USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 892 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 219 HIS HD1 : B 219 HIS ND1 : B 301 ZNZN :(H bumps) USER MOD Set 1.1: A 7 THR OG1 : rot 132:sc= 0.93 USER MOD Set 1.2: A 9 THR OG1 : rot 180:sc= 1.03 USER MOD Set 2.1: A 6 LYS NZ :NH3+ -174:sc= 1.07 (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot 150:sc= 0.917 USER MOD Set 3.1: A 0 HIS : no HD1:sc= -0.42 K(o=-0.57,f=-1.2) USER MOD Set 3.2: A 2 GLN : amide:sc= -0.149 K(o=-0.57,f=-4.1!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -1 SER OG : rot -6:sc= 1.06 USER MOD Single : A -2 GLY N :NH3+ 147:sc= 0.267 (180deg=0.0224) USER MOD Single : A 11 LYS NZ :NH3+ 177:sc= -0.084 (180deg=-0.115) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -32:sc= 0.387 USER MOD Single : A 22 THR OG1 : rot 31:sc= 0.572 USER MOD Single : A 25 ASN : amide:sc= -0.862 K(o=-0.86,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -148:sc= -0.204 (180deg=-1.44!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.032) USER MOD Single : A 33 LYS NZ :NH3+ -142:sc= 0.878 (180deg=0.231) USER MOD Single : A 40 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.51) USER MOD Single : A 41 GLN : amide:sc= -4.89! C(o=-4.9!,f=-7.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.56) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0941 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -82:sc= 0.123 USER MOD Single : A 60 ASN : amide:sc= -2.05! K(o=-2!,f=-0.066) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -167:sc= 0.645 (180deg=0.543) USER MOD Single : A 65 SER OG : rot -130:sc= 0.232 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 45:sc= 0.246 USER MOD Single : B 198 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 200 THR OG1 : rot 105:sc= 0.458 USER MOD Single : B 201 LYS NZ :NH3+ 171:sc= 0.413 (180deg=0.378) USER MOD Single : B 210 ASN : amide:sc= 0.22 X(o=0.22,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 HIS : no HD1:sc=-0.00429 X(o=-0.0043,f=-0.006) USER MOD Single : B 217 ASN : amide:sc= 0.858 K(o=0.86,f=-8.5!) 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 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 -1.421 2.169 -0.319 1.00 0.00 N ATOM 2 CA GLY A -2 -0.443 1.740 -1.351 1.00 0.00 C ATOM 3 C GLY A -2 0.635 2.789 -1.567 1.00 0.00 C ATOM 4 O GLY A -2 0.345 3.985 -1.495 1.00 0.00 O ATOM 0 H1 GLY A -2 -2.362 1.795 -0.556 1.00 0.00 H new ATOM 0 H2 GLY A -2 -1.127 1.805 0.610 1.00 0.00 H new ATOM 0 H3 GLY A -2 -1.459 3.208 -0.288 1.00 0.00 H new ATOM 0 HA2 GLY A -2 0.018 0.800 -1.048 1.00 0.00 H new ATOM 0 HA3 GLY A -2 -0.963 1.552 -2.291 1.00 0.00 H new ATOM 10 N SER A -1 1.887 2.333 -1.815 1.00 0.00 N ATOM 11 CA SER A -1 3.095 3.197 -1.970 1.00 0.00 C ATOM 12 C SER A -1 3.295 4.139 -0.744 1.00 0.00 C ATOM 13 O SER A -1 2.729 3.891 0.334 1.00 0.00 O ATOM 14 CB SER A -1 3.054 3.985 -3.321 1.00 0.00 C ATOM 15 OG SER A -1 2.042 4.977 -3.343 1.00 0.00 O ATOM 0 H SER A -1 2.095 1.339 -1.915 1.00 0.00 H new ATOM 0 HA SER A -1 3.967 2.544 -2.003 1.00 0.00 H new ATOM 0 HB2 SER A -1 4.022 4.455 -3.493 1.00 0.00 H new ATOM 0 HB3 SER A -1 2.890 3.285 -4.141 1.00 0.00 H new ATOM 0 HG SER A -1 1.499 4.908 -2.530 1.00 0.00 H new ATOM 21 N HIS A 0 4.144 5.182 -0.898 1.00 0.00 N ATOM 22 CA HIS A 0 4.283 6.257 0.104 1.00 0.00 C ATOM 23 C HIS A 0 4.943 7.494 -0.525 1.00 0.00 C ATOM 24 O HIS A 0 5.858 7.370 -1.345 1.00 0.00 O ATOM 25 CB HIS A 0 5.093 5.789 1.351 1.00 0.00 C ATOM 26 CG HIS A 0 6.541 5.415 1.101 1.00 0.00 C ATOM 27 ND1 HIS A 0 7.533 6.349 0.870 1.00 0.00 N ATOM 28 CD2 HIS A 0 7.159 4.211 1.062 1.00 0.00 C ATOM 29 CE1 HIS A 0 8.682 5.736 0.699 1.00 0.00 C ATOM 30 NE2 HIS A 0 8.489 4.439 0.812 1.00 0.00 N ATOM 0 H HIS A 0 4.745 5.299 -1.714 1.00 0.00 H new ATOM 0 HA HIS A 0 3.280 6.519 0.442 1.00 0.00 H new ATOM 0 HB2 HIS A 0 5.067 6.585 2.096 1.00 0.00 H new ATOM 0 HB3 HIS A 0 4.586 4.928 1.787 1.00 0.00 H new ATOM 0 HD2 HIS A 0 6.691 3.248 1.202 1.00 0.00 H new ATOM 0 HE1 HIS A 0 9.628 6.217 0.499 1.00 0.00 H new ATOM 0 HE2 HIS A 0 9.209 3.722 0.728 1.00 0.00 H new ATOM 39 N MET A 1 4.460 8.679 -0.136 1.00 0.00 N ATOM 40 CA MET A 1 5.093 9.962 -0.470 1.00 0.00 C ATOM 41 C MET A 1 5.773 10.511 0.785 1.00 0.00 C ATOM 42 O MET A 1 5.370 10.204 1.908 1.00 0.00 O ATOM 43 CB MET A 1 4.054 10.990 -0.989 1.00 0.00 C ATOM 44 CG MET A 1 3.229 10.521 -2.192 1.00 0.00 C ATOM 45 SD MET A 1 4.269 10.160 -3.624 1.00 0.00 S ATOM 46 CE MET A 1 3.056 9.617 -4.827 1.00 0.00 C ATOM 0 H MET A 1 3.613 8.777 0.424 1.00 0.00 H new ATOM 0 HA MET A 1 5.822 9.797 -1.263 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.373 11.240 -0.175 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.576 11.907 -1.260 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.665 9.629 -1.919 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.503 11.290 -2.456 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.558 9.362 -5.760 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.532 8.741 -4.445 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.339 10.418 -5.008 1.00 0.00 H new ATOM 56 N GLN A 2 6.794 11.327 0.583 1.00 0.00 N ATOM 57 CA GLN A 2 7.546 11.942 1.677 1.00 0.00 C ATOM 58 C GLN A 2 7.130 13.402 1.847 1.00 0.00 C ATOM 59 O GLN A 2 7.182 14.173 0.901 1.00 0.00 O ATOM 60 CB GLN A 2 9.079 11.824 1.453 1.00 0.00 C ATOM 61 CG GLN A 2 9.679 10.429 1.783 1.00 0.00 C ATOM 62 CD GLN A 2 9.650 9.406 0.641 1.00 0.00 C ATOM 63 OE1 GLN A 2 8.770 9.412 -0.225 1.00 0.00 O ATOM 64 NE2 GLN A 2 10.608 8.494 0.655 1.00 0.00 N ATOM 0 H GLN A 2 7.130 11.586 -0.345 1.00 0.00 H new ATOM 0 HA GLN A 2 7.311 11.402 2.594 1.00 0.00 H new ATOM 0 HB2 GLN A 2 9.300 12.062 0.412 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.580 12.574 2.065 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.713 10.564 2.099 1.00 0.00 H new ATOM 0 HG3 GLN A 2 9.138 10.013 2.633 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.321 8.515 1.384 1.00 0.00 H new ATOM 0 HE22 GLN A 2 10.633 7.770 -0.063 1.00 0.00 H new ATOM 73 N ILE A 3 6.716 13.746 3.076 1.00 0.00 N ATOM 74 CA ILE A 3 6.361 15.119 3.484 1.00 0.00 C ATOM 75 C ILE A 3 7.251 15.524 4.663 1.00 0.00 C ATOM 76 O ILE A 3 7.815 14.661 5.359 1.00 0.00 O ATOM 77 CB ILE A 3 4.832 15.315 3.872 1.00 0.00 C ATOM 78 CG1 ILE A 3 4.339 14.288 4.953 1.00 0.00 C ATOM 79 CG2 ILE A 3 3.930 15.279 2.618 1.00 0.00 C ATOM 80 CD1 ILE A 3 4.071 12.877 4.443 1.00 0.00 C ATOM 0 H ILE A 3 6.616 13.067 3.830 1.00 0.00 H new ATOM 0 HA ILE A 3 6.526 15.758 2.616 1.00 0.00 H new ATOM 0 HB ILE A 3 4.753 16.303 4.325 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.086 14.234 5.745 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.424 14.673 5.404 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.890 15.416 2.914 1.00 0.00 H new ATOM 0 HG22 ILE A 3 4.222 16.079 1.937 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.041 14.317 2.117 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.736 12.249 5.269 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.299 12.908 3.674 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.987 12.463 4.021 1.00 0.00 H new ATOM 92 N PHE A 4 7.373 16.839 4.880 1.00 0.00 N ATOM 93 CA PHE A 4 8.317 17.406 5.858 1.00 0.00 C ATOM 94 C PHE A 4 7.559 18.087 7.001 1.00 0.00 C ATOM 95 O PHE A 4 6.831 19.052 6.798 1.00 0.00 O ATOM 96 CB PHE A 4 9.284 18.394 5.152 1.00 0.00 C ATOM 97 CG PHE A 4 10.041 17.747 3.993 1.00 0.00 C ATOM 98 CD1 PHE A 4 10.983 16.749 4.237 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.802 18.122 2.671 1.00 0.00 C ATOM 100 CE1 PHE A 4 11.652 16.137 3.198 1.00 0.00 C ATOM 101 CE2 PHE A 4 10.476 17.513 1.631 1.00 0.00 C ATOM 102 CZ PHE A 4 11.404 16.523 1.894 1.00 0.00 C ATOM 0 H PHE A 4 6.823 17.541 4.385 1.00 0.00 H new ATOM 0 HA PHE A 4 8.911 16.600 6.289 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.718 19.248 4.780 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.999 18.779 5.879 1.00 0.00 H new ATOM 0 HD1 PHE A 4 11.192 16.451 5.254 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.081 18.898 2.458 1.00 0.00 H new ATOM 0 HE1 PHE A 4 12.370 15.356 3.403 1.00 0.00 H new ATOM 0 HE2 PHE A 4 10.278 17.810 0.612 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.935 16.051 1.081 1.00 0.00 H new ATOM 112 N VAL A 5 7.729 17.545 8.201 1.00 0.00 N ATOM 113 CA VAL A 5 7.179 18.096 9.440 1.00 0.00 C ATOM 114 C VAL A 5 8.333 18.768 10.196 1.00 0.00 C ATOM 115 O VAL A 5 9.324 18.123 10.537 1.00 0.00 O ATOM 116 CB VAL A 5 6.462 16.960 10.285 1.00 0.00 C ATOM 117 CG1 VAL A 5 6.542 17.188 11.800 1.00 0.00 C ATOM 118 CG2 VAL A 5 4.981 16.802 9.841 1.00 0.00 C ATOM 0 H VAL A 5 8.265 16.690 8.346 1.00 0.00 H new ATOM 0 HA VAL A 5 6.410 18.841 9.237 1.00 0.00 H new ATOM 0 HB VAL A 5 7.005 16.037 10.080 1.00 0.00 H new ATOM 0 HG11 VAL A 5 6.032 16.375 12.318 1.00 0.00 H new ATOM 0 HG12 VAL A 5 7.587 17.216 12.109 1.00 0.00 H new ATOM 0 HG13 VAL A 5 6.064 18.135 12.051 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.506 16.019 10.431 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.453 17.743 9.994 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.944 16.533 8.785 1.00 0.00 H new ATOM 128 N LYS A 6 8.209 20.077 10.392 1.00 0.00 N ATOM 129 CA LYS A 6 9.237 20.904 11.016 1.00 0.00 C ATOM 130 C LYS A 6 8.746 21.341 12.406 1.00 0.00 C ATOM 131 O LYS A 6 7.805 22.141 12.497 1.00 0.00 O ATOM 132 CB LYS A 6 9.511 22.155 10.124 1.00 0.00 C ATOM 133 CG LYS A 6 10.873 22.840 10.386 1.00 0.00 C ATOM 134 CD LYS A 6 12.040 22.153 9.638 1.00 0.00 C ATOM 135 CE LYS A 6 13.398 22.815 9.928 1.00 0.00 C ATOM 136 NZ LYS A 6 14.461 22.372 8.987 1.00 0.00 N ATOM 0 H LYS A 6 7.378 20.602 10.117 1.00 0.00 H new ATOM 0 HA LYS A 6 10.162 20.338 11.120 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.463 21.857 9.077 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.715 22.882 10.285 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.815 23.884 10.079 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.079 22.833 11.456 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.083 21.102 9.926 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.847 22.182 8.566 1.00 0.00 H new ATOM 0 HE2 LYS A 6 13.291 23.898 9.866 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.701 22.582 10.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 15.376 22.766 9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.515 21.333 8.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.237 22.706 8.028 1.00 0.00 H new ATOM 150 N THR A 7 9.363 20.811 13.477 1.00 0.00 N ATOM 151 CA THR A 7 9.030 21.204 14.856 1.00 0.00 C ATOM 152 C THR A 7 9.422 22.668 15.126 1.00 0.00 C ATOM 153 O THR A 7 10.233 23.251 14.393 1.00 0.00 O ATOM 154 CB THR A 7 9.729 20.292 15.913 1.00 0.00 C ATOM 155 OG1 THR A 7 11.136 20.273 15.662 1.00 0.00 O ATOM 156 CG2 THR A 7 9.181 18.862 15.910 1.00 0.00 C ATOM 0 H THR A 7 10.098 20.107 13.412 1.00 0.00 H new ATOM 0 HA THR A 7 7.951 21.088 14.954 1.00 0.00 H new ATOM 0 HB THR A 7 9.523 20.710 16.898 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.620 20.428 16.500 1.00 0.00 H new ATOM 0 HG21 THR A 7 9.702 18.271 16.663 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.115 18.880 16.136 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.336 18.415 14.928 1.00 0.00 H new ATOM 164 N LEU A 8 8.860 23.236 16.206 1.00 0.00 N ATOM 165 CA LEU A 8 9.191 24.599 16.664 1.00 0.00 C ATOM 166 C LEU A 8 10.662 24.713 17.115 1.00 0.00 C ATOM 167 O LEU A 8 11.209 25.808 17.157 1.00 0.00 O ATOM 168 CB LEU A 8 8.260 25.018 17.823 1.00 0.00 C ATOM 169 CG LEU A 8 6.737 25.070 17.510 1.00 0.00 C ATOM 170 CD1 LEU A 8 5.942 25.499 18.757 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.432 25.990 16.305 1.00 0.00 C ATOM 0 H LEU A 8 8.165 22.766 16.786 1.00 0.00 H new ATOM 0 HA LEU A 8 9.045 25.269 15.816 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.414 24.326 18.651 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.570 26.004 18.170 1.00 0.00 H new ATOM 0 HG LEU A 8 6.419 24.065 17.233 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.879 25.529 18.518 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.113 24.783 19.561 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.271 26.488 19.076 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.358 26.000 16.118 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.772 27.002 16.525 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.951 25.617 15.422 1.00 0.00 H new ATOM 183 N THR A 9 11.297 23.567 17.423 1.00 0.00 N ATOM 184 CA THR A 9 12.711 23.520 17.838 1.00 0.00 C ATOM 185 C THR A 9 13.649 23.637 16.615 1.00 0.00 C ATOM 186 O THR A 9 14.859 23.822 16.766 1.00 0.00 O ATOM 187 CB THR A 9 12.999 22.196 18.619 1.00 0.00 C ATOM 188 OG1 THR A 9 12.670 21.066 17.798 1.00 0.00 O ATOM 189 CG2 THR A 9 12.195 22.117 19.930 1.00 0.00 C ATOM 0 H THR A 9 10.847 22.652 17.391 1.00 0.00 H new ATOM 0 HA THR A 9 12.904 24.368 18.496 1.00 0.00 H new ATOM 0 HB THR A 9 14.060 22.187 18.869 1.00 0.00 H new ATOM 0 HG1 THR A 9 12.854 20.239 18.291 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.424 21.182 20.442 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.462 22.957 20.572 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.129 22.156 19.706 1.00 0.00 H new ATOM 197 N GLY A 10 13.062 23.551 15.404 1.00 0.00 N ATOM 198 CA GLY A 10 13.807 23.655 14.147 1.00 0.00 C ATOM 199 C GLY A 10 14.253 22.300 13.615 1.00 0.00 C ATOM 200 O GLY A 10 15.031 22.226 12.661 1.00 0.00 O ATOM 0 H GLY A 10 12.060 23.408 15.277 1.00 0.00 H new ATOM 0 HA2 GLY A 10 13.184 24.147 13.400 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.682 24.287 14.299 1.00 0.00 H new ATOM 204 N LYS A 11 13.762 21.226 14.241 1.00 0.00 N ATOM 205 CA LYS A 11 14.069 19.846 13.842 1.00 0.00 C ATOM 206 C LYS A 11 13.129 19.397 12.707 1.00 0.00 C ATOM 207 O LYS A 11 11.973 19.821 12.641 1.00 0.00 O ATOM 208 CB LYS A 11 13.996 18.918 15.097 1.00 0.00 C ATOM 209 CG LYS A 11 13.470 17.493 14.867 1.00 0.00 C ATOM 210 CD LYS A 11 13.572 16.608 16.125 1.00 0.00 C ATOM 211 CE LYS A 11 12.894 15.255 15.925 1.00 0.00 C ATOM 212 NZ LYS A 11 13.385 14.541 14.713 1.00 0.00 N ATOM 0 H LYS A 11 13.136 21.288 15.044 1.00 0.00 H new ATOM 0 HA LYS A 11 15.083 19.783 13.446 1.00 0.00 H new ATOM 0 HB2 LYS A 11 14.995 18.847 15.528 1.00 0.00 H new ATOM 0 HB3 LYS A 11 13.362 19.400 15.841 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.429 17.542 14.546 1.00 0.00 H new ATOM 0 HG3 LYS A 11 14.032 17.030 14.056 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.621 16.455 16.377 1.00 0.00 H new ATOM 0 HD3 LYS A 11 13.113 17.123 16.969 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.067 14.633 16.803 1.00 0.00 H new ATOM 0 HE3 LYS A 11 11.817 15.401 15.