USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1135 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 152:sc= 0 (180deg=-0.0479) USER MOD Single : A 2 ASN : amide:sc= -0.0497 X(o=-0.05,f=-0.14) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00164 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.319 K(o=-0.32,f=-2.7!) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.624 USER MOD Single : A 30 MET CE :methyl -176:sc= 0 (180deg=-0.0336) USER MOD Single : A 31 MET CE :methyl 175:sc= -2.84 (180deg=-3) USER MOD Single : A 32 ASN : amide:sc= -0.0103 X(o=-0.01,f=-0.51) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -153:sc= 1.15 (180deg=-0.562) USER MOD Single : A 38 MET CE :methyl -175:sc= -0.709 (180deg=-0.755) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -127:sc= -0.559 (180deg=-2.55) USER MOD Single : A 45 LYS NZ :NH3+ -121:sc= 0.904 (180deg=-1.14) USER MOD Single : A 46 SER OG : rot -22:sc= 0.126 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.00341 USER MOD Single : A 53 ASN : amide:sc= -0.175 X(o=-0.17,f=-0.18) USER MOD Single : A 54 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0153) USER MOD Single : A 55 GLN : amide:sc= -0.342 X(o=-0.34,f=-0.34) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.47 K(o=-1.5,f=-5!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 153:sc= -0.121 (180deg=-0.639) USER MOD Single : A 76 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0807) USER MOD Single : A 80 THR OG1 : rot 120:sc= -0.297 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -1.99! USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -2.95 X(o=-3,f=-3.3) USER MOD Single : A 100 SER OG : rot -159:sc= 0.613 USER MOD Single : A 103 LYS NZ :NH3+ -158:sc= -0.0587 (180deg=-0.453) USER MOD Single : A 107 CYS SG : rot 75:sc= -0.477 USER MOD Single : A 110 HIS :FLIP no HE2:sc= -0.276 F(o=-1.2,f=-0.28) USER MOD Single : A 119 CYS SG : rot 137:sc= -2.98! USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0849 USER MOD Single : A 125 TYR OH : rot 88:sc= 0.3 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.668 -2.113 -5.187 1.00 4.34 N ATOM 2 CA MET A 1 0.230 -1.356 -6.052 1.00 31.01 C ATOM 3 C MET A 1 1.370 -0.740 -5.247 1.00 62.42 C ATOM 4 O MET A 1 1.717 0.424 -5.436 1.00 42.55 O ATOM 5 CB MET A 1 -0.541 -0.258 -6.787 1.00 73.55 C ATOM 6 CG MET A 1 -1.354 -0.772 -7.965 1.00 45.45 C ATOM 7 SD MET A 1 -2.717 0.325 -8.399 1.00 52.44 S ATOM 8 CE MET A 1 -4.112 -0.786 -8.235 1.00 23.44 C ATOM 0 H1 MET A 1 -1.624 -2.117 -5.597 1.00 4.34 H new ATOM 0 H2 MET A 1 -0.324 -3.091 -5.100 1.00 4.34 H new ATOM 0 H3 MET A 1 -0.698 -1.671 -4.246 1.00 4.34 H new ATOM 0 HA MET A 1 0.655 -2.044 -6.783 1.00 31.01 H new ATOM 0 HB2 MET A 1 -1.209 0.239 -6.084 1.00 73.55 H new ATOM 0 HB3 MET A 1 0.164 0.494 -7.142 1.00 73.55 H new ATOM 0 HG2 MET A 1 -0.700 -0.891 -8.829 1.00 45.45 H new ATOM 0 HG3 MET A 1 -1.749 -1.759 -7.726 1.00 45.45 H new ATOM 0 HE1 MET A 1 -5.032 -0.252 -8.472 1.00 23.44 H new ATOM 0 HE2 MET A 1 -3.992 -1.624 -8.921 1.00 23.44 H new ATOM 0 HE3 MET A 1 -4.162 -1.159 -7.212 1.00 23.44 H new ATOM 18 N ASN A 2 1.949 -1.531 -4.349 1.00 14.23 N ATOM 19 CA ASN A 2 3.049 -1.062 -3.515 1.00 23.44 C ATOM 20 C ASN A 2 4.268 -1.969 -3.662 1.00 52.44 C ATOM 21 O ASN A 2 4.146 -3.194 -3.664 1.00 44.23 O ATOM 22 CB ASN A 2 2.617 -1.006 -2.048 1.00 50.50 C ATOM 23 CG ASN A 2 1.949 -2.288 -1.592 1.00 72.31 C ATOM 24 OD1 ASN A 2 2.605 -3.193 -1.076 1.00 74.52 O ATOM 25 ND2 ASN A 2 0.637 -2.371 -1.781 1.00 60.43 N ATOM 0 H ASN A 2 1.675 -2.499 -4.181 1.00 14.23 H new ATOM 0 HA ASN A 2 3.321 -0.060 -3.846 1.00 23.44 H new ATOM 0 HB2 ASN A 2 3.488 -0.812 -1.423 1.00 50.50 H new ATOM 0 HB3 ASN A 2 1.930 -0.172 -1.906 1.00 50.50 H new ATOM 0 HD21 ASN A 2 0.133 -3.210 -1.494 1.00 60.43 H new ATOM 0 HD22 ASN A 2 0.134 -1.596 -2.213 1.00 60.43 H new ATOM 32 N ASP A 3 5.441 -1.358 -3.785 1.00 51.34 N ATOM 33 CA ASP A 3 6.682 -2.109 -3.932 1.00 44.21 C ATOM 34 C ASP A 3 7.430 -2.187 -2.605 1.00 31.54 C ATOM 35 O ASP A 3 8.046 -1.214 -2.170 1.00 25.32 O ATOM 36 CB ASP A 3 7.572 -1.462 -4.995 1.00 20.20 C ATOM 37 CG ASP A 3 7.779 0.020 -4.753 1.00 52.14 C ATOM 38 OD1 ASP A 3 6.824 0.795 -4.971 1.00 2.00 O ATOM 39 OD2 ASP A 3 8.895 0.405 -4.348 1.00 4.45 O ATOM 0 H ASP A 3 5.558 -0.345 -3.786 1.00 51.34 H new ATOM 0 HA ASP A 3 6.430 -3.122 -4.247 1.00 44.21 H new ATOM 0 HB2 ASP A 3 8.540 -1.964 -5.009 1.00 20.20 H new ATOM 0 HB3 ASP A 3 7.124 -1.608 -5.978 1.00 20.20 H new ATOM 44 N ILE A 4 7.369 -3.351 -1.966 1.00 4.25 N ATOM 45 CA ILE A 4 8.041 -3.556 -0.688 1.00 14.20 C ATOM 46 C ILE A 4 9.098 -4.650 -0.792 1.00 34.14 C ATOM 47 O ILE A 4 9.012 -5.530 -1.648 1.00 23.51 O ATOM 48 CB ILE A 4 7.039 -3.929 0.421 1.00 52.32 C ATOM 49 CG1 ILE A 4 5.882 -4.745 -0.160 1.00 64.20 C ATOM 50 CG2 ILE A 4 6.517 -2.675 1.107 1.00 41.03 C ATOM 51 CD1 ILE A 4 6.321 -6.043 -0.800 1.00 62.53 C ATOM 0 H ILE A 4 6.862 -4.166 -2.312 1.00 4.25 H new ATOM 0 HA ILE A 4 8.522 -2.613 -0.429 1.00 14.20 H new ATOM 0 HB ILE A 4 7.553 -4.539 1.164 1.00 52.32 H new ATOM 0 HG12 ILE A 4 5.168 -4.964 0.634 1.00 64.20 H new ATOM 0 HG13 ILE A 4 5.359 -4.142 -0.902 1.00 64.20 H new ATOM 0 HG21 ILE A 4 5.810 -2.955 1.888 1.00 41.03 H new ATOM 0 HG22 ILE A 4 7.350 -2.129 1.550 1.00 41.03 H new ATOM 0 HG23 ILE A 4 6.016 -2.041 0.375 1.00 41.03 H new ATOM 0 HD11 ILE A 4 5.450 -6.569 -1.190 1.00 62.53 H new ATOM 0 HD12 ILE A 4 7.012 -5.831 -1.616 1.00 62.53 H new ATOM 0 HD13 ILE A 4 6.818 -6.666 -0.056 1.00 62.53 H new ATOM 63 N ARG A 5 10.093 -4.589 0.087 1.00 35.24 N ATOM 64 CA ARG A 5 11.166 -5.575 0.095 1.00 22.44 C ATOM 65 C ARG A 5 10.620 -6.972 0.379 1.00 51.34 C ATOM 66 O ARG A 5 9.643 -7.130 1.111 1.00 0.35 O ATOM 67 CB ARG A 5 12.219 -5.206 1.142 1.00 31.12 C ATOM 68 CG ARG A 5 13.193 -4.136 0.676 1.00 75.22 C ATOM 69 CD ARG A 5 12.492 -2.806 0.449 1.00 54.12 C ATOM 70 NE ARG A 5 11.746 -2.372 1.627 1.00 33.20 N ATOM 71 CZ ARG A 5 10.847 -1.394 1.609 1.00 71.31 C ATOM 72 NH1 ARG A 5 10.583 -0.752 0.479 1.00 24.41 N ATOM 73 NH2 ARG A 5 10.209 -1.057 2.723 1.00 70.15 N ATOM 0 H ARG A 5 10.178 -3.867 0.803 1.00 35.24 H new ATOM 0 HA ARG A 5 11.629 -5.578 -0.892 1.00 22.44 H new ATOM 0 HB2 ARG A 5 11.716 -4.859 2.044 1.00 31.12 H new ATOM 0 HB3 ARG A 5 12.778 -6.101 1.413 1.00 31.12 H new ATOM 0 HG2 ARG A 5 13.981 -4.011 1.419 1.00 75.22 H new ATOM 0 HG3 ARG A 5 13.674 -4.458 -0.248 1.00 75.22 H new ATOM 0 HD2 ARG A 5 13.230 -2.047 0.188 1.00 54.12 H new ATOM 0 HD3 ARG A 5 11.812 -2.895 -0.398 1.00 54.12 H new ATOM 0 HE ARG A 5 11.925 -2.846 2.512 1.00 33.20 H new ATOM 0 HH11 ARG A 5 11.071 -1.009 -0.379 1.00 24.41 H new ATOM 0 HH12 ARG A 5 9.892 -0.002 0.468 1.00 24.41 H new ATOM 0 HH21 ARG A 5 10.409 -1.549 3.594 1.00 70.15 H new ATOM 0 HH22 ARG A 5 9.519 -0.306 2.708 1.00 70.15 H new ATOM 87 N ILE A 6 11.256 -7.980 -0.207 1.00 61.33 N ATOM 88 CA ILE A 6 10.834 -9.363 -0.017 1.00 41.55 C ATOM 89 C ILE A 6 11.661 -10.046 1.066 1.00 11.24 C ATOM 90 O ILE A 6 11.162 -10.905 1.794 1.00 43.21 O ATOM 91 CB ILE A 6 10.951 -10.171 -1.323 1.00 30.21 C ATOM 92 CG1 ILE A 6 10.541 -9.311 -2.520 1.00 11.11 C ATOM 93 CG2 ILE A 6 10.094 -11.426 -1.247 1.00 51.02 C ATOM 94 CD1 ILE A 6 11.701 -8.595 -3.175 1.00 1.52 C ATOM 0 H ILE A 6 12.065 -7.866 -0.817 1.00 61.33 H new ATOM 0 HA ILE A 6 9.789 -9.335 0.291 1.00 41.55 H new ATOM 0 HB ILE A 6 11.990 -10.471 -1.455 1.00 30.21 H new ATOM 0 HG12 ILE A 6 10.050 -9.943 -3.260 1.00 11.11 H new ATOM 0 HG13 ILE A 6 9.807 -8.574 -2.193 1.00 11.11 H new ATOM 0 HG21 ILE A 6 10.187 -11.987 -2.177 1.00 51.02 H new ATOM 0 HG22 ILE A 6 10.429 -12.045 -0.415 1.00 51.02 H new ATOM 0 HG23 ILE A 6 9.052 -11.146 -1.095 1.00 51.02 H new ATOM 0 HD11 ILE A 6 11.336 -8.005 -4.016 1.00 1.52 H new ATOM 0 HD12 ILE A 6 12.179 -7.937 -2.449 1.00 1.52 H new ATOM 0 HD13 ILE A 6 12.425 -9.327 -3.533 1.00 1.52 H new ATOM 106 N VAL A 7 12.928 -9.657 1.170 1.00 71.10 N ATOM 107 CA VAL A 7 13.824 -10.230 2.167 1.00 2.32 C ATOM 108 C VAL A 7 14.919 -9.242 2.554 1.00 12.41 C ATOM 109 O VAL A 7 15.908 -9.064 1.844 1.00 44.34 O ATOM 110 CB VAL A 7 14.477 -11.528 1.656 1.00 52.20 C ATOM 111 CG1 VAL A 7 13.453 -12.651 1.591 1.00 11.31 C ATOM 112 CG2 VAL A 7 15.118 -11.301 0.295 1.00 5.15 C ATOM 0 H VAL A 7 13.357 -8.947 0.576 1.00 71.10 H new ATOM 0 HA VAL A 7 13.217 -10.458 3.043 1.00 2.32 H new ATOM 0 HB VAL A 7 15.259 -11.821 2.357 1.00 52.20 H new ATOM 0 HG11 VAL A 7 13.932 -13.560 1.228 1.00 11.31 H new ATOM 0 HG12 VAL A 7 13.044 -12.829 2.586 1.00 11.31 H new ATOM 0 HG13 VAL A 7 12.647 -12.370 0.913 1.00 11.31 H new ATOM 0 HG21 VAL A 7 15.575 -12.228 -0.051 1.00 5.15 H new ATOM 0 HG22 VAL A 7 14.357 -10.983 -0.417 1.00 5.15 H new ATOM 0 HG23 VAL A 7 15.883 -10.529 0.377 1.00 5.15 H new ATOM 122 N PRO A 8 14.740 -8.582 3.708 1.00 32.45 N ATOM 123 CA PRO A 8 15.703 -7.601 4.217 1.00 32.23 C ATOM 124 C PRO A 8 17.004 -8.250 4.676 1.00 20.23 C ATOM 125 O PRO A 8 17.061 -9.460 4.895 1.00 15.15 O ATOM 126 CB PRO A 8 14.972 -6.970 5.405 1.00 60.00 C ATOM 127 CG PRO A 8 14.003 -8.010 5.850 1.00 72.33 C ATOM 128 CD PRO A 8 13.584 -8.745 4.606 1.00 12.41 C ATOM 0 HA PRO A 8 15.998 -6.884 3.451 1.00 32.23 H new ATOM 0 HB2 PRO A 8 15.666 -6.709 6.203 1.00 60.00 H new ATOM 0 HB3 PRO A 8 14.461 -6.052 5.113 1.00 60.00 H new ATOM 0 HG2 PRO A 8 14.462 -8.689 6.569 1.00 72.33 H new ATOM 0 HG3 PRO A 8 13.143 -7.557 6.344 1.00 72.33 H new ATOM 0 HD2 PRO A 8 13.379 -9.796 4.810 1.00 12.41 H new ATOM 0 HD3 PRO A 8 12.677 -8.321 4.175 1.00 12.41 H new ATOM 136 N GLN A 9 18.046 -7.438 4.820 1.00 65.32 N ATOM 137 CA GLN A 9 19.347 -7.935 5.253 1.00 61.12 C ATOM 138 C GLN A 9 19.226 -8.709 6.561 1.00 21.32 C ATOM 139 O GLN A 9 18.190 -8.667 7.225 1.00 75.54 O ATOM 140 CB GLN A 9 20.329 -6.775 5.422 1.00 3.30 C ATOM 141 CG GLN A 9 19.945 -5.810 6.532 1.00 43.40 C ATOM 142 CD GLN A 9 21.092 -4.907 6.943 1.00 31.24 C ATOM 143 OE1 GLN A 9 21.516 -4.037 6.183 1.00 40.15 O ATOM 144 NE2 GLN A 9 21.601 -5.110 8.153 1.00 34.21 N ATOM 0 H GLN A 9 18.015 -6.434 4.643 1.00 65.32 H new ATOM 0 HA GLN A 9 19.723 -8.611 4.485 1.00 61.12 H new ATOM 0 HB2 GLN A 9 21.321 -7.177 5.628 1.00 3.30 H new ATOM 0 HB3 GLN A 9 20.396 -6.227 4.482 1.00 3.30 H new ATOM 0 HG2 GLN A 9 19.106 -5.198 6.202 1.00 43.40 H new ATOM 0 HG3 GLN A 9 19.605 -6.376 7.399 1.00 43.40 H new ATOM 0 HE21 GLN A 9 21.219 -5.843 8.751 1.00 34.21 H new ATOM 0 HE22 GLN A 9 22.374 -4.533 8.484 1.00 34.21 H new ATOM 153 N ILE A 10 20.291 -9.415 6.926 1.00 62.01 N ATOM 154 CA ILE A 10 20.304 -10.198 8.155 1.00 13.14 C ATOM 155 C ILE A 10 21.422 -9.742 9.086 1.00 1.32 C ATOM 156 O ILE A 10 22.584 -9.661 8.687 1.00 63.24 O ATOM 157 CB ILE A 10 20.474 -11.701 7.864 1.00 3.42 C ATOM 158 CG1 ILE A 10 21.626 -11.925 6.882 1.00 3.45 C ATOM 159 CG2 ILE A 10 19.181 -12.284 7.314 1.00 43.41 C ATOM 160 CD1 ILE A 10 21.978 -13.383 6.686 1.00 53.43 C ATOM 0 H ILE A 10 21.156 -9.461 6.388 1.00 62.01 H new ATOM 0 HA ILE A 10 19.342 -10.037 8.641 1.00 13.14 H new ATOM 0 HB ILE A 10 20.712 -12.212 8.797 1.00 3.42 H new ATOM 0 HG12 ILE A 10 21.361 -11.491 5.918 1.00 3.45 H new ATOM 0 HG13 ILE A 10 22.507 -11.392 7.240 1.00 3.45 H new ATOM 0 HG21 ILE A 10 19.317 -13.347 7.113 1.00 43.41 H new ATOM 0 HG22 ILE A 10 18.383 -12.152 8.044 1.00 43.41 H new ATOM 0 HG23 ILE A 10 18.915 -11.772 6.389 1.00 43.41 H new ATOM 0 HD11 ILE A 10 22.802 -13.466 5.978 1.00 53.43 H new ATOM 0 HD12 ILE A 10 22.275 -13.817 7.641 1.00 53.43 H new ATOM 0 HD13 ILE A 10 21.111 -13.918 6.298 1.00 53.43 H new ATOM 172 N THR A 11 21.064 -9.445 10.332 1.00 62.32 N ATOM 173 CA THR A 11 22.037 -8.998 11.321 1.00 51.14 C ATOM 174 C THR A 11 22.521 -10.160 12.181 1.00 51.25 C