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 214 SER OG : rot 180:sc= -0.273 USER MOD Set 1.2: B 215 HIS : no HD1:sc= -0.949 K(o=-1.2,f=0.026) USER MOD Set 2.1: A 6 LYS NZ :NH3+ -131:sc= 1.28 (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot 180:sc= 0.988 USER MOD Set 3.1: A 7 THR OG1 : rot 134:sc= 0.4 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.917 USER MOD Set 4.1: A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 4.2: A 1 MET CE :methyl -177:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.0903 K(o=-0.09,f=-3.4!) USER MOD Single : A -1 SER OG : rot -67:sc= 0.212 USER MOD Single : A -2 GLY N :NH3+ 177:sc= 1.22 (180deg=1.2) USER MOD Single : A 11 LYS NZ :NH3+ 140:sc= -0.663 (180deg=-2.63!) USER MOD Single : A 14 THR OG1 : rot -76:sc= 0.202 USER MOD Single : A 20 SER OG : rot -45:sc= 0.291 USER MOD Single : A 22 THR OG1 : rot 29:sc= 0.519 USER MOD Single : A 25 ASN : amide:sc= -1.21 K(o=-1.2,f=-4.9!) USER MOD Single : A 27 LYS NZ :NH3+ -115:sc= 0.196 (180deg=-0.605) USER MOD Single : A 29 LYS NZ :NH3+ -164:sc= -0.0199 (180deg=-0.139) USER MOD Single : A 31 GLN : amide:sc= -0.69 X(o=-0.69,f=-0.3) USER MOD Single : A 33 LYS NZ :NH3+ -179:sc= 0.61 (180deg=0.608) USER MOD Single : A 40 GLN : amide:sc= -2.23 X(o=-2.2,f=-2.3!) USER MOD Single : A 41 GLN : amide:sc= -5.19! C(o=-5.2!,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -2.23! C(o=-2.2!,f=-3.6!) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0346 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -75:sc= -0.0473 USER MOD Single : A 60 ASN : amide:sc= -2! K(o=-2!,f=-0.056) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 0.244 (180deg=0.243) USER MOD Single : A 65 SER OG : rot -140:sc= -0.03 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 196 SER OG : rot 44:sc= 0.172 USER MOD Single : B 198 GLN : amide:sc= -0.624 K(o=-0.62,f=0) USER MOD Single : B 200 THR OG1 : rot 180:sc= 0 USER MOD Single : B 201 LYS NZ :NH3+ -154:sc= -0.607 (180deg=-1.91!) USER MOD Single : B 210 ASN : amide:sc= -0.121 X(o=-0.12,f=0) USER MOD Single : B 217 ASN : amide:sc= -1.12 K(o=-1.1,f=-7.4!) 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 102:sc= 0.538 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 -2.095 5.833 0.291 1.00 0.00 N ATOM 2 CA GLY A -2 -0.889 5.113 0.771 1.00 0.00 C ATOM 3 C GLY A -2 0.350 5.995 0.826 1.00 0.00 C ATOM 4 O GLY A -2 0.274 7.201 0.588 1.00 0.00 O ATOM 0 H1 GLY A -2 -2.893 5.169 0.227 1.00 0.00 H new ATOM 0 H2 GLY A -2 -2.332 6.596 0.957 1.00 0.00 H new ATOM 0 H3 GLY A -2 -1.906 6.239 -0.648 1.00 0.00 H new ATOM 0 HA2 GLY A -2 -1.085 4.710 1.765 1.00 0.00 H new ATOM 0 HA3 GLY A -2 -0.695 4.264 0.115 1.00 0.00 H new ATOM 10 N SER A -1 1.496 5.394 1.181 1.00 0.00 N ATOM 11 CA SER A -1 2.801 6.061 1.111 1.00 0.00 C ATOM 12 C SER A -1 3.237 6.204 -0.358 1.00 0.00 C ATOM 13 O SER A -1 3.349 5.198 -1.070 1.00 0.00 O ATOM 14 CB SER A -1 3.843 5.264 1.927 1.00 0.00 C ATOM 15 OG SER A -1 3.499 5.260 3.303 1.00 0.00 O ATOM 0 H SER A -1 1.542 4.434 1.524 1.00 0.00 H new ATOM 0 HA SER A -1 2.723 7.059 1.542 1.00 0.00 H new ATOM 0 HB2 SER A -1 3.898 4.240 1.557 1.00 0.00 H new ATOM 0 HB3 SER A -1 4.831 5.704 1.794 1.00 0.00 H new ATOM 0 HG SER A -1 3.581 6.168 3.663 1.00 0.00 H new ATOM 21 N HIS A 0 3.443 7.452 -0.823 1.00 0.00 N ATOM 22 CA HIS A 0 3.825 7.710 -2.223 1.00 0.00 C ATOM 23 C HIS A 0 4.611 9.028 -2.336 1.00 0.00 C ATOM 24 O HIS A 0 5.839 9.009 -2.520 1.00 0.00 O ATOM 25 CB HIS A 0 2.561 7.712 -3.141 1.00 0.00 C ATOM 26 CG HIS A 0 2.867 7.749 -4.619 1.00 0.00 C ATOM 27 ND1 HIS A 0 2.156 8.503 -5.525 1.00 0.00 N ATOM 28 CD2 HIS A 0 3.805 7.088 -5.346 1.00 0.00 C ATOM 29 CE1 HIS A 0 2.649 8.312 -6.733 1.00 0.00 C ATOM 30 NE2 HIS A 0 3.647 7.459 -6.654 1.00 0.00 N ATOM 0 H HIS A 0 3.352 8.292 -0.252 1.00 0.00 H new ATOM 0 HA HIS A 0 4.480 6.908 -2.562 1.00 0.00 H new ATOM 0 HB2 HIS A 0 1.969 6.822 -2.927 1.00 0.00 H new ATOM 0 HB3 HIS A 0 1.944 8.574 -2.888 1.00 0.00 H new ATOM 0 HD2 HIS A 0 4.541 6.397 -4.962 1.00 0.00 H new ATOM 0 HE1 HIS A 0 2.292 8.779 -7.639 1.00 0.00 H new ATOM 0 HE2 HIS A 0 4.210 7.129 -7.438 1.00 0.00 H new ATOM 39 N MET A 1 3.900 10.167 -2.209 1.00 0.00 N ATOM 40 CA MET A 1 4.491 11.514 -2.393 1.00 0.00 C ATOM 41 C MET A 1 5.218 11.957 -1.116 1.00 0.00 C ATOM 42 O MET A 1 5.058 11.352 -0.061 1.00 0.00 O ATOM 43 CB MET A 1 3.391 12.550 -2.757 1.00 0.00 C ATOM 44 CG MET A 1 2.594 12.214 -4.019 1.00 0.00 C ATOM 45 SD MET A 1 3.637 12.064 -5.484 1.00 0.00 S ATOM 46 CE MET A 1 2.409 11.895 -6.777 1.00 0.00 C ATOM 0 H MET A 1 2.907 10.183 -1.978 1.00 0.00 H new ATOM 0 HA MET A 1 5.209 11.461 -3.212 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.700 12.636 -1.919 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.858 13.526 -2.887 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.055 11.279 -3.865 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.846 12.989 -4.188 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.907 11.740 -7.734 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.767 11.042 -6.560 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.805 12.801 -6.825 1.00 0.00 H new ATOM 56 N GLN A 2 6.016 13.016 -1.227 1.00 0.00 N ATOM 57 CA GLN A 2 6.760 13.588 -0.094 1.00 0.00 C ATOM 58 C GLN A 2 6.249 14.988 0.230 1.00 0.00 C ATOM 59 O GLN A 2 6.005 15.772 -0.675 1.00 0.00 O ATOM 60 CB GLN A 2 8.285 13.626 -0.376 1.00 0.00 C ATOM 61 CG GLN A 2 8.987 12.236 -0.401 1.00 0.00 C ATOM 62 CD GLN A 2 9.019 11.544 -1.776 1.00 0.00 C ATOM 63 OE1 GLN A 2 8.156 11.747 -2.635 1.00 0.00 O ATOM 64 NE2 GLN A 2 10.027 10.717 -1.988 1.00 0.00 N ATOM 0 H GLN A 2 6.169 13.508 -2.107 1.00 0.00 H new ATOM 0 HA GLN A 2 6.594 12.942 0.768 1.00 0.00 H new ATOM 0 HB2 GLN A 2 8.449 14.116 -1.336 1.00 0.00 H new ATOM 0 HB3 GLN A 2 8.764 14.244 0.383 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.011 12.358 -0.049 1.00 0.00 H new ATOM 0 HG3 GLN A 2 8.482 11.579 0.307 1.00 0.00 H new ATOM 0 HE21 GLN A 2 10.726 10.568 -1.260 1.00 0.00 H new ATOM 0 HE22 GLN A 2 10.106 10.227 -2.879 1.00 0.00 H new ATOM 73 N ILE A 3 6.089 15.268 1.535 1.00 0.00 N ATOM 74 CA ILE A 3 5.761 16.612 2.081 1.00 0.00 C ATOM 75 C ILE A 3 6.765 16.951 3.192 1.00 0.00 C ATOM 76 O ILE A 3 7.465 16.064 3.707 1.00 0.00 O ATOM 77 CB ILE A 3 4.280 16.755 2.649 1.00 0.00 C ATOM 78 CG1 ILE A 3 3.954 15.680 3.756 1.00 0.00 C ATOM 79 CG2 ILE A 3 3.234 16.738 1.503 1.00 0.00 C ATOM 80 CD1 ILE A 3 3.731 14.266 3.239 1.00 0.00 C ATOM 0 H ILE A 3 6.184 14.557 2.261 1.00 0.00 H new ATOM 0 HA ILE A 3 5.826 17.308 1.244 1.00 0.00 H new ATOM 0 HB ILE A 3 4.219 17.727 3.138 1.00 0.00 H new ATOM 0 HG12 ILE A 3 4.773 15.662 4.475 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.062 15.997 4.297 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.233 16.837 1.923 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.426 17.568 0.823 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.307 15.797 0.958 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.514 13.603 4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.891 14.261 2.544 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.628 13.921 2.726 1.00 0.00 H new ATOM 92 N PHE A 4 6.819 18.239 3.557 1.00 0.00 N ATOM 93 CA PHE A 4 7.799 18.761 4.522 1.00 0.00 C ATOM 94 C PHE A 4 7.076 19.372 5.732 1.00 0.00 C ATOM 95 O PHE A 4 6.412 20.387 5.624 1.00 0.00 O ATOM 96 CB PHE A 4 8.720 19.801 3.824 1.00 0.00 C ATOM 97 CG PHE A 4 9.449 19.226 2.601 1.00 0.00 C ATOM 98 CD1 PHE A 4 10.465 18.284 2.760 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.109 19.616 1.304 1.00 0.00 C ATOM 100 CE1 PHE A 4 11.116 17.745 1.665 1.00 0.00 C ATOM 101 CE2 PHE A 4 9.763 19.077 0.208 1.00 0.00 C ATOM 102 CZ PHE A 4 10.768 18.146 0.390 1.00 0.00 C ATOM 0 H PHE A 4 6.185 18.950 3.192 1.00 0.00 H new ATOM 0 HA PHE A 4 8.423 17.945 4.886 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.122 20.659 3.515 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.455 20.167 4.541 1.00 0.00 H new ATOM 0 HD1 PHE A 4 10.748 17.970 3.754 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.327 20.346 1.154 1.00 0.00 H new ATOM 0 HE1 PHE A 4 11.896 17.011 1.807 1.00 0.00 H new ATOM 0 HE2 PHE A 4 9.487 19.385 -0.790 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.281 17.732 -0.465 1.00 0.00 H new ATOM 112 N VAL A 5 7.187 18.705 6.875 1.00 0.00 N ATOM 113 CA VAL A 5 6.681 19.201 8.161 1.00 0.00 C ATOM 114 C VAL A 5 7.858 19.856 8.902 1.00 0.00 C ATOM 115 O VAL A 5 8.951 19.315 8.901 1.00 0.00 O ATOM 116 CB VAL A 5 6.045 18.020 8.990 1.00 0.00 C ATOM 117 CG1 VAL A 5 5.756 18.425 10.439 1.00 0.00 C ATOM 118 CG2 VAL A 5 4.751 17.510 8.310 1.00 0.00 C ATOM 0 H VAL A 5 7.636 17.792 6.941 1.00 0.00 H new ATOM 0 HA VAL A 5 5.892 19.938 8.014 1.00 0.00 H new ATOM 0 HB VAL A 5 6.778 17.213 9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.319 17.581 10.972 1.00 0.00 H new ATOM 0 HG12 VAL A 5 6.685 18.720 10.926 1.00 0.00 H new ATOM 0 HG13 VAL A 5 5.058 19.262 10.450 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.328 16.695 8.898 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.029 18.324 8.245 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.984 17.151 7.307 1.00 0.00 H new ATOM 128 N LYS A 6 7.647 21.035 9.491 1.00 0.00 N ATOM 129 CA LYS A 6 8.724 21.818 10.118 1.00 0.00 C ATOM 130 C LYS A 6 8.400 22.076 11.602 1.00 0.00 C ATOM 131 O LYS A 6 7.349 22.647 11.902 1.00 0.00 O ATOM 132 CB LYS A 6 8.881 23.171 9.372 1.00 0.00 C ATOM 133 CG LYS A 6 10.207 23.900 9.674 1.00 0.00 C ATOM 134 CD LYS A 6 11.403 23.337 8.865 1.00 0.00 C ATOM 135 CE LYS A 6 12.747 23.959 9.291 1.00 0.00 C ATOM 136 NZ LYS A 6 13.878 23.532 8.426 1.00 0.00 N ATOM 0 H LYS A 6 6.729 21.476 9.549 1.00 0.00 H new ATOM 0 HA LYS A 6 9.656 21.256 10.055 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.811 22.993 8.299 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.050 23.822 9.642 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.091 24.961 9.451 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.425 23.820 10.739 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.449 22.256 8.995 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.240 23.524 7.804 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.664 25.046 9.264 1.00 0.00 H new ATOM 0 HE3 LYS A 6 12.960 23.681 10.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.670 23.215 9.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.571 22.750 7.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.186 24.332 7.837 1.00 0.00 H new ATOM 150 N THR A 7 9.304 21.676 12.521 1.00 0.00 N ATOM 151 CA THR A 7 9.102 21.868 13.973 1.00 0.00 C ATOM 152 C THR A 7 9.467 23.296 14.415 1.00 0.00 C ATOM 153 O THR A 7 10.150 24.032 13.691 1.00 0.00 O ATOM 154 CB THR A 7 9.958 20.867 14.805 1.00 0.00 C ATOM 155 OG1 THR A 7 11.339 21.001 14.450 1.00 0.00 O ATOM 156 CG2 THR A 7 9.510 19.418 14.613 1.00 0.00 C ATOM 0 H THR A 7 10.183 21.217 12.282 1.00 0.00 H new ATOM 0 HA THR A 7 8.043 21.689 14.157 1.00 0.00 H new ATOM 0 HB THR A 7 9.817 21.113 15.858 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.884 21.038 15.264 1.00 0.00 H new ATOM 0 HG21 THR A 7 10.138 18.760 15.214 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.471 19.314 14.926 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.601 19.145 13.562 1.00 0.00 H new ATOM 164 N LEU A 8 9.028 23.648 15.641 1.00 0.00 N ATOM 165 CA LEU A 8 9.402 24.909 16.317 1.00 0.00 C ATOM 166 C LEU A 8 10.878 24.888 16.777 1.00 0.00 C ATOM 167 O LEU A 8 11.464 25.939 17.036 1.00 0.00 O ATOM 168 CB LEU A 8 8.473 25.156 17.530 1.00 0.00 C ATOM 169 CG LEU A 8 6.949 25.276 17.218 1.00 0.00 C ATOM 170 CD1 LEU A 8 6.140 25.519 18.510 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.665 26.376 16.160 1.00 0.00 C ATOM 0 H LEU A 8 8.401 23.063 16.193 1.00 0.00 H new ATOM 0 HA LEU A 8 9.285 25.721 15.600 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.614 24.342 18.241 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.794 26.072 18.026 1.00 0.00 H new ATOM 0 HG LEU A 8 6.625 24.327 16.791 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.081 25.599 18.266 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.292 24.686 19.197 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.475 26.443 18.981 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.593 26.429 15.969 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.016 27.338 16.533 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.187 26.134 15.234 1.00 0.00 H new ATOM 183 N THR A 9 11.461 23.678 16.886 1.00 0.00 N ATOM 184 CA THR A 9 12.901 23.508 17.164 1.00 0.00 C ATOM 185 C THR A 9 13.717 23.737 15.875 1.00 0.00 C ATOM 186 O THR A 9 14.920 23.979 15.931 1.00 0.00 O ATOM 187 CB THR A 9 13.190 22.094 17.770 1.00 0.00 C ATOM 188 OG1 THR A 9 12.627 21.074 16.931 1.00 0.00 O ATOM 189 CG2 THR A 9 12.617 21.952 19.194 1.00 0.00 C ATOM 0 H THR A 9 10.953 22.799 16.785 1.00 0.00 H new ATOM 0 HA THR A 9 13.205 24.250 17.902 1.00 0.00 H new ATOM 0 HB THR A 9 14.273 21.979 17.825 1.00 0.00 H new ATOM 0 HG1 THR A 9 12.814 20.193 17.317 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.839 20.956 19.578 1.00 0.00 H new ATOM 0 HG22 THR A 9 13.069 22.701 19.844 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.537 22.098 19.168 1.00 0.00 H new ATOM 197 N GLY A 10 13.026 23.666 14.715 1.00 0.00 N ATOM 198 CA GLY A 10 13.580 24.107 13.433 1.00 0.00 C ATOM 199 C GLY A 10 14.174 22.999 12.587 1.00 0.00 C ATOM 200 O GLY A 10 15.037 23.266 11.745 1.00 0.00 O ATOM 0 H GLY A 10 12.075 23.302 14.650 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.793 24.599 12.862 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.351 24.854 13.623 1.00 0.00 H new ATOM 204 N LYS A 11 13.727 21.759 12.807 1.00 0.00 N ATOM 205 CA LYS A 11 14.099 20.618 11.951 1.00 0.00 C ATOM 206 C LYS A 11 13.011 20.434 10.871 1.00 0.00 C ATOM 207 O LYS A 11 11.850 20.824 11.082 1.00 0.00 O ATOM 208 CB LYS A 11 14.271 19.309 12.786 1.00 0.00 C ATOM 209 CG LYS A 11 12.964 18.537 13.051 1.00 0.00 C ATOM 210 CD LYS A 11 13.133 17.208 13.829 1.00 0.00 C ATOM 211 CE LYS A 11 13.751 16.067 12.988 1.00 0.00 C ATOM 212 NZ LYS A 11 15.200 16.252 12.696 1.00 0.00 N ATOM 0 H LYS A 11 13.102 21.514 13.575 1.00 0.00 H new ATOM 0 HA LYS A 11 15.060 20.826 11.479 1.00 0.00 H new ATOM 0 HB2 LYS A 11 14.966 18.651 12.265 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.728 19.562 13.743 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.285 19.183 13.608 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.487 18.322 12.095 1.00 0.00 H new ATOM 0 HD2 LYS A 11 13.762 17.386 14.701 1.00 0.00 H new ATOM 0 HD3 LYS A 11 12.159 16.888 14.199 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.614 15.124 13.516 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.208 15.987 12.