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 12.930 13.608 14.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 13.152 15.096 13.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.416 14.420 14.775 1.00 0.00 H new ATOM 226 N THR A 12 13.656 18.547 11.807 1.00 0.00 N ATOM 227 CA THR A 12 12.910 18.038 10.642 1.00 0.00 C ATOM 228 C THR A 12 12.567 16.552 10.848 1.00 0.00 C ATOM 229 O THR A 12 13.366 15.775 11.392 1.00 0.00 O ATOM 230 CB THR A 12 13.711 18.220 9.308 1.00 0.00 C ATOM 231 OG1 THR A 12 14.266 19.540 9.262 1.00 0.00 O ATOM 232 CG2 THR A 12 12.821 17.989 8.055 1.00 0.00 C ATOM 0 H THR A 12 14.611 18.194 11.867 1.00 0.00 H new ATOM 0 HA THR A 12 11.992 18.620 10.558 1.00 0.00 H new ATOM 0 HB THR A 12 14.504 17.472 9.293 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.100 19.526 8.748 1.00 0.00 H new ATOM 0 HG21 THR A 12 13.419 18.126 7.154 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.421 16.975 8.075 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.998 18.704 8.056 1.00 0.00 H new ATOM 240 N ILE A 13 11.346 16.196 10.438 1.00 0.00 N ATOM 241 CA ILE A 13 10.787 14.838 10.526 1.00 0.00 C ATOM 242 C ILE A 13 10.218 14.474 9.140 1.00 0.00 C ATOM 243 O ILE A 13 9.307 15.141 8.653 1.00 0.00 O ATOM 244 CB ILE A 13 9.641 14.738 11.619 1.00 0.00 C ATOM 245 CG1 ILE A 13 10.157 15.112 13.055 1.00 0.00 C ATOM 246 CG2 ILE A 13 8.996 13.340 11.634 1.00 0.00 C ATOM 247 CD1 ILE A 13 10.145 16.599 13.372 1.00 0.00 C ATOM 0 H ILE A 13 10.697 16.864 10.022 1.00 0.00 H new ATOM 0 HA ILE A 13 11.575 14.147 10.825 1.00 0.00 H new ATOM 0 HB ILE A 13 8.882 15.467 11.337 1.00 0.00 H new ATOM 0 HG12 ILE A 13 9.544 14.593 13.792 1.00 0.00 H new ATOM 0 HG13 ILE A 13 11.175 14.739 13.168 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.216 13.307 12.394 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.560 13.130 10.657 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.755 12.591 11.861 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.518 16.758 14.384 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.782 17.127 12.663 1.00 0.00 H new ATOM 0 HD13 ILE A 13 9.126 16.979 13.297 1.00 0.00 H new ATOM 259 N THR A 14 10.784 13.444 8.490 1.00 0.00 N ATOM 260 CA THR A 14 10.290 12.957 7.190 1.00 0.00 C ATOM 261 C THR A 14 9.297 11.807 7.416 1.00 0.00 C ATOM 262 O THR A 14 9.651 10.795 8.030 1.00 0.00 O ATOM 263 CB THR A 14 11.464 12.477 6.278 1.00 0.00 C ATOM 264 OG1 THR A 14 12.429 13.537 6.146 1.00 0.00 O ATOM 265 CG2 THR A 14 10.969 12.058 4.871 1.00 0.00 C ATOM 0 H THR A 14 11.589 12.929 8.846 1.00 0.00 H new ATOM 0 HA THR A 14 9.789 13.782 6.683 1.00 0.00 H new ATOM 0 HB THR A 14 11.917 11.604 6.748 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.168 13.238 5.576 1.00 0.00 H new ATOM 0 HG21 THR A 14 11.817 11.731 4.269 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.254 11.240 4.965 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.487 12.907 4.387 1.00 0.00 H new ATOM 273 N LEU A 15 8.053 11.983 6.937 1.00 0.00 N ATOM 274 CA LEU A 15 6.994 10.953 7.026 1.00 0.00 C ATOM 275 C LEU A 15 6.816 10.320 5.651 1.00 0.00 C ATOM 276 O LEU A 15 7.125 10.943 4.634 1.00 0.00 O ATOM 277 CB LEU A 15 5.626 11.539 7.507 1.00 0.00 C ATOM 278 CG LEU A 15 5.637 12.398 8.807 1.00 0.00 C ATOM 279 CD1 LEU A 15 6.405 11.704 9.941 1.00 0.00 C ATOM 280 CD2 LEU A 15 6.182 13.811 8.543 1.00 0.00 C ATOM 0 H LEU A 15 7.750 12.841 6.477 1.00 0.00 H new ATOM 0 HA LEU A 15 7.305 10.214 7.764 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.218 12.150 6.702 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.937 10.708 7.657 1.00 0.00 H new ATOM 0 HG LEU A 15 4.602 12.501 9.134 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.390 12.335 10.830 1.00 0.00 H new ATOM 0 HD12 LEU A 15 5.934 10.747 10.167 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.437 11.537 9.632 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.176 14.383 9.471 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.202 13.743 8.166 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.555 14.311 7.805 1.00 0.00 H new ATOM 292 N GLU A 16 6.292 9.096 5.630 1.00 0.00 N ATOM 293 CA GLU A 16 6.128 8.305 4.405 1.00 0.00 C ATOM 294 C GLU A 16 4.666 7.835 4.310 1.00 0.00 C ATOM 295 O GLU A 16 4.331 6.728 4.742 1.00 0.00 O ATOM 296 CB GLU A 16 7.122 7.116 4.427 1.00 0.00 C ATOM 297 CG GLU A 16 8.609 7.526 4.442 1.00 0.00 C ATOM 298 CD GLU A 16 9.543 6.350 4.733 1.00 0.00 C ATOM 299 OE1 GLU A 16 9.866 5.587 3.802 1.00 0.00 O ATOM 300 OE2 GLU A 16 9.927 6.157 5.908 1.00 0.00 O ATOM 0 H GLU A 16 5.965 8.618 6.470 1.00 0.00 H new ATOM 0 HA GLU A 16 6.349 8.904 3.521 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.918 6.504 5.306 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.940 6.490 3.554 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.871 7.963 3.478 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.761 8.300 5.194 1.00 0.00 H new ATOM 307 N VAL A 17 3.793 8.727 3.791 1.00 0.00 N ATOM 308 CA VAL A 17 2.338 8.468 3.630 1.00 0.00 C ATOM 309 C VAL A 17 1.808 9.172 2.368 1.00 0.00 C ATOM 310 O VAL A 17 2.539 9.889 1.687 1.00 0.00 O ATOM 311 CB VAL A 17 1.473 8.951 4.860 1.00 0.00 C ATOM 312 CG1 VAL A 17 1.858 8.257 6.178 1.00 0.00 C ATOM 313 CG2 VAL A 17 1.500 10.487 4.998 1.00 0.00 C ATOM 0 H VAL A 17 4.076 9.653 3.469 1.00 0.00 H new ATOM 0 HA VAL A 17 2.238 7.385 3.552 1.00 0.00 H new ATOM 0 HB VAL A 17 0.447 8.650 4.649 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.228 8.632 6.984 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.717 7.181 6.077 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.903 8.466 6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.895 10.786 5.854 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.527 10.821 5.145 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.097 10.941 4.093 1.00 0.00 H new ATOM 323 N GLU A 18 0.511 8.991 2.101 1.00 0.00 N ATOM 324 CA GLU A 18 -0.161 9.555 0.920 1.00 0.00 C ATOM 325 C GLU A 18 -0.842 10.897 1.294 1.00 0.00 C ATOM 326 O GLU A 18 -1.136 11.124 2.471 1.00 0.00 O ATOM 327 CB GLU A 18 -1.214 8.522 0.409 1.00 0.00 C ATOM 328 CG GLU A 18 -0.726 7.060 0.490 1.00 0.00 C ATOM 329 CD GLU A 18 -1.659 6.034 -0.176 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.927 6.166 -1.384 1.00 0.00 O ATOM 331 OE2 GLU A 18 -2.108 5.075 0.499 1.00 0.00 O ATOM 0 H GLU A 18 -0.109 8.446 2.700 1.00 0.00 H new ATOM 0 HA GLU A 18 0.563 9.753 0.130 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.128 8.625 0.994 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.470 8.755 -0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.257 6.993 0.024 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.601 6.790 1.539 1.00 0.00 H new ATOM 338 N PRO A 19 -1.078 11.829 0.320 1.00 0.00 N ATOM 339 CA PRO A 19 -1.983 12.981 0.545 1.00 0.00 C ATOM 340 C PRO A 19 -3.443 12.523 0.831 1.00 0.00 C ATOM 341 O PRO A 19 -4.183 13.204 1.543 1.00 0.00 O ATOM 342 CB PRO A 19 -1.863 13.815 -0.764 1.00 0.00 C ATOM 343 CG PRO A 19 -1.314 12.862 -1.785 1.00 0.00 C ATOM 344 CD PRO A 19 -0.435 11.895 -1.018 1.00 0.00 C ATOM 0 HA PRO A 19 -1.711 13.564 1.425 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.832 14.207 -1.072 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.202 14.671 -0.627 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -2.117 12.336 -2.300 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.741 13.392 -2.546 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.402 10.916 -1.496 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.593 12.252 -0.952 1.00 0.00 H new ATOM 352 N SER A 20 -3.816 11.330 0.306 1.00 0.00 N ATOM 353 CA SER A 20 -5.164 10.740 0.480 1.00 0.00 C ATOM 354 C SER A 20 -5.208 9.786 1.699 1.00 0.00 C ATOM 355 O SER A 20 -6.235 9.138 1.941 1.00 0.00 O ATOM 356 CB SER A 20 -5.579 10.000 -0.824 1.00 0.00 C ATOM 357 OG SER A 20 -6.924 9.527 -0.788 1.00 0.00 O ATOM 0 H SER A 20 -3.188 10.750 -0.251 1.00 0.00 H new ATOM 0 HA SER A 20 -5.875 11.543 0.675 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.458 10.674 -1.672 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.907 9.158 -0.988 1.00 0.00 H new ATOM 0 HG SER A 20 -7.161 9.285 0.131 1.00 0.00 H new ATOM 363 N ASP A 21 -4.091 9.719 2.461 1.00 0.00 N ATOM 364 CA ASP A 21 -3.961 8.865 3.663 1.00 0.00 C ATOM 365 C ASP A 21 -4.927 9.345 4.788 1.00 0.00 C ATOM 366 O ASP A 21 -6.116 9.014 4.732 1.00 0.00 O ATOM 367 CB ASP A 21 -2.457 8.831 4.081 1.00 0.00 C ATOM 368 CG ASP A 21 -2.148 8.182 5.437 1.00 0.00 C ATOM 369 OD1 ASP A 21 -2.387 6.973 5.595 1.00 0.00 O ATOM 370 OD2 ASP A 21 -1.654 8.894 6.341 1.00 0.00 O ATOM 0 H ASP A 21 -3.250 10.260 2.257 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.265 7.840 3.452 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -1.899 8.299 3.311 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -2.082 9.854 4.097 1.00 0.00 H new ATOM 375 N THR A 22 -4.418 10.131 5.767 1.00 0.00 N ATOM 376 CA THR A 22 -5.202 10.756 6.861 1.00 0.00 C ATOM 377 C THR A 22 -4.239 11.357 7.894 1.00 0.00 C ATOM 378 O THR A 22 -3.196 10.769 8.176 1.00 0.00 O ATOM 379 CB THR A 22 -6.220 9.794 7.597 1.00 0.00 C ATOM 380 OG1 THR A 22 -6.950 10.521 8.600 1.00 0.00 O ATOM 381 CG2 THR A 22 -5.555 8.571 8.246 1.00 0.00 C ATOM 0 H THR A 22 -3.424 10.354 5.819 1.00 0.00 H new ATOM 0 HA THR A 22 -5.815 11.519 6.381 1.00 0.00 H new ATOM 0 HB THR A 22 -6.891 9.419 6.824 1.00 0.00 H new ATOM 0 HG1 THR A 22 -7.059 11.452 8.314 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.315 7.958 8.731 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.049 7.983 7.480 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.828 8.903 8.988 1.00 0.00 H new ATOM 389 N ILE A 23 -4.619 12.514 8.472 1.00 0.00 N ATOM 390 CA ILE A 23 -3.790 13.251 9.453 1.00 0.00 C ATOM 391 C ILE A 23 -3.569 12.399 10.726 1.00 0.00 C ATOM 392 O ILE A 23 -2.525 12.498 11.368 1.00 0.00 O ATOM 393 CB ILE A 23 -4.438 14.631 9.878 1.00 0.00 C ATOM 394 CG1 ILE A 23 -4.750 15.551 8.652 1.00 0.00 C ATOM 395 CG2 ILE A 23 -3.558 15.396 10.904 1.00 0.00 C ATOM 396 CD1 ILE A 23 -3.534 16.022 7.869 1.00 0.00 C ATOM 0 H ILE A 23 -5.511 12.967 8.273 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.839 13.454 8.960 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.384 14.377 10.355 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.413 15.013 7.974 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.296 16.426 9.004 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.041 16.337 11.167 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.433 14.789 11.800 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.581 15.600 10.465 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.857 16.653 7.041 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.877 16.593 8.525 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.995 15.158 7.479 1.00 0.00 H new ATOM 408 N GLU A 24 -4.588 11.579 11.067 1.00 0.00 N ATOM 409 CA GLU A 24 -4.555 10.632 12.210 1.00 0.00 C ATOM 410 C GLU A 24 -3.331 9.700 12.091 1.00 0.00 C ATOM 411 O GLU A 24 -2.614 9.432 13.070 1.00 0.00 O ATOM 412 CB GLU A 24 -5.892 9.814 12.229 1.00 0.00 C ATOM 413 CG GLU A 24 -6.312 9.167 13.577 1.00 0.00 C ATOM 414 CD GLU A 24 -5.397 8.027 14.053 1.00 0.00 C ATOM 415 OE1 GLU A 24 -5.387 6.955 13.421 1.00 0.00 O ATOM 416 OE2 GLU A 24 -4.701 8.190 15.069 1.00 0.00 O ATOM 0 H GLU A 24 -5.468 11.554 10.552 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.463 11.180 13.148 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.697 10.475 11.907 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.813 9.022 11.485 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -6.336 9.941 14.344 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -7.328 8.783 13.480 1.00 0.00 H new ATOM 423 N ASN A 25 -3.086 9.259 10.865 1.00 0.00 N ATOM 424 CA ASN A 25 -1.994 8.337 10.547 1.00 0.00 C ATOM 425 C ASN A 25 -0.666 9.099 10.468 1.00 0.00 C ATOM 426 O ASN A 25 0.350 8.617 10.949 1.00 0.00 O ATOM 427 CB ASN A 25 -2.287 7.638 9.221 1.00 