ATOM 175 O THR A 11 22.213 -11.319 11.904 1.00 21.42 O ATOM 176 CB THR A 11 21.447 -7.908 12.235 1.00 3.14 C ATOM 177 OG1 THR A 11 20.225 -7.410 11.680 1.00 60.24 O ATOM 178 CG2 THR A 11 22.432 -6.762 12.416 1.00 73.21 C ATOM 0 H THR A 11 20.107 -9.506 10.680 1.00 62.32 H new ATOM 0 HA THR A 11 22.881 -8.583 10.770 1.00 51.14 H new ATOM 0 HB THR A 11 21.247 -8.352 13.210 1.00 3.14 H new ATOM 0 HG1 THR A 11 19.856 -6.719 12.269 1.00 60.24 H new ATOM 0 HG21 THR A 11 21.993 -6.004 13.065 1.00 73.21 H new ATOM 0 HG22 THR A 11 23.350 -7.139 12.867 1.00 73.21 H new ATOM 0 HG23 THR A 11 22.659 -6.321 11.446 1.00 73.21 H new ATOM 186 N ASP A 12 23.279 -9.842 13.224 1.00 41.32 N ATOM 187 CA ASP A 12 23.805 -10.860 14.126 1.00 54.10 C ATOM 188 C ASP A 12 22.672 -11.662 14.759 1.00 13.32 C ATOM 189 O ASP A 12 22.880 -12.776 15.237 1.00 31.32 O ATOM 190 CB ASP A 12 24.660 -10.213 15.217 1.00 71.24 C ATOM 191 CG ASP A 12 26.124 -10.590 15.104 1.00 70.12 C ATOM 192 OD1 ASP A 12 26.480 -11.713 15.516 1.00 64.51 O ATOM 193 OD2 ASP A 12 26.914 -9.761 14.604 1.00 34.21 O ATOM 0 H ASP A 12 23.543 -8.887 13.466 1.00 41.32 H new ATOM 0 HA ASP A 12 24.427 -11.540 13.544 1.00 54.10 H new ATOM 0 HB2 ASP A 12 24.561 -9.129 15.157 1.00 71.24 H new ATOM 0 HB3 ASP A 12 24.285 -10.514 16.195 1.00 71.24 H new ATOM 198 N GLU A 13 21.474 -11.085 14.759 1.00 33.53 N ATOM 199 CA GLU A 13 20.309 -11.747 15.336 1.00 51.41 C ATOM 200 C GLU A 13 19.816 -12.870 14.428 1.00 22.14 C ATOM 201 O GLU A 13 19.244 -13.853 14.897 1.00 74.44 O ATOM 202 CB GLU A 13 19.185 -10.735 15.570 1.00 33.31 C ATOM 203 CG GLU A 13 19.646 -9.460 16.256 1.00 61.41 C ATOM 204 CD GLU A 13 18.495 -8.539 16.609 1.00 10.33 C ATOM 205 OE1 GLU A 13 17.996 -7.838 15.704 1.00 32.04 O ATOM 206 OE2 GLU A 13 18.093 -8.519 17.792 1.00 43.22 O ATOM 0 H GLU A 13 21.285 -10.163 14.367 1.00 33.53 H new ATOM 0 HA GLU A 13 20.604 -12.180 16.292 1.00 51.41 H new ATOM 0 HB2 GLU A 13 18.733 -10.479 14.612 1.00 33.31 H new ATOM 0 HB3 GLU A 13 18.407 -11.202 16.174 1.00 33.31 H new ATOM 0 HG2 GLU A 13 20.192 -9.717 17.164 1.00 61.41 H new ATOM 0 HG3 GLU A 13 20.342 -8.932 15.604 1.00 61.41 H new ATOM 213 N GLU A 14 20.043 -12.715 13.128 1.00 63.03 N ATOM 214 CA GLU A 14 19.621 -13.716 12.155 1.00 43.44 C ATOM 215 C GLU A 14 20.792 -14.605 11.746 1.00 43.44 C ATOM 216 O GLU A 14 20.670 -15.829 11.697 1.00 14.33 O ATOM 217 CB GLU A 14 19.025 -13.038 10.919 1.00 62.00 C ATOM 218 CG GLU A 14 17.766 -12.239 11.211 1.00 43.21 C ATOM 219 CD GLU A 14 16.564 -13.122 11.482 1.00 61.44 C ATOM 220 OE1 GLU A 14 16.628 -14.327 11.159 1.00 33.03 O ATOM 221 OE2 GLU A 14 15.559 -12.608 12.017 1.00 63.35 O ATOM 0 H GLU A 14 20.516 -11.907 12.724 1.00 63.03 H new ATOM 0 HA GLU A 14 18.859 -14.340 12.621 1.00 43.44 H new ATOM 0 HB2 GLU A 14 19.772 -12.376 10.482 1.00 62.00 H new ATOM 0 HB3 GLU A 14 18.798 -13.798 10.172 1.00 62.00 H new ATOM 0 HG2 GLU A 14 17.941 -11.595 12.073 1.00 43.21 H new ATOM 0 HG3 GLU A 14 17.550 -11.587 10.365 1.00 43.21 H new ATOM 228 N PHE A 15 21.927 -13.979 11.451 1.00 24.42 N ATOM 229 CA PHE A 15 23.121 -14.712 11.045 1.00 74.54 C ATOM 230 C PHE A 15 23.497 -15.761 12.088 1.00 51.43 C ATOM 231 O PHE A 15 23.989 -16.838 11.753 1.00 72.43 O ATOM 232 CB PHE A 15 24.289 -13.748 10.830 1.00 70.13 C ATOM 233 CG PHE A 15 25.625 -14.431 10.758 1.00 33.14 C ATOM 234 CD1 PHE A 15 26.357 -14.672 11.910 1.00 40.52 C ATOM 235 CD2 PHE A 15 26.148 -14.833 9.540 1.00 31.31 C ATOM 236 CE1 PHE A 15 27.587 -15.299 11.847 1.00 73.23 C ATOM 237 CE2 PHE A 15 27.377 -15.462 9.471 1.00 50.22 C ATOM 238 CZ PHE A 15 28.097 -15.696 10.626 1.00 52.10 C ATOM 0 H PHE A 15 22.045 -12.966 11.485 1.00 24.42 H new ATOM 0 HA PHE A 15 22.902 -15.221 10.106 1.00 74.54 H new ATOM 0 HB2 PHE A 15 24.125 -13.191 9.908 1.00 70.13 H new ATOM 0 HB3 PHE A 15 24.305 -13.022 11.643 1.00 70.13 H new ATOM 0 HD1 PHE A 15 25.962 -14.366 12.868 1.00 40.52 H new ATOM 0 HD2 PHE A 15 25.589 -14.653 8.634 1.00 31.31 H new ATOM 0 HE1 PHE A 15 28.149 -15.478 12.752 1.00 73.23 H new ATOM 0 HE2 PHE A 15 27.774 -15.770 8.515 1.00 50.22 H new ATOM 0 HZ PHE A 15 29.057 -16.188 10.575 1.00 52.10 H new ATOM 248 N LYS A 16 23.263 -15.436 13.355 1.00 75.33 N ATOM 249 CA LYS A 16 23.575 -16.348 14.449 1.00 42.02 C ATOM 250 C LYS A 16 22.613 -17.531 14.463 1.00 60.53 C ATOM 251 O LYS A 16 22.817 -18.503 15.192 1.00 13.31 O ATOM 252 CB LYS A 16 23.513 -15.610 15.788 1.00 34.43 C ATOM 253 CG LYS A 16 22.097 -15.337 16.267 1.00 61.43 C ATOM 254 CD LYS A 16 21.657 -16.349 17.312 1.00 2.52 C ATOM 255 CE LYS A 16 22.318 -16.084 18.656 1.00 24.22 C ATOM 256 NZ LYS A 16 21.339 -16.140 19.777 1.00 41.03 N ATOM 0 H LYS A 16 22.858 -14.547 13.650 1.00 75.33 H new ATOM 0 HA LYS A 16 24.586 -16.727 14.296 1.00 42.02 H new ATOM 0 HB2 LYS A 16 24.036 -16.198 16.542 1.00 34.43 H new ATOM 0 HB3 LYS A 16 24.046 -14.663 15.697 1.00 34.43 H new ATOM 0 HG2 LYS A 16 22.041 -14.332 16.686 1.00 61.43 H new ATOM 0 HG3 LYS A 16 21.413 -15.367 15.419 1.00 61.43 H new ATOM 0 HD2 LYS A 16 20.573 -16.310 17.424 1.00 2.52 H new ATOM 0 HD3 LYS A 16 21.907 -17.355 16.974 1.00 2.52 H new ATOM 0 HE2 LYS A 16 23.105 -16.819 18.825 1.00 24.22 H new ATOM 0 HE3 LYS A 16 22.795 -15.104 18.639 1.00 24.22 H new ATOM 0 HZ1 LYS A 16 21.829 -15.954 20.675 1.00 41.03 H new ATOM 0 HZ2 LYS A 16 20.601 -15.422 19.630 1.00 41.03 H new ATOM 0 HZ3 LYS A 16 20.902 -17.083 19.810 1.00 41.03 H new ATOM 270 N THR A 17 21.564 -17.445 13.651 1.00 71.24 N ATOM 271 CA THR A 17 20.571 -18.509 13.569 1.00 13.44 C ATOM 272 C THR A 17 21.080 -19.674 12.729 1.00 3.11 C ATOM 273 O THR A 17 20.398 -20.688 12.580 1.00 64.34 O ATOM 274 CB THR A 17 19.248 -17.997 12.969 1.00 72.14 C ATOM 275 OG1 THR A 17 18.142 -18.698 13.550 1.00 4.40 O ATOM 276 CG2 THR A 17 19.233 -18.180 11.458 1.00 31.15 C ATOM 0 H THR A 17 21.380 -16.649 13.040 1.00 71.24 H new ATOM 0 HA THR A 17 20.391 -18.852 14.588 1.00 13.44 H new ATOM 0 HB THR A 17 19.161 -16.934 13.192 1.00 72.14 H new ATOM 0 HG1 THR A 17 17.305 -18.365 13.164 1.00 4.40 H new ATOM 0 HG21 THR A 17 18.289 -17.811 11.056 1.00 31.15 H new ATOM 0 HG22 THR A 17 20.058 -17.622 11.016 1.00 31.15 H new ATOM 0 HG23 THR A 17 19.341 -19.238 11.219 1.00 31.15 H new ATOM 284 N ILE A 18 22.282 -19.523 12.183 1.00 3.44 N ATOM 285 CA ILE A 18 22.883 -20.564 11.360 1.00 63.14 C ATOM 286 C ILE A 18 24.123 -21.148 12.029 1.00 11.40 C ATOM 287 O ILE A 18 25.013 -20.426 12.481 1.00 74.43 O ATOM 288 CB ILE A 18 23.269 -20.029 9.968 1.00 1.41 C ATOM 289 CG1 ILE A 18 22.029 -19.512 9.235 1.00 65.45 C ATOM 290 CG2 ILE A 18 23.958 -21.114 9.155 1.00 24.32 C ATOM 291 CD1 ILE A 18 21.969 -18.004 9.138 1.00 70.01 C ATOM 0 H ILE A 18 22.859 -18.689 12.296 1.00 3.44 H new ATOM 0 HA ILE A 18 22.133 -21.346 11.245 1.00 63.14 H new ATOM 0 HB ILE A 18 23.966 -19.200 10.094 1.00 1.41 H new ATOM 0 HG12 ILE A 18 22.009 -19.934 8.230 1.00 65.45 H new ATOM 0 HG13 ILE A 18 21.137 -19.871 9.749 1.00 65.45 H new ATOM 0 HG21 ILE A 18 24.224 -20.720 8.174 1.00 24.32 H new ATOM 0 HG22 ILE A 18 24.860 -21.439 9.673 1.00 24.32 H new ATOM 0 HG23 ILE A 18 23.284 -21.962 9.034 1.00 24.32 H new ATOM 0 HD11 ILE A 18 21.064 -17.709 8.607 1.00 70.01 H new ATOM 0 HD12 ILE A 18 21.957 -17.575 10.140 1.00 70.01 H new ATOM 0 HD13 ILE A 18 22.842 -17.639 8.597 1.00 70.01 H new ATOM 303 N PRO A 19 24.186 -22.486 12.094 1.00 53.12 N ATOM 304 CA PRO A 19 25.313 -23.197 12.704 1.00 1.21 C ATOM 305 C PRO A 19 26.589 -23.079 11.877 1.00 32.10 C ATOM 306 O PRO A 19 26.540 -22.991 10.650 1.00 52.20 O ATOM 307 CB PRO A 19 24.835 -24.650 12.746 1.00 61.30 C ATOM 308 CG PRO A 19 23.833 -24.751 11.648 1.00 22.41 C ATOM 309 CD PRO A 19 23.161 -23.408 11.576 1.00 62.12 C ATOM 0 HA PRO A 19 25.570 -22.790 13.682 1.00 1.21 H new ATOM 0 HB2 PRO A 19 25.662 -25.343 12.592 1.00 61.30 H new ATOM 0 HB3 PRO A 19 24.391 -24.893 13.711 1.00 61.30 H new ATOM 0 HG2 PRO A 19 24.315 -24.998 10.702 1.00 22.41 H new ATOM 0 HG3 PRO A 19 23.109 -25.539 11.852 1.00 22.41 H new ATOM 0 HD2 PRO A 19 22.873 -23.157 10.555 1.00 62.12 H new ATOM 0 HD3 PRO A 19 22.253 -23.380 12.179 1.00 62.12 H new ATOM 317 N LYS A 20 27.731 -23.079 12.556 1.00 12.02 N ATOM 318 CA LYS A 20 29.021 -22.974 11.885 1.00 72.02 C ATOM 319 C LYS A 20 29.197 -24.096 10.866 1.00 12.50 C ATOM 320 O LYS A 20 29.972 -23.970 9.918 1.00 41.12 O ATOM 321 CB LYS A 20 30.157 -23.018 12.909 1.00 21.20 C ATOM 322 CG LYS A 20 30.150 -24.268 13.772 1.00 14.23 C ATOM 323 CD LYS A 20 31.072 -25.338 13.213 1.00 43.41 C ATOM 324 CE LYS A 20 32.469 -25.236 13.807 1.00 14.32 C ATOM 325 NZ LYS A 20 32.549 -25.879 15.148 1.00 62.33 N ATOM 0 H LYS A 20 27.789 -23.151 13.572 1.00 12.02 H new ATOM 0 HA LYS A 20 29.052 -22.020 11.358 1.00 72.02 H new ATOM 0 HB2 LYS A 20 31.110 -22.954 12.384 1.00 21.20 H new ATOM 0 HB3 LYS A 20 30.088 -22.141 13.553 1.00 21.20 H new ATOM 0 HG2 LYS A 20 30.460 -24.013 14.785 1.00 14.23 H new ATOM 0 HG3 LYS A 20 29.135 -24.660 13.838 1.00 14.23 H new ATOM 0 HD2 LYS A 20 30.657 -26.324 13.424 1.00 43.41 H new ATOM 0 HD3 LYS A 20 31.128 -25.241 12.129 1.00 43.41 H new ATOM 0 HE2 LYS A 20 33.185 -25.708 13.134 1.00 14.32 H new ATOM 0 HE3 LYS A 20 32.753 -24.187 13.890 1.00 14.32 H new ATOM 0 HZ1 LYS A 20 33.516 -25.789 15.519 1.00 62.33 H new ATOM 0 HZ2 LYS A 20 31.884 -25.412 15.797 1.00 62.33 H new ATOM 0 HZ3 LYS A 20 32.303 -26.886 15.065 1.00 62.33 H new ATOM 339 N TYR A 21 28.472 -25.190 11.067 1.00 32.21 N ATOM 340 CA TYR A 21 28.549 -26.334 10.166 1.00 32.13 C ATOM 341 C TYR A 21 28.066 -25.960 8.768 1.00 35.23 C ATOM 342 O TYR A 21 28.440 -26.593 7.781 1.00 1.53 O ATOM 343 CB TYR A 21 27.717 -27.496 10.712 1.00 70.24 C ATOM 344 CG TYR A 21 28.224 -28.038 12.029 1.00 13.43 C ATOM 345 CD1 TYR A 21 29.276 -28.944 12.072 1.00 60.14 C ATOM 346 CD2 TYR A 21 27.650 -27.644 13.232 1.00 51.33 C ATOM 347 CE1 TYR A 21 29.742 -29.442 13.273 1.00 30.01 C ATOM 348 CE2 TYR A 21 28.110 -28.135 14.438 1.00 63.22 C ATOM 349 CZ TYR A 21 29.156 -29.034 14.453 1.00 22.23 C ATOM 350 OH TYR A 21 29.617 -29.527 15.653 1.00 72.23 O ATOM 0 H TYR A 21 27.824 -25.309 11.846 1.00 32.21 H new ATOM 0 HA TYR A 21 29.592 -26.643 10.099 1.00 32.13 H new ATOM 0 HB2 TYR A 21 26.686 -27.166 10.838 1.00 70.24 H new ATOM 0 HB3 TYR A 21 27.707 -28.301 9.977 1.00 70.24 H new ATOM 0 HD1 TYR A 21 29.738 -29.265 11.150 1.00 60.14 H new ATOM 0 HD2 TYR A 21 26.830 -26.941 13.223 1.00 51.33 H new ATOM 0 HE1 TYR A 21 30.560 -30.147 13.288 1.00 30.01 H new ATOM 0 HE2 TYR A 21 27.654 -27.817 15.364 1.00 63.22 H new ATOM 0 HH TYR A 21 29.097 -29.139 16.388 1.00 72.23 H new ATOM 360 N GLN A 22 27.232 -24.928 8.694 1.00 1.51 N ATOM 361 CA GLN A 22 26.697 -24.469 7.418 1.00 41.44 C ATOM 362 C GLN A 22 27.487 -23.273 6.895 1.00 71.34 C ATOM 363 O GLN A 22 27.717 -23.146 5.691 1.00 21.42 O ATOM 364 CB GLN A 22 25.221 -24.095 7.564 1.00 20.00 C ATOM 365 CG GLN A 22 24.366 -25.210 8.144 1.00 31.01 C ATOM 366 CD GLN A 22 23.940 -26.223 7.099 1.00 3.25 C ATOM 367 OE1 GLN A 22 24.052 -25.977 5.898 1.00 23.21 O ATOM 368 NE2 GLN A 22 23.448 -27.370 7.553 1.00 65.04 N ATOM 0 H GLN A 22 26.912 -24.394 9.502 1.00 1.51 H new ATOM 0 HA GLN A 22 26.789 -25.284 6.700 1.00 41.44 H new ATOM 0 HB2 GLN A 22 25.139 -23.216 8.203 1.00 20.00 H new ATOM 0 HB3 GLN A 22 24.827 -23.817 6.587 1.00 20.00 H new ATOM 0 HG2 GLN A 22 24.923 -25.718 8.931 1.00 31.01 H new ATOM 0 HG3 GLN A 22 23.480 -24.779 8.609 1.00 31.01 H new ATOM 0 HE21 GLN A 22 23.373 -27.531 8.557 1.00 65.04 H new ATOM 0 HE22 GLN A 22 23.145 -28.090 6.897 1.00 65.04 H new ATOM 377 N LEU A 23 27.899 -22.399 7.806 1.00 42.35 N ATOM 378 CA LEU A 23 28.664 -21.212 7.436 1.00 34.32 C ATOM 379 C LEU A 23 30.056 -21.593 6.943 1.00 31.23 C