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.690 15.338 12.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.315 16.624 11.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.608 16.923 13.377 1.00 0.00 H new ATOM 226 N THR A 12 13.390 19.872 9.721 1.00 0.00 N ATOM 227 CA THR A 12 12.430 19.444 8.691 1.00 0.00 C ATOM 228 C THR A 12 12.220 17.918 8.790 1.00 0.00 C ATOM 229 O THR A 12 13.149 17.163 9.107 1.00 0.00 O ATOM 230 CB THR A 12 12.936 19.812 7.265 1.00 0.00 C ATOM 231 OG1 THR A 12 13.280 21.197 7.193 1.00 0.00 O ATOM 232 CG2 THR A 12 11.898 19.499 6.164 1.00 0.00 C ATOM 0 H THR A 12 14.365 19.700 9.475 1.00 0.00 H new ATOM 0 HA THR A 12 11.486 19.962 8.861 1.00 0.00 H new ATOM 0 HB THR A 12 13.816 19.194 7.087 1.00 0.00 H new ATOM 0 HG1 THR A 12 13.597 21.409 6.290 1.00 0.00 H new ATOM 0 HG21 THR A 12 12.305 19.776 5.191 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.669 18.433 6.172 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.987 20.067 6.351 1.00 0.00 H new ATOM 240 N ILE A 13 10.988 17.489 8.526 1.00 0.00 N ATOM 241 CA ILE A 13 10.567 16.082 8.548 1.00 0.00 C ATOM 242 C ILE A 13 9.935 15.754 7.178 1.00 0.00 C ATOM 243 O ILE A 13 8.905 16.323 6.824 1.00 0.00 O ATOM 244 CB ILE A 13 9.516 15.793 9.703 1.00 0.00 C ATOM 245 CG1 ILE A 13 10.052 16.217 11.118 1.00 0.00 C ATOM 246 CG2 ILE A 13 9.102 14.314 9.712 1.00 0.00 C ATOM 247 CD1 ILE A 13 9.764 17.660 11.490 1.00 0.00 C ATOM 0 H ILE A 13 10.229 18.126 8.283 1.00 0.00 H new ATOM 0 HA ILE A 13 11.438 15.456 8.742 1.00 0.00 H new ATOM 0 HB ILE A 13 8.639 16.404 9.489 1.00 0.00 H new ATOM 0 HG12 ILE A 13 9.610 15.565 11.871 1.00 0.00 H new ATOM 0 HG13 ILE A 13 11.129 16.054 11.149 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.382 14.143 10.512 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.649 14.057 8.755 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.981 13.691 9.876 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.168 17.868 12.481 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.230 18.324 10.762 1.00 0.00 H new ATOM 0 HD13 ILE A 13 8.687 17.826 11.495 1.00 0.00 H new ATOM 259 N THR A 14 10.583 14.879 6.394 1.00 0.00 N ATOM 260 CA THR A 14 10.040 14.397 5.108 1.00 0.00 C ATOM 261 C THR A 14 9.189 13.139 5.357 1.00 0.00 C ATOM 262 O THR A 14 9.684 12.165 5.931 1.00 0.00 O ATOM 263 CB THR A 14 11.184 14.083 4.085 1.00 0.00 C ATOM 264 OG1 THR A 14 11.985 15.268 3.890 1.00 0.00 O ATOM 265 CG2 THR A 14 10.637 13.597 2.715 1.00 0.00 C ATOM 0 H THR A 14 11.494 14.485 6.629 1.00 0.00 H new ATOM 0 HA THR A 14 9.420 15.183 4.677 1.00 0.00 H new ATOM 0 HB THR A 14 11.786 13.275 4.500 1.00 0.00 H new ATOM 0 HG1 THR A 14 11.503 15.898 3.314 1.00 0.00 H new ATOM 0 HG21 THR A 14 11.470 13.393 2.042 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.055 12.687 2.858 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.002 14.370 2.282 1.00 0.00 H new ATOM 273 N LEU A 15 7.902 13.189 4.960 1.00 0.00 N ATOM 274 CA LEU A 15 6.962 12.048 5.080 1.00 0.00 C ATOM 275 C LEU A 15 6.629 11.529 3.693 1.00 0.00 C ATOM 276 O LEU A 15 6.639 12.289 2.727 1.00 0.00 O ATOM 277 CB LEU A 15 5.627 12.445 5.786 1.00 0.00 C ATOM 278 CG LEU A 15 5.738 13.153 7.172 1.00 0.00 C ATOM 279 CD1 LEU A 15 6.719 12.421 8.097 1.00 0.00 C ATOM 280 CD2 LEU A 15 6.108 14.643 7.028 1.00 0.00 C ATOM 0 H LEU A 15 7.481 14.021 4.546 1.00 0.00 H new ATOM 0 HA LEU A 15 7.454 11.287 5.686 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.072 13.100 5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.031 11.542 5.915 1.00 0.00 H new ATOM 0 HG LEU A 15 4.752 13.110 7.634 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.773 12.940 9.054 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.375 11.399 8.257 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.707 12.403 7.638 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.175 15.098 8.016 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.069 14.732 6.521 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.342 15.153 6.445 1.00 0.00 H new ATOM 292 N GLU A 16 6.299 10.238 3.614 1.00 0.00 N ATOM 293 CA GLU A 16 5.852 9.603 2.377 1.00 0.00 C ATOM 294 C GLU A 16 4.383 9.213 2.552 1.00 0.00 C ATOM 295 O GLU A 16 4.082 8.200 3.182 1.00 0.00 O ATOM 296 CB GLU A 16 6.714 8.368 1.987 1.00 0.00 C ATOM 297 CG GLU A 16 8.227 8.648 1.779 1.00 0.00 C ATOM 298 CD GLU A 16 9.043 8.653 3.086 1.00 0.00 C ATOM 299 OE1 GLU A 16 9.335 7.552 3.607 1.00 0.00 O ATOM 300 OE2 GLU A 16 9.389 9.738 3.600 1.00 0.00 O ATOM 0 H GLU A 16 6.335 9.603 4.411 1.00 0.00 H new ATOM 0 HA GLU A 16 5.967 10.312 1.557 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.606 7.611 2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.312 7.941 1.068 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.638 7.894 1.108 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.344 9.612 1.285 1.00 0.00 H new ATOM 307 N VAL A 17 3.486 10.098 2.084 1.00 0.00 N ATOM 308 CA VAL A 17 2.027 9.847 1.967 1.00 0.00 C ATOM 309 C VAL A 17 1.525 10.606 0.726 1.00 0.00 C ATOM 310 O VAL A 17 2.315 11.180 -0.011 1.00 0.00 O ATOM 311 CB VAL A 17 1.175 10.301 3.236 1.00 0.00 C ATOM 312 CG1 VAL A 17 1.587 9.579 4.539 1.00 0.00 C ATOM 313 CG2 VAL A 17 1.206 11.833 3.410 1.00 0.00 C ATOM 0 H VAL A 17 3.754 11.030 1.768 1.00 0.00 H new ATOM 0 HA VAL A 17 1.888 8.769 1.889 1.00 0.00 H new ATOM 0 HB VAL A 17 0.147 9.999 3.036 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.968 9.934 5.363 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.449 8.504 4.419 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.635 9.788 4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.616 12.112 4.283 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.236 12.163 3.547 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.788 12.308 2.523 1.00 0.00 H new ATOM 323 N GLU A 18 0.217 10.619 0.500 1.00 0.00 N ATOM 324 CA GLU A 18 -0.384 11.400 -0.598 1.00 0.00 C ATOM 325 C GLU A 18 -1.009 12.688 -0.035 1.00 0.00 C ATOM 326 O GLU A 18 -1.334 12.743 1.158 1.00 0.00 O ATOM 327 CB GLU A 18 -1.436 10.527 -1.336 1.00 0.00 C ATOM 328 CG GLU A 18 -0.922 9.100 -1.587 1.00 0.00 C ATOM 329 CD GLU A 18 -1.779 8.259 -2.531 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.564 8.315 -3.759 1.00 0.00 O ATOM 331 OE2 GLU A 18 -2.668 7.531 -2.050 1.00 0.00 O ATOM 0 H GLU A 18 -0.458 10.098 1.060 1.00 0.00 H new ATOM 0 HA GLU A 18 0.382 11.688 -1.318 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.351 10.485 -0.746 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.692 10.993 -2.287 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.087 9.160 -1.994 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.849 8.583 -0.630 1.00 0.00 H new ATOM 338 N PRO A 19 -1.165 13.769 -0.871 1.00 0.00 N ATOM 339 CA PRO A 19 -1.989 14.939 -0.495 1.00 0.00 C ATOM 340 C PRO A 19 -3.448 14.518 -0.185 1.00 0.00 C ATOM 341 O PRO A 19 -4.083 15.068 0.708 1.00 0.00 O ATOM 342 CB PRO A 19 -1.892 15.879 -1.736 1.00 0.00 C ATOM 343 CG PRO A 19 -1.406 14.998 -2.849 1.00 0.00 C ATOM 344 CD PRO A 19 -0.521 13.965 -2.197 1.00 0.00 C ATOM 0 HA PRO A 19 -1.644 15.431 0.414 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.860 16.320 -1.975 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.202 16.703 -1.555 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -2.241 14.527 -3.368 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.854 15.574 -3.591 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.489 13.039 -2.772 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.506 14.316 -2.100 1.00 0.00 H new ATOM 352 N SER A 20 -3.931 13.471 -0.884 1.00 0.00 N ATOM 353 CA SER A 20 -5.309 12.970 -0.742 1.00 0.00 C ATOM 354 C SER A 20 -5.355 11.746 0.210 1.00 0.00 C ATOM 355 O SER A 20 -6.347 11.012 0.232 1.00 0.00 O ATOM 356 CB SER A 20 -5.867 12.632 -2.154 1.00 0.00 C ATOM 357 OG SER A 20 -7.262 12.351 -2.134 1.00 0.00 O ATOM 0 H SER A 20 -3.375 12.950 -1.562 1.00 0.00 H new ATOM 0 HA SER A 20 -5.939 13.737 -0.292 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.677 13.469 -2.826 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.332 11.772 -2.557 1.00 0.00 H new ATOM 0 HG SER A 20 -7.465 11.753 -1.385 1.00 0.00 H new ATOM 363 N ASP A 21 -4.297 11.563 1.041 1.00 0.00 N ATOM 364 CA ASP A 21 -4.195 10.422 1.979 1.00 0.00 C ATOM 365 C ASP A 21 -5.003 10.728 3.270 1.00 0.00 C ATOM 366 O ASP A 21 -6.214 10.477 3.295 1.00 0.00 O ATOM 367 CB ASP A 21 -2.703 10.109 2.271 1.00 0.00 C ATOM 368 CG ASP A 21 -2.476 8.811 3.057 1.00 0.00 C ATOM 369 OD1 ASP A 21 -2.572 8.830 4.296 1.00 0.00 O ATOM 370 OD2 ASP A 21 -2.211 7.774 2.438 1.00 0.00 O ATOM 0 H ASP A 21 -3.499 12.197 1.078 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.629 9.529 1.529 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -2.164 10.047 1.325 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -2.272 10.939 2.830 1.00 0.00 H new ATOM 375 N THR A 22 -4.329 11.302 4.312 1.00 0.00 N ATOM 376 CA THR A 22 -4.964 11.763 5.574 1.00 0.00 C ATOM 377 C THR A 22 -3.899 12.312 6.556 1.00 0.00 C ATOM 378 O THR A 22 -2.749 11.842 6.573 1.00 0.00 O ATOM 379 CB THR A 22 -5.820 10.649 6.297 1.00 0.00 C ATOM 380 OG1 THR A 22 -6.542 11.207 7.409 1.00 0.00 O ATOM 381 CG2 THR A 22 -4.976 9.469 6.803 1.00 0.00 C ATOM 0 H THR A 22 -3.321 11.456 4.293 1.00 0.00 H new ATOM 0 HA THR A 22 -5.652 12.557 5.283 1.00 0.00 H new ATOM 0 HB THR A 22 -6.509 10.269 5.543 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.729 12.153 7.236 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.624 8.740 7.289 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.467 8.998 5.962 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.237 9.831 7.518 1.00 0.00 H new ATOM 389 N ILE A 23 -4.316 13.292 7.388 1.00 0.00 N ATOM 390 CA ILE A 23 -3.459 13.962 8.396 1.00 0.00 C ATOM 391 C ILE A 23 -3.029 12.970 9.496 1.00 0.00 C ATOM 392 O ILE A 23 -1.897 13.030 10.000 1.00 0.00 O ATOM 393 CB ILE A 23 -4.221 15.179 9.066 1.00 0.00 C ATOM 394 CG1 ILE A 23 -4.686 16.240 8.006 1.00 0.00 C ATOM 395 CG2 ILE A 23 -3.377 15.851 10.180 1.00 0.00 C ATOM 396 CD1 ILE A 23 -3.561 16.914 7.234 1.00 0.00 C ATOM 0 H ILE A 23 -5.272 13.647 7.379 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.574 14.333 7.878 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.114 14.761 9.531 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.353 15.753 7.295 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.268 17.008 8.515 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.938 16.680 10.612 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.153 15.121 10.957 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.446 16.226 9.755 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.982 17.629 6.527 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.904 17.436 7.930 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.990 16.161 6.691 1.00 0.00 H new ATOM 408 N GLU A 24 -3.966 12.070 9.854 1.00 0.00 N ATOM 409 CA GLU A 24 -3.762 11.020 10.874 1.00 0.00 C ATOM 410 C GLU A 24 -2.535 10.149 10.535 1.00 0.00 C ATOM 411 O GLU A 24 -1.747 9.770 11.418 1.00 0.00 O ATOM 412 CB GLU A 24 -5.034 10.134 10.974 1.00 0.00 C ATOM 413 CG GLU A 24 -4.969 9.026 12.046 1.00 0.00 C ATOM 414 CD GLU A 24 -6.216 8.131 12.070 1.00 0.00 C ATOM 415 OE1 GLU A 24 -6.386 7.316 11.138 1.00 0.00 O ATOM 416 OE2 GLU A 24 -7.034 8.244 13.007 1.00 0.00 O ATOM 0 H GLU A 24 -4.897 12.051 9.438 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.579 11.502 11.834 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -5.890 10.775 11.185 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.214 9.671 10.004 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.090 8.407 11.866 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.841 9.485 13.026 1.00 0.00 H new ATOM 423 N ASN A 25 -2.368 9.870 9.237 1.00 0.00 N ATOM 424 CA ASN A 25 -1.281 9.016 8.744 1.00 0.00 C ATOM 425 C ASN A 25 0.035 9.785 8.741 1.00 0.00 C ATOM 426 O ASN A 25 1.071 9.226 9.089 1.00 0.00 O ATOM 427 CB ASN A 