0.00 C ATOM 428 CG ASN A 25 -1.351 6.468 8.919 1.00 0.00 C ATOM 429 OD1 ASN A 25 -1.580 5.345 9.370 1.00 0.00 O ATOM 430 ND2 ASN A 25 -0.305 6.719 8.148 1.00 0.00 N ATOM 0 H ASN A 25 -3.641 9.531 10.054 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.914 7.587 11.334 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -3.315 7.275 9.232 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -2.215 8.367 8.413 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.344 5.969 7.909 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.148 7.662 7.793 1.00 0.00 H new ATOM 437 N VAL A 26 -0.718 10.297 9.863 1.00 0.00 N ATOM 438 CA VAL A 26 0.452 11.200 9.722 1.00 0.00 C ATOM 439 C VAL A 26 1.069 11.519 11.100 1.00 0.00 C ATOM 440 O VAL A 26 2.281 11.445 11.266 1.00 0.00 O ATOM 441 CB VAL A 26 0.079 12.547 8.979 1.00 0.00 C ATOM 442 CG1 VAL A 26 1.286 13.524 8.880 1.00 0.00 C ATOM 443 CG2 VAL A 26 -0.492 12.256 7.577 1.00 0.00 C ATOM 0 H VAL A 26 -1.573 10.674 9.454 1.00 0.00 H new ATOM 0 HA VAL A 26 1.185 10.672 9.113 1.00 0.00 H new ATOM 0 HB VAL A 26 -0.686 13.039 9.580 1.00 0.00 H new ATOM 0 HG11 VAL A 26 0.977 14.432 8.362 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.632 13.777 9.882 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.095 13.048 8.326 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.742 13.195 7.084 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.251 11.722 6.985 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.390 11.645 7.669 1.00 0.00 H new ATOM 453 N LYS A 27 0.214 11.820 12.089 1.00 0.00 N ATOM 454 CA LYS A 27 0.656 12.167 13.454 1.00 0.00 C ATOM 455 C LYS A 27 1.158 10.920 14.213 1.00 0.00 C ATOM 456 O LYS A 27 2.047 11.010 15.078 1.00 0.00 O ATOM 457 CB LYS A 27 -0.472 12.900 14.217 1.00 0.00 C ATOM 458 CG LYS A 27 -1.727 12.080 14.539 1.00 0.00 C ATOM 459 CD LYS A 27 -2.832 12.926 15.208 1.00 0.00 C ATOM 460 CE LYS A 27 -3.364 14.034 14.291 1.00 0.00 C ATOM 461 NZ LYS A 27 -4.317 14.930 14.991 1.00 0.00 N ATOM 0 H LYS A 27 -0.799 11.831 11.969 1.00 0.00 H new ATOM 0 HA LYS A 27 1.502 12.851 13.382 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.061 13.276 15.154 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -0.773 13.767 13.630 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.116 11.642 13.620 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.458 11.254 15.197 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.656 12.275 15.500 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.439 13.373 16.121 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -2.528 14.621 13.911 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.857 13.585 13.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -5.028 15.276 14.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -4.791 14.405 15.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -3.801 15.738 15.395 1.00 0.00 H new ATOM 475 N ALA A 28 0.586 9.748 13.859 1.00 0.00 N ATOM 476 CA ALA A 28 1.112 8.438 14.296 1.00 0.00 C ATOM 477 C ALA A 28 2.529 8.198 13.723 1.00 0.00 C ATOM 478 O ALA A 28 3.351 7.525 14.354 1.00 0.00 O ATOM 479 CB ALA A 28 0.154 7.308 13.873 1.00 0.00 C ATOM 0 H ALA A 28 -0.244 9.684 13.269 1.00 0.00 H new ATOM 0 HA ALA A 28 1.184 8.440 15.384 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.555 6.349 14.202 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -0.823 7.469 14.330 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.051 7.305 12.788 1.00 0.00 H new ATOM 485 N LYS A 29 2.802 8.763 12.520 1.00 0.00 N ATOM 486 CA LYS A 29 4.121 8.652 11.871 1.00 0.00 C ATOM 487 C LYS A 29 5.165 9.519 12.602 1.00 0.00 C ATOM 488 O LYS A 29 6.309 9.110 12.707 1.00 0.00 O ATOM 489 CB LYS A 29 4.081 9.037 10.365 1.00 0.00 C ATOM 490 CG LYS A 29 3.090 8.272 9.459 1.00 0.00 C ATOM 491 CD LYS A 29 3.236 6.722 9.477 1.00 0.00 C ATOM 492 CE LYS A 29 2.280 6.024 10.464 1.00 0.00 C ATOM 493 NZ LYS A 29 2.536 4.566 10.554 1.00 0.00 N ATOM 0 H LYS A 29 2.121 9.300 11.984 1.00 0.00 H new ATOM 0 HA LYS A 29 4.409 7.603 11.935 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.849 10.100 10.296 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.083 8.902 9.957 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.074 8.529 9.761 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.216 8.621 8.434 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.054 6.337 8.474 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.263 6.465 9.736 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.389 6.472 11.452 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.250 6.192 10.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.870 4.138 11.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.407 4.132 9.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.511 4.404 10.879 1.00 0.00 H new ATOM 507 N ILE A 30 4.769 10.728 13.086 1.00 0.00 N ATOM 508 CA ILE A 30 5.646 11.571 13.943 1.00 0.00 C ATOM 509 C ILE A 30 6.116 10.765 15.175 1.00 0.00 C ATOM 510 O ILE A 30 7.309 10.750 15.511 1.00 0.00 O ATOM 511 CB ILE A 30 4.940 12.925 14.397 1.00 0.00 C ATOM 512 CG1 ILE A 30 4.964 14.011 13.265 1.00 0.00 C ATOM 513 CG2 ILE A 30 5.556 13.509 15.698 1.00 0.00 C ATOM 514 CD1 ILE A 30 3.982 13.815 12.132 1.00 0.00 C ATOM 0 H ILE A 30 3.854 11.138 12.898 1.00 0.00 H new ATOM 0 HA ILE A 30 6.510 11.854 13.342 1.00 0.00 H new ATOM 0 HB ILE A 30 3.903 12.660 14.602 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.774 14.984 13.719 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.969 14.046 12.845 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.039 14.431 15.963 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.449 12.787 16.507 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.613 13.719 15.537 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.091 14.626 11.412 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.180 12.863 11.640 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.966 13.815 12.527 1.00 0.00 H new ATOM 526 N GLN A 31 5.159 10.070 15.808 1.00 0.00 N ATOM 527 CA GLN A 31 5.433 9.187 16.955 1.00 0.00 C ATOM 528 C GLN A 31 6.383 8.024 16.563 1.00 0.00 C ATOM 529 O GLN A 31 7.198 7.578 17.371 1.00 0.00 O ATOM 530 CB GLN A 31 4.095 8.649 17.521 1.00 0.00 C ATOM 531 CG GLN A 31 4.240 7.794 18.794 1.00 0.00 C ATOM 532 CD GLN A 31 2.919 7.311 19.392 1.00 0.00 C ATOM 533 OE1 GLN A 31 2.808 7.146 20.602 1.00 0.00 O ATOM 534 NE2 GLN A 31 1.916 7.049 18.566 1.00 0.00 N ATOM 0 H GLN A 31 4.175 10.103 15.541 1.00 0.00 H new ATOM 0 HA GLN A 31 5.941 9.764 17.728 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.441 9.493 17.738 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.603 8.053 16.752 1.00 0.00 H new ATOM 0 HG2 GLN A 31 4.858 6.926 18.564 1.00 0.00 H new ATOM 0 HG3 GLN A 31 4.773 8.375 19.547 1.00 0.00 H new ATOM 0 HE21 GLN A 31 2.030 7.194 17.563 1.00 0.00 H new ATOM 0 HE22 GLN A 31 1.030 6.703 18.934 1.00 0.00 H new ATOM 543 N ASP A 32 6.261 7.560 15.311 1.00 0.00 N ATOM 544 CA ASP A 32 7.128 6.503 14.742 1.00 0.00 C ATOM 545 C ASP A 32 8.560 7.026 14.465 1.00 0.00 C ATOM 546 O ASP A 32 9.531 6.272 14.588 1.00 0.00 O ATOM 547 CB ASP A 32 6.478 5.949 13.439 1.00 0.00 C ATOM 548 CG ASP A 32 7.383 5.013 12.611 1.00 0.00 C ATOM 549 OD1 ASP A 32 7.641 3.869 13.049 1.00 0.00 O ATOM 550 OD2 ASP A 32 7.833 5.412 11.509 1.00 0.00 O ATOM 0 H ASP A 32 5.558 7.905 14.658 1.00 0.00 H new ATOM 0 HA ASP A 32 7.219 5.698 15.472 1.00 0.00 H new ATOM 0 HB2 ASP A 32 5.568 5.410 13.704 1.00 0.00 H new ATOM 0 HB3 ASP A 32 6.179 6.790 12.813 1.00 0.00 H new ATOM 555 N LYS A 33 8.684 8.320 14.111 1.00 0.00 N ATOM 556 CA LYS A 33 9.967 8.904 13.658 1.00 0.00 C ATOM 557 C LYS A 33 10.760 9.475 14.843 1.00 0.00 C ATOM 558 O LYS A 33 11.837 8.968 15.174 1.00 0.00 O ATOM 559 CB LYS A 33 9.739 10.006 12.588 1.00 0.00 C ATOM 560 CG LYS A 33 9.038 9.535 11.296 1.00 0.00 C ATOM 561 CD LYS A 33 9.827 8.458 10.524 1.00 0.00 C ATOM 562 CE LYS A 33 9.043 7.896 9.319 1.00 0.00 C ATOM 563 NZ LYS A 33 9.768 6.764 8.683 1.00 0.00 N ATOM 0 H LYS A 33 7.910 8.984 14.129 1.00 0.00 H new ATOM 0 HA LYS A 33 10.548 8.101 13.204 1.00 0.00 H new ATOM 0 HB2 LYS A 33 9.146 10.805 13.033 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.704 10.436 12.322 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.054 9.141 11.549 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.879 10.394 10.645 1.00 0.00 H new ATOM 0 HD2 LYS A 33 10.768 8.883 10.174 1.00 0.00 H new ATOM 0 HD3 LYS A 33 10.079 7.642 11.201 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.059 7.562 9.647 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.883 8.686 8.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.653 6.815 7.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 10.779 6.821 8.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.380 5.864 9.031 1.00 0.00 H new ATOM 577 N GLU A 34 10.233 10.539 15.476 1.00 0.00 N ATOM 578 CA GLU A 34 10.937 11.229 16.571 1.00 0.00 C ATOM 579 C GLU A 34 10.631 10.594 17.939 1.00 0.00 C ATOM 580 O GLU A 34 11.453 10.669 18.862 1.00 0.00 O ATOM 581 CB GLU A 34 10.636 12.747 16.566 1.00 0.00 C ATOM 582 CG GLU A 34 9.182 13.179 16.831 1.00 0.00 C ATOM 583 CD GLU A 34 9.022 14.720 16.850 1.00 0.00 C ATOM 584 OE1 GLU A 34 9.628 15.374 17.733 1.00 0.00 O ATOM 585 OE2 GLU A 34 8.313 15.273 15.988 1.00 0.00 O ATOM 0 H GLU A 34 9.323 10.939 15.248 1.00 0.00 H new ATOM 0 HA GLU A 34 12.006 11.106 16.396 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.270 13.219 17.316 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.936 13.147 15.597 1.00 0.00 H new ATOM 0 HG2 GLU A 34 8.534 12.758 16.062 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.852 12.770 17.786 1.00 0.00 H new ATOM 592 N GLY A 35 9.454 9.962 18.062 1.00 0.00 N ATOM 593 CA GLY A 35 9.077 9.243 19.281 1.00 0.00 C ATOM 594 C GLY A 35 8.291 10.110 20.246 1.00 0.00 C ATOM 595 O GLY A 35 8.363 9.916 21.467 1.00 0.00 O ATOM 0 H GLY A 35 8.747 9.936 17.327 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.482 8.370 19.015 1.00 0.00 H new ATOM 0 HA3 GLY A 35 9.976 8.877 19.776 1.00 0.00 H new ATOM 599 N ILE A 36 7.545 11.087 19.700 1.00 0.00 N ATOM 600 CA ILE A 36 6.667 11.974 20.491 1.00 0.00 C ATOM 601 C ILE A 36 5.195 11.600 20.186 1.00 0.00 C ATOM 602 O ILE A 36 4.807 11.573 19.015 1.00 0.00 O ATOM 603 CB ILE A 36 6.951 13.520 20.222 1.00 0.00 C ATOM 604 CG1 ILE A 36 8.218 14.022 21.011 1.00 0.00 C ATOM 605 CG2 ILE A 36 5.726 14.402 20.588 1.00 0.00 C ATOM 606 CD1 ILE A 36 9.558 13.446 20.582 1.00 0.00 C ATOM 0 H ILE A 36 7.532 11.285 18.700 1.00 0.00 H new ATOM 0 HA ILE A 36 6.876 11.824 21.550 1.00 0.00 H new ATOM 0 HB ILE A 36 7.142 13.618 19.153 1.00 0.00 H new ATOM 0 HG12 ILE A 36 8.268 15.107 20.920 1.00 0.00 H new ATOM 0 HG13 ILE A 36 8.073 13.797 22.068 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.959 15.448 20.391 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.868 14.101 19.986 1.00 0.00 H new ATOM 0 HG23 ILE A 36 5.490 14.276 21.645 1.00 0.00 H new ATOM 0 HD11 ILE A 36 10.350 13.869 21.200 1.00 0.00 H new ATOM 0 HD12 ILE A 36 9.544 12.363 20.702 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.742 13.693 19.536 1.00 0.00 H new ATOM 618 N PRO A 37 4.359 11.303 21.238 1.00 0.00 N ATOM 619 CA PRO A 37 2.972 10.800 21.049 1.00 0.00 C ATOM 620 C PRO A 37 2.040 11.859 20.405 1.00 0.00 C ATOM 621 O PRO A 37 2.285 13.056 20.582 1.00 0.00 O ATOM 622 CB PRO A 37 2.528 10.451 22.499 1.00 0.00 C ATOM 623 CG PRO A 37 3.344 11.350 23.373 1.00 0.00 C ATOM 624 CD PRO A 37 4.688 11.467 22.689 1.00 0.00 C ATOM 0 HA PRO A 37 2.923 9.953 20.365 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.461 10.625 22.639 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.713 9.402 22.728 1.00 0.00 H new ATOM 0 HG2 PRO A 37 2.872 12.327 23.481 1.00 0.00 H new ATOM 0 HG3 PRO A 37 3.448 10.934 24.375 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.157 12.431 22.888 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.381 10.699 23.032 1.00 0.00 H new ATOM 632 N PRO A 38 0.939 11.432 19.682 1.00 0.00 N ATOM 633 CA PRO A 38 -0.042 12.360 19.049 1.00 0.00 C ATOM 634 C PRO A 38 -0.692 13.336 20.052 1.00 0.00 C ATOM 635 O PRO A 38 -1.226 14.379 19.662 1.00 0.00 O ATOM 636 CB PRO A 38 -1.097 11.412 18.411 1.00 0.00 C ATOM 637 CG PRO A 38 -0.913 10.109 19.120 1.00 0.00 C ATOM 638 CD PRO A 38 0.566 10.020 19.409 1.00 0.00 C ATOM 0 HA PRO A 38 0.441 13.015 18.323 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -2.108 11.797 18.545 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -0.936 11.305 17.338 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.497 10.076 20.040 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -1.244 9.274 18.502 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.772 9.376 20.264 1.00 0.00 H new ATOM 0 HD3 PRO A 38 1.119 9.613 18.562 1.00 0.00 H new ATOM 646 N ASP A 39 -0.621 12.975 21.342 1.00 0.00 N ATOM 647 CA ASP A 39 -1.125 13.797 22.452 1.00 0.00 C ATOM 648 C ASP A 39 -0.225 15.038 22.678 1.00 0.00 C ATOM 649 O ASP A 39 -0.715 16.119 23.010 1.00 0.00 O ATOM 650 CB ASP A 39 -1.199 12.926 23.733 1.00 0.00 C ATOM 651 CG ASP A 39 -1.862 13.635 24.928 1.00 0.00 C ATOM 652 OD1 ASP A 39 -3.102 13.782 24.936 1.00 0.00 O ATOM 653 OD2 ASP A 39 -1.150 14.033 25.873 1.00 0.00 O ATOM 0 H ASP A 39 -0.207 12.094 21.647 1.00 0.00 H new ATOM 0 HA ASP A 39 -2.122 14.161 22.205 