1333 CG1 VAL B 199 12.393 27.686 31.187 1.00 0.00 C ATOM 1334 CG2 VAL B 199 10.041 27.885 30.170 1.00 0.00 C ATOM 0 H VAL B 199 12.749 25.145 31.326 1.00 0.00 H new ATOM 0 HA VAL B 199 10.461 25.137 29.725 1.00 0.00 H new ATOM 0 HB VAL B 199 10.678 26.520 31.699 1.00 0.00 H new ATOM 0 HG11 VAL B 199 12.137 28.520 31.840 1.00 0.00 H new ATOM 0 HG12 VAL B 199 13.062 27.005 31.714 1.00 0.00 H new ATOM 0 HG13 VAL B 199 12.890 28.064 30.293 1.00 0.00 H new ATOM 0 HG21 VAL B 199 9.867 28.718 30.851 1.00 0.00 H new ATOM 0 HG22 VAL B 199 10.403 28.267 29.216 1.00 0.00 H new ATOM 0 HG23 VAL B 199 9.108 27.344 30.014 1.00 0.00 H new ATOM 1344 N THR B 200 11.044 25.736 27.396 1.00 0.00 N ATOM 1345 CA THR B 200 11.400 25.928 25.985 1.00 0.00 C ATOM 1346 C THR B 200 10.690 27.170 25.424 1.00 0.00 C ATOM 1347 O THR B 200 9.465 27.181 25.310 1.00 0.00 O ATOM 1348 CB THR B 200 11.013 24.650 25.159 1.00 0.00 C ATOM 1349 OG1 THR B 200 11.374 23.467 25.894 1.00 0.00 O ATOM 1350 CG2 THR B 200 11.702 24.606 23.778 1.00 0.00 C ATOM 0 H THR B 200 10.158 25.250 27.533 1.00 0.00 H new ATOM 0 HA THR B 200 12.476 26.082 25.906 1.00 0.00 H new ATOM 0 HB THR B 200 9.936 24.692 24.996 1.00 0.00 H new ATOM 0 HG1 THR B 200 11.808 23.724 26.734 1.00 0.00 H new ATOM 0 HG21 THR B 200 11.400 23.702 23.249 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.410 25.481 23.198 1.00 0.00 H new ATOM 0 HG23 THR B 200 12.784 24.604 23.911 1.00 0.00 H new ATOM 1358 N LYS B 201 11.459 28.228 25.106 1.00 0.00 N ATOM 1359 CA LYS B 201 10.904 29.443 24.481 1.00 0.00 C ATOM 1360 C LYS B 201 10.856 29.212 22.963 1.00 0.00 C ATOM 1361 O LYS B 201 11.878 28.906 22.334 1.00 0.00 O ATOM 1362 CB LYS B 201 11.728 30.720 24.833 1.00 0.00 C ATOM 1363 CG LYS B 201 11.621 31.217 26.307 1.00 0.00 C ATOM 1364 CD LYS B 201 12.295 30.278 27.339 1.00 0.00 C ATOM 1365 CE LYS B 201 13.817 30.155 27.137 1.00 0.00 C ATOM 1366 NZ LYS B 201 14.421 29.177 28.080 1.00 0.00 N ATOM 0 H LYS B 201 12.465 28.266 25.271 1.00 0.00 H new ATOM 0 HA LYS B 201 9.902 29.622 24.870 1.00 0.00 H new ATOM 0 HB2 LYS B 201 12.777 30.524 24.612 1.00 0.00 H new ATOM 0 HB3 LYS B 201 11.409 31.527 24.174 1.00 0.00 H new ATOM 0 HG2 LYS B 201 12.074 32.206 26.380 1.00 0.00 H new ATOM 0 HG3 LYS B 201 10.568 31.329 26.566 1.00 0.00 H new ATOM 0 HD2 LYS B 201 12.096 30.650 28.344 1.00 0.00 H new ATOM 0 HD3 LYS B 201 11.844 29.288 27.270 1.00 0.00 H new ATOM 0 HE2 LYS B 201 14.024 29.847 26.112 1.00 0.00 H new ATOM 0 HE3 LYS B 201 14.282 31.131 27.277 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 15.379 28.930 27.758 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 14.473 29.597 29.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 13.835 28.319 28.113 1.00 0.00 H new ATOM 1380 N VAL B 202 9.658 29.347 22.402 1.00 0.00 N ATOM 1381 CA VAL B 202 9.326 28.955 21.018 1.00 0.00 C ATOM 1382 C VAL B 202 8.302 29.947 20.433 1.00 0.00 C ATOM 1383 O VAL B 202 7.958 30.930 21.087 1.00 0.00 O ATOM 1384 CB VAL B 202 8.772 27.470 20.974 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.911 26.424 21.123 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.683 27.244 22.056 1.00 0.00 C ATOM 0 H VAL B 202 8.863 29.742 22.904 1.00 0.00 H new ATOM 0 HA VAL B 202 10.230 28.986 20.410 1.00 0.00 H new ATOM 0 HB VAL B 202 8.317 27.329 19.993 1.00 0.00 H new ATOM 0 HG11 