25 -1.600 8.509 7.328 1.00 0.00 C ATOM 428 CG ASN A 25 -0.839 7.241 6.956 1.00 0.00 C ATOM 429 OD1 ASN A 25 0.213 7.279 6.330 1.00 0.00 O ATOM 430 ND2 ASN A 25 -1.365 6.104 7.377 1.00 0.00 N ATOM 0 H ASN A 25 -2.979 10.228 8.502 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.185 8.158 9.410 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.670 8.318 7.250 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -1.363 9.292 6.607 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -0.893 5.221 7.183 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -2.243 6.110 7.896 1.00 0.00 H new ATOM 437 N VAL A 26 -0.045 11.080 8.359 1.00 0.00 N ATOM 438 CA VAL A 26 1.124 11.994 8.320 1.00 0.00 C ATOM 439 C VAL A 26 1.792 12.086 9.706 1.00 0.00 C ATOM 440 O VAL A 26 3.007 11.967 9.816 1.00 0.00 O ATOM 441 CB VAL A 26 0.737 13.454 7.846 1.00 0.00 C ATOM 442 CG1 VAL A 26 1.966 14.409 7.811 1.00 0.00 C ATOM 443 CG2 VAL A 26 0.033 13.424 6.477 1.00 0.00 C ATOM 0 H VAL A 26 -0.918 11.522 8.070 1.00 0.00 H new ATOM 0 HA VAL A 26 1.818 11.570 7.594 1.00 0.00 H new ATOM 0 HB VAL A 26 0.041 13.850 8.585 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.649 15.398 7.480 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.399 14.482 8.809 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.712 14.017 7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.221 14.440 6.176 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.698 12.982 5.735 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.877 12.828 6.549 1.00 0.00 H new ATOM 453 N LYS A 27 0.971 12.276 10.762 1.00 0.00 N ATOM 454 CA LYS A 27 1.465 12.424 12.149 1.00 0.00 C ATOM 455 C LYS A 27 2.001 11.092 12.711 1.00 0.00 C ATOM 456 O LYS A 27 2.883 11.090 13.583 1.00 0.00 O ATOM 457 CB LYS A 27 0.376 13.032 13.066 1.00 0.00 C ATOM 458 CG LYS A 27 -0.901 12.194 13.251 1.00 0.00 C ATOM 459 CD LYS A 27 -1.964 12.913 14.114 1.00 0.00 C ATOM 460 CE LYS A 27 -2.540 14.172 13.438 1.00 0.00 C ATOM 461 NZ LYS A 27 -3.399 14.958 14.367 1.00 0.00 N ATOM 0 H LYS A 27 -0.044 12.331 10.679 1.00 0.00 H new ATOM 0 HA LYS A 27 2.304 13.119 12.125 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.815 13.209 14.048 1.00 0.00 H new ATOM 0 HB3 LYS A 27 0.092 14.004 12.663 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.326 11.965 12.274 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.643 11.243 13.717 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.777 12.220 14.331 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.520 13.192 15.069 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.723 14.799 13.082 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.123 13.880 12.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -4.380 14.952 14.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.364 14.533 15.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -3.054 15.938 14.414 1.00 0.00 H new ATOM 475 N ALA A 28 1.461 9.969 12.196 1.00 0.00 N ATOM 476 CA ALA A 28 2.017 8.626 12.448 1.00 0.00 C ATOM 477 C ALA A 28 3.416 8.477 11.802 1.00 0.00 C ATOM 478 O ALA A 28 4.331 7.892 12.398 1.00 0.00 O ATOM 479 CB ALA A 28 1.046 7.556 11.922 1.00 0.00 C ATOM 0 H ALA A 28 0.634 9.968 11.599 1.00 0.00 H new ATOM 0 HA ALA A 28 2.138 8.489 13.523 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.460 6.565 12.110 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.088 7.652 12.433 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.901 7.691 10.850 1.00 0.00 H new ATOM 485 N LYS A 29 3.568 9.044 10.582 1.00 0.00 N ATOM 486 CA LYS A 29 4.852 9.049 9.847 1.00 0.00 C ATOM 487 C LYS A 29 5.897 9.903 10.586 1.00 0.00 C ATOM 488 O LYS A 29 7.065 9.556 10.614 1.00 0.00 O ATOM 489 CB LYS A 29 4.683 9.573 8.388 1.00 0.00 C ATOM 490 CG LYS A 29 3.716 8.781 7.491 1.00 0.00 C ATOM 491 CD LYS A 29 4.141 7.298 7.260 1.00 0.00 C ATOM 492 CE LYS A 29 3.032 6.298 7.621 1.00 0.00 C ATOM 493 NZ LYS A 29 2.658 6.376 9.056 1.00 0.00 N ATOM 0 H LYS A 29 2.808 9.508 10.083 1.00 0.00 H new ATOM 0 HA LYS A 29 5.198 8.016 9.799 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.340 10.607 8.433 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.663 9.582 7.911 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.723 8.799 7.940 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.639 9.281 6.526 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.419 7.163 6.215 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.027 7.082 7.856 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.153 6.494 7.006 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.366 5.287 7.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.120 5.527 9.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.519 6.436 9.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.073 7.221 9.217 1.00 0.00 H new ATOM 507 N ILE A 30 5.446 11.019 11.182 1.00 0.00 N ATOM 508 CA ILE A 30 6.308 11.942 11.955 1.00 0.00 C ATOM 509 C ILE A 30 6.884 11.241 13.207 1.00 0.00 C ATOM 510 O ILE A 30 8.060 11.429 13.557 1.00 0.00 O ATOM 511 CB ILE A 30 5.493 13.229 12.333 1.00 0.00 C ATOM 512 CG1 ILE A 30 5.116 14.010 11.032 1.00 0.00 C ATOM 513 CG2 ILE A 30 6.254 14.144 13.323 1.00 0.00 C ATOM 514 CD1 ILE A 30 4.089 15.083 11.224 1.00 0.00 C ATOM 0 H ILE A 30 4.470 11.312 11.144 1.00 0.00 H new ATOM 0 HA ILE A 30 7.157 12.241 11.340 1.00 0.00 H new ATOM 0 HB ILE A 30 4.585 12.910 12.844 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.019 14.460 10.619 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.747 13.300 10.292 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.646 15.019 13.551 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.459 13.595 14.242 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.195 14.463 12.874 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.890 15.571 10.270 1.00 0.00 H new ATOM 0 HD12 ILE A 30 3.168 14.641 11.605 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.461 15.819 11.937 1.00 0.00 H new ATOM 526 N GLN A 31 6.046 10.400 13.844 1.00 0.00 N ATOM 527 CA GLN A 31 6.469 9.555 14.981 1.00 0.00 C ATOM 528 C GLN A 31 7.521 8.511 14.536 1.00 0.00 C ATOM 529 O GLN A 31 8.380 8.115 15.324 1.00 0.00 O ATOM 530 CB GLN A 31 5.248 8.854 15.631 1.00 0.00 C ATOM 531 CG GLN A 31 5.592 8.008 16.878 1.00 0.00 C ATOM 532 CD GLN A 31 4.389 7.333 17.542 1.00 0.00 C ATOM 533 OE1 GLN A 31 4.377 7.126 18.759 1.00 0.00 O ATOM 534 NE2 GLN A 31 3.382 6.954 16.765 1.00 0.00 N ATOM 0 H GLN A 31 5.065 10.287 13.589 1.00 0.00 H new ATOM 0 HA GLN A 31 6.929 10.204 15.726 1.00 0.00 H new ATOM 0 HB2 GLN A 31 4.515 9.611 15.910 1.00 0.00 H new ATOM 0 HB3 GLN A 31 4.775 8.211 14.889 1.00 0.00 H new ATOM 0 HG2 GLN A 31 6.311 7.240 16.593 1.00 0.00 H new ATOM 0 HG3 GLN A 31 6.083 8.648 17.611 1.00 0.00 H new ATOM 0 HE21 GLN A 31 3.415 7.136 15.762 1.00 0.00 H new ATOM 0 HE22 GLN A 31 2.575 6.480 17.171 1.00 0.00 H new ATOM 543 N ASP A 32 7.431 8.065 13.273 1.00 0.00 N ATOM 544 CA ASP A 32 8.457 7.186 12.667 1.00 0.00 C ATOM 545 C ASP A 32 9.784 7.954 12.444 1.00 0.00 C ATOM 546 O ASP A 32 10.865 7.408 12.697 1.00 0.00 O ATOM 547 CB ASP A 32 7.933 6.589 11.326 1.00 0.00 C ATOM 548 CG ASP A 32 9.001 5.816 10.523 1.00 0.00 C ATOM 549 OD1 ASP A 32 9.342 4.681 10.911 1.00 0.00 O ATOM 550 OD2 ASP A 32 9.530 6.357 9.519 1.00 0.00 O ATOM 0 H ASP A 32 6.659 8.296 12.647 1.00 0.00 H new ATOM 0 HA ASP A 32 8.657 6.367 13.357 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.099 5.920 11.539 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.543 7.398 10.708 1.00 0.00 H new ATOM 555 N LYS A 33 9.685 9.234 12.025 1.00 0.00 N ATOM 556 CA LYS A 33 10.857 9.994 11.535 1.00 0.00 C ATOM 557 C LYS A 33 11.617 10.636 12.707 1.00 0.00 C ATOM 558 O LYS A 33 12.720 10.192 13.048 1.00 0.00 O ATOM 559 CB LYS A 33 10.431 11.095 10.526 1.00 0.00 C ATOM 560 CG LYS A 33 9.655 10.607 9.285 1.00 0.00 C ATOM 561 CD LYS A 33 10.470 9.708 8.335 1.00 0.00 C ATOM 562 CE LYS A 33 9.619 9.204 7.155 1.00 0.00 C ATOM 563 NZ LYS A 33 10.415 8.376 6.219 1.00 0.00 N ATOM 0 H LYS A 33 8.812 9.761 12.016 1.00 0.00 H new ATOM 0 HA LYS A 33 11.514 9.289 11.025 1.00 0.00 H new ATOM 0 HB2 LYS A 33 9.815 11.824 11.052 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.326 11.618 10.189 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.773 10.059 9.616 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.301 11.475 8.729 1.00 0.00 H new ATOM 0 HD2 LYS A 33 11.327 10.264 7.954 1.00 0.00 H new ATOM 0 HD3 LYS A 33 10.864 8.856 8.889 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.781 8.620 7.534 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.198 10.055 6.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.813 8.069 5.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 11.210 8.936 5.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 10.781 7.541 6.720 1.00 0.00 H new ATOM 577 N GLU A 34 10.999 11.656 13.356 1.00 0.00 N ATOM 578 CA GLU A 34 11.658 12.408 14.443 1.00 0.00 C ATOM 579 C GLU A 34 11.491 11.689 15.794 1.00 0.00 C ATOM 580 O GLU A 34 12.259 11.939 16.729 1.00 0.00 O ATOM 581 CB GLU A 34 11.166 13.879 14.516 1.00 0.00 C ATOM 582 CG GLU A 34 9.694 14.098 14.923 1.00 0.00 C ATOM 583 CD GLU A 34 9.352 15.595 15.117 1.00 0.00 C ATOM 584 OE1 GLU A 34 9.946 16.226 16.020 1.00 0.00 O ATOM 585 OE2 GLU A 34 8.525 16.146 14.365 1.00 0.00 O ATOM 0 H GLU A 34 10.052 11.971 13.144 1.00 0.00 H new ATOM 0 HA GLU A 34 12.723 12.443 14.213 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.798 14.414 15.224 1.00 0.00 H new ATOM 0 HB3 GLU A 34 11.321 14.338 13.540 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.042 13.675 14.159 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.492 13.559 15.849 1.00 0.00 H new ATOM 592 N GLY A 35 10.479 10.801 15.880 1.00 0.00 N ATOM 593 CA GLY A 35 10.302 9.905 17.028 1.00 0.00 C ATOM 594 C GLY A 35 9.480 10.515 18.145 1.00 0.00 C ATOM 595 O GLY A 35 9.649 10.148 19.316 1.00 0.00 O ATOM 0 H GLY A 35 9.768 10.690 15.157 1.00 0.00 H new ATOM 0 HA2 GLY A 35 9.820 8.987 16.692 1.00 0.00 H new ATOM 0 HA3 GLY A 35 11.281 9.627 17.417 1.00 0.00 H new ATOM 599 N ILE A 36 8.606 11.470 17.791 1.00 0.00 N ATOM 600 CA ILE A 36 7.706 12.136 18.754 1.00 0.00 C ATOM 601 C ILE A 36 6.251 11.675 18.472 1.00 0.00 C ATOM 602 O ILE A 36 5.787 11.795 17.329 1.00 0.00 O ATOM 603 CB ILE A 36 7.822 13.726 18.721 1.00 0.00 C ATOM 604 CG1 ILE A 36 9.149 14.234 19.407 1.00 0.00 C ATOM 605 CG2 ILE A 36 6.602 14.401 19.403 1.00 0.00 C ATOM 606 CD1 ILE A 36 10.440 13.956 18.664 1.00 0.00 C ATOM 0 H ILE A 36 8.501 11.804 16.833 1.00 0.00 H new ATOM 0 HA ILE A 36 8.006 11.843 19.760 1.00 0.00 H new ATOM 0 HB ILE A 36 7.843 14.009 17.668 1.00 0.00 H new ATOM 0 HG12 ILE A 36 9.066 15.310 19.557 1.00 0.00 H new ATOM 0 HG13 ILE A 36 9.219 13.779 20.395 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.715 15.484 19.362 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.689 14.112 18.883 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.544 14.082 20.444 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.280 14.352 19.234 1.00 0.00 H new ATOM 0 HD12 ILE A 36 10.562 12.880 18.537 1.00 0.00 H new ATOM 0 HD13 ILE A 36 10.407 14.435 17.686 1.00 0.00 H new ATOM 618 N PRO A 37 5.516 11.140 19.510 1.00 0.00 N ATOM 619 CA PRO A 37 4.156 10.569 19.327 1.00 0.00 C ATOM 620 C PRO A 37 3.115 11.641 18.906 1.00 0.00 C ATOM 621 O PRO A 37 3.264 12.803 19.301 1.00 0.00 O ATOM 622 CB PRO A 37 3.837 9.954 20.725 1.00 0.00 C ATOM 623 CG PRO A 37 4.679 10.730 21.687 1.00 0.00 C ATOM 624 CD PRO A 37 5.949 11.066 20.938 1.00 0.00 C ATOM 0 HA PRO A 37 4.113 9.836 18.521 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.778 10.045 20.964 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.080 8.892 20.754 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.167 11.634 22.015 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.894 10.144 22.580 1.00 0.00 H new ATOM 0 HD2 PRO A 37 6.374 12.011 21.276 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.713 10.303 21.085 1.00 0.00 H new ATOM 632 N PRO A 38 2.040 11.257 18.113 1.00 0.00 N ATOM 633 CA PRO A 38 0.962 12.185 17.645 1.00 0.00 C ATOM 634 C PRO A 38 0.262 12.975 18.780 1.00 0.00 C ATOM 635 O PRO A 38 -0.406 13.985 18.517 1.00 0.00 O ATOM 636 CB PRO A 38 -0.037 11.257 16.887 1.00 0.00 C ATOM 637 CG PRO A 38 0.333 9.861 17.286 1.00 0.00 C ATOM 638 CD PRO A 38 1.814 9.891 17.567 1.00 0.00 C ATOM 0 HA PRO A 38 1.379 12.974 17.019 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.068 11.483 17.160 1.00 0.00 H new ATOM 0 HB3 PRO A 38 0.044 11.391 15.808 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.226 9.546 18.167 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.100 9.153 16.491 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.102 9.121 18.283 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.397 9.720 16.662 1.00 0.00 H new ATOM 646 N ASP A 39 0.419 12.497 20.028 1.00 0.00 N ATOM 647 CA ASP A 39 -0.092 13.187 21.232 1.00 0.00 C ATOM 648 C ASP A 39 0.773 14.420 21.579 1.00 0.00 C ATOM 649 O ASP A 39 0.245 15.480 21.915 1.00 0.00 O ATOM 650 CB ASP A 39 -0.130 12.201 22.430 1.00 0.00 C ATOM 651 CG ASP A 39 -0.742 12.800 23.714 1.00 0.00 C ATOM 652 OD1 ASP A 39 -1.960 13.075 23.720 1.00 0.00 O ATOM 653 OD2 ASP A 39 -0.020 12.989 24.719 1.00 0.00 O ATOM 0 H ASP A 39 0.903 11.623 20.233 1.00 0.00 H new ATOM 0 HA ASP A 39 -1.103 13.536 21.023 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.703 