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -1.753 12.014 23.510 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -0.190 12.625 24.015 1.00 0.00 H new ATOM 658 N GLN A 40 1.097 14.866 22.481 1.00 0.00 N ATOM 659 CA GLN A 40 2.105 15.924 22.728 1.00 0.00 C ATOM 660 C GLN A 40 2.449 16.697 21.463 1.00 0.00 C ATOM 661 O GLN A 40 2.868 17.824 21.550 1.00 0.00 O ATOM 662 CB GLN A 40 3.398 15.328 23.363 1.00 0.00 C ATOM 663 CG GLN A 40 3.429 15.335 24.901 1.00 0.00 C ATOM 664 CD GLN A 40 2.138 14.852 25.557 1.00 0.00 C ATOM 665 OE1 GLN A 40 1.263 15.655 25.865 1.00 0.00 O ATOM 666 NE2 GLN A 40 2.011 13.554 25.769 1.00 0.00 N ATOM 0 H GLN A 40 1.499 13.991 22.146 1.00 0.00 H new ATOM 0 HA GLN A 40 1.657 16.625 23.432 1.00 0.00 H new ATOM 0 HB2 GLN A 40 3.515 14.301 23.017 1.00 0.00 H new ATOM 0 HB3 GLN A 40 4.257 15.888 22.995 1.00 0.00 H new ATOM 0 HG2 GLN A 40 4.252 14.706 25.239 1.00 0.00 H new ATOM 0 HG3 GLN A 40 3.640 16.348 25.244 1.00 0.00 H new ATOM 0 HE21 GLN A 40 2.761 12.917 25.499 1.00 0.00 H new ATOM 0 HE22 GLN A 40 1.163 13.189 26.203 1.00 0.00 H new ATOM 675 N GLN A 41 2.332 16.089 20.300 1.00 0.00 N ATOM 676 CA GLN A 41 2.608 16.790 19.036 1.00 0.00 C ATOM 677 C GLN A 41 1.298 17.400 18.477 1.00 0.00 C ATOM 678 O GLN A 41 0.223 16.803 18.620 1.00 0.00 O ATOM 679 CB GLN A 41 3.350 15.841 18.059 1.00 0.00 C ATOM 680 CG GLN A 41 2.690 14.483 17.754 1.00 0.00 C ATOM 681 CD GLN A 41 1.727 14.528 16.579 1.00 0.00 C ATOM 682 OE1 GLN A 41 2.131 14.359 15.435 1.00 0.00 O ATOM 683 NE2 GLN A 41 0.448 14.728 16.850 1.00 0.00 N ATOM 0 H GLN A 41 2.050 15.115 20.191 1.00 0.00 H new ATOM 0 HA GLN A 41 3.281 17.633 19.196 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.487 16.369 17.115 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.344 15.650 18.464 1.00 0.00 H new ATOM 0 HG2 GLN A 41 3.468 13.748 17.548 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.155 14.141 18.640 1.00 0.00 H new ATOM 0 HE21 GLN A 41 0.146 14.865 17.815 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -0.237 14.745 16.094 1.00 0.00 H new ATOM 692 N ARG A 42 1.382 18.624 17.914 1.00 0.00 N ATOM 693 CA ARG A 42 0.204 19.370 17.413 1.00 0.00 C ATOM 694 C ARG A 42 0.466 19.812 15.962 1.00 0.00 C ATOM 695 O ARG A 42 1.494 20.440 15.674 1.00 0.00 O ATOM 696 CB ARG A 42 -0.088 20.591 18.353 1.00 0.00 C ATOM 697 CG ARG A 42 -1.582 20.982 18.483 1.00 0.00 C ATOM 698 CD ARG A 42 -1.829 21.975 19.635 1.00 0.00 C ATOM 699 NE ARG A 42 -3.269 22.142 19.935 1.00 0.00 N ATOM 700 CZ ARG A 42 -3.785 22.556 21.110 1.00 0.00 C ATOM 701 NH1 ARG A 42 -2.993 22.920 22.115 1.00 0.00 N ATOM 702 NH2 ARG A 42 -5.104 22.597 21.269 1.00 0.00 N ATOM 0 H ARG A 42 2.264 19.123 17.793 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.680 18.732 17.419 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.299 20.365 19.346 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.466 21.454 17.984 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.922 21.424 17.546 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -2.177 20.084 18.647 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.312 21.626 20.529 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.400 22.943 19.376 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.928 21.925 19.188 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.980 22.888 22.003 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.399 23.231 22.998 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.719 22.316 20.505 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.501 22.909 22.155 1.00 0.00 H new ATOM 716 N LEU A 43 -0.477 19.492 15.064 1.00 0.00 N ATOM 717 CA LEU A 43 -0.297 19.632 13.605 1.00 0.00 C ATOM 718 C LEU A 43 -0.887 20.951 13.122 1.00 0.00 C ATOM 719 O LEU A 43 -2.065 21.205 13.341 1.00 0.00 O ATOM 720 CB LEU A 43 -0.978 18.442 12.858 1.00 0.00 C ATOM 721 CG LEU A 43 -0.174 17.119 12.759 1.00 0.00 C ATOM 722 CD1 LEU A 43 1.149 17.346 12.001 1.00 0.00 C ATOM 723 CD2 LEU A 43 0.053 16.499 14.143 1.00 0.00 C ATOM 0 H LEU A 43 -1.392 19.127 15.327 1.00 0.00 H new ATOM 0 HA LEU A 43 0.771 19.622 13.387 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.924 18.227 13.355 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.217 18.770 11.846 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.762 16.401 12.187 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.700 16.407 11.941 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.935 17.706 10.995 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.749 18.086 12.530 1.00 0.00 H new ATOM 0 HD21 LEU A 43 0.619 15.573 14.039 1.00 0.00 H new ATOM 0 HD22 LEU A 43 0.611 17.197 14.767 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.909 16.285 14.608 1.00 0.00 H new ATOM 735 N ILE A 44 -0.070 21.793 12.465 1.00 0.00 N ATOM 736 CA ILE A 44 -0.521 23.090 11.918 1.00 0.00 C ATOM 737 C ILE A 44 0.153 23.347 10.559 1.00 0.00 C ATOM 738 O ILE A 44 1.376 23.243 10.433 1.00 0.00 O ATOM 739 CB ILE A 44 -0.230 24.285 12.917 1.00 0.00 C ATOM 740 CG1 ILE A 44 -1.024 24.083 14.252 1.00 0.00 C ATOM 741 CG2 ILE A 44 -0.563 25.672 12.289 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.640 25.005 15.371 1.00 0.00 C ATOM 0 H ILE A 44 0.917 21.597 12.298 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.601 23.039 11.781 1.00 0.00 H new ATOM 0 HB ILE A 44 0.839 24.277 13.131 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.087 24.211 14.046 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.885 23.055 14.586 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.347 26.460 13.011 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.044 25.822 11.396 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.619 25.706 12.020 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.247 24.784 16.249 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.413 24.864 15.613 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.807 26.038 15.065 1.00 0.00 H new ATOM 754 N PHE A 45 -0.667 23.685 9.556 1.00 0.00 N ATOM 755 CA PHE A 45 -0.214 24.084 8.215 1.00 0.00 C ATOM 756 C PHE A 45 -0.937 25.381 7.835 1.00 0.00 C ATOM 757 O PHE A 45 -2.157 25.419 7.859 1.00 0.00 O ATOM 758 CB PHE A 45 -0.518 22.957 7.190 1.00 0.00 C ATOM 759 CG PHE A 45 -0.144 23.284 5.737 1.00 0.00 C ATOM 760 CD1 PHE A 45 1.180 23.198 5.307 1.00 0.00 C ATOM 761 CD2 PHE A 45 -1.115 23.684 4.808 1.00 0.00 C ATOM 762 CE1 PHE A 45 1.524 23.488 4.001 1.00 0.00 C ATOM 763 CE2 PHE A 45 -0.765 23.975 3.503 1.00 0.00 C ATOM 764 CZ PHE A 45 0.554 23.879 3.102 1.00 0.00 C ATOM 0 H PHE A 45 -1.682 23.689 9.654 1.00 0.00 H new ATOM 0 HA PHE A 45 0.863 24.250 8.210 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.016 22.057 7.493 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.582 22.725 7.232 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.948 22.900 6.006 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.147 23.766 5.115 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.553 23.408 3.684 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.523 24.278 2.796 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.826 24.111 2.083 1.00 0.00 H new ATOM 774 N ALA A 46 -0.171 26.444 7.542 1.00 0.00 N ATOM 775 CA ALA A 46 -0.708 27.733 7.041 1.00 0.00 C ATOM 776 C ALA A 46 -1.664 28.427 8.047 1.00 0.00 C ATOM 777 O ALA A 46 -2.446 29.303 7.657 1.00 0.00 O ATOM 778 CB ALA A 46 -1.377 27.544 5.658 1.00 0.00 C ATOM 0 H ALA A 46 0.844 26.440 7.644 1.00 0.00 H new ATOM 0 HA ALA A 46 0.142 28.406 6.926 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.765 28.501 5.308 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.642 27.168 4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.196 26.830 5.745 1.00 0.00 H new ATOM 784 N GLY A 47 -1.565 28.061 9.343 1.00 0.00 N ATOM 785 CA GLY A 47 -2.388 28.662 10.406 1.00 0.00 C ATOM 786 C GLY A 47 -3.583 27.811 10.820 1.00 0.00 C ATOM 787 O GLY A 47 -4.168 28.038 11.888 1.00 0.00 O ATOM 0 H GLY A 47 -0.917 27.347 9.676 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.761 28.840 11.280 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.747 29.634 10.068 1.00 0.00 H new ATOM 791 N LYS A 48 -3.956 26.832 9.976 1.00 0.00 N ATOM 792 CA LYS A 48 -5.076 25.913 10.257 1.00 0.00 C ATOM 793 C LYS A 48 -4.524 24.681 11.005 1.00 0.00 C ATOM 794 O LYS A 48 -3.453 24.155 10.650 1.00 0.00 O ATOM 795 CB LYS A 48 -5.808 25.519 8.926 1.00 0.00 C ATOM 796 CG LYS A 48 -5.076 24.480 8.033 1.00 0.00 C ATOM 797 CD LYS A 48 -5.512 24.491 6.548 1.00 0.00 C ATOM 798 CE LYS A 48 -5.049 25.732 5.776 1.00 0.00 C ATOM 799 NZ LYS A 48 -5.428 25.645 4.342 1.00 0.00 N ATOM 0 H LYS A 48 -3.493 26.655 9.084 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.818 26.400 10.889 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.792 25.124 9.178 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.969 26.424 8.340 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.003 24.666 8.085 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.247 23.484 8.441 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.118 23.601 6.057 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.599 24.428 6.498 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.491 26.625 6.218 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.967 25.835 5.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.102 26.498 3.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.986 24.806 3.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.462 25.570 4.260 1.00 0.00 H new ATOM 813 N GLN A 49 -5.225 24.256 12.071 1.00 0.00 N ATOM 814 CA GLN A 49 -4.850 23.054 12.841 1.00 0.00 C ATOM 815 C GLN A 49 -5.402 21.833 12.092 1.00 0.00 C ATOM 816 O GLN A 49 -6.551 21.844 11.627 1.00 0.00 O ATOM 817 CB GLN A 49 -5.388 23.136 14.308 1.00 0.00 C ATOM 818 CG GLN A 49 -4.545 22.383 15.380 1.00 0.00 C ATOM 819 CD GLN A 49 -4.538 20.853 15.282 1.00 0.00 C ATOM 820 OE1 GLN A 49 -3.539 20.209 15.609 1.00 0.00 O ATOM 821 NE2 GLN A 49 -5.655 20.251 14.887 1.00 0.00 N ATOM 0 H GLN A 49 -6.058 24.729 12.421 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.766 22.973 12.923 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -5.451 24.186 14.594 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.403 22.739 14.326 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -3.515 22.735 15.316 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.917 22.662 16.366 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -6.468 20.807 14.622 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -5.700 19.233 14.849 1.00 0.00 H new ATOM 830 N LEU A 50 -4.578 20.788 11.962 1.00 0.00 N ATOM 831 CA LEU A 50 -4.911 19.629 11.145 1.00 0.00 C ATOM 832 C LEU A 50 -5.666 18.577 11.976 1.00 0.00 C ATOM 833 O LEU A 50 -5.104 17.989 12.912 1.00 0.00 O ATOM 834 CB LEU A 50 -3.640 19.029 10.507 1.00 0.00 C ATOM 835 CG LEU A 50 -2.641 20.033 9.846 1.00 0.00 C ATOM 836 CD1 LEU A 50 -1.485 19.282 9.180 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.336 20.999 8.862 1.00 0.00 C ATOM 0 H LEU A 50 -3.668 20.727 12.419 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.569 19.953 10.339 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.104 18.473 11.276 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.948 18.308 9.750 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.231 20.655 10.642 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.800 19.998 8.725 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.953 18.696 9.929 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.878 18.617 8.411 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.596 21.674 8.432 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.812 20.427 8.066 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.091 21.579 9.393 1.00 0.00 H new ATOM 849 N GLU A 51 -6.942 18.355 11.615 1.00 0.00 N ATOM 850 CA GLU A 51 -7.821 17.403 12.293 1.00 0.00 C ATOM 851 C GLU A 51 -7.466 15.980 11.863 1.00 0.00 C ATOM 852 O GLU A 51 -7.285 15.724 10.668 1.00 0.00 O ATOM 853 CB GLU A 51 -9.301 17.694 11.937 1.00 0.00 C ATOM 854 CG GLU A 51 -10.319 16.735 12.588 1.00 0.00 C ATOM 855 CD GLU A 51 -11.742 16.910 12.047 1.00 0.00 C ATOM 856 OE1 GLU A 51 -12.459 17.828 12.513 1.00 0.00 O ATOM 857 OE2 GLU A 51 -12.151 16.127 11.159 1.00 0.00 O ATOM 0 H GLU A 51 -7.390 18.839 10.837 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.687 17.505 13.370 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.539 18.714 12.238 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.417 17.645 10.854 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.998 15.707 12.422 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.324 16.897 13.666 1.00 0.00 H new ATOM 864 N ASP A 52 -7.455 15.063 12.837 1.00 0.00 N ATOM 865 CA ASP A 52 -7.110 13.651 12.626 1.00 0.00 C ATOM 866 C ASP A 52 -8.070 12.965 11.626 1.00 0.00 C ATOM 867 O ASP A 52 -7.631 12.163 10.796 1.00 0.00 O ATOM 868 CB ASP A 52 -7.088 12.910 13.986 1.00 0.00 C ATOM 869 CG ASP A 52 -8.421 12.981 14.744 1.00 0.00 C ATOM 870 OD1 ASP A 52 -8.651 13.982 15.458 1.00 0.00 O ATOM 871 OD2 ASP A 52 -9.248 12.058 14.614 1.00 0.00 O ATOM 0 H ASP A 52 -7.688 15.282 13.806 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.115 13.604 12.183 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -6.831 11.864 13.817 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.301 13.335 14.610 1.00 0.00 H new ATOM 876 N GLY A 53 -9.366 13.329 11.701 1.00 0.00 N