VAL B 202 9.489 25.419 21.088 1.00 0.00 H new ATOM 0 HG12 VAL B 202 10.626 26.546 20.309 1.00 0.00 H new ATOM 0 HG13 VAL B 202 10.418 26.571 22.077 1.00 0.00 H new ATOM 0 HG21 VAL B 202 7.323 26.217 22.001 1.00 0.00 H new ATOM 0 HG22 VAL B 202 8.107 27.427 23.043 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.853 27.929 21.885 1.00 0.00 H new ATOM 1396 N ASP B 203 7.844 29.710 19.190 1.00 0.00 N ATOM 1397 CA ASP B 203 6.894 30.622 18.496 1.00 0.00 C ATOM 1398 C ASP B 203 5.537 29.951 18.300 1.00 0.00 C ATOM 1399 O ASP B 203 5.466 28.743 18.117 1.00 0.00 O ATOM 1400 CB ASP B 203 7.463 31.085 17.130 1.00 0.00 C ATOM 1401 CG ASP B 203 8.767 31.877 17.283 1.00 0.00 C ATOM 1402 OD1 ASP B 203 8.722 33.019 17.779 1.00 0.00 O ATOM 1403 OD2 ASP B 203 9.841 31.359 16.917 1.00 0.00 O ATOM 0 H ASP B 203 8.113 28.895 18.638 1.00 0.00 H new ATOM 0 HA ASP B 203 6.759 31.499 19.128 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.641 30.214 16.499 1.00 0.00 H new ATOM 0 HB3 ASP B 203 6.723 31.702 16.621 1.00 0.00 H new ATOM 1408 N CYS B 204 4.465 30.765 18.343 1.00 0.00 N ATOM 1409 CA CYS B 204 3.075 30.326 18.109 1.00 0.00 C ATOM 1410 C CYS B 204 2.785 30.391 16.600 1.00 0.00 C ATOM 1411 O CYS B 204 2.573 31.480 16.089 1.00 0.00 O ATOM 1412 CB CYS B 204 2.102 31.231 18.911 1.00 0.00 C ATOM 1413 SG CYS B 204 0.324 30.791 18.857 1.00 0.00 S ATOM 0 H CYS B 204 4.541 31.762 18.544 1.00 0.00 H new ATOM 0 HA CYS B 204 2.935 29.300 18.449 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.420 31.230 19.954 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.210 32.252 18.546 1.00 0.00 H new ATOM 1418 N PRO B 205 2.795 29.232 15.853 1.00 0.00 N ATOM 1419 CA PRO B 205 2.683 29.216 14.359 1.00 0.00 C ATOM 1420 C PRO B 205 1.333 29.714 13.791 1.00 0.00 C ATOM 1421 O PRO B 205 1.129 29.683 12.573 1.00 0.00 O ATOM 1422 CB PRO B 205 2.931 27.726 14.009 1.00 0.00 C ATOM 1423 CG PRO B 205 2.528 26.978 15.240 1.00 0.00 C ATOM 1424 CD PRO B 205 2.959 27.853 16.387 1.00 0.00 C ATOM 0 HA PRO B 205 3.391 29.913 13.911 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.340 27.418 13.146 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.977 27.546 13.760 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.452 26.802 15.260 1.00 0.00 H new ATOM 0 HG3 PRO B 205 3.012 26.002 15.285 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.342 27.689 17.271 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.991 27.655 16.677 1.00 0.00 H new ATOM 1432 N VAL B 206 0.422 30.160 14.665 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.865 30.733 14.247 1.00 0.00 C ATOM 1434 C VAL B 206 -0.805 32.278 14.241 1.00 0.00 C ATOM 1435 O VAL B 206 -1.147 32.913 13.238 1.00 0.00 O ATOM 1436 CB VAL B 206 -2.048 30.240 15.158 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.409 30.686 14.568 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -1.994 28.700 15.372 1.00 0.00 C ATOM 0 H VAL B 206 0.554 30.135 15.676 1.00 0.00 H new ATOM 0 HA VAL B 206 -1.056 30.384 13.232 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.939 30.703 16.139 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.217 30.336 15.211 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.440 31.774 14.506 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.530 30.262 13.571 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.825 