11.319 22.144 1.00 0.00 H new ATOM 0 HB3 ASP A 39 0.885 11.866 22.645 1.00 0.00 H new ATOM 658 N GLN A 40 2.107 14.273 21.474 1.00 0.00 N ATOM 659 CA GLN A 40 3.086 15.321 21.864 1.00 0.00 C ATOM 660 C GLN A 40 3.320 16.324 20.725 1.00 0.00 C ATOM 661 O GLN A 40 3.588 17.494 20.973 1.00 0.00 O ATOM 662 CB GLN A 40 4.437 14.672 22.299 1.00 0.00 C ATOM 663 CG GLN A 40 4.548 14.238 23.781 1.00 0.00 C ATOM 664 CD GLN A 40 3.260 13.692 24.379 1.00 0.00 C ATOM 665 OE1 GLN A 40 2.473 14.438 24.945 1.00 0.00 O ATOM 666 NE2 GLN A 40 3.051 12.398 24.296 1.00 0.00 N ATOM 0 H GLN A 40 2.544 13.424 21.116 1.00 0.00 H new ATOM 0 HA GLN A 40 2.667 15.866 22.710 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.613 13.797 21.673 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.239 15.380 22.090 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.324 13.477 23.866 1.00 0.00 H new ATOM 0 HG3 GLN A 40 4.874 15.093 24.373 1.00 0.00 H new ATOM 0 HE21 GLN A 40 3.726 11.802 23.817 1.00 0.00 H new ATOM 0 HE22 GLN A 40 2.213 11.989 24.710 1.00 0.00 H new ATOM 675 N GLN A 41 3.262 15.856 19.480 1.00 0.00 N ATOM 676 CA GLN A 41 3.392 16.734 18.304 1.00 0.00 C ATOM 677 C GLN A 41 2.000 17.248 17.886 1.00 0.00 C ATOM 678 O GLN A 41 0.993 16.575 18.135 1.00 0.00 O ATOM 679 CB GLN A 41 4.146 15.994 17.167 1.00 0.00 C ATOM 680 CG GLN A 41 3.556 14.640 16.710 1.00 0.00 C ATOM 681 CD GLN A 41 2.552 14.758 15.567 1.00 0.00 C ATOM 682 OE1 GLN A 41 1.344 14.864 15.776 1.00 0.00 O ATOM 683 NE2 GLN A 41 3.055 14.762 14.349 1.00 0.00 N ATOM 0 H GLN A 41 3.126 14.871 19.252 1.00 0.00 H new ATOM 0 HA GLN A 41 3.992 17.611 18.548 1.00 0.00 H new ATOM 0 HB2 GLN A 41 4.191 16.655 16.302 1.00 0.00 H new ATOM 0 HB3 GLN A 41 5.172 15.825 17.493 1.00 0.00 H new ATOM 0 HG2 GLN A 41 4.371 13.986 16.399 1.00 0.00 H new ATOM 0 HG3 GLN A 41 3.070 14.161 17.560 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.062 14.672 14.213 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.437 14.855 13.543 1.00 0.00 H new ATOM 692 N ARG A 42 1.938 18.466 17.313 1.00 0.00 N ATOM 693 CA ARG A 42 0.671 19.099 16.914 1.00 0.00 C ATOM 694 C ARG A 42 0.785 19.663 15.488 1.00 0.00 C ATOM 695 O ARG A 42 1.734 20.391 15.178 1.00 0.00 O ATOM 696 CB ARG A 42 0.314 20.221 17.927 1.00 0.00 C ATOM 697 CG ARG A 42 -1.180 20.598 17.966 1.00 0.00 C ATOM 698 CD ARG A 42 -1.494 21.552 19.124 1.00 0.00 C ATOM 699 NE ARG A 42 -2.943 21.685 19.353 1.00 0.00 N ATOM 700 CZ ARG A 42 -3.518 22.294 20.400 1.00 0.00 C ATOM 701 NH1 ARG A 42 -2.790 22.903 21.328 1.00 0.00 N ATOM 702 NH2 ARG A 42 -4.835 22.276 20.521 1.00 0.00 N ATOM 0 H ARG A 42 2.762 19.034 17.116 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.125 18.355 16.919 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.621 19.904 18.924 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.894 21.111 17.683 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.462 21.066 17.023 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -1.781 19.694 18.066 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.015 21.188 20.033 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.069 22.533 18.911 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.564 21.278 18.653 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.773 22.914 21.253 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.248 23.360 22.117 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.405 21.801 19.821 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.281 22.737 21.314 1.00 0.00 H new ATOM 716 N LEU A 43 -0.211 19.342 14.649 1.00 0.00 N ATOM 717 CA LEU A 43 -0.219 19.693 13.216 1.00 0.00 C ATOM 718 C LEU A 43 -0.983 20.995 12.999 1.00 0.00 C ATOM 719 O LEU A 43 -2.132 21.110 13.433 1.00 0.00 O ATOM 720 CB LEU A 43 -0.869 18.547 12.369 1.00 0.00 C ATOM 721 CG LEU A 43 0.063 17.368 11.969 1.00 0.00 C ATOM 722 CD1 LEU A 43 1.239 17.871 11.101 1.00 0.00 C ATOM 723 CD2 LEU A 43 0.552 16.606 13.209 1.00 0.00 C ATOM 0 H LEU A 43 -1.041 18.828 14.945 1.00 0.00 H new ATOM 0 HA LEU A 43 0.813 19.824 12.889 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.710 18.142 12.931 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.276 18.985 11.458 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.512 16.665 11.366 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.879 17.030 10.832 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.850 18.335 10.195 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.819 18.603 11.663 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.202 15.787 12.900 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.106 17.284 13.858 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.305 16.205 13.751 1.00 0.00 H new ATOM 735 N ILE A 44 -0.317 21.977 12.356 1.00 0.00 N ATOM 736 CA ILE A 44 -0.913 23.280 11.994 1.00 0.00 C ATOM 737 C ILE A 44 -0.373 23.718 10.618 1.00 0.00 C ATOM 738 O ILE A 44 0.833 23.651 10.377 1.00 0.00 O ATOM 739 CB ILE A 44 -0.594 24.392 13.079 1.00 0.00 C ATOM 740 CG1 ILE A 44 -1.213 23.990 14.465 1.00 0.00 C ATOM 741 CG2 ILE A 44 -1.090 25.804 12.638 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.727 24.788 15.642 1.00 0.00 C ATOM 0 H ILE A 44 0.658 21.887 12.071 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.996 23.163 11.953 1.00 0.00 H new ATOM 0 HB ILE A 44 0.490 24.454 13.179 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.297 24.089 14.403 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.999 22.937 14.648 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.850 26.532 13.412 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.599 26.088 11.707 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.169 25.779 12.486 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.215 24.432 16.549 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.352 24.671 15.740 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.965 25.841 15.491 1.00 0.00 H new ATOM 754 N PHE A 45 -1.277 24.154 9.728 1.00 0.00 N ATOM 755 CA PHE A 45 -0.926 24.777 8.442 1.00 0.00 C ATOM 756 C PHE A 45 -1.812 26.005 8.263 1.00 0.00 C ATOM 757 O PHE A 45 -3.011 25.917 8.484 1.00 0.00 O ATOM 758 CB PHE A 45 -1.135 23.784 7.270 1.00 0.00 C ATOM 759 CG PHE A 45 -0.904 24.379 5.870 1.00 0.00 C ATOM 760 CD1 PHE A 45 0.384 24.521 5.357 1.00 0.00 C ATOM 761 CD2 PHE A 45 -1.976 24.801 5.075 1.00 0.00 C ATOM 762 CE1 PHE A 45 0.594 25.046 4.095 1.00 0.00 C ATOM 763 CE2 PHE A 45 -1.763 25.325 3.814 1.00 0.00 C ATOM 764 CZ PHE A 45 -0.478 25.452 3.325 1.00 0.00 C ATOM 0 H PHE A 45 -2.283 24.083 9.882 1.00 0.00 H new ATOM 0 HA PHE A 45 0.126 25.062 8.441 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.462 22.938 7.405 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.151 23.394 7.320 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.231 24.216 5.954 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.984 24.716 5.453 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.599 25.139 3.711 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.603 25.636 3.210 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.312 25.868 2.342 1.00 0.00 H new ATOM 774 N ALA A 46 -1.200 27.139 7.890 1.00 0.00 N ATOM 775 CA ALA A 46 -1.913 28.403 7.592 1.00 0.00 C ATOM 776 C ALA A 46 -2.712 28.928 8.815 1.00 0.00 C ATOM 777 O ALA A 46 -3.665 29.699 8.654 1.00 0.00 O ATOM 778 CB ALA A 46 -2.813 28.240 6.343 1.00 0.00 C ATOM 0 H ALA A 46 -0.188 27.211 7.784 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.162 29.161 7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.328 29.179 6.141 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.198 27.971 5.484 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.547 27.455 6.524 1.00 0.00 H new ATOM 784 N GLY A 47 -2.298 28.512 10.034 1.00 0.00 N ATOM 785 CA GLY A 47 -2.889 28.997 11.285 1.00 0.00 C ATOM 786 C GLY A 47 -4.024 28.125 11.832 1.00 0.00 C ATOM 787 O GLY A 47 -4.493 28.354 12.953 1.00 0.00 O ATOM 0 H GLY A 47 -1.548 27.834 10.169 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.105 29.066 12.039 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.268 30.006 11.126 1.00 0.00 H new ATOM 791 N LYS A 48 -4.468 27.127 11.054 1.00 0.00 N ATOM 792 CA LYS A 48 -5.552 26.204 11.463 1.00 0.00 C ATOM 793 C LYS A 48 -4.944 24.854 11.884 1.00 0.00 C ATOM 794 O LYS A 48 -3.959 24.389 11.284 1.00 0.00 O ATOM 795 CB LYS A 48 -6.570 26.034 10.293 1.00 0.00 C ATOM 796 CG LYS A 48 -5.997 25.335 9.030 1.00 0.00 C ATOM 797 CD LYS A 48 -6.741 25.685 7.725 1.00 0.00 C ATOM 798 CE LYS A 48 -6.605 27.163 7.335 1.00 0.00 C ATOM 799 NZ LYS A 48 -7.485 27.498 6.189 1.00 0.00 N ATOM 0 H LYS A 48 -4.092 26.932 10.126 1.00 0.00 H new ATOM 0 HA LYS A 48 -6.090 26.616 12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.424 25.460 10.653 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.944 27.018 10.009 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.947 25.608 8.922 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.032 24.256 9.178 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.356 25.065 6.916 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.797 25.441 7.839 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.859 27.792 8.188 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.568 27.380 7.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.372 28.503 5.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.225 26.913 5.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.476 27.313 6.446 1.00 0.00 H new ATOM 813 N GLN A 49 -5.513 24.245 12.943 1.00 0.00 N ATOM 814 CA GLN A 49 -5.084 22.919 13.426 1.00 0.00 C ATOM 815 C GLN A 49 -5.597 21.839 12.460 1.00 0.00 C ATOM 816 O GLN A 49 -6.774 21.844 12.078 1.00 0.00 O ATOM 817 CB GLN A 49 -5.603 22.655 14.863 1.00 0.00 C ATOM 818 CG GLN A 49 -5.098 21.338 15.504 1.00 0.00 C ATOM 819 CD GLN A 49 -5.731 21.015 16.869 1.00 0.00 C ATOM 820 OE1 GLN A 49 -5.094 20.419 17.738 1.00 0.00 O ATOM 821 NE2 GLN A 49 -6.995 21.367 17.058 1.00 0.00 N ATOM 0 H GLN A 49 -6.276 24.654 13.483 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.995 22.889 13.459 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -5.308 23.489 15.500 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.693 22.639 14.843 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.299 20.514 14.819 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.016 21.397 15.623 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.502 21.860 16.323 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.460 21.145 17.938 1.00 0.00 H new ATOM 830 N LEU A 50 -4.707 20.929 12.052 1.00 0.00 N ATOM 831 CA LEU A 50 -5.035 19.899 11.072 1.00 0.00 C ATOM 832 C LEU A 50 -5.724 18.707 11.762 1.00 0.00 C ATOM 833 O LEU A 50 -5.128 18.053 12.628 1.00 0.00 O ATOM 834 CB LEU A 50 -3.772 19.448 10.315 1.00 0.00 C ATOM 835 CG LEU A 50 -2.860 20.580 9.742 1.00 0.00 C ATOM 836 CD1 LEU A 50 -1.756 19.987 8.870 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.663 21.669 8.991 1.00 0.00 C ATOM 0 H LEU A 50 -3.746 20.889 12.392 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.729 20.318 10.343 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.172 18.835 10.987 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.080 18.807 9.489 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.394 21.083 10.589 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.130 20.790 8.479 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.146 19.309 9.467 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.203 19.439 8.041 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.980 22.430 8.614 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.198 21.216 8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.378 22.129 9.673 1.00 0.00 H new ATOM 849 N GLU A 51 -6.982 18.446 11.362 1.00 0.00 N ATOM 850 CA GLU A 51 -7.812 17.377 11.920 1.00 0.00 C ATOM 851 C GLU A 51 -7.398 16.031 11.312 1.00 0.00 C ATOM 852 O GLU A 51 -7.208 15.934 10.094 1.00 0.00 O ATOM 853 CB GLU A 51 -9.305 17.691 11.624 1.00 0.00 C ATOM 854 CG GLU A 51 -10.311 16.563 11.946 1.00 0.00 C ATOM 855 CD GLU A 51 -11.773 16.992 11.742 1.00 0.00 C ATOM 856 OE1 GLU A 51 -12.255 16.988 10.600 1.00 0.00 O ATOM 857 OE2 GLU A 51 -12.439 17.380 12.723 1.00 0.00 O ATOM 0 H GLU A 51 -7.451 18.982 10.632 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.674 17.316 12.999 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.589 18.577 12.192 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.400 17.945 10.568 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -10.098 15.701 11.313 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.172 16.242 12.978 1.00 0.00 H new ATOM 864 N ASP A 52 -7.334 15.004 12.177 1.00 0.00 N ATOM 865 CA ASP A 52 -6.849 13.653 11.842 1.00 0.00 C ATOM 866 C ASP A 52 -7.593 13.062 10.640 1.00 0.00 C ATOM 867 O ASP A 52 -6.964 12.601 9.686 1.00 0.00 O ATOM 868 CB ASP A 52 -7.018 12.720 13.073 1.00 0.00 C ATOM 869 CG ASP A 52 -6.098 13.092 14.243 1.00 0.00 C ATOM 870 OD1 ASP A 52 -6.201 14.230 14.758 1.00 0.00 O ATOM 871 OD2 ASP A 52 -5.234 12.273 14.630 1.00 0.00 O ATOM 0 H ASP A 52 -7.625 15.092 13.151 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.795 13.732 11.574 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.054 12.756 13.408 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.816 11.692 12.772 1.00 0.00 H new ATOM 876 N GLY A 53 -8.940 13.115 10.708 1.00 0.00 N ATOM 877 CA GLY A 53 -9.817 