ATOM 380 O LEU A 23 30.500 -21.135 5.892 1.00 61.15 O ATOM 381 CB LEU A 23 28.775 -20.261 8.629 1.00 31.43 C ATOM 382 CG LEU A 23 27.489 -20.027 9.423 1.00 40.22 C ATOM 383 CD1 LEU A 23 27.791 -19.307 10.728 1.00 21.31 C ATOM 384 CD2 LEU A 23 26.488 -19.235 8.594 1.00 1.33 C ATOM 0 H LEU A 23 27.717 -22.489 8.806 1.00 42.35 H new ATOM 0 HA LEU A 23 28.137 -20.708 6.625 1.00 34.32 H new ATOM 0 HB2 LEU A 23 29.532 -20.650 9.309 1.00 31.43 H new ATOM 0 HB3 LEU A 23 29.136 -19.298 8.268 1.00 31.43 H new ATOM 0 HG LEU A 23 27.049 -20.996 9.660 1.00 40.22 H new ATOM 0 HD11 LEU A 23 26.864 -19.149 11.279 1.00 21.31 H new ATOM 0 HD12 LEU A 23 28.472 -19.911 11.328 1.00 21.31 H new ATOM 0 HD13 LEU A 23 28.254 -18.344 10.513 1.00 21.31 H new ATOM 0 HD21 LEU A 23 25.579 -19.078 9.174 1.00 1.33 H new ATOM 0 HD22 LEU A 23 26.919 -18.270 8.327 1.00 1.33 H new ATOM 0 HD23 LEU A 23 26.248 -19.789 7.687 1.00 1.33 H new ATOM 396 N GLY A 24 30.740 -22.437 7.711 1.00 53.14 N ATOM 397 CA GLY A 24 32.074 -22.867 7.334 1.00 34.05 C ATOM 398 C GLY A 24 33.090 -21.746 7.420 1.00 50.33 C ATOM 399 O GLY A 24 33.771 -21.592 8.434 1.00 53.21 O ATOM 0 H GLY A 24 30.394 -22.830 8.586 1.00 53.14 H new ATOM 0 HA2 GLY A 24 32.385 -23.686 7.983 1.00 34.05 H new ATOM 0 HA3 GLY A 24 32.053 -23.257 6.316 1.00 34.05 H new ATOM 403 N ARG A 25 33.194 -20.961 6.352 1.00 65.41 N ATOM 404 CA ARG A 25 34.137 -19.850 6.309 1.00 25.34 C ATOM 405 C ARG A 25 33.433 -18.554 5.920 1.00 61.01 C ATOM 406 O ARG A 25 34.071 -17.595 5.484 1.00 2.31 O ATOM 407 CB ARG A 25 35.265 -20.148 5.319 1.00 31.12 C ATOM 408 CG ARG A 25 34.778 -20.419 3.905 1.00 33.42 C ATOM 409 CD ARG A 25 35.822 -21.166 3.090 1.00 32.40 C ATOM 410 NE ARG A 25 36.883 -20.281 2.617 1.00 72.41 N ATOM 411 CZ ARG A 25 38.028 -20.716 2.103 1.00 30.32 C ATOM 412 NH1 ARG A 25 38.259 -22.018 1.997 1.00 52.44 N ATOM 413 NH2 ARG A 25 38.945 -19.849 1.694 1.00 0.24 N ATOM 0 H ARG A 25 32.637 -21.074 5.505 1.00 65.41 H new ATOM 0 HA ARG A 25 34.561 -19.728 7.306 1.00 25.34 H new ATOM 0 HB2 ARG A 25 35.954 -19.304 5.301 1.00 31.12 H new ATOM 0 HB3 ARG A 25 35.828 -21.012 5.672 1.00 31.12 H new ATOM 0 HG2 ARG A 25 33.858 -21.002 3.941 1.00 33.42 H new ATOM 0 HG3 ARG A 25 34.538 -19.476 3.414 1.00 33.42 H new ATOM 0 HD2 ARG A 25 36.256 -21.960 3.698 1.00 32.40 H new ATOM 0 HD3 ARG A 25 35.341 -21.644 2.237 1.00 32.40 H new ATOM 0 HE ARG A 25 36.737 -19.274 2.685 1.00 72.41 H new ATOM 0 HH11 ARG A 25 37.557 -22.688 2.311 1.00 52.44 H new ATOM 0 HH12 ARG A 25 39.139 -22.349 1.602 1.00 52.44 H new ATOM 0 HH21 ARG A 25 38.771 -18.847 1.774 1.00 0.24 H new ATOM 0 HH22 ARG A 25 39.824 -20.184 1.300 1.00 0.24 H new ATOM 427 N LEU A 26 32.114 -18.533 6.079 1.00 4.41 N ATOM 428 CA LEU A 26 31.322 -17.354 5.744 1.00 63.32 C ATOM 429 C LEU A 26 31.271 -16.381 6.917 1.00 40.31 C ATOM 430 O LEU A 26 31.767 -16.675 8.005 1.00 62.10 O ATOM 431 CB LEU A 26 29.904 -17.766 5.345 1.00 11.52 C ATOM 432 CG LEU A 26 29.625 -17.844 3.844 1.00 53.12 C ATOM 433 CD1 LEU A 26 29.201 -19.251 3.452 1.00 23.14 C ATOM 434 CD2 LEU A 26 28.558 -16.834 3.446 1.00 30.03 C ATOM 0 H LEU A 26 31.571 -19.318 6.438 1.00 4.41 H new ATOM 0 HA LEU A 26 31.799 -16.853 4.902 1.00 63.32 H new ATOM 0 HB2 LEU A 26 29.693 -18.741 5.785 1.00 11.52 H new ATOM 0 HB3 LEU A 26 29.203 -17.058 5.788 1.00 11.52 H new ATOM 0 HG LEU A 26 30.544 -17.601 3.311 1.00 53.12 H new ATOM 0 HD11 LEU A 26 29.007 -19.287 2.380 1.00 23.14 H new ATOM 0 HD12 LEU A 26 29.997 -19.953 3.700 1.00 23.14 H new ATOM 0 HD13 LEU A 26 28.295 -19.522 3.994 1.00 23.14 H new ATOM 0 HD21 LEU A 26 28.373 -16.904 2.374 1.00 30.03 H new ATOM 0 HD22 LEU A 26 27.636 -17.046 3.988 1.00 30.03 H new ATOM 0 HD23 LEU A 26 28.900 -15.828 3.690 1.00 30.03 H new ATOM 446 N THR A 27 30.665 -15.219 6.690 1.00 64.35 N ATOM 447 CA THR A 27 30.548 -14.203 7.727 1.00 12.41 C ATOM 448 C THR A 27 29.315 -13.334 7.508 1.00 14.33 C ATOM 449 O THR A 27 28.746 -13.308 6.416 1.00 45.04 O ATOM 450 CB THR A 27 31.796 -13.301 7.774 1.00 54.43 C ATOM 451 OG1 THR A 27 32.318 -13.119 6.453 1.00 2.31 O ATOM 452 CG2 THR A 27 32.867 -13.904 8.670 1.00 75.33 C ATOM 0 H THR A 27 30.248 -14.959 5.796 1.00 64.35 H new ATOM 0 HA THR A 27 30.454 -14.730 8.676 1.00 12.41 H new ATOM 0 HB THR A 27 31.504 -12.335 8.185 1.00 54.43 H new ATOM 0 HG1 THR A 27 33.110 -12.543 6.491 1.00 2.31 H new ATOM 0 HG21 THR A 27 33.738 -13.249 8.687 1.00 75.33 H new ATOM 0 HG22 THR A 27 32.476 -14.014 9.681 1.00 75.33 H new ATOM 0 HG23 THR A 27 33.156 -14.882 8.284 1.00 75.33 H new ATOM 460 N LEU A 28 28.905 -12.622 8.553 1.00 60.42 N ATOM 461 CA LEU A 28 27.738 -11.750 8.474 1.00 21.45 C ATOM 462 C LEU A 28 27.838 -10.814 7.275 1.00 51.32 C ATOM 463 O LEU A 28 26.853 -10.578 6.576 1.00 32.40 O ATOM 464 CB LEU A 28 27.598 -10.936 9.762 1.00 42.13 C ATOM 465 CG LEU A 28 26.206 -10.912 10.393 1.00 54.23 C ATOM 466 CD1 LEU A 28 26.297 -11.123 11.896 1.00 70.11 C ATOM 467 CD2 LEU A 28 25.500 -9.600 10.078 1.00 24.45 C ATOM 0 H LEU A 28 29.363 -12.632 9.464 1.00 60.42 H new ATOM 0 HA LEU A 28 26.854 -12.376 8.349 1.00 21.45 H new ATOM 0 HB2 LEU A 28 28.301 -11.331 10.496 1.00 42.13 H new ATOM 0 HB3 LEU A 28 27.898 -9.909 9.553 1.00 42.13 H new ATOM 0 HG LEU A 28 25.621 -11.728 9.968 1.00 54.23 H new ATOM 0 HD11 LEU A 28 25.296 -11.103 12.328 1.00 70.11 H new ATOM 0 HD12 LEU A 28 26.761 -12.088 12.101 1.00 70.11 H new ATOM 0 HD13 LEU A 28 26.899 -10.330 12.339 1.00 70.11 H new ATOM 0 HD21 LEU A 28 24.510 -9.600 10.535 1.00 24.45 H new ATOM 0 HD22 LEU A 28 26.083 -8.769 10.475 1.00 24.45 H new ATOM 0 HD23 LEU A 28 25.401 -9.490 8.998 1.00 24.45 H new ATOM 479 N GLU A 29 29.035 -10.284 7.042 1.00 72.22 N ATOM 480 CA GLU A 29 29.263 -9.374 5.925 1.00 34.32 C ATOM 481 C GLU A 29 28.956 -10.057 4.596 1.00 70.45 C ATOM 482 O GLU A 29 28.322 -9.473 3.717 1.00 4.12 O ATOM 483 CB GLU A 29 30.709 -8.874 5.933 1.00 73.32 C ATOM 484 CG GLU A 29 31.050 -7.981 4.752 1.00 61.53 C ATOM 485 CD GLU A 29 31.412 -6.570 5.172 1.00 30.35 C ATOM 486 OE1 GLU A 29 30.574 -5.913 5.825 1.00 31.30 O ATOM 487 OE2 GLU A 29 32.532 -6.123 4.849 1.00 21.04 O ATOM 0 H GLU A 29 29.861 -10.469 7.611 1.00 72.22 H new ATOM 0 HA GLU A 29 28.592 -8.523 6.040 1.00 34.32 H new ATOM 0 HB2 GLU A 29 30.890 -8.325 6.857 1.00 73.32 H new ATOM 0 HB3 GLU A 29 31.381 -9.732 5.935 1.00 73.32 H new ATOM 0 HG2 GLU A 29 31.883 -8.417 4.201 1.00 61.53 H new ATOM 0 HG3 GLU A 29 30.200 -7.946 4.070 1.00 61.53 H new ATOM 494 N MET A 30 29.411 -11.298 4.456 1.00 60.23 N ATOM 495 CA MET A 30 29.185 -12.061 3.234 1.00 60.42 C ATOM 496 C MET A 30 27.693 -12.248 2.977 1.00 10.13 C ATOM 497 O MET A 30 27.223 -12.087 1.852 1.00 54.14 O ATOM 498 CB MET A 30 29.873 -13.425 3.324 1.00 2.21 C ATOM 499 CG MET A 30 31.390 -13.345 3.266 1.00 20.01 C ATOM 500 SD MET A 30 32.156 -14.938 2.908 1.00 2.53 S ATOM 501 CE MET A 30 33.821 -14.426 2.490 1.00 51.13 C ATOM 0 H MET A 30 29.938 -11.796 5.173 1.00 60.23 H new ATOM 0 HA MET A 30 29.612 -11.501 2.402 1.00 60.42 H new ATOM 0 HB2 MET A 30 29.578 -13.911 4.254 1.00 2.21 H new ATOM 0 HB3 MET A 30 29.519 -14.056 2.509 1.00 2.21 H new ATOM 0 HG2 MET A 30 31.683 -12.625 2.502 1.00 20.01 H new ATOM 0 HG3 MET A 30 31.767 -12.971 4.218 1.00 20.01 H new ATOM 0 HE1 MET A 30 34.400 -15.294 2.175 1.00 51.13 H new ATOM 0 HE2 MET A 30 33.785 -13.699 1.678 1.00 51.13 H new ATOM 0 HE3 MET A 30 34.292 -13.973 3.362 1.00 51.13 H new ATOM 511 N MET A 31 26.954 -12.588 4.028 1.00 24.35 N ATOM 512 CA MET A 31 25.515 -12.796 3.916 1.00 43.41 C ATOM 513 C MET A 31 24.782 -11.464 3.789 1.00 5.35 C ATOM 514 O MET A 31 23.769 -11.366 3.100 1.00 54.23 O ATOM 515 CB MET A 31 24.993 -13.565 5.130 1.00 32.24 C ATOM 516 CG MET A 31 25.585 -14.959 5.268 1.00 53.44 C ATOM 517 SD MET A 31 24.638 -16.008 6.387 1.00 71.42 S ATOM 518 CE MET A 31 25.365 -17.609 6.046 1.00 24.22 C ATOM 0 H MET A 31 27.328 -12.725 4.967 1.00 24.35 H new ATOM 0 HA MET A 31 25.327 -13.382 3.016 1.00 43.41 H new ATOM 0 HB2 MET A 31 25.213 -12.995 6.033 1.00 32.24 H new ATOM 0 HB3 MET A 31 23.908 -13.645 5.060 1.00 32.24 H new ATOM 0 HG2 MET A 31 25.630 -15.429 4.286 1.00 53.44 H new ATOM 0 HG3 MET A 31 26.610 -14.880 5.630 1.00 53.44 H new ATOM 0 HE1 MET A 31 24.946 -18.351 6.726 1.00 24.22 H new ATOM 0 HE2 MET A 31 25.148 -17.896 5.017 1.00 24.22 H new ATOM 0 HE3 MET A 31 26.444 -17.556 6.188 1.00 24.22 H new ATOM 528 N ASN A 32 25.303 -10.441 4.460 1.00 34.15 N ATOM 529 CA ASN A 32 24.697 -9.115 4.423 1.00 35.14 C ATOM 530 C ASN A 32 24.587 -8.607 2.989 1.00 4.20 C ATOM 531 O ASN A 32 23.580 -8.012 2.606 1.00 23.52 O ATOM 532 CB ASN A 32 25.516 -8.133 5.263 1.00 20.33 C ATOM 533 CG ASN A 32 24.906 -6.745 5.290 1.00 74.43 C ATOM 534 OD1 ASN A 32 23.778 -6.560 5.747 1.00 12.32 O ATOM 535 ND2 ASN A 32 25.650 -5.762 4.797 1.00 22.23 N ATOM 0 H ASN A 32 26.143 -10.505 5.035 1.00 34.15 H new ATOM 0 HA ASN A 32 23.693 -9.190 4.841 1.00 35.14 H new ATOM 0 HB2 ASN A 32 25.597 -8.511 6.282 1.00 20.33 H new ATOM 0 HB3 ASN A 32 26.528 -8.074 4.863 1.00 20.33 H new ATOM 0 HD21 ASN A 32 25.292 -4.807 4.787 1.00 22.23 H new ATOM 0 HD22 ASN A 32 26.580 -5.962 4.428 1.00 22.23 H new ATOM 542 N GLU A 33 25.631 -8.846 2.201 1.00 1.11 N ATOM 543 CA GLU A 33 25.652 -8.412 0.809 1.00 12.12 C ATOM 544 C GLU A 33 24.892 -9.394 -0.078 1.00 40.32 C ATOM 545 O GLU A 33 24.273 -9.001 -1.068 1.00 22.13 O ATOM 546 CB GLU A 33 27.094 -8.273 0.317 1.00 52.14 C ATOM 547 CG GLU A 33 27.920 -9.537 0.487 1.00 13.20 C ATOM 548 CD GLU A 33 29.395 -9.310 0.220 1.00 1.04 C ATOM 549 OE1 GLU A 33 29.751 -9.021 -0.941 1.00 23.11 O ATOM 550 OE2 GLU A 33 30.194 -9.421 1.174 1.00 34.34 O ATOM 0 H GLU A 33 26.472 -9.337 2.503 1.00 1.11 H new ATOM 0 HA GLU A 33 25.161 -7.441 0.750 1.00 12.12 H new ATOM 0 HB2 GLU A 33 27.084 -7.995 -0.737 1.00 52.14 H new ATOM 0 HB3 GLU A 33 27.576 -7.458 0.857 1.00 52.14 H new ATOM 0 HG2 GLU A 33 27.792 -9.916 1.501 1.00 13.20 H new ATOM 0 HG3 GLU A 33 27.546 -10.305 -0.190 1.00 13.20 H new ATOM 557 N ILE A 34 24.945 -10.671 0.283 1.00 34.21 N ATOM 558 CA ILE A 34 24.261 -11.709 -0.479 1.00 45.13 C ATOM 559 C ILE A 34 22.748 -11.542 -0.401 1.00 73.10 C ATOM 560 O ILE A 34 22.052 -11.608 -1.414 1.00 52.34 O ATOM 561 CB ILE A 34 24.638 -13.116 0.022 1.00 42.34 C ATOM 562 CG1 ILE A 34 26.066 -13.466 -0.402 1.00 22.13 C ATOM 563 CG2 ILE A 34 23.654 -14.148 -0.509 1.00 3.21 C ATOM 564 CD1 ILE A 34 26.711 -14.524 0.466 1.00 42.00 C ATOM 0 H ILE A 34 25.454 -11.012 1.098 1.00 34.21 H new ATOM 0 HA ILE A 34 24.582 -11.603 -1.515 1.00 45.13 H new ATOM 0 HB ILE A 34 24.590 -13.123 1.111 1.00 42.34 H new ATOM 0 HG12 ILE A 34 26.055 -13.812 -1.435 1.00 22.13 H new ATOM 0 HG13 ILE A 34 26.676 -12.563 -0.375 1.00 22.13 H new ATOM 0 HG21 ILE A 34 23.933 -15.137 -0.147 1.00 3.21 H new ATOM 0 HG22 ILE A 34 22.650 -13.905 -0.163 1.00 3.21 H new ATOM 0 HG23 ILE A 34 23.673 -14.142 -1.599 1.00 3.21 H new ATOM 0 HD11 ILE A 34 27.721 -14.722 0.108 1.00 42.00 H new ATOM 0 HD12 ILE A 34 26.754 -14.172 1.497 1.00 42.00 H new ATOM 0 HD13 ILE A 34 26.123 -15.441 0.420 1.00 42.00 H new ATOM 576 N VAL A 35 22.244 -11.324 0.810 1.00 73.05 N ATOM 577 CA VAL A 35 20.812 -11.144 1.021 1.00 62.44 C ATOM 578 C VAL A 35 20.357 -9.766 0.556 1.00 0.41 C ATOM 579 O VAL A 35 19.230 -9.597 0.091 1.00 11.31 O ATOM 580 CB VAL A 35 20.437 -11.324 2.504 1.00 73.35 C ATOM 581 CG1 VAL A 35 18.925 -11.362 2.671 1.00 3.40 C ATOM 582 CG2 VAL A 35 21.075 -12.586 3.065 1.00 11.21 C ATOM 0 H VAL A 35 22.806 -11.268 1.659 1.00 73.05 H new ATOM 0 HA VAL A 35 20.306 -11.908 0.431 1.00 62.44 H new ATOM 0 HB VAL A 35 20.820 -10.471 3.064 1.00 73.35 H new ATOM 0 HG11 VAL A 35 18.678 -11.490 3.725 1.00 3.40 H new ATOM 0 HG12 VAL A 35 18.495 -10.428 2.308 1.00 3.40 H new ATOM 0 HG13 VAL A 35 18.517 -12.195 2.099 1.00 3.40 H new ATOM 0 HG21 VAL A 35 20.800 -12.698 4.114 1.00 11.21 H new ATOM 0 HG22 VAL A 35 20.724 -13.452 2.503 1.00 11.21 H new ATOM 0 HG23 VAL A 35 22.159 -12.514 2.980 1.00 11.21 H new ATOM 592 N SER A 36 21.242 -8.782 0.685 1.00 54.13 N ATOM 593 CA SER A 36 20.930 -7.416 0.281 1.00 12.20 C ATOM 594 C SER A 36 20.801 -7.313 -1.236 1.00 22.53 C ATOM 595 O SER A 36 19.808 -6.803 -1.754 1.00 34.43 O ATOM 596 CB SER A 36 22.012 -6.455 0.778 1.00 35.05 C ATOM 597 OG SER A 36 22.024 -5.261 0.015 1.00 73.31 O ATOM 0 H SER A 36 22.180 -8.905 1.066 1.00 54.13 H new ATOM 0 HA SER A 36 19.975 -7.141 0.729 1.00 12.20 H new ATOM 0 HB2 SER A 36 21.838 -6.218 1.827 1.00 35.05 H new ATOM 0 HB3 SER A 36 22.987 -6.938 0.718 1.00 35.05 H new ATOM 0 HG SER A 36 22.723 -4.663 0.354 1.00 73.31 H new ATOM 603 N LYS A 37 21.814 -7.802 -1.943 1.00 60.43 N ATOM 604 CA LYS A 37 21.816 -7.769 -3.401 1.00 4.40 C ATOM 605 C LYS A 37 20.676 -8.609 -3.967 1.00 24.44 C ATOM 606 O LYS A 37 19.941 -8.163 -4.847 1.00 23.02 O ATOM 607 CB LYS A 37 23.155 -8.276 -3.941 1.00 63.12 C ATOM 608 CG LYS A 37 23.378 -7.960 -5.410 1.00 74.11 C ATOM 609 CD LYS A 37 23.521 -6.466 -5.644 1.00 14.54 C ATOM 610 CE LYS A 37 24.981 -6.039 -5.647 1.00 73.11 C ATOM 611 NZ LYS A 37 25.292 -5.134 -6.788 1.00 75.32 N ATOM 0 H LYS A 37 22.645 -8.226 -1.530 1.00 60.43 H new ATOM 0 HA LYS A 37 21.672 -6.735 -3.716 1.00 4.40 H new ATOM 0 HB2 LYS A 37 23.963 -7.836 -3.357 1.00 63.12 H new ATOM 0 HB3 LYS A 37 23.210 -9.355 -3.798 1.00 63.12 H new ATOM 0 HG2 LYS A 37 24.274 -8.471 -5.761 1.00 74.11 H new ATOM 0 HG3 LYS A 37 22.542 -8.343 -5.996 1.00 74.11 H new ATOM 0 HD2 LYS A 37 23.061 -6.200 -6.596 1.00 14.54 H new ATOM 0 HD3 LYS A 37 22.983 -5.922 -4.867 1.00 14.54 H new ATOM 0 HE2 LYS A 37 25.214 -5.534 -4.709 1.00 73.11 H new ATOM 0 HE3 LYS A 37 25.618 -6.922 -5.700 1.00 73.11 H new ATOM 0 HZ1 LYS A 37 26.297 -5.224 -7.039 1.00 75.32 H new ATOM 0 HZ2 LYS A 37 24.706 -5.394 -7.607 1.00 75.32 H new ATOM 0 HZ3 LYS A 37 25.090 -4.151 -6.516 1.00 75.32 H new ATOM 625 N MET A 38 20.535 -9.828 -3.454 1.00 51.52 N ATOM 626 CA MET A 38 19.482 -10.729 -3.907 1.00 60.12 C ATOM 627 C MET A 38 18.111 -10.075 -3.771 1.00 35.53 C ATOM 628 O MET A 38 17.291 -10.134 -4.687 1.00 52.44 O ATOM 629 CB MET A 38 19.520 -12.034 -3.109 1.00 51.31 C ATOM 630 CG MET A 38 18.232 -12.837 -3.195 1.00 50.53 C ATOM 631 SD MET A 38 17.789 -13.259 -4.891 1.00 51.23 S ATOM 632 CE MET A 38 18.847 -14.676 -5.175 1.00 34.24 C ATOM 0 H MET A 38 21.136 -10.213 -2.726 1.00 51.52 H new ATOM 0 HA MET A 38 19.656 -10.951 -4.960 1.00 60.12 H new ATOM 0 HB2 MET A 38 20.346 -12.647 -3.470 1.00 51.31 H new ATOM 0 HB3 MET A 38 19.727 -11.805 -2.064 1.00 51.31 H new ATOM 0 HG2 MET A 38 18.340 -13.752 -2.613 1.00 50.53 H new ATOM 0 HG3 MET A 38 17.421 -12.266 -2.743 1.00 50.53 H new ATOM 0 HE1 MET A 38 18.754 -14.998 -6.212 1.00 34.24 H new ATOM 0 HE2 MET A 38 19.883 -14.404 -4.971 1.00 34.24 H new ATOM 0 HE3 MET A 38 18.549 -15.490 -4.515 1.00 34.24 H new ATOM 642 N ASP A 39 17.868 -9.455 -2.622 1.00 11.44 N ATOM 643 CA ASP A 39 16.596 -8.789 -2.366 1.00 33.32 C ATOM 644 C ASP A 39 16.422 -7.580 -3.279 1.00 11.54 C ATOM 645 O ASP A 39 15.300 -7.200 -3.616 1.00 63.45 O ATOM 646 CB ASP A 39 16.508 -8.356 -0.902 1.00 12.14 C ATOM 647 CG ASP A 39 15.130 -7.843 -0.531 1.00 71.43 C ATOM 648 OD1 ASP A 39 14.145 -8.282 -1.161 1.00 61.11 O ATOM 649 OD2 ASP A 39 15.036 -7.003 0.388 1.00 44.11 O ATOM 0 H ASP A 39 18.535 -9.400 -1.852 1.00 11.44 H new ATOM 0 HA ASP A 39 15.795 -9.497 -2.575 1.00 33.32 H new ATOM 0 HB2 ASP A 39 16.763 -9.200 -0.261 1.00 12.14 H new ATOM 0 HB3 ASP A 39 17.246 -7.577 -0.712 1.00 12.14 H new ATOM 654 N ASP A 40 17.538 -6.977 -3.673 1.00 63.52 N ATOM 655 CA ASP A 40 17.510 -5.810 -4.547 1.00 32.20 C ATOM 656 C ASP A 40 16.911 -6.162 -5.905 1.00 33.51 C ATOM 657 O ASP A 40 15.940 -5.546 -6.346 1.00 21.34 O ATOM 658 CB ASP A 40 18.921 -5.248 -4.728 1.00 55.14 C ATOM 659 CG ASP A 40 18.951 -4.049 -5.656 1.00 20.01 C ATOM 660 OD1 ASP A 40 17.894 -3.407 -5.830 1.00 62.43 O ATOM 661 OD2 ASP A 40 20.032 -3.753 -6.208 1.00 55.10 O ATOM 0 H ASP A 40 18.474 -7.277 -3.401 1.00 63.52 H new ATOM 0 HA ASP A 40 16.882 -5.051 -4.079 1.00 32.20 H new ATOM 0 HB2 ASP A 40 19.323 -4.962 -3.756 1.00 55.14 H new ATOM 0 HB3 ASP A 40 19.572 -6.027 -5.125 1.00 55.14 H new ATOM 666 N PHE A 41 17.496 -7.157 -6.564 1.00 41.33 N ATOM 667 CA PHE A 41 17.022 -7.590 -7.873 1.00 54.24 C ATOM 668 C PHE A 41 15.592 -8.116 -7.787 1.00 12.11 C ATOM 669 O PHE A 41 14.754 -7.812 -8.637 1.00 14.32 O ATOM 670 CB PHE A 41 17.942 -8.673 -8.440 1.00 50.45 C ATOM 671 CG PHE A 41 18.452 -8.364 -9.819 1.00 3.10 C ATOM 672 CD1 PHE A 41 17.694 -7.611 -10.700 1.00 52.34 C ATOM 673 CD2 PHE A 41 19.691 -8.827 -10.233 1.00 74.55 C ATOM 674 CE1 PHE A 41 18.161 -7.324 -11.970 1.00 34.55 C ATOM 675 CE2 PHE A 41 20.163 -8.544 -11.501 1.00 72.11 C ATOM 676 CZ PHE A 41 19.396 -7.793 -12.371 1.00 4.24 C ATOM 0 H PHE A 41 18.299 -7.678 -6.213 1.00 41.33 H new ATOM 0 HA PHE A 41 17.034 -6.727 -8.539 1.00 54.24 H new ATOM 0 HB2 PHE A 41 18.790 -8.806 -7.769 1.00 50.45 H new ATOM 0 HB3 PHE A 41 17.403 -9.620 -8.464 1.00 50.45 H new ATOM 0 HD1 PHE A 41 16.726 -7.243 -10.392 1.00 52.34 H new ATOM 0 HD2 PHE A 41 20.294 -9.415 -9.558 1.00 74.55 H new ATOM 0 HE1 PHE A 41 17.561 -6.734 -12.647 1.00 34.55 H new ATOM 0 HE2 PHE A 41 21.131 -8.910 -11.811 1.00 72.11 H new ATOM 0 HZ PHE A 41 19.762 -7.573 -13.363 1.00 4.24 H new ATOM 686 N LEU A 42 15.321 -8.907 -6.755 1.00 74.20 N ATOM 687 CA LEU A 42 13.993 -9.477 -6.556 1.00 75.22 C ATOM 688 C LEU A 42 12.977 -8.389 -6.222 1.00 4.12 C ATOM 689 O LEU A 42 11.788 -8.527 -6.506 1.00 61.40 O ATOM 690 CB LEU A 42 14.026 -10.520 -5.438 1.00 72.41 C ATOM 691 CG LEU A 42 13.406 -11.878 -5.768 1.00 74.55 C ATOM 692 CD1 LEU A 42 11.890 -11.770 -5.839 1.00 23.43 C ATOM 693 CD2 LEU A 42 13.965 -12.416 -7.078 1.00 1.04 C ATOM 0 H LEU A 42 16.003 -9.168 -6.043 1.00 74.20 H new ATOM 0 HA LEU A 42 13.689 -9.959 -7.485 1.00 75.22 H new ATOM 0 HB2 LEU A 42 15.064 -10.678 -5.147 1.00 72.41 H new ATOM 0 HB3 LEU A 42 13.511 -10.109 -4.570 1.00 72.41 H new ATOM 0 HG LEU A 42 13.664 -12.576 -4.972 1.00 74.55 H new ATOM 0 HD11 LEU A 42 11.466 -12.746 -6.075 1.00 23.43 H new ATOM 0 HD12 LEU A 42 11.504 -11.430 -4.878 1.00 23.43 H new ATOM 0 HD13 LEU A 42 11.612 -11.057 -6.615 1.00 23.43 H new ATOM 0 HD21 LEU A 42 13.512 -13.383 -7.297 1.00 1.04 H new ATOM 0 HD22 LEU A 42 13.738 -11.718 -7.884 1.00 1.04 H new ATOM 0 HD23 LEU A 42 15.045 -12.532 -6.992 1.00 1.04 H new ATOM 705 N MET A 43 13.456 -7.306 -5.618 1.00 51.24 N ATOM 706 CA MET A 43 12.590 -6.192 -5.249 1.00 22.03 C ATOM 707 C MET A 43 12.125 -5.431 -6.486 1.00 75.32 C ATOM 708 O MET A 43 10.981 -4.982 -6.557 1.00 55.24 O ATOM 709 CB MET A 43 13.322 -5.243 -4.298 1.00 21.12 C ATOM 710 CG MET A 43 12.539 -3.981 -3.977 1.00 14.42 C ATOM 711 SD MET A 43 13.396 -2.910 -2.806 1.00 74.01 S ATOM 712 CE MET A 43 14.539 -2.065 -3.895 1.00 2.30 C ATOM 0 H MET A 43 14.438 -7.176 -5.374 1.00 51.24 H new ATOM 0 HA MET A 43 11.714 -6.598 -4.744 1.00 22.03 H new ATOM 0 HB2 MET A 43 13.542 -5.770 -3.370 1.00 21.12 H new ATOM 0 HB3 MET A 43 14.278 -4.965 -4.741 1.00 21.12 H new ATOM 0 HG2 MET A 43 12.353 -3.429 -4.899 1.00 14.42 H new ATOM 0 HG3 MET A 43 11.567 -4.256 -3.568 1.00 14.42 H new ATOM 0 HE1 MET A 43 15.142 -1.365 -3.317 1.00 2.30 H new ATOM 0 HE2 MET A 43 15.190 -2.795 -4.376 1.00 2.30 H new ATOM 0 HE3 MET A 43 13.981 -1.520 -4.656 1.00 2.30 H new ATOM 722 N LYS A 44 13.018 -5.290 -7.459 1.00 70.24 N ATOM 723 CA LYS A 44 12.699 -4.585 -8.695 1.00 41.20 C ATOM 724 C LYS A 44 11.745 -5.404 -9.558 1.00 40.24 C ATOM 725 O LYS A 44 10.835 -4.860 -10.184 1.00 14.22 O ATOM 726 CB LYS A 44 13.979 -4.281 -9.478 1.00 14.24 C ATOM 727 CG LYS A 44 14.277 -5.291 -10.572 1.00 32.11 C ATOM 728 CD LYS A 44 15.642 -5.051 -11.195 1.00 74.34 C ATOM 729 CE LYS A 44 15.646 -3.803 -12.064 1.00 51.21 C ATOM 730 NZ LYS A 44 14.601 -3.861 -13.124 1.00 1.23 N ATOM 0 H LYS A 44 13.970 -5.655 -7.416 1.00 70.24 H new ATOM 0 HA LYS A 44 12.209 -3.647 -8.433 1.00 41.20 H new ATOM 0 HB2 LYS A 44 13.896 -3.290 -9.923 1.00 14.24 H new ATOM 0 HB3 LYS A 44 14.820 -4.250 -8.785 1.00 14.24 H new ATOM 0 HG2 LYS A 44 14.237 -6.299 -10.159 1.00 32.11 H new ATOM 0 HG3 LYS A 44 13.509 -5.231 -11.343 1.00 32.11 H new ATOM 0 HD2 LYS A 44 16.390 -4.950 -10.408 1.00 74.34 H new ATOM 0 HD3 LYS A 44 15.926 -5.915 -11.796 1.00 74.34 H new ATOM 0 HE2 LYS A 44 15.481 -2.925 -11.439 1.00 51.21 H new ATOM 0 HE3 LYS A 44 16.626 -3.686 -12.526 1.00 51.21 H new ATOM 0 HZ1 LYS A 44 15.037 -3.683 -14.051 1.00 1.23 H new ATOM 0 HZ2 LYS A 44 14.158 -4.802 -13.124 1.00 1.23 H new ATOM 0 HZ3 LYS A 44 13.877 -3.138 -12.938 1.00 1.23 H new ATOM 744 N LYS A 45 11.958 -6.715 -9.587 1.00 42.04 N ATOM 745 CA LYS A 45 11.116 -7.610 -10.372 1.00 20.45 C ATOM 746 C LYS A 45 9.683 -7.608 -9.848 1.00 5.24 C ATOM 747 O LYS A 45 8.735 -7.407 -10.607 1.00 23.35 O ATOM 748 CB LYS A 45 11.680 -9.033 -10.339 1.00 14.10 C ATOM 749 CG LYS A 45 10.750 -10.070 -10.945 1.00 52.43 C ATOM 750 CD LYS A 45 11.297 -11.477 -10.776 1.00 44.20 C ATOM 751 CE LYS A 45 10.685 -12.438 -11.783 1.00 32.21 C ATOM 752 NZ LYS A 45 11.191 -13.827 -11.603 1.00 44.10 N ATOM 0 H LYS A 45 12.707 -7.182 -9.076 1.00 42.04 H new ATOM 0 HA LYS A 45 11.108 -7.252 -11.401 1.00 20.45 H new ATOM 0 HB2 LYS A 45 12.629 -9.051 -10.875 1.00 14.10 H new ATOM 0 HB3 LYS A 45 11.892 -9.307 -9.306 1.00 14.10 H new ATOM 0 HG2 LYS A 45 9.770 -10.001 -10.473 1.00 52.43 H new ATOM 0 HG3 LYS A 45 10.609 -9.858 -12.005 1.00 52.43 H new ATOM 0 HD2 LYS A 45 12.380 -11.464 -10.896 1.00 44.20 H new ATOM 0 HD3 LYS A 45 11.092 -11.829 -9.765 1.00 44.20 H new ATOM 0 HE2 LYS A 45 9.600 -12.430 -11.679 1.00 32.21 H new ATOM 0 HE3 LYS A 45 10.911 -12.097 -12.794 1.00 32.21 H new ATOM 0 HZ1 LYS A 45 11.650 -14.146 -12.480 1.00 44.10 H new ATOM 0 HZ2 LYS A 45 11.881 -13.847 -10.825 1.00 44.10 H new ATOM 0 HZ3 LYS A 45 10.397 -14.459 -11.378 1.00 44.10 H new ATOM 766 N SER A 46 9.534 -7.830 -8.546 1.00 31.43 N ATOM 767 CA SER A 46 8.217 -7.856 -7.921 1.00 15.10 C ATOM 768 C SER A 46 7.514 -6.511 -8.080 1.00 11.13 C ATOM 769 O SER A 46 6.286 -6.440 -8.126 1.00 34.01 O ATOM 770 CB SER A 46 8.339 -8.208 -6.437 1.00 61.12 C ATOM 771 OG SER A 46 9.039 -7.199 -5.730 1.00 31.33 O ATOM 0 H SER A 46 10.309 -7.994 -7.904 1.00 31.43 H new ATOM 0 HA SER A 46 7.621 -8.620 -8.420 1.00 15.10 H new ATOM 0 HB2 SER A 46 7.345 -8.335 -6.007 1.00 61.12 H new ATOM 0 HB3 SER A 46 8.858 -9.160 -6.327 1.00 61.12 H new ATOM 0 HG SER A 46 9.588 -6.682 -6.356 1.00 31.33 H new ATOM 777 N LYS A 47 8.303 -5.445 -8.163 1.00 14.24 N ATOM 778 CA LYS A 47 7.759 -4.101 -8.317 1.00 41.34 C ATOM 779 C LYS A 47 7.206 -3.896 -9.724 1.00 61.12 C ATOM 780 O LYS A 47 6.266 -3.127 -9.926 1.00 0.44 O ATOM 781 CB LYS A 47 8.838 -3.055 -8.025 1.00 70.41 C ATOM 782 CG LYS A 47 9.194 -2.196 -9.226 1.00 34.01 C ATOM 783 CD LYS A 47 8.179 -1.085 -9.437 1.00 12.14 C ATOM 784 CE LYS A 47 8.857 0.269 -9.580 1.00 14.23 C ATOM 785 NZ LYS A 47 9.656 0.360 -10.833 1.00 31.30 N ATOM 0 H LYS A 47 9.322 -5.486 -8.126 1.00 14.24 H new ATOM 0 HA LYS A 47 6.944 -3.982 -7.604 1.00 41.34 H new ATOM 0 HB2 LYS A 47 8.497 -2.410 -7.216 1.00 70.41 H new ATOM 0 HB3 LYS A 47 9.736 -3.561 -7.672 1.00 70.41 H new ATOM 0 HG2 LYS A 47 10.184 -1.763 -9.084 1.00 34.01 H new ATOM 0 HG3 LYS A 47 9.243 -2.819 -10.119 1.00 34.01 H new ATOM 0 HD2 LYS A 47 7.589 -1.294 -10.330 1.00 12.14 H new ATOM 0 HD3 LYS A 47 7.486 -1.059 -8.596 1.00 12.14 H new ATOM 0 HE2 LYS A 