28.391 16.006 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -2.066 28.196 14.408 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -1.053 28.432 15.852 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.358 32.883 15.367 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.353 34.367 15.528 1.00 0.00 C ATOM 1450 C CYS B 207 1.081 34.944 15.634 1.00 0.00 C ATOM 1451 O CYS B 207 1.246 36.122 15.952 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.210 34.792 16.747 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.444 34.485 18.364 1.00 0.00 S ATOM 0 H CYS B 207 0.002 32.376 16.175 1.00 0.00 H new ATOM 0 HA CYS B 207 -0.799 34.786 14.626 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.433 35.856 16.663 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.162 34.263 16.706 1.00 0.00 H new ATOM 1458 N GLY B 208 2.104 34.098 15.384 1.00 0.00 N ATOM 1459 CA GLY B 208 3.512 34.530 15.222 1.00 0.00 C ATOM 1460 C GLY B 208 4.125 35.277 16.413 1.00 0.00 C ATOM 1461 O GLY B 208 4.833 36.271 16.220 1.00 0.00 O ATOM 0 H GLY B 208 1.977 33.091 15.288 1.00 0.00 H new ATOM 0 HA2 GLY B 208 4.121 33.649 15.018 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.576 35.172 14.343 1.00 0.00 H new ATOM 1465 N VAL B 209 3.857 34.802 17.646 1.00 0.00 N ATOM 1466 CA VAL B 209 4.392 35.425 18.887 1.00 0.00 C ATOM 1467 C VAL B 209 5.356 34.457 19.611 1.00 0.00 C ATOM 1468 O VAL B 209 5.105 33.247 19.659 1.00 0.00 O ATOM 1469 CB VAL B 209 3.233 35.874 19.865 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.335 36.953 19.214 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.387 34.672 20.348 1.00 0.00 C ATOM 0 H VAL B 209 3.271 33.985 17.816 1.00 0.00 H new ATOM 0 HA VAL B 209 4.942 36.318 18.590 1.00 0.00 H new ATOM 0 HB VAL B 209 3.709 36.313 20.742 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.548 37.241 19.911 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.938 37.827 18.966 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.886 36.553 18.305 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.602 35.025 21.017 1.00 0.00 H new ATOM 0 HG22 VAL B 209 1.935 34.176 19.489 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.027 33.967 20.879 1.00 0.00 H new ATOM 1481 N ASN B 210 6.453 35.003 20.175 1.00 0.00 N ATOM 1482 CA ASN B 210 7.461 34.209 20.909 1.00 0.00 C ATOM 1483 C ASN B 210 7.063 34.091 22.394 1.00 0.00 C ATOM 1484 O ASN B 210 7.065 35.081 23.134 1.00 0.00 O ATOM 1485 CB ASN B 210 8.877 34.819 20.758 1.00 0.00 C ATOM 1486 CG ASN B 210 9.948 34.010 21.503 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.312 34.325 22.636 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.417 32.934 20.891 1.00 0.00 N ATOM 0 H ASN B 210 6.665 36.000 20.135 1.00 0.00 H new ATOM 0 HA ASN B 210 7.491 33.209 20.477 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.136 34.871 19.700 1.00 0.00 H new ATOM 0 HB3 ASN B 210 8.871 35.842 21.135 1.00 0.00 H new ATOM 0 HD21 ASN B 210 11.100 32.338 21.359 1.00 0.00 H new ATOM 0 HD22 ASN B 210 10.095 32.700 19.952 1.00 0.00 H new ATOM 1495 N ILE B 211 6.726 32.861 22.799 1.00 0.00 N ATOM 1496 CA ILE B 211 6.185 32.514 24.130 1.00 0.00 C ATOM 1497 C ILE B 211 6.783 31.156 24.600 1.00 0.00 C ATOM 1498 O ILE B 211 7.205 30.358 23.760 1.00 0.00 O ATOM 1499 CB ILE B 211 4.605 32.412 24.055 