12.517 9.697 1.00 0.00 C ATOM 878 C GLY A 53 -9.684 13.140 8.311 1.00 0.00 C ATOM 879 O GLY A 53 -9.933 12.467 7.305 1.00 0.00 O ATOM 0 H GLY A 53 -9.443 13.575 11.467 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.599 11.451 9.627 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.851 12.610 10.028 1.00 0.00 H new ATOM 883 N ARG A 54 -9.284 14.429 8.261 1.00 0.00 N ATOM 884 CA ARG A 54 -9.136 15.185 6.999 1.00 0.00 C ATOM 885 C ARG A 54 -7.853 14.815 6.257 1.00 0.00 C ATOM 886 O ARG A 54 -7.041 14.042 6.756 1.00 0.00 O ATOM 887 CB ARG A 54 -9.176 16.703 7.281 1.00 0.00 C ATOM 888 CG ARG A 54 -10.547 17.193 7.770 1.00 0.00 C ATOM 889 CD ARG A 54 -10.607 18.707 7.963 1.00 0.00 C ATOM 890 NE ARG A 54 -11.942 19.159 8.383 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.698 20.062 7.739 1.00 0.00 C ATOM 892 NH1 ARG A 54 -12.319 20.573 6.578 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.858 20.415 8.245 1.00 0.00 N ATOM 0 H ARG A 54 -9.055 14.974 9.093 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.973 14.916 6.354 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -8.422 16.947 8.030 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.908 17.242 6.372 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.311 16.893 7.052 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.786 16.702 8.713 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.872 19.006 8.710 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.334 19.202 7.031 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.326 18.752 9.236 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -11.437 20.282 6.156 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.909 21.258 6.105 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -14.179 20.003 9.122 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.438 21.101 7.761 1.00 0.00 H new ATOM 907 N THR A 55 -7.686 15.389 5.061 1.00 0.00 N ATOM 908 CA THR A 55 -6.510 15.149 4.211 1.00 0.00 C ATOM 909 C THR A 55 -5.657 16.413 4.130 1.00 0.00 C ATOM 910 O THR A 55 -6.125 17.512 4.465 1.00 0.00 O ATOM 911 CB THR A 55 -6.918 14.701 2.765 1.00 0.00 C ATOM 912 OG1 THR A 55 -7.772 15.687 2.159 1.00 0.00 O ATOM 913 CG2 THR A 55 -7.621 13.336 2.768 1.00 0.00 C ATOM 0 H THR A 55 -8.362 16.034 4.652 1.00 0.00 H new ATOM 0 HA THR A 55 -5.936 14.342 4.666 1.00 0.00 H new ATOM 0 HB THR A 55 -6.002 14.606 2.183 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.018 15.396 1.256 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.887 13.062 1.747 1.00 0.00 H new ATOM 0 HG22 THR A 55 -6.951 12.583 3.183 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.524 13.393 3.376 1.00 0.00 H new ATOM 921 N LEU A 56 -4.407 16.242 3.672 1.00 0.00 N ATOM 922 CA LEU A 56 -3.485 17.360 3.417 1.00 0.00 C ATOM 923 C LEU A 56 -4.138 18.365 2.445 1.00 0.00 C ATOM 924 O LEU A 56 -4.300 19.540 2.772 1.00 0.00 O ATOM 925 CB LEU A 56 -2.142 16.834 2.825 1.00 0.00 C ATOM 926 CG LEU A 56 -1.223 16.002 3.778 1.00 0.00 C ATOM 927 CD1 LEU A 56 -0.046 15.369 2.997 1.00 0.00 C ATOM 928 CD2 LEU A 56 -0.696 16.867 4.956 1.00 0.00 C ATOM 0 H LEU A 56 -4.007 15.326 3.468 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.272 17.863 4.360 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.373 16.219 1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.571 17.691 2.467 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.828 15.199 4.198 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.579 14.796 3.682 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.436 14.709 2.223 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.550 16.157 2.536 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.061 16.258 5.599 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.119 17.704 4.563 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.539 17.247 5.534 1.00 0.00 H new ATOM 940 N SER A 57 -4.597 17.840 1.295 1.00 0.00 N ATOM 941 CA SER A 57 -5.135 18.632 0.181 1.00 0.00 C ATOM 942 C SER A 57 -6.455 19.328 0.573 1.00 0.00 C ATOM 943 O SER A 57 -6.833 20.331 -0.046 1.00 0.00 O ATOM 944 CB SER A 57 -5.332 17.726 -1.060 1.00 0.00 C ATOM 945 OG SER A 57 -5.570 18.480 -2.242 1.00 0.00 O ATOM 0 H SER A 57 -4.603 16.836 1.113 1.00 0.00 H new ATOM 0 HA SER A 57 -4.418 19.415 -0.065 1.00 0.00 H new ATOM 0 HB2 SER A 57 -4.447 17.105 -1.199 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.170 17.051 -0.886 1.00 0.00 H new ATOM 0 HG SER A 57 -5.687 17.871 -3.001 1.00 0.00 H new ATOM 951 N ASP A 58 -7.129 18.808 1.626 1.00 0.00 N ATOM 952 CA ASP A 58 -8.340 19.435 2.197 1.00 0.00 C ATOM 953 C ASP A 58 -7.964 20.772 2.854 1.00 0.00 C ATOM 954 O ASP A 58 -8.664 21.782 2.696 1.00 0.00 O ATOM 955 CB ASP A 58 -8.997 18.484 3.229 1.00 0.00 C ATOM 956 CG ASP A 58 -10.198 19.107 3.965 1.00 0.00 C ATOM 957 OD1 ASP A 58 -11.341 18.985 3.481 1.00 0.00 O ATOM 958 OD2 ASP A 58 -9.994 19.747 5.010 1.00 0.00 O ATOM 0 H ASP A 58 -6.850 17.949 2.099 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.060 19.624 1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.324 17.578 2.719 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.248 18.184 3.962 1.00 0.00 H new ATOM 963 N TYR A 59 -6.827 20.759 3.575 1.00 0.00 N ATOM 964 CA TYR A 59 -6.269 21.950 4.220 1.00 0.00 C ATOM 965 C TYR A 59 -5.354 22.752 3.257 1.00 0.00 C ATOM 966 O TYR A 59 -4.584 23.600 3.710 1.00 0.00 O ATOM 967 CB TYR A 59 -5.494 21.532 5.491 1.00 0.00 C ATOM 968 CG TYR A 59 -6.392 21.223 6.689 1.00 0.00 C ATOM 969 CD1 TYR A 59 -7.138 22.242 7.273 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.480 19.949 7.250 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.919 22.024 8.378 1.00 0.00 C ATOM 972 CE2 TYR A 59 -7.271 19.727 8.354 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.990 20.773 8.909 1.00 0.00 C ATOM 974 OH TYR A 59 -8.757 20.564 10.033 1.00 0.00 O ATOM 0 H TYR A 59 -6.272 19.916 3.724 1.00 0.00 H new ATOM 0 HA TYR A 59 -7.093 22.607 4.497 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.891 20.653 5.265 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.804 22.330 5.763 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.101 23.232 6.844 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -5.924 19.132 6.815 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.473 22.837 8.823 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -7.331 18.739 8.787 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.294 20.926 10.817 1.00 0.00 H new ATOM 984 N ASN A 60 -5.465 22.467 1.930 1.00 0.00 N ATOM 985 CA ASN A 60 -4.733 23.172 0.839 1.00 0.00 C ATOM 986 C ASN A 60 -3.223 22.835 0.832 1.00 0.00 C ATOM 987 O ASN A 60 -2.419 23.525 0.191 1.00 0.00 O ATOM 988 CB ASN A 60 -4.974 24.720 0.867 1.00 0.00 C ATOM 989 CG ASN A 60 -6.435 25.137 0.621 1.00 0.00 C ATOM 990 OD1 ASN A 60 -6.704 26.075 -0.126 1.00 0.00 O ATOM 991 ND2 ASN A 60 -7.387 24.518 1.309 1.00 0.00 N ATOM 0 H ASN A 60 -6.076 21.728 1.582 1.00 0.00 H new ATOM 0 HA ASN A 60 -5.149 22.799 -0.097 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.655 25.108 1.834 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.343 25.188 0.112 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.357 24.819 1.222 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.148 23.741 1.925 1.00 0.00 H new ATOM 998 N ILE A 61 -2.866 21.744 1.512 1.00 0.00 N ATOM 999 CA ILE A 61 -1.497 21.215 1.557 1.00 0.00 C ATOM 1000 C ILE A 61 -1.333 20.211 0.405 1.00 0.00 C ATOM 1001 O ILE A 61 -1.847 19.089 0.470 1.00 0.00 O ATOM 1002 CB ILE A 61 -1.224 20.476 2.921 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -1.723 21.326 4.125 1.00 0.00 C ATOM 1004 CG2 ILE A 61 0.270 20.089 3.084 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -1.997 20.521 5.386 1.00 0.00 C ATOM 0 H ILE A 61 -3.529 21.192 2.057 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.791 22.040 1.464 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.793 19.546 2.905 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.978 22.090 4.350 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.636 21.847 3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.412 19.582 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.564 19.424 2.272 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.884 20.989 3.056 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.341 21.188 6.176 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.765 19.775 5.182 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.082 20.022 5.705 1.00 0.00 H new ATOM 1017 N GLN A 62 -0.656 20.622 -0.653 1.00 0.00 N ATOM 1018 CA GLN A 62 -0.346 19.727 -1.780 1.00 0.00 C ATOM 1019 C GLN A 62 0.941 18.951 -1.446 1.00 0.00 C ATOM 1020 O GLN A 62 1.523 19.115 -0.351 1.00 0.00 O ATOM 1021 CB GLN A 62 -0.207 20.525 -3.115 1.00 0.00 C ATOM 1022 CG GLN A 62 0.983 21.511 -3.178 1.00 0.00 C ATOM 1023 CD GLN A 62 1.219 22.079 -4.570 1.00 0.00 C ATOM 1024 OE1 GLN A 62 0.679 23.126 -4.934 1.00 0.00 O ATOM 1025 NE2 GLN A 62 2.034 21.392 -5.360 1.00 0.00 N ATOM 0 H GLN A 62 -0.304 21.573 -0.765 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.165 19.022 -1.926 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -0.111 19.814 -3.935 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -1.128 21.083 -3.283 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.803 22.332 -2.484 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.886 21.002 -2.843 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.463 20.530 -5.024 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.232 21.726 -6.303 1.00 0.00 H new ATOM 1034 N LYS A 63 1.387 18.099 -2.375 1.00 0.00 N ATOM 1035 CA LYS A 63 2.683 17.425 -2.253 1.00 0.00 C ATOM 1036 C LYS A 63 3.820 18.467 -2.169 1.00 0.00 C ATOM 1037 O LYS A 63 3.741 19.530 -2.796 1.00 0.00 O ATOM 1038 CB LYS A 63 2.933 16.468 -3.437 1.00 0.00 C ATOM 1039 CG LYS A 63 2.918 17.133 -4.830 1.00 0.00 C ATOM 1040 CD LYS A 63 3.125 16.089 -5.944 1.00 0.00 C ATOM 1041 CE LYS A 63 4.418 15.280 -5.734 1.00 0.00 C ATOM 1042 NZ LYS A 63 5.645 16.056 -6.043 1.00 0.00 N ATOM 0 H LYS A 63 0.869 17.860 -3.220 1.00 0.00 H new ATOM 0 HA LYS A 63 2.667 16.834 -1.337 1.00 0.00 H new ATOM 0 HB2 LYS A 63 3.898 15.982 -3.294 1.00 0.00 H new ATOM 0 HB3 LYS A 63 2.175 15.685 -3.417 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.969 17.647 -4.981 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.702 17.888 -4.885 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.272 15.411 -5.970 1.00 0.00 H new ATOM 0 HD3 LYS A 63 3.163 16.591 -6.911 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.462 14.938 -4.700 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.389 14.390 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.484 15.477 -5.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.646 16.318 -7.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 5.666 16.918 -5.461 1.00 0.00 H new ATOM 1056 N GLU A 64 4.833 18.146 -1.353 1.00 0.00 N ATOM 1057 CA GLU A 64 6.032 18.983 -1.112 1.00 0.00 C ATOM 1058 C GLU A 64 5.716 20.334 -0.430 1.00 0.00 C ATOM 1059 O GLU A 64 6.599 21.191 -0.349 1.00 0.00 O ATOM 1060 CB GLU A 64 6.840 19.182 -2.434 1.00 0.00 C ATOM 1061 CG GLU A 64 7.310 17.868 -3.095 1.00 0.00 C ATOM 1062 CD GLU A 64 7.953 18.090 -4.474 1.00 0.00 C ATOM 1063 OE1 GLU A 64 7.206 18.377 -5.436 1.00 0.00 O ATOM 1064 OE2 GLU A 64 9.195 18.009 -4.599 1.00 0.00 O ATOM 0 H GLU A 64 4.848 17.274 -0.824 1.00 0.00 H new ATOM 0 HA GLU A 64 6.653 18.437 -0.402 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.222 19.732 -3.144 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.712 19.801 -2.224 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.028 17.374 -2.440 1.00 0.00 H new ATOM 0 HG3 GLU A 64 6.459 17.195 -3.200 1.00 0.00 H new ATOM 1071 N SER A 65 4.481 20.516 0.089 1.00 0.00 N ATOM 1072 CA SER A 65 4.130 21.724 0.861 1.00 0.00 C ATOM 1073 C SER A 65 4.741 21.662 2.271 1.00 0.00 C ATOM 1074 O SER A 65 4.929 20.567 2.829 1.00 0.00 O ATOM 1075 CB SER A 65 2.607 21.884 0.967 1.00 0.00 C ATOM 1076 OG SER A 65 2.021 22.011 -0.306 1.00 0.00 O ATOM 0 H SER A 65 3.718 19.847 -0.013 1.00 0.00 H new ATOM 0 HA SER A 65 4.538 22.586 0.332 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.183 21.022 1.482 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.371 22.762 1.568 1.00 0.00 H new ATOM 0 HG SER A 65 1.309 22.683 -0.273 1.00 0.00 H new ATOM 1082 N THR A 66 5.061 22.839 2.833 1.00 0.00 N ATOM 1083 CA THR A 66 5.592 22.948 4.191 1.00 0.00 C ATOM 1084 C THR A 66 4.478 23.378 5.157 1.00 0.00 C ATOM 1085 O THR A 66 3.766 24.344 4.902 1.00 0.00 O ATOM 1086 CB THR A 66 6.802 23.933 4.272 1.00 0.00 C ATOM 1087 OG1 THR A 66 7.791 23.570 3.284 1.00 0.00 O ATOM 1088 CG2 THR A 66 7.458 23.915 5.670 1.00 0.00 C ATOM 0 H THR A 66 4.958 23.735 2.357 1.00 0.00 H new ATOM 0 HA THR A 66 5.961 21.965 4.483 1.00 0.00 H new ATOM 0 HB THR A 66 6.425 24.938 4.082 1.00 0.00 H new ATOM 0 HG1 THR A 66 8.548 24.190 3.336 1.00 0.00 H new ATOM 0 HG21 THR A 66 8.296 24.612 5.688 1.00 0.00 H new ATOM 0 HG22 THR A 66 6.724 24.210 6.420 1.00 0.00 H new ATOM 0 HG23 THR A 66 7.818 22.910 5.890 1.00 0.00 H new ATOM 1096 N LEU A 67 4.348 22.646 6.262 1.00 0.00 N ATOM 1097 CA LEU A 67 3.376 22.906 7.336 1.00 0.00 C ATOM 1098 C LEU A 67 4.119 22.856 8.676 1.00 0.00 C ATOM 1099 O LEU A 67 5.156 22.210 8.778 1.00 0.00 O ATOM 1100 CB LEU A 67 2.199 21.879 7.305 1.00 0.00 C ATOM 1101 CG LEU A 67 2.578 20.350 7.295 1.00 0.00 