ATOM 877 CA GLY A 53 -10.406 12.752 10.843 1.00 0.00 C ATOM 878 C GLY A 53 -10.272 13.117 9.365 1.00 0.00 C ATOM 879 O GLY A 53 -10.814 12.421 8.499 1.00 0.00 O ATOM 0 H GLY A 53 -9.714 14.028 12.357 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.382 11.667 10.941 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.381 13.083 11.200 1.00 0.00 H new ATOM 883 N ARG A 54 -9.566 14.227 9.080 1.00 0.00 N ATOM 884 CA ARG A 54 -9.317 14.703 7.699 1.00 0.00 C ATOM 885 C ARG A 54 -8.026 14.099 7.118 1.00 0.00 C ATOM 886 O ARG A 54 -7.322 13.352 7.796 1.00 0.00 O ATOM 887 CB ARG A 54 -9.246 16.250 7.688 1.00 0.00 C ATOM 888 CG ARG A 54 -10.553 16.944 8.135 1.00 0.00 C ATOM 889 CD ARG A 54 -10.563 18.437 7.801 1.00 0.00 C ATOM 890 NE ARG A 54 -11.795 19.119 8.205 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.258 20.253 7.653 1.00 0.00 C ATOM 892 NH1 ARG A 54 -11.710 20.749 6.546 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.289 20.870 8.194 1.00 0.00 N ATOM 0 H ARG A 54 -9.151 14.821 9.797 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.143 14.374 7.068 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -8.435 16.571 8.342 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.995 16.585 6.681 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.402 16.460 7.652 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.681 16.814 9.210 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.715 18.916 8.290 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.424 18.562 6.727 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.341 18.703 8.960 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.927 20.267 6.104 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.073 21.611 6.139 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -13.732 20.486 9.029 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -13.644 21.731 7.778 1.00 0.00 H new ATOM 907 N THR A 55 -7.740 14.425 5.842 1.00 0.00 N ATOM 908 CA THR A 55 -6.504 14.000 5.147 1.00 0.00 C ATOM 909 C THR A 55 -5.577 15.203 4.918 1.00 0.00 C ATOM 910 O THR A 55 -5.989 16.356 5.108 1.00 0.00 O ATOM 911 CB THR A 55 -6.814 13.336 3.765 1.00 0.00 C ATOM 912 OG1 THR A 55 -7.582 14.238 2.950 1.00 0.00 O ATOM 913 CG2 THR A 55 -7.560 12.006 3.906 1.00 0.00 C ATOM 0 H THR A 55 -8.359 14.991 5.262 1.00 0.00 H new ATOM 0 HA THR A 55 -6.015 13.266 5.787 1.00 0.00 H new ATOM 0 HB THR A 55 -5.857 13.123 3.290 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.771 13.817 2.085 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.750 11.589 2.917 1.00 0.00 H new ATOM 0 HG22 THR A 55 -6.954 11.308 4.484 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.508 12.173 4.417 1.00 0.00 H new ATOM 921 N LEU A 56 -4.330 14.917 4.488 1.00 0.00 N ATOM 922 CA LEU A 56 -3.365 15.958 4.078 1.00 0.00 C ATOM 923 C LEU A 56 -3.984 16.833 2.967 1.00 0.00 C ATOM 924 O LEU A 56 -4.112 18.050 3.115 1.00 0.00 O ATOM 925 CB LEU A 56 -2.038 15.314 3.563 1.00 0.00 C ATOM 926 CG LEU A 56 -1.130 14.598 4.613 1.00 0.00 C ATOM 927 CD1 LEU A 56 0.078 13.911 3.927 1.00 0.00 C ATOM 928 CD2 LEU A 56 -0.649 15.583 5.706 1.00 0.00 C ATOM 0 H LEU A 56 -3.966 13.967 4.416 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.135 16.576 4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.293 14.590 2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.448 16.096 3.085 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.731 13.828 5.096 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.694 13.420 4.681 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.282 13.170 3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.673 14.659 3.404 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.019 15.054 6.421 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.076 16.387 5.244 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.512 16.002 6.223 1.00 0.00 H new ATOM 940 N SER A 57 -4.429 16.158 1.893 1.00 0.00 N ATOM 941 CA SER A 57 -4.980 16.792 0.683 1.00 0.00 C ATOM 942 C SER A 57 -6.252 17.610 0.993 1.00 0.00 C ATOM 943 O SER A 57 -6.591 18.535 0.242 1.00 0.00 O ATOM 944 CB SER A 57 -5.282 15.701 -0.361 1.00 0.00 C ATOM 945 OG SER A 57 -5.672 16.235 -1.616 1.00 0.00 O ATOM 0 H SER A 57 -4.416 15.139 1.841 1.00 0.00 H new ATOM 0 HA SER A 57 -4.241 17.489 0.289 1.00 0.00 H new ATOM 0 HB2 SER A 57 -4.398 15.078 -0.495 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.074 15.053 0.015 1.00 0.00 H new ATOM 0 HG SER A 57 -5.850 15.502 -2.242 1.00 0.00 H new ATOM 951 N ASP A 58 -6.940 17.275 2.117 1.00 0.00 N ATOM 952 CA ASP A 58 -8.131 18.019 2.580 1.00 0.00 C ATOM 953 C ASP A 58 -7.715 19.458 2.920 1.00 0.00 C ATOM 954 O ASP A 58 -8.324 20.434 2.466 1.00 0.00 O ATOM 955 CB ASP A 58 -8.758 17.333 3.827 1.00 0.00 C ATOM 956 CG ASP A 58 -10.161 17.860 4.203 1.00 0.00 C ATOM 957 OD1 ASP A 58 -10.313 19.057 4.532 1.00 0.00 O ATOM 958 OD2 ASP A 58 -11.121 17.062 4.195 1.00 0.00 O ATOM 0 H ASP A 58 -6.685 16.491 2.717 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.881 18.027 1.789 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.822 16.261 3.643 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.091 17.471 4.678 1.00 0.00 H new ATOM 963 N TYR A 59 -6.616 19.553 3.675 1.00 0.00 N ATOM 964 CA TYR A 59 -6.042 20.819 4.127 1.00 0.00 C ATOM 965 C TYR A 59 -5.072 21.427 3.082 1.00 0.00 C ATOM 966 O TYR A 59 -4.272 22.312 3.421 1.00 0.00 O ATOM 967 CB TYR A 59 -5.323 20.576 5.466 1.00 0.00 C ATOM 968 CG TYR A 59 -6.267 20.454 6.667 1.00 0.00 C ATOM 969 CD1 TYR A 59 -7.083 21.526 7.026 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.327 19.305 7.452 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.910 21.471 8.119 1.00 0.00 C ATOM 972 CE2 TYR A 59 -7.153 19.251 8.549 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.937 20.342 8.882 1.00 0.00 C ATOM 974 OH TYR A 59 -8.762 20.289 9.986 1.00 0.00 O ATOM 0 H TYR A 59 -6.093 18.737 3.993 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.846 21.544 4.257 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.731 19.664 5.388 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.626 21.395 5.646 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.063 22.424 6.427 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -5.719 18.449 7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.534 22.315 8.373 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -7.190 18.356 9.152 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.323 20.729 10.744 1.00 0.00 H new ATOM 984 N ASN A 60 -5.167 20.933 1.817 1.00 0.00 N ATOM 985 CA ASN A 60 -4.383 21.418 0.645 1.00 0.00 C ATOM 986 C ASN A 60 -2.900 20.983 0.707 1.00 0.00 C ATOM 987 O ASN A 60 -2.082 21.422 -0.111 1.00 0.00 O ATOM 988 CB ASN A 60 -4.501 22.967 0.454 1.00 0.00 C ATOM 989 CG ASN A 60 -5.916 23.481 0.138 1.00 0.00 C ATOM 990 OD1 ASN A 60 -6.080 24.408 -0.646 1.00 0.00 O ATOM 991 ND2 ASN A 60 -6.941 22.945 0.788 1.00 0.00 N ATOM 0 H ASN A 60 -5.803 20.172 1.578 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.827 20.942 -0.229 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.148 23.457 1.361 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -3.833 23.270 -0.352 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -7.884 23.304 0.639 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.786 22.174 1.437 1.00 0.00 H new ATOM 998 N ILE A 61 -2.581 20.092 1.655 1.00 0.00 N ATOM 999 CA ILE A 61 -1.219 19.566 1.858 1.00 0.00 C ATOM 1000 C ILE A 61 -0.966 18.431 0.850 1.00 0.00 C ATOM 1001 O ILE A 61 -1.714 17.445 0.806 1.00 0.00 O ATOM 1002 CB ILE A 61 -1.051 19.002 3.316 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -1.561 20.027 4.369 1.00 0.00 C ATOM 1004 CG2 ILE A 61 0.410 18.575 3.617 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -1.905 19.405 5.707 1.00 0.00 C ATOM 0 H ILE A 61 -3.264 19.711 2.309 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.504 20.376 1.711 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.664 18.104 3.384 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.798 20.791 4.519 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.443 20.531 3.975 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.475 18.192 4.636 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.713 17.796 2.917 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.070 19.436 3.510 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.253 20.180 6.390 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.690 18.661 5.571 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.019 18.925 6.124 1.00 0.00 H new ATOM 1017 N GLN A 62 0.079 18.579 0.052 1.00 0.00 N ATOM 1018 CA GLN A 62 0.485 17.572 -0.934 1.00 0.00 C ATOM 1019 C GLN A 62 1.799 16.914 -0.491 1.00 0.00 C ATOM 1020 O GLN A 62 2.298 17.175 0.620 1.00 0.00 O ATOM 1021 CB GLN A 62 0.642 18.235 -2.329 1.00 0.00 C ATOM 1022 CG GLN A 62 1.689 19.368 -2.397 1.00 0.00 C ATOM 1023 CD GLN A 62 2.063 19.755 -3.823 1.00 0.00 C ATOM 1024 OE1 GLN A 62 1.437 20.615 -4.435 1.00 0.00 O ATOM 1025 NE2 GLN A 62 3.091 19.116 -4.359 1.00 0.00 N ATOM 0 H GLN A 62 0.678 19.404 0.065 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.282 16.800 -1.004 1.00 0.00 H new ATOM 0 HB2 GLN A 62 0.913 17.466 -3.052 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.325 18.635 -2.636 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.300 20.245 -1.880 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.587 19.056 -1.864 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.588 18.407 -3.820 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.386 19.333 -5.311 1.00 0.00 H new ATOM 1034 N LYS A 63 2.354 16.055 -1.361 1.00 0.00 N ATOM 1035 CA LYS A 63 3.685 15.470 -1.154 1.00 0.00 C ATOM 1036 C LYS A 63 4.752 16.572 -1.041 1.00 0.00 C ATOM 1037 O LYS A 63 4.653 17.622 -1.693 1.00 0.00 O ATOM 1038 CB LYS A 63 4.053 14.500 -2.301 1.00 0.00 C ATOM 1039 CG LYS A 63 4.095 15.130 -3.710 1.00 0.00 C ATOM 1040 CD LYS A 63 4.395 14.067 -4.785 1.00 0.00 C ATOM 1041 CE LYS A 63 5.742 13.357 -4.555 1.00 0.00 C ATOM 1042 NZ LYS A 63 6.887 14.136 -5.089 1.00 0.00 N ATOM 0 H LYS A 63 1.896 15.750 -2.220 1.00 0.00 H new ATOM 0 HA LYS A 63 3.656 14.908 -0.221 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.029 14.064 -2.087 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.333 13.682 -2.308 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.140 15.610 -3.926 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.858 15.908 -3.741 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.595 13.327 -4.792 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.401 14.540 -5.767 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.885 13.191 -3.487 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.719 12.376 -5.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.735 13.534 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.666 14.462 -6.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.063 14.958 -4.477 1.00 0.00 H new ATOM 1056 N GLU A 64 5.744 16.312 -0.176 1.00 0.00 N ATOM 1057 CA GLU A 64 6.881 17.210 0.100 1.00 0.00 C ATOM 1058 C GLU A 64 6.464 18.571 0.702 1.00 0.00 C ATOM 1059 O GLU A 64 7.306 19.467 0.825 1.00 0.00 O ATOM 1060 CB GLU A 64 7.749 17.371 -1.180 1.00 0.00 C ATOM 1061 CG GLU A 64 8.266 16.032 -1.749 1.00 0.00 C ATOM 1062 CD GLU A 64 8.930 16.176 -3.125 1.00 0.00 C ATOM 1063 OE1 GLU A 64 8.215 16.496 -4.094 1.00 0.00 O ATOM 1064 OE2 GLU A 64 10.147 15.937 -3.252 1.00 0.00 O ATOM 0 H GLU A 64 5.781 15.449 0.366 1.00 0.00 H new ATOM 0 HA GLU A 64 7.485 16.740 0.877 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.162 17.879 -1.945 1.00 0.00 H new ATOM 0 HB3 GLU A 64 8.600 18.013 -0.953 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.983 15.600 -1.050 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.434 15.332 -1.826 1.00 0.00 H new ATOM 1071 N SER A 65 5.183 18.721 1.118 1.00 0.00 N ATOM 1072 CA SER A 65 4.733 19.938 1.806 1.00 0.00 C ATOM 1073 C SER A 65 5.345 20.010 3.211 1.00 0.00 C ATOM 1074 O SER A 65 5.359 19.013 3.949 1.00 0.00 O ATOM 1075 CB SER A 65 3.199 20.009 1.885 1.00 0.00 C ATOM 1076 OG SER A 65 2.618 20.102 0.596 1.00 0.00 O ATOM 0 H SER A 65 4.456 18.018 0.987 1.00 0.00 H new ATOM 0 HA SER A 65 5.074 20.795 1.225 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.818 19.124 2.394 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.904 20.872 2.482 1.00 0.00 H new ATOM 0 HG SER A 65 1.976 20.842 0.579 1.00 0.00 H new ATOM 1082 N THR A 66 5.886 21.186 3.544 1.00 0.00 N ATOM 1083 CA THR A 66 6.445 21.465 4.862 1.00 0.00 C ATOM 1084 C THR A 66 5.362 22.120 5.732 1.00 0.00 C ATOM 1085 O THR A 66 4.689 23.052 5.292 1.00 0.00 O ATOM 1086 CB THR A 66 7.710 22.374 4.755 1.00 0.00 C ATOM 1087 OG1 THR A 66 8.640 21.788 3.818 1.00 0.00 O ATOM 1088 CG2 THR A 66 8.415 22.555 6.120 1.00 0.00 C ATOM 0 H THR A 66 5.947 21.974 2.899 1.00 0.00 H new ATOM 0 HA THR A 66 6.763 20.531 5.326 1.00 0.00 H new ATOM 0 HB THR A 66 7.383 23.356 4.414 1.00 0.00 H new ATOM 0 HG1 THR A 66 9.435 22.357 3.747 1.00 0.00 H new ATOM 0 HG21 THR A 66 9.289 23.194 5.996 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.726 23.016 6.827 1.00 0.00 H new ATOM 0 HG23 THR A 66 8.728 21.582 6.500 1.00 0.00 H new ATOM 1096 N LEU A 67 5.188 21.600 6.949 1.00 0.00 N ATOM 1097 CA LEU A 67 4.191 22.086 7.916 1.00 0.00 C ATOM 1098 C LEU A 67 4.823 22.153 9.308 1.00 0.00 C ATOM 1099 O LEU A 67 5.842 21.515 9.562 1.00 