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.202 31.538 22.821 1.00 0.00 C ATOM 1501 CG2 ILE B 211 3.939 33.816 24.014 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.722 31.436 22.566 1.00 0.00 C ATOM 0 H ILE B 211 6.824 32.047 22.192 1.00 0.00 H new ATOM 0 HA ILE B 211 6.458 33.291 24.844 1.00 0.00 H new ATOM 0 HB ILE B 211 4.238 31.929 24.961 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.680 31.950 21.932 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.601 30.533 22.961 1.00 0.00 H new ATOM 0 HG21 ILE B 211 2.856 33.704 23.963 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.204 34.371 24.914 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.289 34.359 23.136 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.546 30.810 21.691 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.233 30.993 23.434 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.314 32.431 22.388 1.00 0.00 H new ATOM 1514 N PRO B 212 6.833 30.866 25.946 1.00 0.00 N ATOM 1515 CA PRO B 212 7.296 29.548 26.470 1.00 0.00 C ATOM 1516 C PRO B 212 6.338 28.395 26.069 1.00 0.00 C ATOM 1517 O PRO B 212 5.186 28.644 25.716 1.00 0.00 O ATOM 1518 CB PRO B 212 7.335 29.768 28.002 1.00 0.00 C ATOM 1519 CG PRO B 212 6.340 30.857 28.247 1.00 0.00 C ATOM 1520 CD PRO B 212 6.460 31.784 27.057 1.00 0.00 C ATOM 0 HA PRO B 212 8.261 29.246 26.064 1.00 0.00 H new ATOM 0 HB2 PRO B 212 7.069 28.859 28.541 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.331 30.057 28.337 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.330 30.455 28.332 1.00 0.00 H new ATOM 0 HG3 PRO B 212 6.553 31.382 29.178 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.523 32.302 26.854 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.219 32.550 27.218 1.00 0.00 H new ATOM 1528 N GLU B 213 6.829 27.148 26.168 1.00 0.00 N ATOM 1529 CA GLU B 213 6.188 25.956 25.567 1.00 0.00 C ATOM 1530 C GLU B 213 4.822 25.611 26.218 1.00 0.00 C ATOM 1531 O GLU B 213 3.878 25.210 25.523 1.00 0.00 O ATOM 1532 CB GLU B 213 7.192 24.767 25.600 1.00 0.00 C ATOM 1533 CG GLU B 213 6.748 23.468 24.872 1.00 0.00 C ATOM 1534 CD GLU B 213 5.926 22.516 25.761 1.00 0.00 C ATOM 1535 OE1 GLU B 213 6.511 21.908 26.679 1.00 0.00 O ATOM 1536 OE2 GLU B 213 4.695 22.401 25.579 1.00 0.00 O ATOM 0 H GLU B 213 7.690 26.932 26.671 1.00 0.00 H new ATOM 0 HA GLU B 213 5.945 26.178 24.528 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.132 25.101 25.160 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.397 24.522 26.642 1.00 0.00 H new ATOM 0 HG2 GLU B 213 6.157 23.736 23.996 1.00 0.00 H new ATOM 0 HG3 GLU B 213 7.632 22.943 24.511 1.00 0.00 H new ATOM 1543 N SER B 214 4.711 25.761 27.540 1.00 0.00 N ATOM 1544 CA SER B 214 3.424 25.622 28.257 1.00 0.00 C ATOM 1545 C SER B 214 2.382 26.600 27.662 1.00 0.00 C ATOM 1546 O SER B 214 1.248 26.221 27.323 1.00 0.00 O ATOM 1547 CB SER B 214 3.635 25.883 29.770 1.00 0.00 C ATOM 1548 OG SER B 214 2.431 25.739 30.509 1.00 0.00 O ATOM 0 H SER B 214 5.500 25.981 28.148 1.00 0.00 H new ATOM 0 HA SER B 214 3.046 24.607 28.135 1.00 0.00 H new ATOM 0 HB2 SER B 214 4.382 25.190 30.156 1.00 0.00 H new ATOM 0 HB3 SER B 214 4.029 26.889 29.913 1.00 0.00 H new ATOM 0 HG SER B 214 2.607 25.910 31.458 1.00 0.00 H new ATOM 1554 N HIS B 215 2.835 27.843 27.442 1.00 0.00 N ATOM 1555 CA HIS B 215 1.996 