C ATOM 1102 CD1 LEU A 67 1.411 19.477 7.798 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.024 19.867 5.889 1.00 0.00 C ATOM 0 H LEU A 67 4.931 21.830 6.445 1.00 0.00 H new ATOM 0 HA LEU A 67 2.931 23.891 7.195 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.566 22.064 8.173 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.596 22.083 6.421 1.00 0.00 H new ATOM 0 HG LEU A 67 3.422 20.239 7.976 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.706 18.428 7.778 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.156 19.763 8.819 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.544 19.622 7.153 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.275 18.807 5.931 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.212 20.019 5.178 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.898 20.435 5.570 1.00 0.00 H new ATOM 1115 N HIS A 68 3.587 23.545 9.693 1.00 0.00 N ATOM 1116 CA HIS A 68 4.253 23.686 11.009 1.00 0.00 C ATOM 1117 C HIS A 68 3.897 22.529 11.959 1.00 0.00 C ATOM 1118 O HIS A 68 2.866 21.855 11.801 1.00 0.00 O ATOM 1119 CB HIS A 68 3.910 25.048 11.657 1.00 0.00 C ATOM 1120 CG HIS A 68 4.458 26.234 10.899 1.00 0.00 C ATOM 1121 ND1 HIS A 68 3.669 27.133 10.215 1.00 0.00 N ATOM 1122 CD2 HIS A 68 5.735 26.667 10.734 1.00 0.00 C ATOM 1123 CE1 HIS A 68 4.433 28.064 9.678 1.00 0.00 C ATOM 1124 NE2 HIS A 68 5.687 27.803 9.974 1.00 0.00 N ATOM 0 H HIS A 68 2.687 24.021 9.635 1.00 0.00 H new ATOM 0 HA HIS A 68 5.328 23.646 10.833 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.827 25.143 11.730 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.301 25.066 12.674 1.00 0.00 H new ATOM 0 HD2 HIS A 68 6.625 26.200 11.130 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.086 28.902 9.092 1.00 0.00 H new ATOM 0 HE2 HIS A 68 6.493 28.357 9.684 1.00 0.00 H new ATOM 1133 N LEU A 69 4.773 22.339 12.960 1.00 0.00 N ATOM 1134 CA LEU A 69 4.700 21.249 13.931 1.00 0.00 C ATOM 1135 C LEU A 69 5.122 21.807 15.296 1.00 0.00 C ATOM 1136 O LEU A 69 6.170 22.455 15.420 1.00 0.00 O ATOM 1137 CB LEU A 69 5.636 20.091 13.466 1.00 0.00 C ATOM 1138 CG LEU A 69 5.456 18.663 14.095 1.00 0.00 C ATOM 1139 CD1 LEU A 69 5.926 18.596 15.555 1.00 0.00 C ATOM 1140 CD2 LEU A 69 4.000 18.166 13.947 1.00 0.00 C ATOM 0 H LEU A 69 5.569 22.958 13.115 1.00 0.00 H new ATOM 0 HA LEU A 69 3.690 20.848 14.010 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.523 19.991 12.386 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.663 20.404 13.651 1.00 0.00 H new ATOM 0 HG LEU A 69 6.102 17.989 13.532 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.778 17.587 15.939 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.984 18.854 15.609 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.350 19.300 16.155 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.907 17.175 14.392 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.326 18.856 14.455 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.739 18.115 12.890 1.00 0.00 H new ATOM 1152 N VAL A 70 4.287 21.549 16.309 1.00 0.00 N ATOM 1153 CA VAL A 70 4.516 21.996 17.690 1.00 0.00 C ATOM 1154 C VAL A 70 4.823 20.791 18.591 1.00 0.00 C ATOM 1155 O VAL A 70 3.981 19.899 18.754 1.00 0.00 O ATOM 1156 CB VAL A 70 3.269 22.782 18.230 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.470 23.233 19.707 1.00 0.00 C ATOM 1158 CG2 VAL A 70 2.959 23.980 17.289 1.00 0.00 C ATOM 0 H VAL A 70 3.424 21.018 16.193 1.00 0.00 H new ATOM 0 HA VAL A 70 5.374 22.668 17.700 1.00 0.00 H new ATOM 0 HB VAL A 70 2.407 22.115 18.231 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.586 23.774 20.046 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.623 22.357 20.337 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.341 23.884 19.773 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.093 24.524 17.666 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.820 24.648 17.254 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.746 23.609 16.286 1.00 0.00 H new ATOM 1168 N LEU A 71 6.035 20.785 19.153 1.00 0.00 N ATOM 1169 CA LEU A 71 6.506 19.752 20.085 1.00 0.00 C ATOM 1170 C LEU A 71 6.098 20.096 21.529 1.00 0.00 C ATOM 1171 O LEU A 71 6.147 21.262 21.928 1.00 0.00 O ATOM 1172 CB LEU A 71 8.045 19.622 19.963 1.00 0.00 C ATOM 1173 CG LEU A 71 8.571 19.104 18.586 1.00 0.00 C ATOM 1174 CD1 LEU A 71 10.118 19.069 18.541 1.00 0.00 C ATOM 1175 CD2 LEU A 71 7.972 17.716 18.263 1.00 0.00 C ATOM 0 H LEU A 71 6.730 21.509 18.971 1.00 0.00 H new ATOM 0 HA LEU A 71 6.044 18.798 19.831 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.491 20.597 20.159 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.398 18.948 20.744 1.00 0.00 H new ATOM 0 HG LEU A 71 8.243 19.806 17.819 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.446 18.703 17.568 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.509 20.073 18.702 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.490 18.405 19.322 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.350 17.372 17.300 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.258 17.007 19.040 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.885 17.790 18.221 1.00 0.00 H new ATOM 1187 N ARG A 72 5.682 19.064 22.290 1.00 0.00 N ATOM 1188 CA ARG A 72 5.263 19.201 23.709 1.00 0.00 C ATOM 1189 C ARG A 72 6.170 18.382 24.650 1.00 0.00 C ATOM 1190 O ARG A 72 6.565 18.867 25.716 1.00 0.00 O ATOM 1191 CB ARG A 72 3.780 18.765 23.858 1.00 0.00 C ATOM 1192 CG ARG A 72 2.757 19.761 23.253 1.00 0.00 C ATOM 1193 CD ARG A 72 1.302 19.219 23.244 1.00 0.00 C ATOM 1194 NE ARG A 72 0.932 18.563 21.964 1.00 0.00 N ATOM 1195 CZ ARG A 72 -0.318 18.515 21.444 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -1.320 19.172 22.013 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -0.548 17.823 20.335 1.00 0.00 N ATOM 0 H ARG A 72 5.625 18.107 21.941 1.00 0.00 H new ATOM 0 HA ARG A 72 5.361 20.248 23.997 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.650 17.794 23.381 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.557 18.632 24.917 1.00 0.00 H new ATOM 0 HG2 ARG A 72 2.787 20.691 23.820 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.054 20.001 22.232 1.00 0.00 H new ATOM 0 HD2 ARG A 72 1.182 18.505 24.059 1.00 0.00 H new ATOM 0 HD3 ARG A 72 0.613 20.042 23.436 1.00 0.00 H new ATOM 0 HE ARG A 72 1.678 18.113 21.434 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -1.155 19.724 22.855 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -2.255 19.125 21.609 1.00 0.00 H new ATOM 0 HH21 ARG A 72 0.216 17.328 19.875 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.489 17.786 19.943 1.00 0.00 H new ATOM 1211 N LEU A 73 6.460 17.126 24.249 1.00 0.00 N ATOM 1212 CA LEU A 73 7.298 16.170 25.028 1.00 0.00 C ATOM 1213 C LEU A 73 6.748 15.932 26.463 1.00 0.00 C ATOM 1214 O LEU A 73 7.518 15.640 27.388 1.00 0.00 O ATOM 1215 CB LEU A 73 8.809 16.609 25.043 1.00 0.00 C ATOM 1216 CG LEU A 73 9.629 16.416 23.711 1.00 0.00 C ATOM 1217 CD1 LEU A 73 9.622 14.940 23.246 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.153 17.365 22.588 1.00 0.00 C ATOM 0 H LEU A 73 6.120 16.737 23.370 1.00 0.00 H new ATOM 0 HA LEU A 73 7.242 15.210 24.515 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.852 17.663 25.316 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.314 16.054 25.834 1.00 0.00 H new ATOM 0 HG LEU A 73 10.661 16.685 23.936 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.197 14.846 22.325 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.068 14.313 24.018 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.596 14.620 23.067 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.748 17.194 21.691 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.103 17.172 22.369 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.272 18.399 22.911 1.00 0.00 H new ATOM 1230 N ARG A 74 5.397 15.993 26.601 1.00 0.00 N ATOM 1231 CA ARG A 74 4.689 15.784 27.891 1.00 0.00 C ATOM 1232 C ARG A 74 4.971 14.368 28.421 1.00 0.00 C ATOM 1233 O ARG A 74 5.509 14.193 29.519 1.00 0.00 O ATOM 1234 CB ARG A 74 3.151 15.993 27.723 1.00 0.00 C ATOM 1235 CG ARG A 74 2.710 17.416 27.329 1.00 0.00 C ATOM 1236 CD ARG A 74 2.954 18.449 28.445 1.00 0.00 C ATOM 1237 NE ARG A 74 2.535 19.806 28.038 1.00 0.00 N ATOM 1238 CZ ARG A 74 3.269 20.651 27.303 1.00 0.00 C ATOM 1239 NH1 ARG A 74 4.479 20.313 26.910 1.00 0.00 N ATOM 1240 NH2 ARG A 74 2.788 21.840 26.964 1.00 0.00 N ATOM 0 H ARG A 74 4.769 16.188 25.821 1.00 0.00 H new ATOM 0 HA ARG A 74 5.059 16.518 28.607 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.789 15.297 26.966 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.662 15.727 28.660 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.249 17.723 26.433 1.00 0.00 H new ATOM 0 HG3 ARG A 74 1.650 17.406 27.076 1.00 0.00 H new ATOM 0 HD2 ARG A 74 2.407 18.153 29.340 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.012 18.458 28.706 1.00 0.00 H new ATOM 0 HE ARG A 74 1.614 20.124 28.341 1.00 0.00 H new ATOM 0 HH11 ARG A 74 4.862 19.403 27.165 1.00 0.00 H new ATOM 0 HH12 ARG A 74 5.033 20.961 26.350 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.853 22.116 27.263 1.00 0.00 H new ATOM 0 HH22 ARG A 74 3.353 22.478 26.404 1.00 0.00 H new ATOM 1254 N GLY A 75 4.617 13.372 27.586 1.00 0.00 N ATOM 1255 CA GLY A 75 4.910 11.961 27.849 1.00 0.00 C ATOM 1256 C GLY A 75 6.171 11.490 27.125 1.00 0.00 C ATOM 1257 O GLY A 75 6.259 10.324 26.727 1.00 0.00 O ATOM 0 H GLY A 75 4.119 13.530 26.710 1.00 0.00 H new ATOM 0 HA2 GLY A 75 5.031 11.810 28.922 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.063 11.351 27.535 1.00 0.00 H new ATOM 1261 N GLY A 76 7.150 12.411 26.954 1.00 0.00 N ATOM 1262 CA GLY A 76 8.424 12.097 26.295 1.00 0.00 C ATOM 1263 C GLY A 76 8.289 11.864 24.790 1.00 0.00 C ATOM 1264 O GLY A 76 7.387 12.421 24.142 1.00 0.00 O ATOM 0 H GLY A 76 7.073 13.379 27.268 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.124 12.914 26.467 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.853 11.207 26.756 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 17.853 13.724 26.563 1.00 0.00 N ATOM 1270 CA GLY B 195 16.667 14.555 26.349 1.00 0.00 C ATOM 1271 C GLY B 195 16.325 15.377 27.583 1.00 0.00 C ATOM 1272 O GLY B 195 15.283 15.153 28.225 1.00 0.00 O ATOM 0 HA2 GLY B 195 16.838 15.222 25.504 1.00 0.00 H new ATOM 0 HA3 GLY B 195 15.820 13.920 26.089 1.00 0.00 H new ATOM 1276 N SER B 196 17.229 16.320 27.934 1.00 0.00 N ATOM 1277 CA SER B 196 17.042 17.242 29.070 1.00 0.00 C ATOM 1278 C SER B 196 15.929 18.263 28.748 1.00 0.00 C ATOM 1279 O SER B 196 16.177 19.306 28.130 1.00 0.00 O ATOM 1280 CB SER B 196 18.387 17.941 29.417 1.00 0.00 C ATOM 1281 OG SER B 196 18.986 18.538 28.273 1.00 0.00 O ATOM 0 H SER B 196 18.108 16.460 27.435 1.00 0.00 H new ATOM 0 HA SER B 196 16.727 16.678 29.948 1.00 0.00 H new ATOM 0 HB2 SER B 196 18.214 18.704 30.176 1.00 0.00 H new ATOM 0 HB3 SER B 196 19.074 17.213 29.848 1.00 0.00 H new ATOM 0 HG SER B 196 18.303 19.015 27.757 1.00 0.00 H new ATOM 1287 N ARG B 197 14.688 17.905 29.114 1.00 0.00 N ATOM 1288 CA ARG B 197 13.512 18.765 28.898 1.00 0.00 C ATOM 1289 C ARG B 197 13.500 19.916 29.926 1.00 0.00 C ATOM 1290 O ARG B 197 13.569 19.679 31.136 1.00 0.00 O ATOM 1291 CB ARG B 197 12.198 17.935 28.993 1.00 0.00 C ATOM 1292 CG ARG B 197 10.903 18.750 28.744 1.00 0.00 C ATOM 1293 CD ARG B 197 9.628 17.892 28.826 1.00 0.00 C ATOM 1294 NE ARG B 197 8.413 18.719 28.707 1.00 0.00 N ATOM 1295 CZ ARG B 197 7.231 18.449 29.274 1.00 0.00 C ATOM 1296 NH1 ARG B 197 7.030 17.310 29.925 1.00 0.00 N ATOM 1297 NH2 ARG B 197 6.244 19.319 29.169 1.00 0.00 N ATOM 0 H ARG B 197 14.471 17.016 29.566 1.00 0.00 H new ATOM 0 HA ARG B 197 13.573 19.190 27.896 1.00 0.00 H new ATOM 0 HB2 ARG B 197 12.244 17.121 28.270 1.00 0.00 H new ATOM 0 HB3 ARG B 197 12.141 17.480 29.982 1.00 0.00 H new ATOM 0 HG2 ARG B 197 10.840 19.555 29.476 1.00 0.00 H new ATOM 0 HG3 ARG B 197 10.958 19.217 27.761 1.00 0.00 H new ATOM 0 HD2 ARG B 197 9.640 17.144 28.033 1.00 0.00 H new ATOM 0 HD3 ARG B 197 9.611 17.353 29.773 1.00 0.00 H new ATOM 0 HE ARG B 197 8.479 19.568 28.146 1.00 0.00 H new ATOM 0 HH11 ARG B 197 7.782 16.625 29.999 1.00 0.00 H new ATOM 0 HH12 ARG B 197 6.123 17.120 30.352 1.00 0.00 H new ATOM 0 HH21 ARG B 197 6.385 20.191 28.658 1.00 0.00 H new ATOM 0 HH22 ARG B 197 5.341 19.120 29.599 1.00 0.00 H new ATOM 1311 N GLN B 198 13.434 21.152 29.415 1.00 0.00 N ATOM 1312 CA GLN B 198 13.330 22.382 30.225 1.00 0.00 C ATOM 1313 C GLN B 198 12.129 23.213 29.734 1.00 0.00 C ATOM 1314 O GLN B 198 11.481 22.848 28.734 1.00 0.00 O ATOM 1315 CB GLN B 198 14.647 23.205 30.105 1.00 0.00 C ATOM 1316 CG GLN B 198 14.973 23.701 28.672 1.00 0.00 C ATOM 1317 CD GLN B 198 16.212 24.603 28.575 1.00 0.00 C ATOM 1318 OE1 GLN B 198 16.910 24.605 27.563 1.00 0.00 O ATOM 1319 NE2 GLN B 198 16.476 25.404 29.600 1.00 0.00 N ATOM 0 H GLN B 198 13.451 21.333 28.411 1.00 0.00 H new ATOM 0 HA GLN B 198 13.179 22.122 31.273 1.00 0.00 H new ATOM 0 HB2 GLN B 198 14.582 24.068 30.767 1.00 0.00 H new ATOM 0 HB3 GLN B 198 15.476 22.593 30.460 1.00 0.00 H new ATOM 0 HG2 GLN B 198 15.119 22.835 28.026 1.00 0.00 H new ATOM 0 HG3 GLN B 198 14.112 24.246 28.285 1.00 0.00 H new ATOM 0 HE21 GLN B 198 15.882 25.384 30.429 1.00 0.00 H new ATOM 0 HE22 GLN B 198 17.273 26.039 29.559 1.00 0.00 H new ATOM 1328 N VAL B 199 11.831 24.329 30.433 1.00 0.00 N ATOM 1329 CA VAL B 199 10.832 25.311 29.975 1.00 