0.00 O ATOM 1100 CB LEU A 67 2.921 21.183 7.929 1.00 0.00 C ATOM 1101 CG LEU A 67 3.142 19.648 8.173 1.00 0.00 C ATOM 1102 CD1 LEU A 67 1.897 18.993 8.792 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.536 18.905 6.871 1.00 0.00 C ATOM 0 H LEU A 67 5.742 20.818 7.299 1.00 0.00 H new ATOM 0 HA LEU A 67 3.873 23.084 7.615 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.248 21.556 8.701 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.409 21.304 6.974 1.00 0.00 H new ATOM 0 HG LEU A 67 3.970 19.562 8.877 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.084 17.931 8.948 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.674 19.466 9.748 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.048 19.117 8.120 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.679 17.846 7.086 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.744 19.022 6.132 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.463 19.324 6.479 1.00 0.00 H new ATOM 1115 N HIS A 68 4.206 22.936 10.203 1.00 0.00 N ATOM 1116 CA HIS A 68 4.712 23.143 11.570 1.00 0.00 C ATOM 1117 C HIS A 68 4.167 22.086 12.534 1.00 0.00 C ATOM 1118 O HIS A 68 2.985 21.716 12.480 1.00 0.00 O ATOM 1119 CB HIS A 68 4.359 24.561 12.073 1.00 0.00 C ATOM 1120 CG HIS A 68 5.062 25.637 11.297 1.00 0.00 C ATOM 1121 ND1 HIS A 68 4.506 26.284 10.215 1.00 0.00 N ATOM 1122 CD2 HIS A 68 6.311 26.141 11.428 1.00 0.00 C ATOM 1123 CE1 HIS A 68 5.382 27.134 9.721 1.00 0.00 C ATOM 1124 NE2 HIS A 68 6.483 27.067 10.437 1.00 0.00 N ATOM 0 H HIS A 68 3.344 23.443 10.002 1.00 0.00 H new ATOM 0 HA HIS A 68 5.797 23.042 11.539 1.00 0.00 H new ATOM 0 HB2 HIS A 68 3.282 24.711 12.002 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.624 24.646 13.127 1.00 0.00 H new ATOM 0 HD2 HIS A 68 7.038 25.863 12.177 1.00 0.00 H new ATOM 0 HE1 HIS A 68 5.223 27.779 8.869 1.00 0.00 H new ATOM 0 HE2 HIS A 68 7.328 27.616 10.279 1.00 0.00 H new ATOM 1133 N LEU A 69 5.058 21.616 13.406 1.00 0.00 N ATOM 1134 CA LEU A 69 4.753 20.665 14.467 1.00 0.00 C ATOM 1135 C LEU A 69 5.088 21.354 15.784 1.00 0.00 C ATOM 1136 O LEU A 69 6.130 22.013 15.916 1.00 0.00 O ATOM 1137 CB LEU A 69 5.588 19.371 14.265 1.00 0.00 C ATOM 1138 CG LEU A 69 5.176 18.073 15.049 1.00 0.00 C ATOM 1139 CD1 LEU A 69 5.533 18.137 16.542 1.00 0.00 C ATOM 1140 CD2 LEU A 69 3.682 17.744 14.833 1.00 0.00 C ATOM 0 H LEU A 69 6.039 21.896 13.391 1.00 0.00 H new ATOM 0 HA LEU A 69 3.704 20.370 14.460 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.574 19.132 13.202 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.621 19.601 14.527 1.00 0.00 H new ATOM 0 HG LEU A 69 5.766 17.256 14.633 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.224 17.213 17.030 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.610 18.264 16.653 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.019 18.980 17.003 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.424 16.841 15.387 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.072 18.574 15.188 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.494 17.584 13.771 1.00 0.00 H new ATOM 1152 N VAL A 70 4.186 21.217 16.745 1.00 0.00 N ATOM 1153 CA VAL A 70 4.315 21.836 18.060 1.00 0.00 C ATOM 1154 C VAL A 70 4.442 20.768 19.147 1.00 0.00 C ATOM 1155 O VAL A 70 3.514 19.979 19.368 1.00 0.00 O ATOM 1156 CB VAL A 70 3.091 22.763 18.336 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.156 23.383 19.757 1.00 0.00 C ATOM 1158 CG2 VAL A 70 2.987 23.843 17.220 1.00 0.00 C ATOM 0 H VAL A 70 3.334 20.667 16.634 1.00 0.00 H new ATOM 0 HA VAL A 70 5.221 22.442 18.075 1.00 0.00 H new ATOM 0 HB VAL A 70 2.180 22.165 18.310 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.288 24.023 19.915 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.160 22.587 20.501 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.066 23.975 19.854 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.131 24.488 17.417 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.898 24.442 17.207 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.860 23.356 16.253 1.00 0.00 H new ATOM 1168 N LEU A 71 5.608 20.756 19.803 1.00 0.00 N ATOM 1169 CA LEU A 71 5.872 19.898 20.956 1.00 0.00 C ATOM 1170 C LEU A 71 5.274 20.552 22.221 1.00 0.00 C ATOM 1171 O LEU A 71 5.832 21.504 22.775 1.00 0.00 O ATOM 1172 CB LEU A 71 7.395 19.649 21.117 1.00 0.00 C ATOM 1173 CG LEU A 71 8.136 19.045 19.875 1.00 0.00 C ATOM 1174 CD1 LEU A 71 9.666 18.973 20.111 1.00 0.00 C ATOM 1175 CD2 LEU A 71 7.566 17.654 19.500 1.00 0.00 C ATOM 0 H LEU A 71 6.398 21.347 19.544 1.00 0.00 H new ATOM 0 HA LEU A 71 5.400 18.928 20.803 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.871 20.596 21.372 1.00 0.00 H new ATOM 0 HB3 LEU A 71 7.544 18.979 21.964 1.00 0.00 H new ATOM 0 HG LEU A 71 7.960 19.715 19.033 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.150 18.550 19.231 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.054 19.976 20.292 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.871 18.343 20.977 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.101 17.263 18.635 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.688 16.972 20.341 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.507 17.748 19.259 1.00 0.00 H new ATOM 1187 N ARG A 72 4.089 20.062 22.599 1.00 0.00 N ATOM 1188 CA ARG A 72 3.382 20.438 23.838 1.00 0.00 C ATOM 1189 C ARG A 72 4.175 19.913 25.052 1.00 0.00 C ATOM 1190 O ARG A 72 4.281 20.591 26.082 1.00 0.00 O ATOM 1191 CB ARG A 72 1.934 19.849 23.811 1.00 0.00 C ATOM 1192 CG ARG A 72 1.110 20.237 22.549 1.00 0.00 C ATOM 1193 CD ARG A 72 -0.237 19.484 22.445 1.00 0.00 C ATOM 1194 NE ARG A 72 -1.189 19.932 23.464 1.00 0.00 N ATOM 1195 CZ ARG A 72 -2.325 19.306 23.824 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -2.627 18.096 23.370 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -3.152 19.907 24.662 1.00 0.00 N ATOM 0 H ARG A 72 3.579 19.376 22.042 1.00 0.00 H new ATOM 0 HA ARG A 72 3.307 21.523 23.916 1.00 0.00 H new ATOM 0 HB2 ARG A 72 1.995 18.762 23.871 1.00 0.00 H new ATOM 0 HB3 ARG A 72 1.399 20.188 24.698 1.00 0.00 H new ATOM 0 HG2 ARG A 72 0.919 21.310 22.564 1.00 0.00 H new ATOM 0 HG3 ARG A 72 1.704 20.031 21.658 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -0.665 19.639 21.454 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -0.065 18.413 22.554 1.00 0.00 H new ATOM 0 HE ARG A 72 -0.970 20.803 23.948 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -1.991 17.617 22.732 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -3.495 17.645 23.659 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -2.925 20.832 25.026 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -4.017 19.445 24.944 1.00 0.00 H new ATOM 1211 N LEU A 73 4.696 18.670 24.892 1.00 0.00 N ATOM 1212 CA LEU A 73 5.627 18.006 25.842 1.00 0.00 C ATOM 1213 C LEU A 73 5.018 17.876 27.258 1.00 0.00 C ATOM 1214 O LEU A 73 5.728 17.795 28.267 1.00 0.00 O ATOM 1215 CB LEU A 73 7.018 18.734 25.824 1.00 0.00 C ATOM 1216 CG LEU A 73 8.275 17.875 25.477 1.00 0.00 C ATOM 1217 CD1 LEU A 73 8.632 16.904 26.616 1.00 0.00 C ATOM 1218 CD2 LEU A 73 8.092 17.138 24.127 1.00 0.00 C ATOM 0 H LEU A 73 4.477 18.089 24.083 1.00 0.00 H new ATOM 0 HA LEU A 73 5.793 16.980 25.513 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.961 19.552 25.106 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.176 19.182 26.805 1.00 0.00 H new ATOM 0 HG LEU A 73 9.119 18.555 25.366 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.512 16.324 26.337 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.843 17.470 27.524 1.00 0.00 H new ATOM 0 HD13 LEU A 73 7.795 16.230 26.795 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.983 16.548 23.911 1.00 0.00 H new ATOM 0 HD22 LEU A 73 7.226 16.479 24.187 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.939 17.868 23.332 1.00 0.00 H new ATOM 1230 N ARG A 74 3.684 17.761 27.285 1.00 0.00 N ATOM 1231 CA ARG A 74 2.885 17.704 28.523 1.00 0.00 C ATOM 1232 C ARG A 74 2.905 16.301 29.161 1.00 0.00 C ATOM 1233 O ARG A 74 2.397 16.114 30.271 1.00 0.00 O ATOM 1234 CB ARG A 74 1.432 18.136 28.204 1.00 0.00 C ATOM 1235 CG ARG A 74 1.303 19.552 27.599 1.00 0.00 C ATOM 1236 CD ARG A 74 1.861 20.651 28.526 1.00 0.00 C ATOM 1237 NE ARG A 74 1.197 20.642 29.845 1.00 0.00 N ATOM 1238 CZ ARG A 74 1.782 20.930 31.019 1.00 0.00 C ATOM 1239 NH1 ARG A 74 3.069 21.263 31.088 1.00 0.00 N ATOM 1240 NH2 ARG A 74 1.065 20.880 32.131 1.00 0.00 N ATOM 0 H ARG A 74 3.119 17.704 26.438 1.00 0.00 H new ATOM 0 HA ARG A 74 3.326 18.386 29.250 1.00 0.00 H new ATOM 0 HB2 ARG A 74 0.997 17.417 27.510 1.00 0.00 H new ATOM 0 HB3 ARG A 74 0.843 18.091 29.120 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.831 19.584 26.646 1.00 0.00 H new ATOM 0 HG3 ARG A 74 0.253 19.758 27.389 1.00 0.00 H new ATOM 0 HD2 ARG A 74 2.933 20.506 28.657 1.00 0.00 H new ATOM 0 HD3 ARG A 74 1.726 21.626 28.057 1.00 0.00 H new ATOM 0 HE ARG A 74 0.207 20.395 29.866 1.00 0.00 H new ATOM 0 HH11 ARG A 74 3.632 21.303 30.238 1.00 0.00 H new ATOM 0 HH12 ARG A 74 3.493 21.478 31.991 1.00 0.00 H new ATOM 0 HH21 ARG A 74 0.078 20.625 32.091 1.00 0.00 H new ATOM 0 HH22 ARG A 74 1.499 21.097 33.028 1.00 0.00 H new ATOM 1254 N GLY A 75 3.494 15.331 28.446 1.00 0.00 N ATOM 1255 CA GLY A 75 3.600 13.952 28.905 1.00 0.00 C ATOM 1256 C GLY A 75 4.932 13.341 28.509 1.00 0.00 C ATOM 1257 O GLY A 75 5.004 12.155 28.159 1.00 0.00 O ATOM 0 H GLY A 75 3.910 15.490 27.528 1.00 0.00 H new ATOM 0 HA2 GLY A 75 3.489 13.917 29.989 1.00 0.00 H new ATOM 0 HA3 GLY A 75 2.787 13.362 28.483 1.00 0.00 H new ATOM 1261 N GLY A 76 5.988 14.181 28.553 1.00 0.00 N ATOM 1262 CA GLY A 76 7.363 13.746 28.315 1.00 0.00 C ATOM 1263 C GLY A 76 7.624 13.280 26.882 1.00 0.00 C ATOM 1264 O GLY A 76 7.161 13.916 25.923 1.00 0.00 O ATOM 0 H GLY A 76 5.902 15.177 28.755 1.00 0.00 H new ATOM 0 HA2 GLY A 76 8.040 14.568 28.549 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.601 12.933 29.001 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 16.179 16.497 22.836 1.00 0.00 N ATOM 1270 CA GLY B 195 16.669 17.208 24.022 1.00 0.00 C ATOM 1271 C GLY B 195 15.602 18.077 24.675 1.00 0.00 C ATOM 1272 O GLY B 195 15.819 19.269 24.927 1.00 0.00 O ATOM 0 HA2 GLY B 195 17.035 16.483 24.749 1.00 0.00 H new ATOM 0 HA3 GLY B 195 17.517 17.832 23.741 1.00 0.00 H new ATOM 1276 N SER B 196 14.443 17.466 24.956 1.00 0.00 N ATOM 1277 CA SER B 196 13.298 18.119 25.597 1.00 0.00 C ATOM 1278 C SER B 196 13.301 17.773 27.104 1.00 0.00 C ATOM 1279 O SER B 196 12.726 16.761 27.534 1.00 0.00 O ATOM 1280 CB SER B 196 11.999 17.664 24.887 1.00 0.00 C ATOM 1281 OG SER B 196 11.903 16.242 24.827 1.00 0.00 O ATOM 0 H SER B 196 14.274 16.484 24.739 1.00 0.00 H new ATOM 0 HA SER B 196 13.361 19.204 25.508 1.00 0.00 H new ATOM 0 HB2 SER B 196 11.135 18.065 25.416 1.00 0.00 H new ATOM 0 HB3 SER B 196 11.973 18.074 23.877 1.00 0.00 H new ATOM 0 HG SER B 196 12.140 15.861 25.698 1.00 0.00 H new ATOM 1287 N ARG B 197 14.035 18.589 27.889 1.00 0.00 N ATOM 1288 CA ARG B 197 14.254 18.366 29.336 1.00 0.00 C ATOM 1289 C ARG B 197 13.631 19.527 30.140 1.00 0.00 C ATOM 1290 O ARG B 197 12.796 19.318 31.031 1.00 0.00 O ATOM 1291 CB ARG B 197 15.781 18.255 29.624 1.00 0.00 C ATOM 1292 CG ARG B 197 16.539 17.239 28.730 1.00 0.00 C ATOM 1293 CD ARG B 197 18.037 17.143 29.063 1.00 0.00 C ATOM 1294 NE ARG B 197 18.748 16.244 28.140 1.00 0.00 N ATOM 1295 CZ ARG B 197 20.049 15.925 28.216 1.00 0.00 C ATOM 1296 NH1 ARG B 197 20.803 16.381 29.211 1.00 0.00 N ATOM 1297 NH2 ARG B 197 20.588 15.139 27.295 1.00 0.00 N ATOM 0 H ARG B 197 14.496 19.427 27.535 1.00 0.00 H new ATOM 0 HA ARG B 197 13.774 17.436 29.640 1.00 0.00 H new ATOM 0 HB2 ARG B 197 16.233 19.238 29.496 1.00 0.00 H new ATOM 0 HB3 ARG B 197 15.920 17.974 30.668 1.00 0.00 H new ATOM 0 HG2 ARG B 197 16.084 16.255 28.843 1.00 0.00 H new ATOM 0 HG3 ARG B 197 16.423 17.526 27.685 1.00 0.00 H new ATOM 0 HD2 ARG B 197 18.483 18.136 29.018 1.00 0.00 H new ATOM 0 HD3 ARG B 197 18.159 16.785 30.085 1.00 0.00 H new ATOM 0 HE ARG B 197 18.208 15.830 27.381 1.00 0.00 H new ATOM 0 HH11 ARG B 197 20.394 16.980 29.928 1.00 0.00 H new ATOM 0 HH12 ARG B 197 21.791 16.131 29.258 1.00 0.00 H new ATOM 0 HH21 ARG B 197 20.014 14.779 26.532 1.00 0.00 H new ATOM 0 HH22 ARG B 197 21.577 14.894 27.349 1.00 0.00 H new ATOM 1311 N GLN B 198 14.065 20.755 29.815 1.00 0.00 N ATOM 1312 CA GLN B 198 13.516 21.999 30.395 1.00 0.00 C ATOM 1313 C GLN B 198 12.412 22.561 29.481 1.00 0.00 C ATOM 1314 O GLN B 198 12.296 22.143 28.320 1.00 0.00 O ATOM 1315 CB GLN B 198 14.650 23.046 30.566 1.00 0.00 C ATOM 1316 CG GLN B 198 15.772 22.617 31.531 1.00 0.00 C ATOM 1317 CD GLN B 198 16.894 23.652 31.661 1.00 0.00 C ATOM 1318 OE1 GLN B 198 16.842 24.552 32.504 1.00 0.00 O ATOM 1319 NE2 GLN B 198 17.920 23.530 30.834 1.00 0.00 N ATOM 0 H GLN B 198 14.811 20.918 29.139 1.00 0.00 H new ATOM 0 HA GLN B 198 13.087 21.778 31.372 1.00 0.00 H new ATOM 0 HB2 GLN B 198 15.087 23.253 29.589 1.00 0.00 H new ATOM 0 HB3 GLN B 198 14.215 23.979 30.925 1.00 0.00 H new ATOM 0 HG2 GLN B 198 15.343 22.432 32.516 1.00 0.00 H new ATOM 0 HG3 GLN B 198 16.196 21.674 31.186 1.00 0.00 H new ATOM 0 HE21 GLN B 198 17.935 22.776 30.148 1.00 0.00 H new ATOM 0 HE22 GLN B 198 18.696 24.190 30.883 1.00 0.00 H new ATOM 1328 N VAL B 199 11.607 23.507 30.015 1.00 0.00 N ATOM 1329 CA VAL B 199 10.557 24.193 29.237 1.00 0.00 C ATOM 1330 C VAL B 199 11.192 