28.927 26.910 1.00 0.00 C ATOM 1556 C HIS B 215 1.843 28.838 25.389 1.00 0.00 C ATOM 1557 O HIS B 215 0.952 29.480 24.844 1.00 0.00 O ATOM 1558 CB HIS B 215 2.575 30.300 27.314 1.00 0.00 C ATOM 1559 CG HIS B 215 2.439 30.596 28.781 1.00 0.00 C ATOM 1560 ND1 HIS B 215 3.339 30.165 29.729 1.00 0.00 N ATOM 1561 CD2 HIS B 215 1.479 31.269 29.458 1.00 0.00 C ATOM 1562 CE1 HIS B 215 2.944 30.569 30.915 1.00 0.00 C ATOM 1563 NE2 HIS B 215 1.822 31.240 30.779 1.00 0.00 N ATOM 0 H HIS B 215 3.797 28.126 27.629 1.00 0.00 H new ATOM 0 HA HIS B 215 1.002 28.817 27.344 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.629 30.337 27.040 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.070 31.081 26.745 1.00 0.00 H new ATOM 0 HD2 HIS B 215 0.605 31.741 29.033 1.00 0.00 H new ATOM 0 HE1 HIS B 215 3.456 30.381 31.847 1.00 0.00 H new ATOM 0 HE2 HIS B 215 1.293 31.670 31.538 1.00 0.00 H new ATOM 1572 N ILE B 216 2.709 28.053 24.700 1.00 0.00 N ATOM 1573 CA ILE B 216 2.628 27.905 23.234 1.00 0.00 C ATOM 1574 C ILE B 216 1.413 27.032 22.909 1.00 0.00 C ATOM 1575 O ILE B 216 0.553 27.459 22.147 1.00 0.00 O ATOM 1576 CB ILE B 216 3.986 27.394 22.539 1.00 0.00 C ATOM 1577 CG1 ILE B 216 4.122 27.931 21.070 1.00 0.00 C ATOM 1578 CG2 ILE B 216 4.158 25.851 22.531 1.00 0.00 C ATOM 1579 CD1 ILE B 216 3.215 27.279 20.038 1.00 0.00 C ATOM 0 H ILE B 216 3.462 27.520 25.135 1.00 0.00 H new ATOM 0 HA ILE B 216 2.496 28.894 22.795 1.00 0.00 H new ATOM 0 HB ILE B 216 4.780 27.804 23.163 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.922 29.003 21.076 1.00 0.00 H new ATOM 0 HG13 ILE B 216 5.156 27.801 20.750 1.00 0.00 H new ATOM 0 HG21 ILE B 216 5.098 25.592 22.045 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.166 25.480 23.556 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.331 25.395 21.987 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.394 27.727 19.061 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.426 26.211 19.991 1.00 0.00 H new ATOM 0 HD13 ILE B 216 2.173 27.431 20.321 1.00 0.00 H new ATOM 1591 N ASN B 217 1.307 25.867 23.576 1.00 0.00 N ATOM 1592 CA ASN B 217 0.204 24.924 23.354 1.00 0.00 C ATOM 1593 C ASN B 217 -1.128 25.513 23.828 1.00 0.00 C ATOM 1594 O ASN B 217 -2.153 25.321 23.168 1.00 0.00 O ATOM 1595 CB ASN B 217 0.499 23.554 24.014 1.00 0.00 C ATOM 1596 CG ASN B 217 1.483 22.725 23.186 1.00 0.00 C ATOM 1597 OD1 ASN B 217 1.074 22.026 22.252 1.00 0.00 O ATOM 1598 ND2 ASN B 217 2.769 22.797 23.499 1.00 0.00 N ATOM 0 H ASN B 217 1.980 25.558 24.278 1.00 0.00 H new ATOM 0 HA ASN B 217 0.117 24.752 22.281 1.00 0.00 H new ATOM 0 HB2 ASN B 217 0.907 23.712 25.012 1.00 0.00 H new ATOM 0 HB3 ASN B 217 -0.432 23.000 24.134 1.00 0.00 H new ATOM 0 HD21 ASN B 217 3.455 22.266 22.963 1.00 0.00 H new ATOM 0 HD22 ASN B 217 3.073 23.384 24.276 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.088 26.268 24.943 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.264 27.007 25.452 1.00 0.00 C ATOM 1607 C LYS B 218 -2.757 28.042 24.414 1.00 0.00 C ATOM 1608 O LYS B 218 -3.967 28.112 24.096 1.00 0.00 O ATOM 1609 CB LYS B 218 -1.913 27.700 26.802 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.112 28.383 27.514 1.00 0.00 C ATOM 1611 CD LYS B 218 -4.241 27.384 27.883 1.00 0.00 C ATOM 1612 CE LYS B 218 -3.761 26.264 28.829 1.00 0.00 C ATOM 1613 NZ LYS B 218 -4.821 25.251 29.085 1.00 0.00 N ATOM 0 H LYS B 218 -0.250 26.384 25.512 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.074 26.298 25.623 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.484 26.957 27.475 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.142 28.449 26.620 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -2.758 28.875 28.420 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -3.518 29.160 26.867 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -5.060 27.926 28.355 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -4.638 26.938 26.971 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -2.889 25.774 28.396 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -3.443 26.702 29.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -4.454 24.518 29.725 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -5.644 25.713 29.523 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -5.107 24.813 28.186 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.787 28.808 23.866 1.00 0.00 N ATOM 1628 CA HIS B 219 -2.044 29.822 22.827 1.00 0.00 C ATOM 1629 C HIS B 219 -2.687 29.173 21.607 1.00 0.00 C ATOM 1630 O HIS B 219 -3.588 29.745 21.038 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.728 30.560 22.400 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.731 32.054 22.620 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.697 32.953 21.571 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.725 32.747 23.785 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.676 34.151 22.133 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.690 34.074 23.465 1.00 0.00 N ATOM 0 H HIS B 219 -0.805 28.738 24.134 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.724 30.561 23.250 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.107 30.129 22.952 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.547 30.364 21.343 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -0.744 32.328 24.780 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.651 35.079 21.580 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.677 34.857 24.119 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.208 27.966 21.238 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.681 27.244 20.046 1.00 0.00 C ATOM 1646 C LEU B 220 -4.164 26.934 20.133 1.00 0.00 C ATOM 1647 O LEU B 220 -4.890 27.242 19.214 1.00 0.00 O ATOM 1648 CB LEU B 220 -1.885 25.938 19.841 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.382 26.126 19.538 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.352 24.780 19.484 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.165 26.968 18.264 1.00 0.00 C ATOM 0 H LEU B 220 -1.485 27.469 21.759 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.518 27.897 19.189 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -1.985 25.326 20.737 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.338 25.380 19.021 1.00 0.00 H new ATOM 0 HG LEU B 220 0.057 26.688 20.363 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.407 24.949 19.269 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.254 24.273 20.444 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.083 24.160 18.701 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.903 27.081 18.080 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.629 26.468 17.414 