0.00 C ATOM 1330 C VAL B 199 11.391 26.074 28.741 1.00 0.00 C ATOM 1331 O VAL B 199 12.012 27.138 28.845 1.00 0.00 O ATOM 1332 CB VAL B 199 10.374 26.278 31.144 1.00 0.00 C ATOM 1333 CG1 VAL B 199 11.569 27.009 31.821 1.00 0.00 C ATOM 1334 CG2 VAL B 199 9.281 27.276 30.661 1.00 0.00 C ATOM 0 H VAL B 199 12.272 24.571 31.320 1.00 0.00 H new ATOM 0 HA VAL B 199 9.928 24.786 29.667 1.00 0.00 H new ATOM 0 HB VAL B 199 9.928 25.649 31.914 1.00 0.00 H new ATOM 0 HG11 VAL B 199 11.197 27.658 32.614 1.00 0.00 H new ATOM 0 HG12 VAL B 199 12.253 26.273 32.245 1.00 0.00 H new ATOM 0 HG13 VAL B 199 12.096 27.609 31.079 1.00 0.00 H new ATOM 0 HG21 VAL B 199 8.990 27.924 31.487 1.00 0.00 H new ATOM 0 HG22 VAL B 199 9.676 27.882 29.846 1.00 0.00 H new ATOM 0 HG23 VAL B 199 8.411 26.721 30.311 1.00 0.00 H new ATOM 1344 N THR B 200 11.223 25.443 27.573 1.00 0.00 N ATOM 1345 CA THR B 200 11.730 25.950 26.291 1.00 0.00 C ATOM 1346 C THR B 200 10.806 27.063 25.767 1.00 0.00 C ATOM 1347 O THR B 200 9.587 26.950 25.873 1.00 0.00 O ATOM 1348 CB THR B 200 11.821 24.775 25.256 1.00 0.00 C ATOM 1349 OG1 THR B 200 12.609 23.710 25.809 1.00 0.00 O ATOM 1350 CG2 THR B 200 12.438 25.220 23.913 1.00 0.00 C ATOM 0 H THR B 200 10.726 24.556 27.490 1.00 0.00 H new ATOM 0 HA THR B 200 12.727 26.367 26.434 1.00 0.00 H new ATOM 0 HB THR B 200 10.804 24.437 25.056 1.00 0.00 H new ATOM 0 HG1 THR B 200 12.665 22.975 25.163 1.00 0.00 H new ATOM 0 HG21 THR B 200 12.479 24.370 23.232 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.825 26.008 23.474 1.00 0.00 H new ATOM 0 HG23 THR B 200 13.446 25.597 24.083 1.00 0.00 H new ATOM 1358 N LYS B 201 11.385 28.161 25.254 1.00 0.00 N ATOM 1359 CA LYS B 201 10.615 29.250 24.628 1.00 0.00 C ATOM 1360 C LYS B 201 10.651 29.068 23.105 1.00 0.00 C ATOM 1361 O LYS B 201 11.724 28.984 22.496 1.00 0.00 O ATOM 1362 CB LYS B 201 11.153 30.651 25.062 1.00 0.00 C ATOM 1363 CG LYS B 201 10.643 31.161 26.441 1.00 0.00 C ATOM 1364 CD LYS B 201 11.103 30.318 27.673 1.00 0.00 C ATOM 1365 CE LYS B 201 12.568 30.578 28.117 1.00 0.00 C ATOM 1366 NZ LYS B 201 13.580 30.095 27.143 1.00 0.00 N ATOM 0 H LYS B 201 12.393 28.319 25.261 1.00 0.00 H new ATOM 0 HA LYS B 201 9.579 29.205 24.965 1.00 0.00 H new ATOM 0 HB2 LYS B 201 12.242 30.612 25.088 1.00 0.00 H new ATOM 0 HB3 LYS B 201 10.878 31.380 24.299 1.00 0.00 H new ATOM 0 HG2 LYS B 201 10.980 32.189 26.578 1.00 0.00 H new ATOM 0 HG3 LYS B 201 9.553 31.183 26.422 1.00 0.00 H new ATOM 0 HD2 LYS B 201 10.439 30.530 28.511 1.00 0.00 H new ATOM 0 HD3 LYS B 201 10.990 29.260 27.437 1.00 0.00 H new ATOM 0 HE2 LYS B 201 12.707 31.648 28.272 1.00 0.00 H new ATOM 0 HE3 LYS B 201 12.739 30.092 29.077 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 14.469 29.887 27.641 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 13.232 29.231 26.680 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 13.749 30.828 26.425 1.00 0.00 H new ATOM 1380 N VAL B 202 9.450 28.990 22.521 1.00 0.00 N ATOM 1381 CA VAL B 202 9.213 28.740 21.091 1.00 0.00 C ATOM 1382 C VAL B 202 8.151 29.735 20.571 1.00 0.00 C ATOM 1383 O VAL B 202 7.672 30.597 21.320 1.00 0.00 O ATOM 1384 CB VAL B 202 8.757 27.241 20.853 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.933 26.239 21.005 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.594 26.856 21.801 1.00 0.00 C ATOM 0 H VAL B 202 8.584 29.103 23.048 1.00 0.00 H new ATOM 0 HA VAL B 202 10.140 28.890 20.538 1.00 0.00 H new ATOM 0 HB VAL B 202 8.405 27.179 19.823 1.00 0.00 H new ATOM 0 HG11 VAL B 202 9.572 25.225 20.833 1.00 0.00 H new ATOM 0 HG12 VAL B 202 10.709 26.476 20.277 1.00 0.00 H new ATOM 0 HG13 VAL B 202 10.345 26.311 22.012 1.00 0.00 H new ATOM 0 HG21 VAL B 202 7.301 25.823 21.616 1.00 0.00 H new ATOM 0 HG22 VAL B 202 7.918 26.962 22.836 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.743 27.512 21.618 1.00 0.00 H new ATOM 1396 N ASP B 203 7.800 29.627 19.285 1.00 0.00 N ATOM 1397 CA ASP B 203 6.876 30.567 18.617 1.00 0.00 C ATOM 1398 C ASP B 203 5.532 29.894 18.307 1.00 0.00 C ATOM 1399 O ASP B 203 5.481 28.704 18.019 1.00 0.00 O ATOM 1400 CB ASP B 203 7.519 31.118 17.321 1.00 0.00 C ATOM 1401 CG ASP B 203 8.765 31.974 17.598 1.00 0.00 C ATOM 1402 OD1 ASP B 203 8.613 33.173 17.914 1.00 0.00 O ATOM 1403 OD2 ASP B 203 9.902 31.458 17.502 1.00 0.00 O ATOM 0 H ASP B 203 8.145 28.888 18.673 1.00 0.00 H new ATOM 0 HA ASP B 203 6.685 31.398 19.296 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.791 30.285 16.672 1.00 0.00 H new ATOM 0 HB3 ASP B 203 6.785 31.716 16.781 1.00 0.00 H new ATOM 1408 N CYS B 204 4.447 30.684 18.379 1.00 0.00 N ATOM 1409 CA CYS B 204 3.066 30.227 18.125 1.00 0.00 C ATOM 1410 C CYS B 204 2.745 30.390 16.628 1.00 0.00 C ATOM 1411 O CYS B 204 2.465 31.503 16.209 1.00 0.00 O ATOM 1412 CB CYS B 204 2.091 31.050 19.006 1.00 0.00 C ATOM 1413 SG CYS B 204 0.309 30.668 18.848 1.00 0.00 S ATOM 0 H CYS B 204 4.504 31.674 18.619 1.00 0.00 H new ATOM 0 HA CYS B 204 2.957 29.174 18.383 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.377 30.911 20.049 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.233 32.106 18.774 1.00 0.00 H new ATOM 1418 N PRO B 205 2.763 29.283 15.800 1.00 0.00 N ATOM 1419 CA PRO B 205 2.753 29.362 14.297 1.00 0.00 C ATOM 1420 C PRO B 205 1.493 30.023 13.685 1.00 0.00 C ATOM 1421 O PRO B 205 1.460 30.305 12.478 1.00 0.00 O ATOM 1422 CB PRO B 205 2.881 27.870 13.867 1.00 0.00 C ATOM 1423 CG PRO B 205 2.344 27.099 15.031 1.00 0.00 C ATOM 1424 CD PRO B 205 2.794 27.864 16.253 1.00 0.00 C ATOM 0 HA PRO B 205 3.554 30.007 13.935 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.311 27.668 12.960 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.917 27.604 13.659 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.257 27.028 14.989 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.730 26.080 15.040 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.128 27.697 17.100 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.793 27.565 16.570 1.00 0.00 H new ATOM 1432 N VAL B 206 0.467 30.261 14.517 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.785 30.895 14.084 1.00 0.00 C ATOM 1434 C VAL B 206 -0.650 32.438 14.090 1.00 0.00 C ATOM 1435 O VAL B 206 -0.784 33.078 13.046 1.00 0.00 O ATOM 1436 CB VAL B 206 -1.992 30.471 14.997 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.323 31.063 14.462 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -2.065 28.924 15.158 1.00 0.00 C ATOM 0 H VAL B 206 0.483 30.019 15.508 1.00 0.00 H new ATOM 0 HA VAL B 206 -0.983 30.554 13.068 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.827 30.885 15.992 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.144 30.756 15.110 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.258 32.151 14.449 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.503 30.698 13.451 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.910 28.664 15.795 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -2.193 28.462 14.179 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -1.143 28.562 15.613 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.366 33.019 15.280 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.339 34.497 15.471 1.00 0.00 C ATOM 1450 C CYS B 207 1.102 35.054 15.481 1.00 0.00 C ATOM 1451 O CYS B 207 1.293 36.270 15.516 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.077 34.888 16.771 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.247 34.371 18.303 1.00 0.00 S ATOM 0 H CYS B 207 -0.152 32.490 16.125 1.00 0.00 H new ATOM 0 HA CYS B 207 -0.855 34.943 14.621 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.202 35.971 16.790 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.076 34.452 16.750 1.00 0.00 H new ATOM 1458 N GLY B 208 2.098 34.148 15.468 1.00 0.00 N ATOM 1459 CA GLY B 208 3.520 34.508 15.352 1.00 0.00 C ATOM 1460 C GLY B 208 4.079 35.249 16.564 1.00 0.00 C ATOM 1461 O GLY B 208 4.683 36.312 16.411 1.00 0.00 O ATOM 0 H GLY B 208 1.936 33.143 15.538 1.00 0.00 H new ATOM 0 HA2 GLY B 208 4.102 33.599 15.196 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.655 35.129 14.467 1.00 0.00 H new ATOM 1465 N VAL B 209 3.868 34.697 17.775 1.00 0.00 N ATOM 1466 CA VAL B 209 4.351 35.312 19.042 1.00 0.00 C ATOM 1467 C VAL B 209 5.330 34.369 19.768 1.00 0.00 C ATOM 1468 O VAL B 209 5.128 33.150 19.773 1.00 0.00 O ATOM 1469 CB VAL B 209 3.160 35.696 20.004 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.186 36.677 19.314 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.406 34.450 20.532 1.00 0.00 C ATOM 0 H VAL B 209 3.364 33.821 17.910 1.00 0.00 H new ATOM 0 HA VAL B 209 4.872 36.230 18.772 1.00 0.00 H new ATOM 0 HB VAL B 209 3.598 36.195 20.868 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.375 36.926 19.998 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.720 37.586 19.039 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.775 36.212 18.418 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.596 34.766 21.189 1.00 0.00 H new ATOM 0 HG22 VAL B 209 1.994 33.891 19.692 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.097 33.815 21.087 1.00 0.00 H new ATOM 1481 N ASN B 210 6.380 34.943 20.386 1.00 0.00 N ATOM 1482 CA ASN B 210 7.398 34.182 21.141 1.00 0.00 C ATOM 1483 C ASN B 210 7.002 34.108 22.626 1.00 0.00 C ATOM 1484 O ASN B 210 6.849 35.138 23.295 1.00 0.00 O ATOM 1485 CB ASN B 210 8.797 34.828 20.979 1.00 0.00 C ATOM 1486 CG ASN B 210 9.923 34.104 21.729 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.853 34.744 22.213 1.00 0.00 O ATOM 1488 ND2 ASN B 210 9.887 32.772 21.788 1.00 0.00 N ATOM 0 H ASN B 210 6.548 35.949 20.377 1.00 0.00 H new ATOM 0 HA ASN B 210 7.447 33.170 20.740 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.047 34.862 19.919 1.00 0.00 H new ATOM 0 HB3 ASN B 210 8.750 35.859 21.328 1.00 0.00 H new ATOM 0 HD21 ASN B 210 10.643 32.261 22.243 1.00 0.00 H new ATOM 0 HD22 ASN B 210 9.103 32.264 21.378 1.00 0.00 H new ATOM 1495 N ILE B 211 6.877 32.868 23.120 1.00 0.00 N ATOM 1496 CA ILE B 211 6.295 32.515 24.434 1.00 0.00 C ATOM 1497 C ILE B 211 6.920 31.182 24.934 1.00 0.00 C ATOM 1498 O ILE B 211 7.490 30.441 24.126 1.00 0.00 O ATOM 1499 CB ILE B 211 4.719 32.343 24.299 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.390 31.466 23.035 1.00 0.00 C ATOM 1501 CG2 ILE B 211 3.977 33.711 24.267 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.926 31.368 22.674 1.00 0.00 C ATOM 0 H ILE B 211 7.189 32.048 22.600 1.00 0.00 H new ATOM 0 HA ILE B 211 6.509 33.311 25.147 1.00 0.00 H new ATOM 0 HB ILE B 211 4.353 31.827 25.187 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.930 31.874 22.181 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.773 30.459 23.203 1.00 0.00 H new ATOM 0 HG21 ILE B 211 2.904 33.541 24.174 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.179 34.256 25.189 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.327 34.295 23.416 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.811 30.742 21.789 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.375 30.928 23.505 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.535 32.364 22.467 1.00 0.00 H new ATOM 1514 N PRO B 212 6.846 30.850 26.272 1.00 0.00 N ATOM 1515 CA PRO B 212 7.233 29.504 26.777 1.00 0.00 C ATOM 1516 C PRO B 212 6.309 28.400 26.220 1.00 0.00 C ATOM 1517 O PRO B 212 5.185 28.676 25.806 1.00 0.00 O ATOM 1518 CB PRO B 212 7.132 29.642 28.320 1.00 0.00 C ATOM 1519 CG PRO B 212 6.213 30.805 28.543 1.00 0.00 C ATOM 1520 CD PRO B 212 6.438 31.750 27.380 1.00 0.00 C ATOM 0 HA PRO B 212 8.231 29.204 26.459 1.00 0.00 H new ATOM 0 HB2 PRO B 212 6.736 28.733 28.773 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.111 29.820 28.766 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.174 30.478 28.584 1.00 0.00 H new ATOM 0 HG3 PRO B 212 6.430 31.296 29.492 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.533 32.305 27.133 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.211 32.485 27.605 1.00 0.00 H new ATOM 1528 N GLU B 213 6.805 27.155 26.238 1.00 0.00 N ATOM 1529 CA GLU B 213 6.184 26.007 25.546 1.00 0.00 C ATOM 1530 C GLU B 213 4.847 25.576 26.212 1.00 0.00 C ATOM 1531 O GLU B 213 3.929 25.084 25.540 1.00 0.00 O ATOM 1532 CB GLU B 213 7.234 24.857 25.445 1.00 0.00 C ATOM 1533 CG GLU B 213 6.895 23.691 24.476 1.00 0.00 C ATOM 1534 CD GLU B 213 6.074 22.575 25.133 1.00 0.00 C ATOM 1535 OE1 GLU B 213 6.645 21.846 25.970 1.00 0.00 O ATOM 1536 OE2 GLU B 213 4.857 22.438 24.854 1.00 0.00 O ATOM 0 H GLU B 213 7.659 26.909 26.739 1.00 0.00 H new ATOM 0 HA GLU B 213 5.900 26.295 24.534 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.186 25.290 25.137 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.381 24.441 26.442 1.00 0.00 H new ATOM 0 HG2 GLU B 213 6.342 24.085 23.624 1.00 0.00 H new ATOM 0 HG3 GLU B 213 7.822 23.270 24.087 1.00 0.00 H new ATOM 1543 N SER B 214 4.718 25.812 27.521 1.00 0.00 N ATOM 1544 CA SER B 214 3.432 25.662 28.235 1.00 0.00 C ATOM 1545 C SER B 214 2.378 26.627 27.639 1.00 0.00 C ATOM 1546 O SER B 214 1.236 26.237 27.328 1.00 0.00 O ATOM 1547 CB SER B 214 3.657 25.945 29.736 1.00 0.00 C ATOM 1548 OG SER B 214 4.286 27.205 29.918 1.00 0.00 O ATOM 0 H SER B 214 5.490 26.110 28.117 1.00 0.00 H new ATOM 0 HA SER B 214 3.057 24.645 28.118 1.00 0.00 H new ATOM 0 HB2 SER B 214 2.702 25.930 30.262 1.00 0.00 H new ATOM 0 HB3 SER B 214 4.273 25.158 30.172 1.00 0.00 H new ATOM 0 HG SER B 214 4.419 27.369 30.875 1.00 