47 8.102 1.055 -9.573 1.00 14.23 H new ATOM 0 HE3 LYS A 47 9.506 0.442 -8.722 1.00 14.23 H new ATOM 0 HZ1 LYS A 47 10.102 1.298 -10.893 1.00 31.30 H new ATOM 0 HZ2 LYS A 47 10.393 -0.374 -10.829 1.00 31.30 H new ATOM 0 HZ3 LYS A 47 9.032 0.220 -11.653 1.00 31.30 H new ATOM 799 N ILE A 48 7.794 -4.590 -10.693 1.00 1.02 N ATOM 800 CA ILE A 48 7.358 -4.486 -12.080 1.00 13.43 C ATOM 801 C ILE A 48 6.083 -5.289 -12.317 1.00 25.01 C ATOM 802 O ILE A 48 5.247 -4.919 -13.142 1.00 43.41 O ATOM 803 CB ILE A 48 8.448 -4.975 -13.051 1.00 50.32 C ATOM 804 CG1 ILE A 48 9.658 -4.039 -13.007 1.00 72.14 C ATOM 805 CG2 ILE A 48 7.894 -5.068 -14.465 1.00 43.43 C ATOM 806 CD1 ILE A 48 10.984 -4.767 -12.991 1.00 50.42 C ATOM 0 H ILE A 48 8.574 -5.230 -10.543 1.00 1.02 H new ATOM 0 HA ILE A 48 7.161 -3.431 -12.271 1.00 13.43 H new ATOM 0 HB ILE A 48 8.770 -5.969 -12.742 1.00 50.32 H new ATOM 0 HG12 ILE A 48 9.627 -3.377 -13.872 1.00 72.14 H new ATOM 0 HG13 ILE A 48 9.588 -3.409 -12.120 1.00 72.14 H new ATOM 0 HG21 ILE A 48 8.676 -5.415 -15.140 1.00 43.43 H new ATOM 0 HG22 ILE A 48 7.061 -5.770 -14.484 1.00 43.43 H new ATOM 0 HG23 ILE A 48 7.548 -4.085 -14.785 1.00 43.43 H new ATOM 0 HD11 ILE A 48 11.797 -4.042 -12.960 1.00 50.42 H new ATOM 0 HD12 ILE A 48 11.036 -5.409 -12.111 1.00 50.42 H new ATOM 0 HD13 ILE A 48 11.076 -5.376 -13.890 1.00 50.42 H new ATOM 818 N LEU A 49 5.940 -6.390 -11.587 1.00 45.14 N ATOM 819 CA LEU A 49 4.766 -7.246 -11.716 1.00 64.14 C ATOM 820 C LEU A 49 3.501 -6.501 -11.304 1.00 20.02 C ATOM 821 O LEU A 49 2.394 -6.878 -11.686 1.00 30.05 O ATOM 822 CB LEU A 49 4.932 -8.505 -10.863 1.00 2.53 C ATOM 823 CG LEU A 49 6.294 -9.196 -10.943 1.00 51.42 C ATOM 824 CD1 LEU A 49 6.190 -10.636 -10.468 1.00 23.35 C ATOM 825 CD2 LEU A 49 6.838 -9.139 -12.363 1.00 52.43 C ATOM 0 H LEU A 49 6.622 -6.711 -10.900 1.00 45.14 H new ATOM 0 HA LEU A 49 4.670 -7.534 -12.763 1.00 64.14 H new ATOM 0 HB2 LEU A 49 4.741 -8.242 -9.823 1.00 2.53 H new ATOM 0 HB3 LEU A 49 4.165 -9.222 -11.157 1.00 2.53 H new ATOM 0 HG LEU A 49 6.987 -8.668 -10.288 1.00 51.42 H new ATOM 0 HD11 LEU A 49 7.169 -11.112 -10.532 1.00 23.35 H new ATOM 0 HD12 LEU A 49 5.845 -10.654 -9.434 1.00 23.35 H new ATOM 0 HD13 LEU A 49 5.482 -11.176 -11.097 1.00 23.35 H new ATOM 0 HD21 LEU A 49 7.808 -9.635 -12.401 1.00 52.43 H new ATOM 0 HD22 LEU A 49 6.146 -9.642 -13.038 1.00 52.43 H new ATOM 0 HD23 LEU A 49 6.951 -8.099 -12.668 1.00 52.43 H new ATOM 837 N GLY A 50 3.674 -5.439 -10.523 1.00 13.05 N ATOM 838 CA GLY A 50 2.537 -4.656 -10.073 1.00 24.21 C ATOM 839 C GLY A 50 2.405 -3.344 -10.820 1.00 61.11 C ATOM 840 O GLY A 50 1.296 -2.896 -11.112 1.00 41.11 O ATOM 0 H GLY A 50 4.580 -5.107 -10.194 1.00 13.05 H new ATOM 0 HA2 GLY A 50 1.625 -5.238 -10.203 1.00 24.21 H new ATOM 0 HA3 GLY A 50 2.637 -4.455 -9.006 1.00 24.21 H new ATOM 844 N LYS A 51 3.539 -2.724 -11.130 1.00 30.52 N ATOM 845 CA LYS A 51 3.547 -1.455 -11.847 1.00 75.23 C ATOM 846 C LYS A 51 2.923 -1.608 -13.231 1.00 34.43 C ATOM 847 O LYS A 51 2.631 -2.720 -13.673 1.00 24.53 O ATOM 848 CB LYS A 51 4.977 -0.928 -11.977 1.00 42.31 C ATOM 849 CG LYS A 51 5.190 0.423 -11.315 1.00 71.23 C ATOM 850 CD LYS A 51 4.789 0.395 -9.850 1.00 53.20 C ATOM 851 CE LYS A 51 5.306 1.618 -9.107 1.00 74.24 C ATOM 852 NZ LYS A 51 5.433 1.366 -7.645 1.00 74.02 N ATOM 0 H LYS A 51 4.465 -3.081 -10.895 1.00 30.52 H new ATOM 0 HA LYS A 51 2.953 -0.741 -11.277 1.00 75.23 H new ATOM 0 HB2 LYS A 51 5.663 -1.651 -11.537 1.00 42.31 H new ATOM 0 HB3 LYS A 51 5.232 -0.850 -13.034 1.00 42.31 H new ATOM 0 HG2 LYS A 51 6.238 0.710 -11.401 1.00 71.23 H new ATOM 0 HG3 LYS A 51 4.608 1.181 -11.838 1.00 71.23 H new ATOM 0 HD2 LYS A 51 3.703 0.351 -9.770 1.00 53.20 H new ATOM 0 HD3 LYS A 51 5.180 -0.509 -9.382 1.00 53.20 H new ATOM 0 HE2 LYS A 51 6.276 1.905 -9.512 1.00 74.24 H new ATOM 0 HE3 LYS A 51 4.630 2.457 -9.274 1.00 74.24 H new ATOM 0 HZ1 LYS A 51 5.788 2.223 -7.175 1.00 74.02 H new ATOM 0 HZ2 LYS A 51 4.502 1.116 -7.254 1.00 74.02 H new ATOM 0 HZ3 LYS A 51 6.098 0.582 -7.484 1.00 74.02 H new ATOM 866 N THR A 52 2.721 -0.485 -13.912 1.00 15.32 N ATOM 867 CA THR A 52 2.132 -0.494 -15.245 1.00 33.31 C ATOM 868 C THR A 52 3.187 -0.237 -16.314 1.00 64.11 C ATOM 869 O THR A 52 4.325 0.114 -16.004 1.00 61.25 O ATOM 870 CB THR A 52 1.018 0.562 -15.375 1.00 31.13 C ATOM 871 OG1 THR A 52 0.842 1.244 -14.128 1.00 50.11 O ATOM 872 CG2 THR A 52 -0.294 -0.084 -15.795 1.00 2.12 C ATOM 0 H THR A 52 2.957 0.444 -13.562 1.00 15.32 H new ATOM 0 HA THR A 52 1.702 -1.485 -15.393 1.00 33.31 H new ATOM 0 HB THR A 52 1.314 1.278 -16.142 1.00 31.13 H new ATOM 0 HG1 THR A 52 0.133 1.915 -14.219 1.00 50.11 H new ATOM 0 HG21 THR A 52 -1.065 0.681 -15.880 1.00 2.12 H new ATOM 0 HG22 THR A 52 -0.165 -0.578 -16.758 1.00 2.12 H new ATOM 0 HG23 THR A 52 -0.593 -0.819 -15.048 1.00 2.12 H new ATOM 880 N ASN A 53 2.802 -0.413 -17.574 1.00 22.31 N ATOM 881 CA ASN A 53 3.717 -0.200 -18.690 1.00 13.23 C ATOM 882 C ASN A 53 4.249 1.230 -18.691 1.00 24.24 C ATOM 883 O ASN A 53 5.320 1.505 -19.232 1.00 4.10 O ATOM 884 CB ASN A 53 3.014 -0.495 -20.016 1.00 54.22 C ATOM 885 CG ASN A 53 2.181 -1.761 -19.960 1.00 63.32 C ATOM 886 OD1 ASN A 53 0.951 -1.709 -19.955 1.00 63.33 O ATOM 887 ND2 ASN A 53 2.851 -2.907 -19.917 1.00 74.53 N ATOM 0 H ASN A 53 1.863 -0.702 -17.848 1.00 22.31 H new ATOM 0 HA ASN A 53 4.559 -0.882 -18.573 1.00 13.23 H new ATOM 0 HB2 ASN A 53 2.373 0.347 -20.280 1.00 54.22 H new ATOM 0 HB3 ASN A 53 3.759 -0.588 -20.806 1.00 54.22 H new ATOM 0 HD21 ASN A 53 2.346 -3.792 -19.878 1.00 74.53 H new ATOM 0 HD22 ASN A 53 3.871 -2.902 -19.923 1.00 74.53 H new ATOM 894 N LYS A 54 3.495 2.137 -18.080 1.00 34.12 N ATOM 895 CA LYS A 54 3.890 3.538 -18.007 1.00 51.53 C ATOM 896 C LYS A 54 5.098 3.717 -17.093 1.00 33.40 C ATOM 897 O LYS A 54 5.997 4.505 -17.385 1.00 33.22 O ATOM 898 CB LYS A 54 2.725 4.393 -17.503 1.00 33.10 C ATOM 899 CG LYS A 54 1.438 4.187 -18.283 1.00 15.24 C ATOM 900 CD LYS A 54 0.298 5.011 -17.706 1.00 23.34 C ATOM 901 CE LYS A 54 -1.055 4.489 -18.164 1.00 43.05 C ATOM 902 NZ LYS A 54 -1.455 3.260 -17.425 1.00 61.34 N ATOM 0 H LYS A 54 2.605 1.926 -17.628 1.00 34.12 H new ATOM 0 HA LYS A 54 4.164 3.864 -19.010 1.00 51.53 H new ATOM 0 HB2 LYS A 54 2.544 4.163 -16.453 1.00 33.10 H new ATOM 0 HB3 LYS A 54 3.008 5.444 -17.555 1.00 33.10 H new ATOM 0 HG2 LYS A 54 1.596 4.462 -19.326 1.00 15.24 H new ATOM 0 HG3 LYS A 54 1.168 3.131 -18.269 1.00 15.24 H new ATOM 0 HD2 LYS A 54 0.348 4.990 -16.617 1.00 23.34 H new ATOM 0 HD3 LYS A 54 0.410 6.052 -18.010 1.00 23.34 H new ATOM 0 HE2 LYS A 54 -1.810 5.262 -18.019 1.00 43.05 H new ATOM 0 HE3 LYS A 54 -1.019 4.275 -19.232 1.00 43.05 H new ATOM 0 HZ1 LYS A 54 -2.430 3.004 -17.680 1.00 61.34 H new ATOM 0 HZ2 LYS A 54 -0.815 2.480 -17.676 1.00 61.34 H new ATOM 0 HZ3 LYS A 54 -1.400 3.437 -16.402 1.00 61.34 H new ATOM 916 N GLN A 55 5.112 2.979 -15.988 1.00 34.52 N ATOM 917 CA GLN A 55 6.210 3.055 -15.032 1.00 41.51 C ATOM 918 C GLN A 55 7.381 2.185 -15.477 1.00 34.22 C ATOM 919 O GLN A 55 8.541 2.504 -15.214 1.00 12.30 O ATOM 920 CB GLN A 55 5.737 2.624 -13.643 1.00 72.30 C ATOM 921 CG GLN A 55 6.359 3.426 -12.512 1.00 23.44 C ATOM 922 CD GLN A 55 6.112 4.915 -12.647 1.00 14.11 C ATOM 923 OE1 GLN A 55 4.966 5.367 -12.654 1.00 44.55 O ATOM 924 NE2 GLN A 55 7.187 5.687 -12.755 1.00 32.15 N ATOM 0 H GLN A 55 4.375 2.321 -15.733 1.00 34.52 H new ATOM 0 HA GLN A 55 6.547 4.090 -14.987 1.00 41.51 H new ATOM 0 HB2 GLN A 55 4.652 2.720 -13.592 1.00 72.30 H new ATOM 0 HB3 GLN A 55 5.970 1.569 -13.500 1.00 72.30 H new ATOM 0 HG2 GLN A 55 5.955 3.079 -11.561 1.00 23.44 H new ATOM 0 HG3 GLN A 55 7.433 3.241 -12.488 1.00 23.44 H new ATOM 0 HE21 GLN A 55 8.118 5.270 -12.744 1.00 32.15 H new ATOM 0 HE22 GLN A 55 7.082 6.697 -12.848 1.00 32.15 H new ATOM 933 N LEU A 56 7.069 1.084 -16.151 1.00 63.53 N ATOM 934 CA LEU A 56 8.096 0.166 -16.633 1.00 33.51 C ATOM 935 C LEU A 56 9.176 0.914 -17.407 1.00 1.11 C ATOM 936 O LEU A 56 8.879 1.702 -18.306 1.00 10.15 O ATOM 937 CB LEU A 56 7.469 -0.911 -17.521 1.00 41.31 C ATOM 938 CG LEU A 56 8.428 -1.657 -18.449 1.00 21.40 C ATOM 939 CD1 LEU A 56 7.979 -3.099 -18.633 1.00 51.53 C ATOM 940 CD2 LEU A 56 8.527 -0.952 -19.793 1.00 42.55 C ATOM 0 H LEU A 56 6.114 0.805 -16.376 1.00 63.53 H new ATOM 0 HA LEU A 56 8.559 -0.309 -15.768 1.00 33.51 H new ATOM 0 HB2 LEU A 56 6.975 -1.641 -16.879 1.00 41.31 H new ATOM 0 HB3 LEU A 56 6.694 -0.446 -18.130 1.00 41.31 H new ATOM 0 HG LEU A 56 9.417 -1.661 -17.990 1.00 21.40 H new ATOM 0 HD11 LEU A 56 8.673 -3.614 -19.296 1.00 51.53 H new ATOM 0 HD12 LEU A 56 7.961 -3.601 -17.666 1.00 51.53 H new ATOM 0 HD13 LEU A 56 6.980 -3.116 -19.069 1.00 51.53 H new ATOM 0 HD21 LEU A 56 9.214 -1.497 -20.440 1.00 42.55 H new ATOM 0 HD22 LEU A 56 7.542 -0.916 -20.258 1.00 42.55 H new ATOM 0 HD23 LEU A 56 8.896 0.063 -19.645 1.00 42.55 H new ATOM 952 N THR A 57 10.433 0.661 -17.054 1.00 13.43 N ATOM 953 CA THR A 57 11.558 1.310 -17.715 1.00 53.02 C ATOM 954 C THR A 57 12.422 0.294 -18.453 1.00 21.11 C ATOM 955 O THR A 57 12.090 -0.890 -18.513 1.00 70.03 O ATOM 956 CB THR A 57 12.435 2.078 -16.708 1.00 54.24 C ATOM 957 OG1 THR A 57 11.773 2.154 -15.441 1.00 1.03 O ATOM 958 CG2 THR A 57 12.736 3.481 -17.213 1.00 41.15 C ATOM 0 H THR A 57 10.697 0.011 -16.314 1.00 13.43 H new ATOM 0 HA THR A 57 11.139 2.016 -18.432 1.00 53.02 H new ATOM 0 HB THR A 57 13.376 1.540 -16.594 1.00 54.24 H new ATOM 0 HG1 THR A 57 12.337 2.642 -14.806 1.00 1.03 H new ATOM 0 HG21 THR A 57 13.356 4.004 -16.485 1.00 41.15 H new ATOM 0 HG22 THR A 57 13.265 3.420 -18.164 1.00 41.15 H new ATOM 0 HG23 THR A 57 11.802 4.026 -17.352 1.00 41.15 H new ATOM 966 N ARG A 58 13.532 0.764 -19.012 1.00 65.40 N ATOM 967 CA ARG A 58 14.444 -0.105 -19.746 1.00 45.04 C ATOM 968 C ARG A 58 14.871 -1.293 -18.890 1.00 25.42 C ATOM 969 O ARG A 58 14.719 -2.447 -19.291 1.00 35.12 O ATOM 970 CB ARG A 58 15.677 0.680 -20.199 1.00 10.21 C ATOM 971 CG ARG A 58 15.498 1.376 -21.538 1.00 51.12 C ATOM 972 CD ARG A 58 15.470 0.378 -22.685 1.00 44.13 C ATOM 973 NE ARG A 58 15.066 1.001 -23.943 1.00 64.10 N ATOM 974 CZ ARG A 58 15.205 0.419 -25.129 1.00 45.11 C ATOM 975 NH1 ARG A 58 15.735 -0.793 -25.219 1.00 21.04 N ATOM 976 NH2 ARG A 58 14.814 1.050 -26.229 1.00 32.12 N ATOM 0 H ARG A 58 13.822 1.741 -18.971 1.00 65.40 H new ATOM 0 HA ARG A 58 13.919 -0.482 -20.624 1.00 45.04 H new ATOM 0 HB2 ARG A 58 15.921 1.425 -19.442 1.00 10.21 H new ATOM 0 HB3 ARG A 58 16.527 0.000 -20.263 1.00 10.21 H new ATOM 0 HG2 ARG A 58 14.571 1.949 -21.530 1.00 51.12 H new ATOM 0 HG3 ARG A 58 16.311 2.086 -21.692 1.00 51.12 H new ATOM 0 HD2 ARG A 58 16.458 -0.068 -22.802 1.00 44.13 H new ATOM 0 HD3 ARG A 58 14.781 -0.432 -22.444 1.00 44.13 H new ATOM 0 HE ARG A 58 14.655 1.934 -23.909 1.00 64.10 H new ATOM 0 HH11 ARG A 58 16.037 -1.281 -24.376 1.00 21.04 H new ATOM 0 HH12 ARG A 58 15.840 -1.237 -26.131 1.00 21.04 H new ATOM 0 HH21 ARG A 58 14.406 1.983 -26.164 1.00 32.12 H new ATOM 0 HH22 ARG A 58 14.921 0.602 -27.139 1.00 32.12 H new ATOM 990 N SER A 59 15.408 -1.003 -17.709 1.00 12.21 N ATOM 991 CA SER A 59 15.861 -2.047 -16.797 1.00 40.14 C ATOM 992 C SER A 59 14.747 -3.054 -16.529 1.00 23.43 C ATOM 993 O SER A 59 15.003 -4.244 -16.343 1.00 21.23 O ATOM 994 CB SER A 59 16.337 -1.432 -15.480 1.00 13.12 C ATOM 995 OG SER A 59 17.674 -0.975 -15.584 1.00 0.22 O ATOM 0 H SER A 59 15.540 -0.053 -17.361 1.00 12.21 H new ATOM 0 HA SER A 59 16.694 -2.570 -17.267 1.00 40.14 H new ATOM 0 HB2 SER A 59 15.686 -0.602 -15.207 1.00 13.12 H new ATOM 0 HB3 SER A 59 16.263 -2.171 -14.682 1.00 13.12 H new ATOM 0 HG SER A 59 17.954 -0.585 -14.730 1.00 0.22 H new ATOM 1001 N ASP A 60 13.511 -2.569 -16.510 