24.968 28.054 1.00 0.00 C ATOM 1331 O VAL B 199 12.054 25.843 28.247 1.00 0.00 O ATOM 1332 CB VAL B 199 9.661 25.135 30.142 1.00 0.00 C ATOM 1333 CG1 VAL B 199 10.497 26.161 30.946 1.00 0.00 C ATOM 1334 CG2 VAL B 199 8.555 25.842 29.311 1.00 0.00 C ATOM 0 H VAL B 199 11.667 23.812 30.986 1.00 0.00 H new ATOM 0 HA VAL B 199 9.887 23.434 28.833 1.00 0.00 H new ATOM 0 HB VAL B 199 9.173 24.487 30.870 1.00 0.00 H new ATOM 0 HG11 VAL B 199 9.832 26.780 31.548 1.00 0.00 H new ATOM 0 HG12 VAL B 199 11.191 25.633 31.599 1.00 0.00 H new ATOM 0 HG13 VAL B 199 11.057 26.794 30.257 1.00 0.00 H new ATOM 0 HG21 VAL B 199 7.960 26.480 29.965 1.00 0.00 H new ATOM 0 HG22 VAL B 199 9.017 26.450 28.533 1.00 0.00 H new ATOM 0 HG23 VAL B 199 7.911 25.093 28.851 1.00 0.00 H new ATOM 1344 N THR B 200 10.794 24.578 26.836 1.00 0.00 N ATOM 1345 CA THR B 200 11.368 25.103 25.593 1.00 0.00 C ATOM 1346 C THR B 200 10.824 26.522 25.287 1.00 0.00 C ATOM 1347 O THR B 200 9.691 26.847 25.635 1.00 0.00 O ATOM 1348 CB THR B 200 11.046 24.121 24.413 1.00 0.00 C ATOM 1349 OG1 THR B 200 11.393 22.773 24.789 1.00 0.00 O ATOM 1350 CG2 THR B 200 11.797 24.486 23.122 1.00 0.00 C ATOM 0 H THR B 200 10.060 23.885 26.686 1.00 0.00 H new ATOM 0 HA THR B 200 12.449 25.181 25.709 1.00 0.00 H new ATOM 0 HB THR B 200 9.977 24.203 24.215 1.00 0.00 H new ATOM 0 HG1 THR B 200 10.576 22.266 24.980 1.00 0.00 H new ATOM 0 HG21 THR B 200 11.538 23.775 22.337 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.515 25.491 22.809 1.00 0.00 H new ATOM 0 HG23 THR B 200 12.871 24.451 23.304 1.00 0.00 H new ATOM 1358 N LYS B 201 11.663 27.375 24.673 1.00 0.00 N ATOM 1359 CA LYS B 201 11.253 28.698 24.177 1.00 0.00 C ATOM 1360 C LYS B 201 10.973 28.533 22.684 1.00 0.00 C ATOM 1361 O LYS B 201 11.855 28.116 21.914 1.00 0.00 O ATOM 1362 CB LYS B 201 12.350 29.783 24.432 1.00 0.00 C ATOM 1363 CG LYS B 201 12.694 30.044 25.930 1.00 0.00 C ATOM 1364 CD LYS B 201 13.485 28.884 26.580 1.00 0.00 C ATOM 1365 CE LYS B 201 13.678 29.031 28.093 1.00 0.00 C ATOM 1366 NZ LYS B 201 14.343 27.828 28.665 1.00 0.00 N ATOM 0 H LYS B 201 12.647 27.164 24.507 1.00 0.00 H new ATOM 0 HA LYS B 201 10.367 29.047 24.707 1.00 0.00 H new ATOM 0 HB2 LYS B 201 13.261 29.483 23.914 1.00 0.00 H new ATOM 0 HB3 LYS B 201 12.022 30.720 23.983 1.00 0.00 H new ATOM 0 HG2 LYS B 201 13.276 30.962 26.009 1.00 0.00 H new ATOM 0 HG3 LYS B 201 11.771 30.203 26.487 1.00 0.00 H new ATOM 0 HD2 LYS B 201 12.965 27.947 26.380 1.00 0.00 H new ATOM 0 HD3 LYS B 201 14.463 28.814 26.105 1.00 0.00 H new ATOM 0 HE2 LYS B 201 14.278 29.917 28.302 1.00 0.00 H new ATOM 0 HE3 LYS B 201 12.711 29.180 28.574 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 14.600 28.012 29.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 13.693 27.018 28.620 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 15.202 27.613 28.119 1.00 0.00 H new ATOM 1380 N VAL B 202 9.747 28.869 22.290 1.00 0.00 N ATOM 1381 CA VAL B 202 9.179 28.499 20.986 1.00 0.00 C ATOM 1382 C VAL B 202 8.361 29.667 20.409 1.00 0.00 C ATOM 1383 O VAL B 202 8.289 30.742 21.005 1.00 0.00 O ATOM 1384 CB VAL B 202 8.279 27.201 21.116 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.122 25.907 21.244 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.317 27.328 22.315 1.00 0.00 C ATOM 0 H VAL B 202 9.108 29.412 22.871 1.00 0.00 H new ATOM 0 HA VAL B 202 9.999 28.278 20.303 1.00 0.00 H new ATOM 0 HB VAL B 202 7.701 27.122 20.195 1.00 0.00 H new ATOM 0 HG11 VAL B 202 8.458 25.047 21.330 1.00 0.00 H new ATOM 0 HG12 VAL B 202 9.750 25.793 20.361 1.00 0.00 H new ATOM 0 HG13 VAL B 202 9.752 25.969 22.131 1.00 0.00 H new ATOM 0 HG21 VAL B 202 6.707 26.428 22.389 1.00 0.00 H new ATOM 0 HG22 VAL B 202 7.893 27.452 23.232 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.670 28.194 22.173 1.00 0.00 H new ATOM 1396 N ASP B 203 7.764 29.438 19.230 1.00 0.00 N ATOM 1397 CA ASP B 203 6.940 30.439 18.519 1.00 0.00 C ATOM 1398 C ASP B 203 5.551 29.843 18.229 1.00 0.00 C ATOM 1399 O ASP B 203 5.432 28.643 17.973 1.00 0.00 O ATOM 1400 CB ASP B 203 7.632 30.881 17.195 1.00 0.00 C ATOM 1401 CG ASP B 203 9.035 31.480 17.416 1.00 0.00 C ATOM 1402 OD1 ASP B 203 9.146 32.688 17.708 1.00 0.00 O ATOM 1403 OD2 ASP B 203 10.038 30.744 17.309 1.00 0.00 O ATOM 0 H ASP B 203 7.837 28.549 18.736 1.00 0.00 H new ATOM 0 HA ASP B 203 6.828 31.321 19.149 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.711 30.022 16.529 1.00 0.00 H new ATOM 0 HB3 ASP B 203 7.004 31.617 16.692 1.00 0.00 H new ATOM 1408 N CYS B 204 4.503 30.689 18.288 1.00 0.00 N ATOM 1409 CA CYS B 204 3.101 30.290 18.027 1.00 0.00 C ATOM 1410 C CYS B 204 2.807 30.498 16.538 1.00 0.00 C ATOM 1411 O CYS B 204 2.563 31.630 16.143 1.00 0.00 O ATOM 1412 CB CYS B 204 2.134 31.125 18.913 1.00 0.00 C ATOM 1413 SG CYS B 204 0.353 30.711 18.816 1.00 0.00 S ATOM 0 H CYS B 204 4.604 31.677 18.520 1.00 0.00 H new ATOM 0 HA CYS B 204 2.953 29.240 18.279 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.450 31.021 19.951 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.253 32.175 18.647 1.00 0.00 H new ATOM 1418 N PRO B 205 2.830 29.414 15.689 1.00 0.00 N ATOM 1419 CA PRO B 205 2.794 29.545 14.204 1.00 0.00 C ATOM 1420 C PRO B 205 1.548 30.289 13.664 1.00 0.00 C ATOM 1421 O PRO B 205 1.598 30.863 12.575 1.00 0.00 O ATOM 1422 CB PRO B 205 2.862 28.069 13.704 1.00 0.00 C ATOM 1423 CG PRO B 205 2.402 27.252 14.870 1.00 0.00 C ATOM 1424 CD PRO B 205 2.899 27.981 16.095 1.00 0.00 C ATOM 0 HA PRO B 205 3.615 30.162 13.840 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.222 27.915 12.835 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.875 27.798 13.405 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.316 27.161 14.881 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.806 26.241 14.824 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.275 27.778 16.965 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.915 27.685 16.356 1.00 0.00 H new ATOM 1432 N VAL B 206 0.450 30.299 14.442 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.833 30.871 13.986 1.00 0.00 C ATOM 1434 C VAL B 206 -0.829 32.423 14.072 1.00 0.00 C ATOM 1435 O VAL B 206 -1.111 33.104 13.076 1.00 0.00 O ATOM 1436 CB VAL B 206 -2.047 30.280 14.796 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.394 30.808 14.247 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -2.014 28.727 14.803 1.00 0.00 C ATOM 0 H VAL B 206 0.424 29.918 15.388 1.00 0.00 H new ATOM 0 HA VAL B 206 -0.952 30.590 12.940 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.954 30.618 15.828 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.214 30.383 14.826 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.418 31.895 14.327 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.499 30.518 13.201 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.864 28.348 15.370 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -2.066 28.357 13.779 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -1.088 28.385 15.265 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.503 32.981 15.263 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.545 34.457 15.491 1.00 0.00 C ATOM 1450 C CYS B 207 0.869 35.079 15.479 1.00 0.00 C ATOM 1451 O CYS B 207 1.001 36.303 15.538 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.282 34.802 16.810 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.380 34.389 18.336 1.00 0.00 S ATOM 0 H CYS B 207 -0.210 32.442 16.078 1.00 0.00 H new ATOM 0 HA CYS B 207 -1.106 34.892 14.663 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.502 35.870 16.815 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.238 34.279 16.820 1.00 0.00 H new ATOM 1458 N GLY B 208 1.907 34.220 15.413 1.00 0.00 N ATOM 1459 CA GLY B 208 3.306 34.653 15.250 1.00 0.00 C ATOM 1460 C GLY B 208 3.878 35.404 16.457 1.00 0.00 C ATOM 1461 O GLY B 208 4.424 36.503 16.303 1.00 0.00 O ATOM 0 H GLY B 208 1.797 33.208 15.471 1.00 0.00 H new ATOM 0 HA2 GLY B 208 3.925 33.777 15.055 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.376 35.294 14.371 1.00 0.00 H new ATOM 1465 N VAL B 209 3.736 34.820 17.664 1.00 0.00 N ATOM 1466 CA VAL B 209 4.299 35.392 18.919 1.00 0.00 C ATOM 1467 C VAL B 209 5.312 34.408 19.549 1.00 0.00 C ATOM 1468 O VAL B 209 5.072 33.195 19.554 1.00 0.00 O ATOM 1469 CB VAL B 209 3.166 35.758 19.964 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.163 36.775 19.372 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.427 34.505 20.480 1.00 0.00 C ATOM 0 H VAL B 209 3.232 33.944 17.804 1.00 0.00 H new ATOM 0 HA VAL B 209 4.812 36.317 18.656 1.00 0.00 H new ATOM 0 HB VAL B 209 3.662 36.222 20.817 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.398 37.006 20.114 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.690 37.689 19.098 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.693 36.348 18.486 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.659 34.804 21.194 1.00 0.00 H new ATOM 0 HG22 VAL B 209 1.961 33.986 19.642 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.138 33.839 20.969 1.00 0.00 H new ATOM 1481 N ASN B 210 6.446 34.927 20.066 1.00 0.00 N ATOM 1482 CA ASN B 210 7.448 34.100 20.766 1.00 0.00 C ATOM 1483 C ASN B 210 7.083 33.994 22.258 1.00 0.00 C ATOM 1484 O ASN B 210 6.923 35.013 22.942 1.00 0.00 O ATOM 1485 CB ASN B 210 8.881 34.652 20.589 1.00 0.00 C ATOM 1486 CG ASN B 210 9.932 33.760 21.264 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.319 33.978 22.409 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.354 32.714 20.579 1.00 0.00 N ATOM 0 H ASN B 210 6.689 35.916 20.011 1.00 0.00 H new ATOM 0 HA ASN B 210 7.435 33.105 20.320 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.107 34.737 19.526 1.00 0.00 H new ATOM 0 HB3 ASN B 210 8.936 35.657 21.008 1.00 0.00 H new ATOM 0 HD21 ASN B 210 11.018 32.063 20.999 1.00 0.00 H new ATOM 0 HD22 ASN B 210 10.017 32.556 19.629 1.00 0.00 H new ATOM 1495 N ILE B 211 6.974 32.749 22.738 1.00 0.00 N ATOM 1496 CA ILE B 211 6.426 32.393 24.066 1.00 0.00 C ATOM 1497 C ILE B 211 7.045 31.048 24.535 1.00 0.00 C ATOM 1498 O ILE B 211 7.512 30.270 23.700 1.00 0.00 O ATOM 1499 CB ILE B 211 4.849 32.246 23.994 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.459 31.369 22.761 1.00 0.00 C ATOM 1501 CG2 ILE B 211 4.125 33.623 23.972 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.979 31.230 22.523 1.00 0.00 C ATOM 0 H ILE B 211 7.271 31.933 22.203 1.00 0.00 H new ATOM 0 HA ILE B 211 6.675 33.185 24.772 1.00 0.00 H new ATOM 0 HB ILE B 211 4.514 31.747 24.903 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.917 31.798 21.870 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.886 30.375 22.892 1.00 0.00 H new ATOM 0 HG21 ILE B 211 3.047 33.467 23.922 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.370 34.177 24.878 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.450 34.191 23.100 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.809 30.604 21.647 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.512 30.770 23.394 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.543 32.215 22.356 1.00 0.00 H new ATOM 1514 N PRO B 212 7.077 30.748 25.873 1.00 0.00 N ATOM 1515 CA PRO B 212 7.511 29.423 26.381 1.00 0.00 C ATOM 1516 C PRO B 212 6.506 28.284 26.043 1.00 0.00 C ATOM 1517 O PRO B 212 5.359 28.532 25.674 1.00 0.00 O ATOM 1518 CB PRO B 212 7.667 29.646 27.901 1.00 0.00 C ATOM 1519 CG PRO B 212 6.751 30.791 28.217 1.00 0.00 C ATOM 1520 CD PRO B 212 6.758 31.681 26.990 1.00 0.00 C ATOM 0 HA PRO B 212 8.435 29.086 25.912 1.00 0.00 H new ATOM 0 HB2 PRO B 212 7.392 28.753 28.462 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.699 29.881 28.162 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.744 30.436 28.436 1.00 0.00 H new ATOM 0 HG3 PRO B 212 7.096 31.335 29.096 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.793 32.166 26.842 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.503 32.472 27.075 1.00 0.00 H new ATOM 1528 N GLU B 213 6.988 27.042 26.195 1.00 0.00 N ATOM 1529 CA GLU B 213 6.355 25.800 25.688 1.00 0.00 C ATOM 1530 C GLU B 213 4.928 25.517 26.239 1.00 0.00 C ATOM 1531 O GLU B 213 4.045 25.091 25.484 1.00 0.00 O ATOM 1532 CB GLU B 213 7.315 24.632 26.001 1.00 0.00 C ATOM 1533 CG GLU B 213 6.858 23.230 25.574 1.00 0.00 C ATOM 1534 CD GLU B 213 7.812 22.141 26.083 1.00 0.00 C ATOM 1535 OE1 GLU B 213 7.738 21.787 27.285 1.00 0.00 O ATOM 1536 OE2 GLU B 213 8.664 21.665 25.305 1.00 0.00 O ATOM 0 H GLU B 213 7.860 26.860 26.691 1.00 0.00 H new ATOM 0 HA GLU B 213 6.198 25.921 24.616 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.271 24.839 25.520 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.495 24.618 27.076 1.00 0.00 H new ATOM 0 HG2 GLU B 213 5.855 23.042 25.957 1.00 0.00 H new ATOM 0 HG3 GLU B 213 6.799 23.182 24.487 1.00 0.00 H new ATOM 1543 N SER B 214 4.690 25.729 27.543 1.00 0.00 N ATOM 1544 CA SER B 214 3.339 25.514 28.127 1.00 0.00 C ATOM 1545 C SER B 214 2.366 26.610 27.627 1.00 0.00 C ATOM 1546 O SER B 214 1.168 26.351 27.402 1.00 0.00 O ATOM 1547 CB SER B 214 3.398 25.481 29.675 1.00 0.00 C ATOM 1548 OG SER B 214 2.125 25.219 30.262 1.00 0.00 O ATOM 0 H SER B 214 5.395 26.043 28.210 1.00 0.00 H new ATOM 0 HA SER B 214 2.968 24.544 27.796 1.00 0.00 H new ATOM 0 HB2 SER B 214 4.106 24.716 29.993 1.00 0.00 H new ATOM 0 HB3 SER B 214 3.775 26.436 30.042 1.00 0.00 H new ATOM 0 HG SER B 214 2.211 25.206 31.238 1.00 0.00 H