0.00 H new ATOM 1554 N HIS B 215 2.815 27.885 27.434 1.00 0.00 N ATOM 1555 CA HIS B 215 1.974 28.954 26.874 1.00 0.00 C ATOM 1556 C HIS B 215 1.806 28.811 25.358 1.00 0.00 C ATOM 1557 O HIS B 215 0.890 29.414 24.809 1.00 0.00 O ATOM 1558 CB HIS B 215 2.547 30.359 27.213 1.00 0.00 C ATOM 1559 CG HIS B 215 2.413 30.753 28.660 1.00 0.00 C ATOM 1560 ND1 HIS B 215 1.769 31.899 29.063 1.00 0.00 N ATOM 1561 CD2 HIS B 215 2.876 30.173 29.793 1.00 0.00 C ATOM 1562 CE1 HIS B 215 1.835 32.002 30.369 1.00 0.00 C ATOM 1563 NE2 HIS B 215 2.504 30.971 30.837 1.00 0.00 N ATOM 0 H HIS B 215 3.764 28.186 27.654 1.00 0.00 H new ATOM 0 HA HIS B 215 0.992 28.855 27.336 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.602 30.384 26.939 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.040 31.103 26.598 1.00 0.00 H new ATOM 0 HD2 HIS B 215 3.435 29.251 29.859 1.00 0.00 H new ATOM 0 HE1 HIS B 215 1.411 32.800 30.961 1.00 0.00 H new ATOM 0 HE2 HIS B 215 2.711 30.796 31.820 1.00 0.00 H new ATOM 1572 N ILE B 216 2.692 28.029 24.677 1.00 0.00 N ATOM 1573 CA ILE B 216 2.597 27.848 23.213 1.00 0.00 C ATOM 1574 C ILE B 216 1.391 26.960 22.912 1.00 0.00 C ATOM 1575 O ILE B 216 0.529 27.355 22.135 1.00 0.00 O ATOM 1576 CB ILE B 216 3.951 27.325 22.509 1.00 0.00 C ATOM 1577 CG1 ILE B 216 4.077 27.841 21.028 1.00 0.00 C ATOM 1578 CG2 ILE B 216 4.116 25.777 22.519 1.00 0.00 C ATOM 1579 CD1 ILE B 216 3.168 27.158 20.011 1.00 0.00 C ATOM 0 H ILE B 216 3.463 27.526 25.116 1.00 0.00 H new ATOM 0 HA ILE B 216 2.454 28.831 22.765 1.00 0.00 H new ATOM 0 HB ILE B 216 4.751 27.744 23.119 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.866 28.910 21.016 1.00 0.00 H new ATOM 0 HG13 ILE B 216 5.111 27.716 20.706 1.00 0.00 H new ATOM 0 HG21 ILE B 216 5.051 25.508 22.027 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.132 25.419 23.549 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.281 25.319 21.988 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.337 27.590 19.025 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.390 26.091 19.983 1.00 0.00 H new ATOM 0 HD13 ILE B 216 2.127 27.304 20.298 1.00 0.00 H new ATOM 1591 N ASN B 217 1.291 25.805 23.601 1.00 0.00 N ATOM 1592 CA ASN B 217 0.199 24.842 23.373 1.00 0.00 C ATOM 1593 C ASN B 217 -1.145 25.434 23.832 1.00 0.00 C ATOM 1594 O ASN B 217 -2.181 25.205 23.197 1.00 0.00 O ATOM 1595 CB ASN B 217 0.495 23.492 24.068 1.00 0.00 C ATOM 1596 CG ASN B 217 -0.552 22.423 23.729 1.00 0.00 C ATOM 1597 OD1 ASN B 217 -0.499 21.807 22.668 1.00 0.00 O ATOM 1598 ND2 ASN B 217 -1.503 22.186 24.620 1.00 0.00 N ATOM 0 H ASN B 217 1.955 25.518 24.320 1.00 0.00 H new ATOM 0 HA ASN B 217 0.129 24.646 22.303 1.00 0.00 H new ATOM 0 HB2 ASN B 217 1.482 23.140 23.768 1.00 0.00 H new ATOM 0 HB3 ASN B 217 0.524 23.640 25.148 1.00 0.00 H new ATOM 0 HD21 ASN B 217 -2.213 21.478 24.432 1.00 0.00 H new ATOM 0 HD22 ASN B 217 -1.525 22.711 25.494 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.092 26.222 24.928 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.244 27.002 25.420 1.00 0.00 C ATOM 1607 C LYS B 218 -2.704 28.033 24.366 1.00 0.00 C ATOM 1608 O LYS B 218 -3.915 28.154 24.064 1.00 0.00 O ATOM 1609 CB LYS B 218 -1.879 27.715 26.754 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.018 28.534 27.443 1.00 0.00 C ATOM 1611 CD LYS B 218 -4.217 27.673 27.959 1.00 0.00 C ATOM 1612 CE LYS B 218 -5.340 27.460 26.920 1.00 0.00 C ATOM 1613 NZ LYS B 218 -6.362 26.491 27.387 1.00 0.00 N ATOM 0 H LYS B 218 -0.251 26.334 25.494 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.070 26.314 25.602 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.527 26.961 27.458 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.043 28.388 26.563 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -2.595 29.085 28.283 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -3.396 29.272 26.736 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -3.841 26.700 28.275 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -4.641 28.153 28.841 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -5.819 28.415 26.705 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -4.905 27.104 25.986 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -7.095 26.380 26.657 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -5.911 25.571 27.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -6.797 26.841 28.264 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.716 28.741 23.782 1.00 0.00 N ATOM 1628 CA HIS B 219 -1.962 29.762 22.751 1.00 0.00 C ATOM 1629 C HIS B 219 -2.659 29.132 21.561 1.00 0.00 C ATOM 1630 O HIS B 219 -3.544 29.736 21.000 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.643 30.473 22.287 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.644 31.958 22.528 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.780 32.872 21.502 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.530 32.632 23.699 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.762 34.062 22.079 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.605 33.962 23.403 1.00 0.00 N ATOM 0 H HIS B 219 -0.730 28.620 24.013 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.601 30.526 23.194 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.203 30.029 22.811 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.494 30.286 21.224 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -0.404 32.198 24.680 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.862 34.997 21.548 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.551 34.735 24.067 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.257 27.898 21.216 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.827 27.159 20.086 1.00 0.00 C ATOM 1646 C LEU B 220 -4.286 26.808 20.335 1.00 0.00 C ATOM 1647 O LEU B 220 -5.072 26.901 19.422 1.00 0.00 O ATOM 1648 CB LEU B 220 -2.035 25.880 19.797 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.531 26.087 19.523 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.176 24.750 19.316 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.283 27.082 18.365 1.00 0.00 C ATOM 0 H LEU B 220 -1.528 27.388 21.715 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.765 27.813 19.216 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -2.144 25.205 20.646 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.480 25.383 18.935 1.00 0.00 H new ATOM 0 HG LEU B 220 -0.091 26.546 20.408 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.235 24.924 19.125 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.065 24.137 20.211 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.266 24.233 18.465 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.789 27.197 18.207 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.745 26.702 17.454 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.718 28.049 18.617 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.624 26.424 21.585 1.00 0.00 N ATOM 1664 CA ASP B 221 -6.004 26.069 21.973 1.00 0.00 C ATOM 1665 C ASP B 221 -6.977 27.216 21.649 1.00 0.00 C ATOM 1666 O ASP B 221 -8.098 26.989 21.191 1.00 0.00 O ATOM 1667 CB ASP B 221 -6.091 25.717 23.482 1.00 0.00 C ATOM 1668 CG ASP B 221 -5.201 24.535 23.912 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -5.052 23.566 23.137 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -4.684 24.552 25.048 1.00 0.00 O ATOM 0 H ASP B 221 -3.951 26.352 22.348 1.00 0.00 H new ATOM 0 HA ASP B 221 -6.289 25.190 21.395 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -5.813 26.596 24.064 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -7.127 25.485 23.729 1.00 0.00 H new ATOM 1675 N SER B 222 -6.512 28.454 21.872 1.00 0.00 N ATOM 1676 CA SER B 222 -7.306 29.661 21.571 1.00 0.00 C ATOM 1677 C SER B 222 -7.096 30.142 20.102 1.00 0.00 C ATOM 1678 O SER B 222 -8.013 30.694 19.486 1.00 0.00 O ATOM 1679 CB SER B 222 -6.934 30.765 22.581 1.00 0.00 C ATOM 1680 OG SER B 222 -7.779 31.901 22.465 1.00 0.00 O ATOM 0 H SER B 222 -5.589 28.649 22.260 1.00 0.00 H new ATOM 0 HA SER B 222 -8.365 29.422 21.667 1.00 0.00 H new ATOM 0 HB2 SER B 222 -7.000 30.367 23.594 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.898 31.066 22.423 1.00 0.00 H new ATOM 0 HG SER B 222 -7.511 32.576 23.123 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.886 29.916 19.553 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.480 30.426 18.222 1.00 0.00 C ATOM 1688 C CYS B 223 -5.975 29.536 17.058 1.00 0.00 C ATOM 1689 O CYS B 223 -6.062 30.011 15.924 1.00 0.00 O ATOM 1690 CB CYS B 223 -3.944 30.646 18.164 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.385 32.106 19.110 1.00 0.00 S ATOM 0 H CYS B 223 -5.159 29.374 20.019 1.00 0.00 H new ATOM 0 HA CYS B 223 -5.970 31.390 18.088 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.442 29.758 18.549 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.639 30.758 17.123 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.326 28.257 17.342 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.766 27.293 16.296 1.00 0.00 C ATOM 1698 C LEU B 224 -8.211 27.579 15.859 1.00 0.00 C ATOM 1699 O LEU B 224 -8.685 27.009 14.872 1.00 0.00 O ATOM 1700 CB LEU B 224 -6.581 25.809 16.776 1.00 0.00 C ATOM 1701 CG LEU B 224 -7.387 25.329 18.051 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -8.858 24.958 17.759 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -6.669 24.156 18.748 1.00 0.00 C ATOM 0 H LEU B 224 -6.314 27.867 18.285 1.00 0.00 H new ATOM 0 HA LEU B 224 -6.129 27.427 15.422 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -6.850 25.155 15.947 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -5.521 25.653 16.974 1.00 0.00 H new ATOM 0 HG LEU B 224 -7.415 26.189 18.720 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -9.343 24.639 18.682 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -9.379 25.827 17.356 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -8.891 24.146 17.032 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -7.243 23.845 19.621 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -6.581 23.320 18.055 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -5.675 24.473 19.062 1.00 0.00 H new ATOM 1715 N SER B 225 -8.886 28.498 16.595 1.00 0.00 N ATOM 1716 CA SER B 225 -10.284 28.916 16.356 1.00 0.00 C ATOM 1717 C SER B 225 -10.487 29.620 14.982 1.00 0.00 C ATOM 1718 O SER B 225 -11.592 30.100 14.682 1.00 0.00 O ATOM 1719 CB SER B 225 -10.723 29.850 17.513 1.00 0.00 C ATOM 1720 OG SER B 225 -10.488 29.252 18.782 1.00 0.00 O ATOM 0 H SER B 225 -8.460 28.978 17.388 1.00 0.00 H new ATOM 0 HA SER B 225 -10.902 28.019 16.326 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.180 30.793 17.447 1.00 0.00 H new ATOM 0 HB3 SER B 225 -11.782 30.085 17.411 1.00 0.00 H new ATOM 0 HG SER B 225 -9.681 29.639 19.181 1.00 0.00 H new ATOM 1726 N ARG B 226 -9.403 29.711 14.185 1.00 0.00 N ATOM 1727 CA ARG B 226 -9.445 30.117 12.777 1.00 0.00 C ATOM 1728 C ARG B 226 -10.391 29.178 11.989 1.00 0.00 C ATOM 1729 O ARG B 226 -10.013 28.057 11.627 1.00 0.00 O ATOM 1730 CB ARG B 226 -8.008 30.099 12.181 1.00 0.00 C ATOM 1731 CG ARG B 226 -7.885 30.705 10.760 1.00 0.00 C ATOM 1732 CD ARG B 226 -8.287 32.195 10.715 1.00 0.00 C ATOM 1733 NE ARG B 226 -7.516 33.007 11.688 1.00 0.00 N ATOM 1734 CZ ARG B 226 -6.464 33.792 11.397 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -6.021 33.914 10.154 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -5.858 34.460 12.363 1.00 0.00 N ATOM 0 H ARG B 226 -8.461 29.499 14.513 1.00 0.00 H new ATOM 0 HA ARG B 226 -9.832 31.133 12.699 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -7.345 30.645 12.852 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -7.655 29.068 12.153 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -6.858 30.599 10.411 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -8.515 30.141 10.072 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -8.126 32.584 9.710 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -9.352 32.290 10.927 1.00 0.00 H new ATOM 0 HE ARG B 226 -7.810 32.966 12.664 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -6.480 33.407 9.397 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -5.221 34.515 9.954 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -6.189 34.379 13.324 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -5.059 35.057 12.147 1.00 0.00 H new ATOM 1750 N GLU B 227 -11.626 29.645 11.783 1.00 0.00 N ATOM 1751 CA GLU B 227 -12.710 28.870 11.161 1.00 0.00 C ATOM 1752 C GLU B 227 -13.363 29.754 10.072 1.00 0.00 C ATOM 1753 O GLU B 227 -14.000 30.769 10.421 1.00 0.00 O ATOM 1754 CB GLU B 227 -13.719 28.423 12.280 1.00 0.00 C ATOM 1755 CG GLU B 227 -14.723 27.295 11.912 1.00 0.00 C ATOM 1756 CD GLU B 227 -15.886 27.735 11.010 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -16.855 28.332 11.528 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -15.843 27.488 9.785 1.00 0.00 O ATOM 1759 OXT GLU B 227 -13.206 29.450 8.873 1.00 0.00 O ATOM 0 H GLU B 227 -11.908 30.589 12.048 1.00 0.00 H new ATOM 0 HA GLU B 227 -12.345 27.962 10.680 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -13.143 28.095 13.145 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -14.290 29.298 12.591 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -14.179 26.492 11.414 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -15.133 26.879 12.832 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.064 32.483 19.449 1.00 0.00 ZN