1.00 10.22 N ATOM 1002 CA ASP A 60 12.357 -3.426 -16.265 1.00 54.30 C ATOM 1003 C ASP A 60 12.053 -4.289 -17.485 1.00 75.41 C ATOM 1004 O ASP A 60 11.570 -5.415 -17.357 1.00 1.25 O ATOM 1005 CB ASP A 60 11.134 -2.580 -15.906 1.00 11.12 C ATOM 1006 CG ASP A 60 11.347 -1.759 -14.649 1.00 52.24 C ATOM 1007 OD1 ASP A 60 12.338 -2.015 -13.934 1.00 10.33 O ATOM 1008 OD2 ASP A 60 10.523 -0.860 -14.382 1.00 52.51 O ATOM 0 H ASP A 60 13.282 -1.587 -16.661 1.00 10.22 H new ATOM 0 HA ASP A 60 12.594 -4.082 -15.428 1.00 54.30 H new ATOM 0 HB2 ASP A 60 10.900 -1.914 -16.736 1.00 11.12 H new ATOM 0 HB3 ASP A 60 10.272 -3.233 -15.769 1.00 11.12 H new ATOM 1013 N ARG A 61 12.337 -3.755 -18.668 1.00 52.41 N ATOM 1014 CA ARG A 61 12.092 -4.476 -19.911 1.00 54.43 C ATOM 1015 C ARG A 61 13.152 -5.550 -20.135 1.00 12.10 C ATOM 1016 O ARG A 61 12.842 -6.660 -20.567 1.00 4.30 O ATOM 1017 CB ARG A 61 12.076 -3.505 -21.094 1.00 31.31 C ATOM 1018 CG ARG A 61 10.836 -3.626 -21.964 1.00 54.31 C ATOM 1019 CD ARG A 61 10.424 -2.278 -22.537 1.00 31.43 C ATOM 1020 NE ARG A 61 9.300 -2.397 -23.461 1.00 74.12 N ATOM 1021 CZ ARG A 61 9.416 -2.846 -24.706 1.00 60.10 C ATOM 1022 NH1 ARG A 61 10.600 -3.217 -25.172 1.00 64.14 N ATOM 1023 NH2 ARG A 61 8.346 -2.925 -25.487 1.00 21.11 N ATOM 0 H ARG A 61 12.737 -2.825 -18.792 1.00 52.41 H new ATOM 0 HA ARG A 61 11.119 -4.961 -19.834 1.00 54.43 H new ATOM 0 HB2 ARG A 61 12.147 -2.485 -20.717 1.00 31.31 H new ATOM 0 HB3 ARG A 61 12.959 -3.680 -21.709 1.00 31.31 H new ATOM 0 HG2 ARG A 61 11.028 -4.325 -22.778 1.00 54.31 H new ATOM 0 HG3 ARG A 61 10.016 -4.039 -21.376 1.00 54.31 H new ATOM 0 HD2 ARG A 61 10.154 -1.605 -21.723 1.00 31.43 H new ATOM 0 HD3 ARG A 61 11.272 -1.829 -23.054 1.00 31.43 H new ATOM 0 HE ARG A 61 8.375 -2.120 -23.133 1.00 74.12 H new ATOM 0 HH11 ARG A 61 11.425 -3.158 -24.574 1.00 64.14 H new ATOM 0 HH12 ARG A 61 10.687 -3.561 -26.128 1.00 64.14 H new ATOM 0 HH21 ARG A 61 7.433 -2.641 -25.132 1.00 21.11 H new ATOM 0 HH22 ARG A 61 8.436 -3.270 -26.443 1.00 21.11 H new ATOM 1037 N GLU A 62 14.403 -5.211 -19.838 1.00 55.23 N ATOM 1038 CA GLU A 62 15.508 -6.146 -20.009 1.00 31.43 C ATOM 1039 C GLU A 62 15.389 -7.313 -19.032 1.00 75.25 C ATOM 1040 O GLU A 62 15.700 -8.455 -19.371 1.00 70.12 O ATOM 1041 CB GLU A 62 16.846 -5.432 -19.806 1.00 32.14 C ATOM 1042 CG GLU A 62 17.281 -5.358 -18.352 1.00 4.51 C ATOM 1043 CD GLU A 62 18.003 -6.610 -17.894 1.00 61.12 C ATOM 1044 OE1 GLU A 62 18.155 -7.540 -18.714 1.00 42.44 O ATOM 1045 OE2 GLU A 62 18.415 -6.661 -16.717 1.00 23.34 O ATOM 0 H GLU A 62 14.676 -4.296 -19.478 1.00 55.23 H new ATOM 0 HA GLU A 62 15.464 -6.538 -21.025 1.00 31.43 H new ATOM 0 HB2 GLU A 62 17.615 -5.948 -20.381 1.00 32.14 H new ATOM 0 HB3 GLU A 62 16.773 -4.421 -20.207 1.00 32.14 H new ATOM 0 HG2 GLU A 62 17.934 -4.496 -18.216 1.00 4.51 H new ATOM 0 HG3 GLU A 62 16.406 -5.197 -17.723 1.00 4.51 H new ATOM 1052 N VAL A 63 14.936 -7.017 -17.818 1.00 74.32 N ATOM 1053 CA VAL A 63 14.774 -8.040 -16.792 1.00 62.41 C ATOM 1054 C VAL A 63 13.579 -8.937 -17.094 1.00 33.25 C ATOM 1055 O VAL A 63 13.629 -10.149 -16.881 1.00 74.50 O ATOM 1056 CB VAL A 63 14.592 -7.413 -15.397 1.00 45.24 C ATOM 1057 CG1 VAL A 63 15.831 -6.623 -15.002 1.00 14.42 C ATOM 1058 CG2 VAL A 63 13.354 -6.529 -15.368 1.00 63.53 C ATOM 0 H VAL A 63 14.675 -6.077 -17.521 1.00 74.32 H new ATOM 0 HA VAL A 63 15.685 -8.639 -16.796 1.00 62.41 H new ATOM 0 HB VAL A 63 14.455 -8.215 -14.672 1.00 45.24 H new ATOM 0 HG11 VAL A 63 15.685 -6.187 -14.014 1.00 14.42 H new ATOM 0 HG12 VAL A 63 16.695 -7.287 -14.981 1.00 14.42 H new ATOM 0 HG13 VAL A 63 16.002 -5.828 -15.728 1.00 14.42 H new ATOM 0 HG21 VAL A 63 13.241 -6.094 -14.375 1.00 63.53 H new ATOM 0 HG22 VAL A 63 13.459 -5.731 -16.104 1.00 63.53 H new ATOM 0 HG23 VAL A 63 12.474 -7.127 -15.605 1.00 63.53 H new ATOM 1068 N LEU A 64 12.504 -8.334 -17.590 1.00 64.13 N ATOM 1069 CA LEU A 64 11.294 -9.078 -17.922 1.00 63.14 C ATOM 1070 C LEU A 64 11.569 -10.105 -19.017 1.00 2.43 C ATOM 1071 O LEU A 64 11.144 -11.256 -18.922 1.00 71.15 O ATOM 1072 CB LEU A 64 10.190 -8.120 -18.372 1.00 10.20 C ATOM 1073 CG LEU A 64 8.976 -8.014 -17.448 1.00 41.22 C ATOM 1074 CD1 LEU A 64 9.418 -7.865 -16.001 1.00 23.13 C ATOM 1075 CD2 LEU A 64 8.093 -6.845 -17.861 1.00 35.55 C ATOM 0 H LEU A 64 12.446 -7.332 -17.771 1.00 64.13 H new ATOM 0 HA LEU A 64 10.966 -9.607 -17.027 1.00 63.14 H new ATOM 0 HB2 LEU A 64 10.623 -7.126 -18.486 1.00 10.20 H new ATOM 0 HB3 LEU A 64 9.845 -8.432 -19.358 1.00 10.20 H new ATOM 0 HG LEU A 64 8.395 -8.932 -17.536 1.00 41.22 H new ATOM 0 HD11 LEU A 64 8.541 -7.791 -15.358 1.00 23.13 H new ATOM 0 HD12 LEU A 64 10.009 -8.733 -15.710 1.00 23.13 H new ATOM 0 HD13 LEU A 64 10.022 -6.964 -15.896 1.00 23.13 H new ATOM 0 HD21 LEU A 64 7.234 -6.784 -17.193 1.00 35.55 H new ATOM 0 HD22 LEU A 64 8.665 -5.919 -17.802 1.00 35.55 H new ATOM 0 HD23 LEU A 64 7.747 -6.994 -18.884 1.00 35.55 H new ATOM 1087 N ASP A 65 12.284 -9.680 -20.053 1.00 1.14 N ATOM 1088 CA ASP A 65 12.619 -10.563 -21.164 1.00 2.02 C ATOM 1089 C ASP A 65 13.576 -11.663 -20.714 1.00 41.24 C ATOM 1090 O ASP A 65 13.493 -12.799 -21.179 1.00 4.20 O ATOM 1091 CB ASP A 65 13.243 -9.763 -22.308 1.00 61.25 C ATOM 1092 CG ASP A 65 12.471 -9.910 -23.605 1.00 44.12 C ATOM 1093 OD1 ASP A 65 11.284 -9.524 -23.636 1.00 72.22 O ATOM 1094 OD2 ASP A 65 13.055 -10.410 -24.589 1.00 43.42 O ATOM 0 H ASP A 65 12.643 -8.730 -20.147 1.00 1.14 H new ATOM 0 HA ASP A 65 11.699 -11.029 -21.517 1.00 2.02 H new ATOM 0 HB2 ASP A 65 13.285 -8.710 -22.031 1.00 61.25 H new ATOM 0 HB3 ASP A 65 14.270 -10.093 -22.461 1.00 61.25 H new ATOM 1099 N ASN A 66 14.485 -11.316 -19.808 1.00 54.14 N ATOM 1100 CA ASN A 66 15.459 -12.273 -19.297 1.00 72.45 C ATOM 1101 C ASN A 66 14.789 -13.295 -18.384 1.00 23.52 C ATOM 1102 O ASN A 66 14.984 -14.501 -18.537 1.00 20.31 O ATOM 1103 CB ASN A 66 16.571 -11.546 -18.539 1.00 53.21 C ATOM 1104 CG ASN A 66 17.749 -12.450 -18.234 1.00 4.24 C ATOM 1105 OD1 ASN A 66 17.590 -13.518 -17.642 1.00 51.14 O ATOM 1106 ND2 ASN A 66 18.941 -12.024 -18.636 1.00 62.20 N ATOM 0 H ASN A 66 14.567 -10.379 -19.413 1.00 54.14 H new ATOM 0 HA ASN A 66 15.893 -12.800 -20.146 1.00 72.45 H new ATOM 0 HB2 ASN A 66 16.913 -10.695 -19.128 1.00 53.21 H new ATOM 0 HB3 ASN A 66 16.171 -11.148 -17.606 1.00 53.21 H new ATOM 0 HD21 ASN A 66 19.771 -12.589 -18.457 1.00 62.20 H new ATOM 0 HD22 ASN A 66 19.026 -11.132 -19.123 1.00 62.20 H new ATOM 1113 N TRP A 67 14.000 -12.805 -17.435 1.00 3.21 N ATOM 1114 CA TRP A 67 13.301 -13.676 -16.497 1.00 2.45 C ATOM 1115 C TRP A 67 12.461 -14.710 -17.237 1.00 20.43 C ATOM 1116 O TRP A 67 12.422 -15.880 -16.854 1.00 54.10 O ATOM 1117 CB TRP A 67 12.412 -12.848 -15.567 1.00 74.32 C ATOM 1118 CG TRP A 67 10.951 -13.142 -15.727 1.00 34.13 C ATOM 1119 CD1 TRP A 67 10.027 -12.376 -16.379 1.00 31.12 C ATOM 1120 CD2 TRP A 67 10.246 -14.282 -15.223 1.00 72.11 C ATOM 1121 NE1 TRP A 67 8.790 -12.971 -16.311 1.00 23.22 N ATOM 1122 CE2 TRP A 67 8.898 -14.142 -15.608 1.00 70.00 C ATOM 1123 CE3 TRP A 67 10.622 -15.408 -14.486 1.00 61.45 C ATOM 1124 CZ2 TRP A 67 7.928 -15.085 -15.279 1.00 63.51 C ATOM 1125 CZ3 TRP A 67 9.659 -16.344 -14.161 1.00 15.45 C ATOM 1126 CH2 TRP A 67 8.325 -16.178 -14.557 1.00 72.31 C ATOM 0 H TRP A 67 13.828 -11.809 -17.295 1.00 3.21 H new ATOM 0 HA TRP A 67 14.047 -14.202 -15.902 1.00 2.45 H new ATOM 0 HB2 TRP A 67 12.703 -13.038 -14.534 1.00 74.32 H new ATOM 0 HB3 TRP A 67 12.585 -11.789 -15.758 1.00 74.32 H new ATOM 0 HD1 TRP A 67 10.238 -11.440 -16.875 1.00 31.12 H new ATOM 0 HE1 TRP A 67 7.931 -12.601 -16.718 1.00 23.22 H new ATOM 0 HE3 TRP A 67 11.647 -15.544 -14.176 1.00 61.45 H new ATOM 0 HZ2 TRP A 67 6.899 -14.959 -15.583 1.00 63.51 H new ATOM 0 HZ3 TRP A 67 9.939 -17.218 -13.592 1.00 15.45 H new ATOM 0 HH2 TRP A 67 7.596 -16.927 -14.287 1.00 72.31 H new ATOM 1137 N ARG A 68 11.791 -14.273 -18.298 1.00 12.03 N ATOM 1138 CA ARG A 68 10.950 -15.162 -19.090 1.00 65.34 C ATOM 1139 C ARG A 68 11.802 -16.127 -19.910 1.00 70.24 C ATOM 1140 O ARG A 68 11.352 -17.215 -20.269 1.00 44.11 O ATOM 1141 CB ARG A 68 10.044 -14.350 -20.018 1.00 25.31 C ATOM 1142 CG ARG A 68 10.601 -14.186 -21.422 1.00 44.25 C ATOM 1143 CD ARG A 68 10.093 -12.911 -22.077 1.00 42.14 C ATOM 1144 NE ARG A 68 8.886 -13.144 -22.865 1.00 53.10 N ATOM 1145 CZ ARG A 68 8.125 -12.169 -23.350 1.00 42.23 C ATOM 1146 NH1 ARG A 68 8.446 -10.901 -23.130 1.00 61.42 N ATOM 1147 NH2 ARG A 68 7.041 -12.461 -24.058 1.00 45.21 N ATOM 0 H ARG A 68 11.814 -13.309 -18.629 1.00 12.03 H new ATOM 0 HA ARG A 68 10.331 -15.742 -18.405 1.00 65.34 H new ATOM 0 HB2 ARG A 68 9.070 -14.836 -20.077 1.00 25.31 H new ATOM 0 HB3 ARG A 68 9.883 -13.364 -19.583 1.00 25.31 H new ATOM 0 HG2 ARG A 68 11.690 -14.167 -21.383 1.00 44.25 H new ATOM 0 HG3 ARG A 68 10.319 -15.046 -22.029 1.00 44.25 H new ATOM 0 HD2 ARG A 68 9.886 -12.166 -21.308 1.00 42.14 H new ATOM 0 HD3 ARG A 68 10.871 -12.498 -22.719 1.00 42.14 H new ATOM 0 HE ARG A 68 8.612 -14.108 -23.053 1.00 53.10 H new ATOM 0 HH11 ARG A 68 9.279 -10.673 -22.587 1.00 61.42 H new ATOM 0 HH12 ARG A 68 7.860 -10.154 -23.504 1.00 61.42 H new ATOM 0 HH21 ARG A 68 6.791 -13.435 -24.230 1.00 45.21 H new ATOM 0 HH22 ARG A 68 6.458 -11.712 -24.430 1.00 45.21 H new ATOM 1161 N GLU A 69 13.033 -15.720 -20.203 1.00 41.33 N ATOM 1162 CA GLU A 69 13.946 -16.548 -20.982 1.00 61.11 C ATOM 1163 C GLU A 69 14.474 -17.711 -20.146 1.00 14.50 C ATOM 1164 O GLU A 69 14.678 -18.813 -20.655 1.00 24.53 O ATOM 1165 CB GLU A 69 15.114 -15.708 -21.502 1.00 65.11 C ATOM 1166 CG GLU A 69 16.439 -16.026 -20.830 1.00 25.30 C ATOM 1167 CD GLU A 69 17.566 -15.131 -21.309 1.00 22.53 C ATOM 1168 OE1 GLU A 69 17.413 -14.507 -22.379 1.00 54.51 O ATOM 1169 OE2 GLU A 69 18.601 -15.056 -20.614 1.00 31.21 O ATOM 0 H GLU A 69 13.421 -14.822 -19.913 1.00 41.33 H new ATOM 0 HA GLU A 69 13.394 -16.954 -21.830 1.00 61.11 H new ATOM 0 HB2 GLU A 69 15.214 -15.865 -22.576 1.00 65.11 H new ATOM 0 HB3 GLU A 69 14.885 -14.652 -21.354 1.00 65.11 H new ATOM 0 HG2 GLU A 69 16.329 -15.920 -19.751 1.00 25.30 H new ATOM 0 HG3 GLU A 69 16.699 -17.067 -21.023 1.00 25.30 H new ATOM 1176 N LEU A 70 14.692 -17.456 -18.861 1.00 1.43 N ATOM 1177 CA LEU A 70 15.196 -18.480 -17.953 1.00 4.25 C ATOM 1178 C LEU A 70 14.094 -19.464 -17.575 1.00 52.13 C ATOM 1179 O LEU A 70 14.337 -20.663 -17.448 1.00 72.41 O ATOM 1180 CB LEU A 70 15.772 -17.833 -16.691 1.00 55.44 C ATOM 1181 CG LEU A 70 16.637 -16.591 -16.909 1.00 54.30 C ATOM 1182 CD1 LEU A 70 16.529 -15.650 -15.719 1.00 25.33 C ATOM 1183 CD2 LEU A 70 18.086 -16.986 -17.150 1.00 62.00 C ATOM 0 H LEU A 70 14.528 -16.549 -18.424 1.00 1.43 H new ATOM 0 HA LEU A 70 15.986 -19.028 -18.467 1.00 4.25 H new ATOM 0 HB2 LEU A 70 14.944 -17.564 -16.034 1.00 55.44 H new ATOM 0 HB3 LEU A 70 16.368 -18.578 -16.164 1.00 55.44 H new ATOM 0 HG LEU A 70 16.273 -16.068 -17.793 1.00 54.30 H new ATOM 0 HD11 LEU A 70 17.151 -14.772 -15.892 1.00 25.33 H new ATOM 0 HD12 LEU A 70 15.492 -15.341 -15.593 1.00 25.33 H new ATOM 0 HD13 LEU A 70 16.867 -16.162 -14.818 1.00 25.33 H new ATOM 0 HD21 LEU A 70 18.687 -16.090 -17.303 1.00 62.00 H new ATOM 0 HD22 LEU A 70 18.463 -17.532 -16.285 1.00 62.00 H new ATOM 0 HD23 LEU A 70 18.148 -17.620 -18.035 1.00 62.00 H new ATOM 1195 N GLU A 71 12.881 -18.948 -17.400 1.00 3.41 N ATOM 1196 CA GLU A 71 11.741 -19.782 -17.039 1.00 24.12 C ATOM 1197 C GLU A 71 11.335 -20.682 -18.202 1.00 45.15 C ATOM 1198 O GLU A 71 10.813 -21.778 -18.000 1.00 52.54 O ATOM 1199 CB GLU A 71 10.557 -18.911 -16.616 1.00 53.32 C ATOM 1200 CG GLU A 71 9.493 -19.666 -15.838 1.00 33.12 C ATOM 1201 CD GLU A 71 8.423 -20.257 -16.735 1.00 54.11 C ATOM 1202 OE1 GLU A 71 7.580 -19.485 -17.240 1.00 31.34 O ATOM 1203 OE2 GLU A 71 8.427 -21.490 -16.933 1.00 3.24 O ATOM 0 H GLU A 71 12.663 -17.957 -17.502 1.00 3.41 H new ATOM 0 HA GLU A 71 12.036 -20.413 -16.200 1.00 24.12 H new ATOM 0 HB2 GLU A 71 10.924 -18.085 -16.006 1.00 53.32 H new ATOM 0 HB3 GLU A 71 10.103 -18.473 -17.505 1.00 53.32 H new ATOM 0 HG2 GLU A 71 9.965 -20.465 -15.267 1.00 33.12 H new ATOM 0 HG3 GLU A 71 9.027 -18.992 -15.119 1.00 33.12 H new ATOM 1210 N MET A 72 11.580 -20.210 -19.421 1.00 33.13 N ATOM 1211 CA MET A 72 11.240 -20.972 -20.617 1.00 43.10 C ATOM 1212 C MET A 72 12.394 -21.881 -21.028 1.00 30.32 C ATOM 1213 O MET A 72 12.213 -22.817 -21.807 1.00 44.04 O ATOM 1214 CB MET A 72 10.887 -20.026 -21.766 1.00 73.25 C ATOM 1215 CG MET A 72 12.099 -19.377 -22.414 1.00 10.20 C ATOM 1216 SD MET A 72 11.655 -18.270 -23.767 1.00 32.53 S ATOM 1217 CE MET A 72 11.421 -19.443 -25.100 1.00 64.13 C ATOM 0 H MET A 72 12.012 -19.305 -19.606 1.00 33.13 H new ATOM 0 HA MET A 72 10.374 -21.594 -20.388 1.00 43.10 H new ATOM 0 HB2 MET A 72 10.333 -20.580 -22.524 1.00 73.25 H new ATOM 0 HB3 MET A 72 10.224 -19.246 -21.393 1.00 73.25 H new ATOM 0 HG2 MET A 72 12.654 -18.818 -21.660 1.00 10.20 H new ATOM 0 HG3 MET A 72 12.765 -20.154 -22.789 1.00 10.20 H new ATOM 0 HE1 MET A 72 11.142 -18.910 -26.009 1.00 64.13 H new ATOM 0 HE2 MET A 72 12.348 -19.990 -25.270 1.00 64.13 H new ATOM 0 HE3 MET A 72 10.630 -20.144 -24.833 1.00 64.13 H new ATOM 1227 N LYS A 73 13.580 -21.600 -20.499 1.00 21.40 N ATOM 1228 CA LYS A 73 14.764 -22.393 -20.809 1.00 72.14 C ATOM 1229 C LYS A 73 15.010 -23.447 -19.734 1.00 45.42 C ATOM 1230 O LYS A 73 15.875 -24.310 -19.884 1.00 52.43 O ATOM 1231 CB LYS A 73 15.990 -21.487 -20.941 1.00 12.30 C ATOM 1232 CG LYS A 73 16.159 -20.889 -22.327 1.00 74.32 C ATOM 1233 CD LYS A 73 17.612 -20.906 -22.769 1.00 24.44 C ATOM 1234 CE LYS A 73 17.968 -22.210 -23.466 1.00 72.43 C ATOM 1235 NZ LYS A 73 17.196 -22.393 -24.727 1.00 20.54 N ATOM 0 H LYS A 73 13.747 -20.828 -19.853 1.00 21.40 H new ATOM 0 HA LYS A 73 14.592 -22.901 -21.758 1.00 72.14 H new ATOM 0 HB2 LYS A 73 15.914 -20.679 -20.213 1.00 12.30 H new ATOM 0 HB3 LYS A 73 16.883 -22.060 -20.690 1.00 12.30 H new ATOM 0 HG2 LYS A 73 15.554 -21.448 -23.041 1.00 74.32 H new ATOM 0 HG3 LYS A 73 15.789 -19.864 -22.329 1.00 74.32 H new ATOM 0 HD2 LYS A 73 17.798 -20.070 -23.443 1.00 24.44 H new ATOM 0 HD3 LYS A 73 18.259 -20.767 -21.902 1.00 24.44 H new ATOM 0 HE2 LYS A 73 19.035 -22.224 -23.688 1.00 72.43 H new ATOM 0 HE3 LYS A 73 17.771 -23.046 -22.795 1.00 72.43 H new ATOM 0 HZ1 LYS A 73 17.739 -22.991 -25.383 1.00 20.54 H new ATOM 0 HZ2 LYS A 73 16.286 -22.850 -24.514 1.00 20.54 H new ATOM 0 HZ3 LYS A 73 17.023 -21.466 -25.166 1.00 20.54 H new ATOM 1249 N ALA A 74 14.245 -23.370 -18.651 1.00 34.43 N ATOM 1250 CA ALA A 74 14.378 -24.320 -17.553 1.00 1.54 C ATOM 1251 C ALA A 74 13.803 -25.680 -17.930 1.00 71.42 C ATOM 1252 O ALA A 74 13.826 -26.617 -17.132 1.00 74.51 O ATOM 1253 CB ALA A 74 13.693 -23.783 -16.305 1.00 11.43 C ATOM 0 H ALA A 74 13.527 -22.660 -18.510 1.00 34.43 H new ATOM 0 HA ALA A 74 15.440 -24.450 -17.345 1.00 1.54 H new ATOM 0 HB1 ALA A 74 13.800 -24.502 -15.493 1.00 11.43 H new ATOM 0 HB2 ALA A 74 14.153 -22.838 -16.016 1.00 11.43 H new ATOM 0 HB3 ALA A 74 12.635 -23.623 -16.511 1.00 11.43 H new ATOM 1259 N ARG A 75 13.287 -25.782 -19.151 1.00 3.41 N ATOM 1260 CA ARG A 75 12.704 -27.028 -19.633 1.00 43.21 C ATOM 1261 C ARG A 75 11.713 -27.592 -18.620 1.00 31.13 C ATOM 1262 O ARG A 75 11.495 -28.802 -18.555 1.00 72.23 O ATOM 1263 CB ARG A 75 13.803 -28.055 -19.914 1.00 10.42 C ATOM 1264 CG ARG A 75 13.401 -29.116 -20.925 1.00 34.25 C ATOM 1265 CD ARG A 75 13.465 -28.583 -22.347 1.00 74.44 C ATOM 1266 NE ARG A 75 13.354 -29.651 -23.337 1.00 64.53 N ATOM 1267 CZ ARG A 75 14.316 -30.537 -23.573 1.00 42.34 C ATOM 1268 NH1 ARG A 75 15.453 -30.482 -22.894 1.00 45.01 N ATOM 1269 NH2 ARG A 75 14.141 -31.480 -24.490 1.00 41.33 N ATOM 0 H ARG A 75 13.261 -25.016 -19.824 1.00 3.41 H new ATOM 0 HA ARG A 75 12.169 -26.816 -20.559 1.00 43.21 H new ATOM 0 HB2 ARG A 75 14.689 -27.536 -20.278 1.00 10.42 H new ATOM 0 HB3 ARG A 75 14.081 -28.542 -18.979 1.00 10.42 H new ATOM 0 HG2 ARG A 75 14.059 -29.979 -20.829 1.00 34.25 H new ATOM 0 HG3 ARG A 75 12.390 -29.461 -20.710 1.00 34.25 H new ATOM 0 HD2 ARG A 75 12.662 -27.862 -22.500 1.00 74.44 H new ATOM 0 HD3 ARG A 75 14.405 -28.050 -22.492 1.00 74.44 H new ATOM 0 HE ARG A 75 12.491 -29.721 -23.877 1.00 64.53 H new ATOM 0 HH11 ARG A 75 15.591 -29.758 -22.188 1.00 45.01 H new ATOM 0 HH12 ARG A 75 16.190 -31.163 -23.077 1.00 45.01 H new ATOM 0 HH21 ARG A 75 13.267 -31.525 -25.015 1.00 41.33 H new ATOM 0 HH22 ARG A 75 14.880 -32.159 -24.670 1.00 41.33 H new ATOM 1283 N LYS A 76 11.115 -26.707 -17.829 1.00 21.41 N ATOM 1284 CA LYS A 76 10.146 -27.115 -16.819 1.00 21.45 C ATOM 1285 C LYS A 76 9.605 -25.905 -16.064 1.00 20.43 C ATOM 1286 O LYS A 76 10.364 -25.156 -15.449 1.00 15.25 O ATOM 1287 CB LYS A 76 10.786 -28.098 -15.836 1.00 24.42 C ATOM 1288 CG LYS A 76 9.850 -29.206 -15.386 1.00 75.24 C ATOM 1289 CD LYS A 76 9.585 -30.200 -16.505 1.00 34.35 C ATOM 1290 CE LYS A 76 8.816 -31.413 -16.002 1.00 11.31 C ATOM 1291 NZ LYS A 76 7.507 -31.030 -15.403 1.00 24.54 N ATOM 0 H LYS A 76 11.285 -25.702 -17.868 1.00 21.41 H new ATOM 0 HA LYS A 76 9.316 -27.606 -17.326 1.00 21.45 H new ATOM 0 HB2 LYS A 76 11.665 -28.544 -16.302 1.00 24.42 H new ATOM 0 HB3 LYS A 76 11.133 -27.549 -14.960 1.00 24.42 H new ATOM 0 HG2 LYS A 76 10.284 -29.726 -14.532 1.00 75.24 H new ATOM 0 HG3 LYS A 76 8.907 -28.774 -15.051 1.00 75.24 H new ATOM 0 HD2 LYS A 76 9.020 -29.713 -17.299 1.00 34.35 H new ATOM 0 HD3 LYS A 76 10.532 -30.522 -16.939 1.00 34.35 H new ATOM 0 HE2 LYS A 76 8.649 -32.105 -16.827 1.00 11.31 H new ATOM 0 HE3 LYS A 76 9.415 -31.941 -15.260 1.00 11.31 H new ATOM 0 HZ1 LYS A 76 6.942 -31.885 -15.227 1.00 24.54 H new ATOM 0 HZ2 LYS A 76 7.669 -30.532 -14.505 1.00 24.54 H new ATOM 0 HZ3 LYS A 76 6.995 -30.405 -16.058 1.00 24.54 H new ATOM 1305 N ARG A 77 8.290 -25.722 -16.114 1.00 13.01 N ATOM 1306 CA ARG A 77 7.648 -24.603 -15.434 1.00 72.14 C ATOM 1307 C ARG A 77 7.866 -24.685 -13.926 1.00 63.25 C ATOM 1308 O ARG A 77 7.149 -25.397 -13.222 1.00 70.02 O ATOM 1309 CB ARG A 77 6.150 -24.583 -15.743 1.00 54.01 C ATOM 1310 CG ARG A 77 5.467 -25.925 -15.536 1.00 61.24 C ATOM 1311 CD ARG A 77 4.124 -25.766 -14.841 1.00 21.10 C ATOM 1312 NE ARG A 77 4.257 -25.133 -13.532 1.00 4.42 N ATOM 1313 CZ ARG A 77 3.231 -24.646 -12.843 1.00 21.00 C ATOM 1314 NH1 ARG A 77 2.003 -24.720 -13.336 1.00 74.31 N ATOM 1315 NH2 ARG A 77 3.433 -24.084 -11.658 1.00 34.00 N ATOM 0 H ARG A 77 7.648 -26.334 -16.618 1.00 13.01 H new ATOM 0 HA ARG A 77 8.100 -23.681 -15.799 1.00 72.14 H new ATOM 0 HB2 ARG A 77 5.667 -23.838 -15.111 1.00 54.01 H new ATOM 0 HB3 ARG A 77 6.005 -24.267 -16.776 1.00 54.01 H new ATOM 0 HG2 ARG A 77 5.323 -26.414 -16.500 1.00 61.24 H new ATOM 0 HG3 ARG A 77 6.111 -26.574 -14.942 1.00 61.24 H new ATOM 0 HD2 ARG A 77 3.460 -25.169 -15.467 1.00 21.10 H new ATOM 0 HD3 ARG A 77 3.658 -26.744 -14.725 1.00 21.10 H new ATOM 0 HE ARG A 77 5.189 -25.061 -13.124 1.00 4.42 H new ATOM 0 HH11 ARG A 77 1.844 -25.152 -14.246 1.00 74.31 H new ATOM 0 HH12 ARG A 77 1.217 -24.345 -12.805 1.00 74.31 H new ATOM 0 HH21 ARG A 77 4.377 -24.026 -11.275 1.00 34.00 H new ATOM 0 HH22 ARG A 77 2.645 -23.710 -11.130 1.00 34.00 H new ATOM 1329 N LEU A 78 8.861 -23.953 -13.437 1.00 70.04 N ATOM 1330 CA LEU A 78 9.175 -23.943 -12.013 1.00 12.22 C ATOM 1331 C LEU A 78 7.920 -23.697 -11.181 1.00 4.14 C ATOM 1332 O LEU A 78 6.947 -23.100 -11.641 1.00 42.22 O ATOM 1333 CB LEU A 78 10.221 -22.869 -11.709 1.00 20.13 C ATOM 1334 CG LEU A 78 11.660 -23.360 -11.548 1.00 61.53 C ATOM 1335 CD1 LEU A 78 12.047 -24.266 -12.707 1.00 21.30 C ATOM 1336 CD2 LEU A 78 12.618 -22.182 -11.447 1.00 72.22 C ATOM 0 H LEU A 78 9.464 -23.359 -14.006 1.00 70.04 H new ATOM 0 HA LEU A 78 9.579 -24.920 -11.748 1.00 12.22 H new ATOM 0 HB2 LEU A 78 10.198 -22.131 -12.510 1.00 20.13 H new ATOM 0 HB3 LEU A 78 9.929 -22.355 -10.793 1.00 20.13 H new ATOM 0 HG LEU A 78 11.726 -23.936 -10.625 1.00 61.53 H new ATOM 0 HD11 LEU A 78 13.074 -24.606 -12.576 1.00 21.30 H new ATOM 0 HD12 LEU A 78 11.380 -25.128 -12.734 1.00 21.30 H new ATOM 0 HD13 LEU A 78 11.964 -23.714 -13.643 1.00 21.30 H new ATOM 0 HD21 LEU A 78 13.637 -22.551 -11.333 1.00 72.22 H new ATOM 0 HD22 LEU A 78 12.550 -21.579 -12.352 1.00 72.22 H new ATOM 0 HD23 LEU A 78 12.354 -21.572 -10.583 1.00 72.22 H new ATOM 1348 N PRO A 79 7.942 -24.166 -9.924 1.00 43.40 N ATOM 1349 CA PRO A 79 6.816 -24.006 -9.000 1.00 34.11 C ATOM 1350 C PRO A 79 6.627 -22.558 -8.561 1.00 33.13 C ATOM 1351 O PRO A 79 5.644 -22.222 -7.899 1.00 3.15 O ATOM 1352 CB PRO A 79 7.209 -24.880 -7.806 1.00 44.23 C ATOM 1353 CG PRO A 79 8.697 -24.936 -7.852 1.00 44.52 C ATOM 1354 CD PRO A 79 9.069 -24.887 -9.308 1.00 51.15 C ATOM 0 HA PRO A 79 5.869 -24.289 -9.459 1.00 34.11 H new ATOM 0 HB2 PRO A 79 6.858 -24.450 -6.868 1.00 44.23 H new ATOM 0 HB3 PRO A 79 6.773 -25.876 -7.883 1.00 44.23 H new ATOM 0 HG2 PRO A 79 9.136 -24.099 -7.309 1.00 44.52 H new ATOM 0 HG3 PRO A 79 9.068 -25.849 -7.385 1.00 44.52 H new ATOM 0 HD2 PRO A 79 10.013 -24.365 -9.464 1.00 51.15 H new ATOM 0 HD3 PRO A 79 9.184 -25.887 -9.727 1.00 51.15 H new ATOM 1362 N THR A 80 7.574 -21.703 -8.934 1.00 13.23 N ATOM 1363 CA THR A 80 7.512 -20.291 -8.578 1.00 12.13 C ATOM 1364 C THR A 80 7.650 -19.406 -9.811 1.00 75.35 C ATOM 1365 O THR A 80 8.159 -19.839 -10.846 1.00 24.24 O ATOM 1366 CB THR A 80 8.612 -19.918 -7.567 1.00 5.41 C ATOM 1367 OG1 THR A 80 8.702 -18.494 -7.444 1.00 10.24 O ATOM 1368 CG2 THR A 80 9.958 -20.480 -8.000 1.00 1.12 C ATOM 0 H THR A 80 8.393 -21.964 -9.483 1.00 13.23 H new ATOM 0 HA THR A 80 6.537 -20.123 -8.121 1.00 12.13 H new ATOM 0 HB THR A 80 8.349 -20.350 -6.602 1.00 5.41 H new ATOM 0 HG1 THR A 80 8.523 -18.234 -6.516 1.00 10.24 H new ATOM 0 HG21 THR A 80 10.719 -20.204 -7.271 1.00 1.12 H new ATOM 0 HG22 THR A 80 9.895 -21.566 -8.065 1.00 1.12 H new ATOM 0 HG23 THR A 80 10.225 -20.073 -8.975 1.00 1.12 H new ATOM 1376 N THR A 81 7.192 -18.163 -9.697 1.00 23.12 N ATOM 1377 CA THR A 81 7.264 -17.217 -10.803 1.00 62.32 C ATOM 1378 C THR A 81 8.205 -16.062 -10.479 1.00 60.51 C ATOM 1379 O THR A 81 8.737 -15.411 -11.379 1.00 5.34 O ATOM 1380 CB THR A 81 5.874 -16.651 -11.149 1.00 43.50 C ATOM 1381 OG1 THR A 81 4.907 -17.706 -11.175 1.00 23.31 O ATOM 1382 CG2 THR A 81 5.898 -15.944 -12.496 1.00 73.21 C ATOM 0 H THR A 81 6.767 -17.788 -8.849 1.00 23.12 H new ATOM 0 HA THR A 81 7.649 -17.765 -11.663 1.00 62.32 H new ATOM 0 HB THR A 81 5.600 -15.927 -10.381 1.00 43.50 H new ATOM 0 HG1 THR A 81 4.026 -17.337 -11.394 1.00 23.31 H new ATOM 0 HG21 THR A 81 4.906 -15.553 -12.719 1.00 73.21 H new ATOM 0 HG22 THR A 81 6.613 -15.122 -12.463 1.00 73.21 H new ATOM 0 HG23 THR A 81 6.192 -16.650 -13.272 1.00 73.21 H new ATOM 1390 N LEU A 82 8.407 -15.814 -9.190 1.00 33.02 N ATOM 1391 CA LEU A 82 9.285 -14.737 -8.747 1.00 22.05 C ATOM 1392 C LEU A 82 10.628 -15.288 -8.278 1.00 45.25 C ATOM 1393 O LEU A 82 10.959 -15.224 -7.094 1.00 50.42 O ATOM 1394 CB LEU A 82 8.624 -13.945 -7.617 1.00 21.42 C ATOM 1395 CG LEU A 82 7.798 -12.731 -8.042 1.00 42.04 C ATOM 1396 CD1 LEU A 82 7.155 -12.072 -6.832 1.00 20.21 C ATOM 1397 CD2 LEU A 82 8.666 -11.734 -8.797 1.00 13.24 C ATOM 0 H LEU A 82 7.975 -16.344 -8.433 1.00 33.02 H new ATOM 0 HA LEU A 82 9.460 -14.073 -9.594 1.00 22.05 H new ATOM 0 HB2 LEU A 82 7.978 -14.621 -7.057 1.00 21.42 H new ATOM 0 HB3 LEU A 82 9.403 -13.608 -6.933 1.00 21.42 H new ATOM 0 HG LEU A 82 7.005 -13.070 -8.708 1.00 42.04 H new ATOM 0 HD11 