new ATOM 1554 N HIS B 215 2.913 27.828 27.421 1.00 0.00 N ATOM 1555 CA HIS B 215 2.150 28.975 26.888 1.00 0.00 C ATOM 1556 C HIS B 215 1.821 28.784 25.399 1.00 0.00 C ATOM 1557 O HIS B 215 0.806 29.297 24.932 1.00 0.00 O ATOM 1558 CB HIS B 215 2.916 30.313 27.107 1.00 0.00 C ATOM 1559 CG HIS B 215 2.918 30.796 28.532 1.00 0.00 C ATOM 1560 ND1 HIS B 215 2.648 32.100 28.875 1.00 0.00 N ATOM 1561 CD2 HIS B 215 3.178 30.155 29.699 1.00 0.00 C ATOM 1562 CE1 HIS B 215 2.739 32.239 30.175 1.00 0.00 C ATOM 1563 NE2 HIS B 215 3.059 31.076 30.701 1.00 0.00 N ATOM 0 H HIS B 215 3.891 28.042 27.619 1.00 0.00 H new ATOM 0 HA HIS B 215 1.212 29.024 27.440 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.947 30.187 26.776 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.470 31.081 26.475 1.00 0.00 H new ATOM 0 HD2 HIS B 215 3.432 29.112 29.814 1.00 0.00 H new ATOM 0 HE1 HIS B 215 2.578 33.155 30.723 1.00 0.00 H new ATOM 0 HE2 HIS B 215 3.196 30.892 31.695 1.00 0.00 H new ATOM 1572 N ILE B 216 2.686 28.050 24.662 1.00 0.00 N ATOM 1573 CA ILE B 216 2.470 27.769 23.224 1.00 0.00 C ATOM 1574 C ILE B 216 1.316 26.763 23.070 1.00 0.00 C ATOM 1575 O ILE B 216 0.505 26.890 22.155 1.00 0.00 O ATOM 1576 CB ILE B 216 3.808 27.286 22.491 1.00 0.00 C ATOM 1577 CG1 ILE B 216 3.926 27.858 21.033 1.00 0.00 C ATOM 1578 CG2 ILE B 216 3.975 25.742 22.461 1.00 0.00 C ATOM 1579 CD1 ILE B 216 2.960 27.280 20.019 1.00 0.00 C ATOM 0 H ILE B 216 3.541 27.641 25.040 1.00 0.00 H new ATOM 0 HA ILE B 216 2.189 28.696 22.724 1.00 0.00 H new ATOM 0 HB ILE B 216 4.617 27.692 23.097 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.779 28.937 21.073 1.00 0.00 H new ATOM 0 HG13 ILE B 216 4.942 27.688 20.677 1.00 0.00 H new ATOM 0 HG21 ILE B 216 4.903 25.486 21.949 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.006 25.359 23.481 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.134 25.295 21.931 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.130 27.746 19.048 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.118 26.205 19.938 1.00 0.00 H new ATOM 0 HD13 ILE B 216 1.937 27.473 20.340 1.00 0.00 H new ATOM 1591 N ASN B 217 1.243 25.797 24.009 1.00 0.00 N ATOM 1592 CA ASN B 217 0.158 24.804 24.064 1.00 0.00 C ATOM 1593 C ASN B 217 -1.212 25.510 24.173 1.00 0.00 C ATOM 1594 O ASN B 217 -2.107 25.290 23.337 1.00 0.00 O ATOM 1595 CB ASN B 217 0.392 23.829 25.259 1.00 0.00 C ATOM 1596 CG ASN B 217 -0.745 22.822 25.483 1.00 0.00 C ATOM 1597 OD1 ASN B 217 -1.488 22.487 24.567 1.00 0.00 O ATOM 1598 ND2 ASN B 217 -0.865 22.306 26.695 1.00 0.00 N ATOM 0 H ASN B 217 1.936 25.686 24.749 1.00 0.00 H new ATOM 0 HA ASN B 217 0.157 24.220 23.143 1.00 0.00 H new ATOM 0 HB2 ASN B 217 1.319 23.281 25.090 1.00 0.00 H new ATOM 0 HB3 ASN B 217 0.529 24.414 26.169 1.00 0.00 H new ATOM 0 HD21 ASN B 217 -1.588 21.612 26.885 1.00 0.00 H new ATOM 0 HD22 ASN B 217 -0.234 22.602 27.440 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.341 26.387 25.183 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.592 27.132 25.433 1.00 0.00 C ATOM 1607 C LYS B 218 -2.867 28.183 24.337 1.00 0.00 C ATOM 1608 O LYS B 218 -4.036 28.428 23.983 1.00 0.00 O ATOM 1609 CB LYS B 218 -2.560 27.786 26.844 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.839 28.582 27.245 1.00 0.00 C ATOM 1611 CD LYS B 218 -5.154 27.759 27.108 1.00 0.00 C ATOM 1612 CE LYS B 218 -5.175 26.474 27.958 1.00 0.00 C ATOM 1613 NZ LYS B 218 -5.053 26.760 29.409 1.00 0.00 N ATOM 0 H LYS B 218 -0.593 26.600 25.843 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.415 26.419 25.400 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -2.394 27.003 27.584 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.704 28.459 26.894 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -3.738 28.920 28.276 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -3.912 29.474 26.623 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -5.997 28.388 27.396 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -5.298 27.493 26.061 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -6.103 25.933 27.773 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -4.358 25.822 27.648 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -5.072 25.867 29.942 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -4.156 27.253 29.591 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -5.846 27.361 29.712 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.789 28.773 23.784 1.00 0.00 N ATOM 1628 CA HIS B 219 -1.914 29.805 22.739 1.00 0.00 C ATOM 1629 C HIS B 219 -2.616 29.229 21.522 1.00 0.00 C ATOM 1630 O HIS B 219 -3.538 29.836 21.012 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.540 30.427 22.332 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.470 31.917 22.563 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.726 32.836 21.560 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.207 32.592 23.717 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.622 34.021 22.133 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.310 33.918 23.427 1.00 0.00 N ATOM 0 H HIS B 219 -0.827 28.553 24.043 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.511 30.615 23.159 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.254 29.940 22.899 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.353 30.220 21.278 1.00 0.00 H new ATOM 0 HD2 HIS B 219 0.036 32.159 24.676 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.771 34.959 21.618 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.174 34.691 24.079 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.182 28.034 21.105 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.764 27.348 19.946 1.00 0.00 C ATOM 1646 C LEU B 220 -4.184 26.908 20.226 1.00 0.00 C ATOM 1647 O LEU B 220 -5.013 26.981 19.350 1.00 0.00 O ATOM 1648 CB LEU B 220 -1.944 26.123 19.563 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.485 26.409 19.185 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.232 25.106 18.872 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.378 27.439 18.037 1.00 0.00 C ATOM 0 H LEU B 220 -1.425 27.520 21.556 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.760 28.062 19.123 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -1.956 25.422 20.397 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.430 25.628 18.723 1.00 0.00 H new ATOM 0 HG LEU B 220 0.014 26.868 20.039 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.268 25.316 18.604 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.208 24.458 19.748 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.264 24.609 18.039 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.672 27.613 17.801 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.890 27.055 17.155 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.840 28.377 18.345 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.428 26.469 21.468 1.00 0.00 N ATOM 1664 CA ASP B 221 -5.747 25.979 21.905 1.00 0.00 C ATOM 1665 C ASP B 221 -6.836 27.051 21.662 1.00 0.00 C ATOM 1666 O ASP B 221 -7.986 26.732 21.350 1.00 0.00 O ATOM 1667 CB ASP B 221 -5.676 25.580 23.398 1.00 0.00 C ATOM 1668 CG ASP B 221 -6.892 24.774 23.879 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -6.967 23.565 23.558 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -7.764 25.335 24.581 1.00 0.00 O ATOM 0 H ASP B 221 -3.718 26.443 22.200 1.00 0.00 H new ATOM 0 HA ASP B 221 -6.019 25.101 21.320 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -4.773 24.993 23.566 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -5.587 26.483 24.003 1.00 0.00 H new ATOM 1675 N SER B 222 -6.421 28.324 21.779 1.00 0.00 N ATOM 1676 CA SER B 222 -7.271 29.490 21.498 1.00 0.00 C ATOM 1677 C SER B 222 -7.099 29.982 20.029 1.00 0.00 C ATOM 1678 O SER B 222 -8.069 30.394 19.393 1.00 0.00 O ATOM 1679 CB SER B 222 -6.916 30.613 22.496 1.00 0.00 C ATOM 1680 OG SER B 222 -7.759 31.748 22.339 1.00 0.00 O ATOM 0 H SER B 222 -5.477 28.573 22.074 1.00 0.00 H new ATOM 0 HA SER B 222 -8.316 29.206 21.617 1.00 0.00 H new ATOM 0 HB2 SER B 222 -7.003 30.234 23.514 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.877 30.910 22.354 1.00 0.00 H new ATOM 0 HG SER B 222 -7.505 32.436 22.988 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.861 29.905 19.495 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.490 30.508 18.190 1.00 0.00 C ATOM 1688 C CYS B 223 -5.973 29.673 16.987 1.00 0.00 C ATOM 1689 O CYS B 223 -6.155 30.220 15.895 1.00 0.00 O ATOM 1690 CB CYS B 223 -3.956 30.742 18.114 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.375 32.058 19.239 1.00 0.00 S ATOM 0 H CYS B 223 -5.088 29.423 19.954 1.00 0.00 H new ATOM 0 HA CYS B 223 -6.001 31.469 18.130 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.440 29.812 18.355 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.684 31.001 17.091 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.187 28.352 17.193 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.652 27.433 16.123 1.00 0.00 C ATOM 1698 C LEU B 224 -8.108 27.746 15.741 1.00 0.00 C ATOM 1699 O LEU B 224 -8.575 27.379 14.660 1.00 0.00 O ATOM 1700 CB LEU B 224 -6.450 25.932 16.541 1.00 0.00 C ATOM 1701 CG LEU B 224 -7.153 25.400 17.854 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -8.672 25.174 17.700 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -6.459 24.113 18.367 1.00 0.00 C ATOM 0 H LEU B 224 -6.045 27.896 18.094 1.00 0.00 H new ATOM 0 HA LEU B 224 -6.043 27.593 15.233 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -6.789 25.311 15.712 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -5.379 25.762 16.649 1.00 0.00 H new ATOM 0 HG LEU B 224 -7.040 26.192 18.594 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -9.083 24.809 18.641 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -9.155 26.114 17.433 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -8.853 24.439 16.916 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -6.959 23.765 19.271 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -6.515 23.340 17.601 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -5.414 24.328 18.591 1.00 0.00 H new ATOM 1715 N SER B 225 -8.800 28.414 16.678 1.00 0.00 N ATOM 1716 CA SER B 225 -10.162 28.903 16.505 1.00 0.00 C ATOM 1717 C SER B 225 -10.163 30.056 15.483 1.00 0.00 C ATOM 1718 O SER B 225 -9.601 31.125 15.736 1.00 0.00 O ATOM 1719 CB SER B 225 -10.711 29.362 17.876 1.00 0.00 C ATOM 1720 OG SER B 225 -10.515 28.357 18.867 1.00 0.00 O ATOM 0 H SER B 225 -8.411 28.630 17.596 1.00 0.00 H new ATOM 0 HA SER B 225 -10.807 28.112 16.124 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.212 30.282 18.182 1.00 0.00 H new ATOM 0 HB3 SER B 225 -11.773 29.589 17.789 1.00 0.00 H new ATOM 0 HG SER B 225 -10.868 28.671 19.725 1.00 0.00 H new ATOM 1726 N ARG B 226 -10.749 29.793 14.315 1.00 0.00 N ATOM 1727 CA ARG B 226 -10.845 30.752 13.200 1.00 0.00 C ATOM 1728 C ARG B 226 -12.193 30.551 12.478 1.00 0.00 C ATOM 1729 O ARG B 226 -12.291 30.664 11.250 1.00 0.00 O ATOM 1730 CB ARG B 226 -9.623 30.582 12.237 1.00 0.00 C ATOM 1731 CG ARG B 226 -9.315 29.119 11.839 1.00 0.00 C ATOM 1732 CD ARG B 226 -8.273 29.009 10.717 1.00 0.00 C ATOM 1733 NE ARG B 226 -8.809 29.535 9.442 1.00 0.00 N ATOM 1734 CZ ARG B 226 -8.318 30.574 8.743 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -7.229 31.222 9.144 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -8.932 30.958 7.638 1.00 0.00 N ATOM 0 H ARG B 226 -11.180 28.892 14.107 1.00 0.00 H new ATOM 0 HA ARG B 226 -10.813 31.775 13.576 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -9.808 31.160 11.331 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -8.740 31.009 12.713 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -8.956 28.578 12.715 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -10.237 28.633 11.520 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -7.375 29.562 10.994 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -7.979 27.967 10.590 1.00 0.00 H new ATOM 0 HE ARG B 226 -9.628 29.065 9.057 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -6.749 30.934 9.997 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -6.873 32.007 8.599 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -9.769 30.468 7.323 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -8.569 31.745 7.100 1.00 0.00 H new ATOM 1750 N GLU B 227 -13.238 30.266 13.279 1.00 0.00 N ATOM 1751 CA GLU B 227 -14.618 30.081 12.787 1.00 0.00 C ATOM 1752 C GLU B 227 -15.250 31.465 12.450 1.00 0.00 C ATOM 1753 O GLU B 227 -15.412 32.306 13.352 1.00 0.00 O ATOM 1754 CB GLU B 227 -15.503 29.244 13.788 1.00 0.00 C ATOM 1755 CG GLU B 227 -15.631 29.775 15.242 1.00 0.00 C ATOM 1756 CD GLU B 227 -14.399 29.519 16.136 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -14.265 28.395 16.666 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -13.568 30.436 16.316 1.00 0.00 O ATOM 1759 OXT GLU B 227 -15.551 31.726 11.274 1.00 0.00 O ATOM 0 H GLU B 227 -13.149 30.157 14.289 1.00 0.00 H new ATOM 0 HA GLU B 227 -14.579 29.493 11.870 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -16.506 29.167 13.368 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -15.097 28.233 13.833 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -15.820 30.848 15.207 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -16.502 29.313 15.707 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.056 32.472 19.500 1.00 0.00 ZN