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.616 27.951 18.397 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.593 26.362 21.265 1.00 0.00 N ATOM 1664 CA ASP B 221 -6.000 25.957 21.480 1.00 0.00 C ATOM 1665 C ASP B 221 -6.957 27.163 21.471 1.00 0.00 C ATOM 1666 O ASP B 221 -8.151 27.010 21.195 1.00 0.00 O ATOM 1667 CB ASP B 221 -6.133 25.151 22.792 1.00 0.00 C ATOM 1668 CG ASP B 221 -5.519 23.747 22.678 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -4.311 23.590 22.931 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -6.235 22.798 22.302 1.00 0.00 O ATOM 0 H ASP B 221 -3.983 26.165 22.058 1.00 0.00 H new ATOM 0 HA ASP B 221 -6.290 25.317 20.647 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -5.644 25.694 23.601 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -7.187 25.064 23.057 1.00 0.00 H new ATOM 1675 N SER B 222 -6.419 28.353 21.786 1.00 0.00 N ATOM 1676 CA SER B 222 -7.153 29.624 21.642 1.00 0.00 C ATOM 1677 C SER B 222 -7.094 30.124 20.175 1.00 0.00 C ATOM 1678 O SER B 222 -8.101 30.554 19.606 1.00 0.00 O ATOM 1679 CB SER B 222 -6.562 30.681 22.608 1.00 0.00 C ATOM 1680 OG SER B 222 -7.310 31.888 22.584 1.00 0.00 O ATOM 0 H SER B 222 -5.471 28.462 22.145 1.00 0.00 H new ATOM 0 HA SER B 222 -8.200 29.461 21.898 1.00 0.00 H new ATOM 0 HB2 SER B 222 -6.549 30.281 23.622 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.528 30.888 22.333 1.00 0.00 H new ATOM 0 HG SER B 222 -6.911 32.532 23.205 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.902 29.997 19.569 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.550 30.634 18.288 1.00 0.00 C ATOM 1688 C CYS B 223 -6.068 29.854 17.058 1.00 0.00 C ATOM 1689 O CYS B 223 -6.349 30.457 16.019 1.00 0.00 O ATOM 1690 CB CYS B 223 -4.012 30.831 18.221 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.400 32.107 19.378 1.00 0.00 S ATOM 0 H CYS B 223 -5.143 29.440 19.961 1.00 0.00 H new ATOM 0 HA CYS B 223 -6.049 31.603 18.251 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.521 29.883 18.442 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.731 31.106 17.204 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.237 28.517 17.188 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.586 27.630 16.048 1.00 0.00 C ATOM 1698 C LEU B 224 -8.091 27.711 15.732 1.00 0.00 C ATOM 1699 O LEU B 224 -8.569 27.052 14.795 1.00 0.00 O ATOM 1700 CB LEU B 224 -6.098 26.153 16.311 1.00 0.00 C ATOM 1701 CG LEU B 224 -6.725 25.349 17.523 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -8.125 24.756 17.226 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -5.766 24.234 18.006 1.00 0.00 C ATOM 0 H LEU B 224 -6.137 28.025 18.076 1.00 0.00 H new ATOM 0 HA LEU B 224 -6.058 27.979 15.160 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -6.281 25.578 15.403 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -5.018 26.183 16.457 1.00 0.00 H new ATOM 0 HG LEU B 224 -6.863 26.083 18.317 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -8.487 24.221 18.104 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -8.817 25.562 16.982 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -8.057 24.068 16.383 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -6.221 23.698 18.839 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -5.575 23.539 17.188 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -4.826 24.679 18.332 1.00 0.00 H new ATOM 1715 N SER B 225 -8.821 28.526 16.533 1.00 0.00 N ATOM 1716 CA SER B 225 -10.248 28.801 16.352 1.00 0.00 C ATOM 1717 C SER B 225 -10.479 29.581 15.036 1.00 0.00 C ATOM 1718 O SER B 225 -10.502 30.817 15.013 1.00 0.00 O ATOM 1719 CB SER B 225 -10.792 29.582 17.573 1.00 0.00 C ATOM 1720 OG SER B 225 -10.487 28.910 18.787 1.00 0.00 O ATOM 0 H SER B 225 -8.418 29.013 17.333 1.00 0.00 H new ATOM 0 HA SER B 225 -10.792 27.859 16.281 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.361 30.583 17.590 1.00 0.00 H new ATOM 0 HB3 SER B 225 -11.872 29.701 17.481 1.00 0.00 H new ATOM 0 HG SER B 225 -9.686 29.307 19.188 1.00 0.00 H new ATOM 1726 N ARG B 226 -10.551 28.817 13.935 1.00 0.00 N ATOM 1727 CA ARG B 226 -10.899 29.325 12.594 1.00 0.00 C ATOM 1728 C ARG B 226 -12.342 29.850 12.582 1.00 0.00 C ATOM 1729 O ARG B 226 -12.652 30.856 11.935 1.00 0.00 O ATOM 1730 CB ARG B 226 -10.738 28.195 11.525 1.00 0.00 C ATOM 1731 CG ARG B 226 -11.365 26.820 11.926 1.00 0.00 C ATOM 1732 CD ARG B 226 -11.952 26.038 10.738 1.00 0.00 C ATOM 1733 NE ARG B 226 -13.189 26.669 10.234 1.00 0.00 N ATOM 1734 CZ ARG B 226 -13.963 26.181 9.253 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -13.595 25.108 8.564 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -15.101 26.788 8.958 1.00 0.00 N ATOM 0 H ARG B 226 -10.367 27.814 13.949 1.00 0.00 H new ATOM 0 HA ARG B 226 -10.221 30.143 12.349 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -11.194 28.528 10.593 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -9.676 28.050 11.327 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -10.602 26.210 12.410 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -12.151 26.990 12.662 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -11.216 25.986 9.936 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -12.163 25.013 11.044 1.00 0.00 H new ATOM 0 HE ARG B 226 -13.478 27.546 10.667 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -12.713 24.643 8.778 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -14.194 24.749 7.821 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -15.384 27.620 9.475 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -15.695 26.423 8.214 1.00 0.00 H new ATOM 1750 N GLU B 227 -13.207 29.144 13.323 1.00 0.00 N ATOM 1751 CA GLU B 227 -14.635 29.435 13.403 1.00 0.00 C ATOM 1752 C GLU B 227 -14.896 30.381 14.600 1.00 0.00 C ATOM 1753 O GLU B 227 -14.747 29.941 15.761 1.00 0.00 O ATOM 1754 CB GLU B 227 -15.427 28.104 13.532 1.00 0.00 C ATOM 1755 CG GLU B 227 -16.949 28.243 13.328 1.00 0.00 C ATOM 1756 CD GLU B 227 -17.329 28.732 11.917 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -17.029 28.016 10.938 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -17.921 29.830 11.780 1.00 0.00 O ATOM 1759 OXT GLU B 227 -15.218 31.561 14.371 1.00 0.00 O ATOM 0 H GLU B 227 -12.925 28.344 13.890 1.00 0.00 H new ATOM 0 HA GLU B 227 -14.974 29.937 12.497 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -15.039 27.393 12.803 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -15.243 27.681 14.519 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -17.423 27.279 13.512 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -17.346 28.940 14.066 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.079 32.560 19.541 1.00 0.00 ZN