LEU A 82 6.571 -11.210 -7.155 1.00 20.21 H new ATOM 0 HD12 LEU A 82 6.501 -12.787 -6.333 1.00 20.21 H new ATOM 0 HD13 LEU A 82 7.931 -11.746 -6.140 1.00 20.21 H new ATOM 0 HD21 LEU A 82 8.062 -10.876 -9.092 1.00 13.24 H new ATOM 0 HD22 LEU A 82 9.480 -11.400 -8.154 1.00 13.24 H new ATOM 0 HD23 LEU A 82 9.078 -12.211 -9.686 1.00 13.24 H new ATOM 1409 N PHE A 83 11.400 -15.827 -9.216 1.00 61.23 N ATOM 1410 CA PHE A 83 12.709 -16.388 -8.900 1.00 74.14 C ATOM 1411 C PHE A 83 13.803 -15.708 -9.717 1.00 65.22 C ATOM 1412 O PHE A 83 13.548 -15.177 -10.798 1.00 60.23 O ATOM 1413 CB PHE A 83 12.719 -17.895 -9.167 1.00 10.21 C ATOM 1414 CG PHE A 83 12.401 -18.254 -10.590 1.00 43.03 C ATOM 1415 CD1 PHE A 83 13.297 -17.966 -11.608 1.00 12.13 C ATOM 1416 CD2 PHE A 83 11.208 -18.880 -10.911 1.00 33.11 C ATOM 1417 CE1 PHE A 83 13.006 -18.295 -12.918 1.00 45.43 C ATOM 1418 CE2 PHE A 83 10.912 -19.212 -12.220 1.00 1.32 C ATOM 1419 CZ PHE A 83 11.813 -18.919 -13.225 1.00 23.44 C ATOM 0 H PHE A 83 11.142 -15.887 -10.201 1.00 61.23 H new ATOM 0 HA PHE A 83 12.907 -16.212 -7.843 1.00 74.14 H new ATOM 0 HB2 PHE A 83 13.700 -18.295 -8.910 1.00 10.21 H new ATOM 0 HB3 PHE A 83 11.996 -18.377 -8.509 1.00 10.21 H new ATOM 0 HD1 PHE A 83 14.232 -17.479 -11.375 1.00 12.13 H new ATOM 0 HD2 PHE A 83 10.500 -19.112 -10.129 1.00 33.11 H new ATOM 0 HE1 PHE A 83 13.712 -18.064 -13.702 1.00 45.43 H new ATOM 0 HE2 PHE A 83 9.978 -19.700 -12.456 1.00 1.32 H new ATOM 0 HZ PHE A 83 11.585 -19.177 -14.249 1.00 23.44 H new ATOM 1429 N PHE A 84 15.024 -15.728 -9.192 1.00 30.20 N ATOM 1430 CA PHE A 84 16.158 -15.113 -9.871 1.00 5.34 C ATOM 1431 C PHE A 84 17.322 -16.094 -9.984 1.00 52.42 C ATOM 1432 O PHE A 84 17.260 -17.209 -9.465 1.00 41.43 O ATOM 1433 CB PHE A 84 16.607 -13.856 -9.122 1.00 25.23 C ATOM 1434 CG PHE A 84 16.437 -12.592 -9.915 1.00 63.43 C ATOM 1435 CD1 PHE A 84 15.188 -12.011 -10.058 1.00 34.13 C ATOM 1436 CD2 PHE A 84 17.527 -11.985 -10.518 1.00 60.45 C ATOM 1437 CE1 PHE A 84 15.028 -10.849 -10.788 1.00 44.31 C ATOM 1438 CE2 PHE A 84 17.374 -10.823 -11.250 1.00 11.41 C ATOM 1439 CZ PHE A 84 16.123 -10.253 -11.384 1.00 11.01 C ATOM 0 H PHE A 84 15.253 -16.164 -8.299 1.00 30.20 H new ATOM 0 HA PHE A 84 15.841 -14.835 -10.876 1.00 5.34 H new ATOM 0 HB2 PHE A 84 16.039 -13.773 -8.195 1.00 25.23 H new ATOM 0 HB3 PHE A 84 17.656 -13.963 -8.845 1.00 25.23 H new ATOM 0 HD1 PHE A 84 14.329 -12.472 -9.593 1.00 34.13 H new ATOM 0 HD2 PHE A 84 18.508 -12.425 -10.415 1.00 60.45 H new ATOM 0 HE1 PHE A 84 14.048 -10.407 -10.893 1.00 44.31 H new ATOM 0 HE2 PHE A 84 18.231 -10.361 -11.717 1.00 11.41 H new ATOM 0 HZ PHE A 84 16.001 -9.343 -11.953 1.00 11.01 H new ATOM 1449 N ILE A 85 18.380 -15.670 -10.667 1.00 22.22 N ATOM 1450 CA ILE A 85 19.557 -16.510 -10.848 1.00 65.34 C ATOM 1451 C ILE A 85 20.765 -15.930 -10.119 1.00 74.13 C ATOM 1452 O ILE A 85 20.860 -14.719 -9.924 1.00 20.05 O ATOM 1453 CB ILE A 85 19.905 -16.678 -12.339 1.00 75.44 C ATOM 1454 CG1 ILE A 85 20.462 -15.371 -12.906 1.00 72.14 C ATOM 1455 CG2 ILE A 85 18.677 -17.121 -13.122 1.00 64.12 C ATOM 1456 CD1 ILE A 85 20.783 -15.441 -14.383 1.00 32.11 C ATOM 0 H ILE A 85 18.446 -14.751 -11.104 1.00 22.22 H new ATOM 0 HA ILE A 85 19.315 -17.486 -10.427 1.00 65.34 H new ATOM 0 HB ILE A 85 20.671 -17.448 -12.434 1.00 75.44 H new ATOM 0 HG12 ILE A 85 19.738 -14.574 -12.737 1.00 72.14 H new ATOM 0 HG13 ILE A 85 21.365 -15.103 -12.358 1.00 72.14 H new ATOM 0 HG21 ILE A 85 18.938 -17.236 -14.174 1.00 64.12 H new ATOM 0 HG22 ILE A 85 18.320 -18.074 -12.731 1.00 64.12 H new ATOM 0 HG23 ILE A 85 17.892 -16.371 -13.023 1.00 64.12 H new ATOM 0 HD11 ILE A 85 21.173 -14.479 -14.716 1.00 32.11 H new ATOM 0 HD12 ILE A 85 21.530 -16.216 -14.557 1.00 32.11 H new ATOM 0 HD13 ILE A 85 19.877 -15.678 -14.941 1.00 32.11 H new ATOM 1468 N GLU A 86 21.685 -16.803 -9.721 1.00 72.25 N ATOM 1469 CA GLU A 86 22.887 -16.376 -9.015 1.00 32.42 C ATOM 1470 C GLU A 86 23.889 -15.746 -9.978 1.00 20.14 C ATOM 1471 O GLU A 86 24.744 -14.957 -9.574 1.00 24.41 O ATOM 1472 CB GLU A 86 23.531 -17.563 -8.296 1.00 30.53 C ATOM 1473 CG GLU A 86 24.862 -17.230 -7.642 1.00 75.01 C ATOM 1474 CD GLU A 86 25.068 -17.964 -6.331 1.00 71.14 C ATOM 1475 OE1 GLU A 86 24.129 -17.985 -5.508 1.00 61.44 O ATOM 1476 OE2 GLU A 86 26.169 -18.518 -6.129 1.00 40.32 O ATOM 0 H GLU A 86 21.621 -17.809 -9.875 1.00 72.25 H new ATOM 0 HA GLU A 86 22.598 -15.627 -8.278 1.00 32.42 H new ATOM 0 HB2 GLU A 86 22.844 -17.932 -7.534 1.00 30.53 H new ATOM 0 HB3 GLU A 86 23.679 -18.373 -9.011 1.00 30.53 H new ATOM 0 HG2 GLU A 86 25.672 -17.482 -8.326 1.00 75.01 H new ATOM 0 HG3 GLU A 86 24.917 -16.156 -7.465 1.00 75.01 H new ATOM 1483 N THR A 87 23.778 -16.100 -11.254 1.00 74.22 N ATOM 1484 CA THR A 87 24.674 -15.572 -12.275 1.00 12.21 C ATOM 1485 C THR A 87 24.354 -14.114 -12.586 1.00 61.20 C ATOM 1486 O THR A 87 25.065 -13.462 -13.351 1.00 62.51 O ATOM 1487 CB THR A 87 24.590 -16.393 -13.575 1.00 41.25 C ATOM 1488 OG1 THR A 87 23.279 -16.950 -13.720 1.00 11.13 O ATOM 1489 CG2 THR A 87 25.624 -17.509 -13.578 1.00 51.13 C ATOM 0 H THR A 87 23.076 -16.751 -11.605 1.00 74.22 H new ATOM 0 HA THR A 87 25.686 -15.642 -11.875 1.00 12.21 H new ATOM 0 HB THR A 87 24.795 -15.727 -14.413 1.00 41.25 H new ATOM 0 HG1 THR A 87 23.234 -17.469 -14.550 1.00 11.13 H new ATOM 0 HG21 THR A 87 25.546 -18.075 -14.506 1.00 51.13 H new ATOM 0 HG22 THR A 87 26.623 -17.080 -13.498 1.00 51.13 H new ATOM 0 HG23 THR A 87 25.446 -18.173 -12.732 1.00 51.13 H new ATOM 1497 N ASP A 88 23.281 -13.608 -11.988 1.00 62.12 N ATOM 1498 CA ASP A 88 22.868 -12.226 -12.200 1.00 43.34 C ATOM 1499 C ASP A 88 23.028 -11.409 -10.922 1.00 41.52 C ATOM 1500 O ASP A 88 22.775 -10.204 -10.909 1.00 14.44 O ATOM 1501 CB ASP A 88 21.416 -12.172 -12.677 1.00 32.25 C ATOM 1502 CG ASP A 88 21.074 -10.856 -13.347 1.00 4.13 C ATOM 1503 OD1 ASP A 88 22.009 -10.090 -13.659 1.00 44.41 O ATOM 1504 OD2 ASP A 88 19.872 -10.592 -13.558 1.00 41.41 O ATOM 0 H ASP A 88 22.681 -14.134 -11.353 1.00 62.12 H new ATOM 0 HA ASP A 88 23.510 -11.795 -12.968 1.00 43.34 H new ATOM 0 HB2 ASP A 88 21.236 -12.989 -13.375 1.00 32.25 H new ATOM 0 HB3 ASP A 88 20.752 -12.327 -11.827 1.00 32.25 H new ATOM 1509 N ILE A 89 23.449 -12.072 -9.851 1.00 35.15 N ATOM 1510 CA ILE A 89 23.642 -11.407 -8.568 1.00 33.00 C ATOM 1511 C ILE A 89 25.050 -11.642 -8.033 1.00 64.25 C ATOM 1512 O ILE A 89 25.674 -10.737 -7.480 1.00 4.20 O ATOM 1513 CB ILE A 89 22.620 -11.893 -7.523 1.00 4.45 C ATOM 1514 CG1 ILE A 89 21.197 -11.751 -8.065 1.00 35.24 C ATOM 1515 CG2 ILE A 89 22.779 -11.113 -6.225 1.00 70.55 C ATOM 1516 CD1 ILE A 89 20.131 -12.205 -7.091 1.00 5.52 C ATOM 0 H ILE A 89 23.663 -13.069 -9.846 1.00 35.15 H new ATOM 0 HA ILE A 89 23.495 -10.341 -8.740 1.00 33.00 H new ATOM 0 HB ILE A 89 22.806 -12.947 -7.317 1.00 4.45 H new ATOM 0 HG12 ILE A 89 21.019 -10.708 -8.326 1.00 35.24 H new ATOM 0 HG13 ILE A 89 21.108 -12.329 -8.985 1.00 35.24 H new ATOM 0 HG21 ILE A 89 22.050 -11.467 -5.496 1.00 70.55 H new ATOM 0 HG22 ILE A 89 23.785 -11.260 -5.833 1.00 70.55 H new ATOM 0 HG23 ILE A 89 22.615 -10.052 -6.416 1.00 70.55 H new ATOM 0 HD11 ILE A 89 19.147 -12.076 -7.542 1.00 5.52 H new ATOM 0 HD12 ILE A 89 20.284 -13.257 -6.849 1.00 5.52 H new ATOM 0 HD13 ILE A 89 20.193 -11.610 -6.180 1.00 5.52 H new ATOM 1528 N ARG A 90 25.546 -12.863 -8.204 1.00 70.45 N ATOM 1529 CA ARG A 90 26.882 -13.218 -7.740 1.00 13.12 C ATOM 1530 C ARG A 90 27.910 -12.191 -8.206 1.00 33.01 C ATOM 1531 O ARG A 90 28.654 -11.616 -7.411 1.00 34.20 O ATOM 1532 CB ARG A 90 27.269 -14.609 -8.246 1.00 54.41 C ATOM 1533 CG ARG A 90 28.762 -14.884 -8.189 1.00 43.34 C ATOM 1534 CD ARG A 90 29.403 -14.767 -9.564 1.00 12.24 C ATOM 1535 NE ARG A 90 30.613 -15.577 -9.674 1.00 41.31 N ATOM 1536 CZ ARG A 90 31.332 -15.675 -10.787 1.00 23.44 C ATOM 1537 NH1 ARG A 90 30.965 -15.018 -11.878 1.00 21.11 N ATOM 1538 NH2 ARG A 90 32.422 -16.433 -10.809 1.00 13.43 N ATOM 0 H ARG A 90 25.043 -13.623 -8.661 1.00 70.45 H new ATOM 0 HA ARG A 90 26.870 -13.226 -6.650 1.00 13.12 H new ATOM 0 HB2 ARG A 90 26.747 -15.360 -7.653 1.00 54.41 H new ATOM 0 HB3 ARG A 90 26.927 -14.720 -9.275 1.00 54.41 H new ATOM 0 HG2 ARG A 90 29.237 -14.181 -7.504 1.00 43.34 H new ATOM 0 HG3 ARG A 90 28.934 -15.884 -7.790 1.00 43.34 H new ATOM 0 HD2 ARG A 90 28.688 -15.079 -10.325 1.00 12.24 H new ATOM 0 HD3 ARG A 90 29.646 -13.723 -9.763 1.00 12.24 H new ATOM 0 HE ARG A 90 30.923 -16.096 -8.852 1.00 41.31 H new ATOM 0 HH11 ARG A 90 30.128 -14.435 -11.865 1.00 21.11 H new ATOM 0 HH12 ARG A 90 31.519 -15.096 -12.731 1.00 21.11 H new ATOM 0 HH21 ARG A 90 32.707 -16.940 -9.971 1.00 13.43 H new ATOM 0 HH22 ARG A 90 32.974 -16.508 -11.664 1.00 13.43 H new ATOM 1552 N PRO A 91 27.954 -11.954 -9.525 1.00 71.54 N ATOM 1553 CA PRO A 91 28.886 -10.997 -10.127 1.00 44.31 C ATOM 1554 C PRO A 91 28.538 -9.553 -9.781 1.00 22.02 C ATOM 1555 O PRO A 91 29.221 -8.621 -10.206 1.00 34.33 O ATOM 1556 CB PRO A 91 28.724 -11.240 -11.630 1.00 25.14 C ATOM 1557 CG PRO A 91 27.352 -11.800 -11.777 1.00 30.31 C ATOM 1558 CD PRO A 91 27.097 -12.603 -10.532 1.00 33.54 C ATOM 0 HA PRO A 91 29.905 -11.139 -9.766 1.00 44.31 H new ATOM 0 HB2 PRO A 91 28.837 -10.315 -12.195 1.00 25.14 H new ATOM 0 HB3 PRO A 91 29.477 -11.935 -12.002 1.00 25.14 H new ATOM 0 HG2 PRO A 91 26.615 -11.004 -11.886 1.00 30.31 H new ATOM 0 HG3 PRO A 91 27.279 -12.426 -12.667 1.00 30.31 H new ATOM 0 HD2 PRO A 91 26.046 -12.574 -10.244 1.00 33.54 H new ATOM 0 HD3 PRO A 91 27.362 -13.652 -10.669 1.00 33.54 H new ATOM 1566 N MET A 92 27.473 -9.376 -9.007 1.00 13.54 N ATOM 1567 CA MET A 92 27.036 -8.044 -8.602 1.00 73.31 C ATOM 1568 C MET A 92 27.442 -7.753 -7.161 1.00 20.31 C ATOM 1569 O MET A 92 27.679 -6.602 -6.792 1.00 53.03 O ATOM 1570 CB MET A 92 25.519 -7.914 -8.753 1.00 32.53 C ATOM 1571 CG MET A 92 25.095 -7.142 -9.991 1.00 41.23 C ATOM 1572 SD MET A 92 23.764 -5.972 -9.658 1.00 51.14 S ATOM 1573 CE MET A 92 24.327 -4.546 -10.585 1.00 33.10 C ATOM 0 H MET A 92 26.897 -10.137 -8.648 1.00 13.54 H new ATOM 0 HA MET A 92 27.522 -7.316 -9.252 1.00 73.31 H new ATOM 0 HB2 MET A 92 25.079 -8.911 -8.788 1.00 32.53 H new ATOM 0 HB3 MET A 92 25.116 -7.418 -7.870 1.00 32.53 H new ATOM 0 HG2 MET A 92 25.955 -6.604 -10.391 1.00 41.23 H new ATOM 0 HG3 MET A 92 24.772 -7.844 -10.760 1.00 41.23 H new ATOM 0 HE1 MET A 92 23.607 -3.735 -10.478 1.00 33.10 H new ATOM 0 HE2 MET A 92 25.296 -4.224 -10.204 1.00 33.10 H new ATOM 0 HE3 MET A 92 24.421 -4.811 -11.638 1.00 33.10 H new ATOM 1583 N LEU A 93 27.521 -8.802 -6.350 1.00 32.41 N ATOM 1584 CA LEU A 93 27.899 -8.659 -4.948 1.00 75.21 C ATOM 1585 C LEU A 93 29.265 -7.993 -4.818 1.00 34.25 C ATOM 1586 O LEU A 93 29.386 -6.776 -4.947 1.00 42.50 O ATOM 1587 CB LEU A 93 27.917 -10.026 -4.262 1.00 63.43 C ATOM 1588 CG LEU A 93 26.603 -10.807 -4.286 1.00 32.14 C ATOM 1589 CD1 LEU A 93 26.848 -12.275 -3.972 1.00 0.21 C ATOM 1590 CD2 LEU A 93 25.609 -10.208 -3.301 1.00 22.12 C ATOM 0 H LEU A 93 27.328 -9.761 -6.639 1.00 32.41 H new ATOM 0 HA LEU A 93 27.159 -8.025 -4.460 1.00 75.21 H new ATOM 0 HB2 LEU A 93 28.688 -10.636 -4.733 1.00 63.43 H new ATOM 0 HB3 LEU A 93 28.213 -9.885 -3.223 1.00 63.43 H new ATOM 0 HG LEU A 93 26.179 -10.737 -5.288 1.00 32.14 H new ATOM 0 HD11 LEU A 93 25.901 -12.815 -3.994 1.00 0.21 H new ATOM 0 HD12 LEU A 93 27.524 -12.698 -4.715 1.00 0.21 H new ATOM 0 HD13 LEU A 93 27.295 -12.366 -2.982 1.00 0.21 H new ATOM 0 HD21 LEU A 93 24.679 -10.776 -3.331 1.00 22.12 H new ATOM 0 HD22 LEU A 93 26.026 -10.247 -2.295 1.00 22.12 H new ATOM 0 HD23 LEU A 93 25.409 -9.171 -3.571 1.00 22.12 H new ATOM 1602 N GLN A 94 30.289 -8.801 -4.563 1.00 11.25 N ATOM 1603 CA GLN A 94 31.646 -8.289 -4.416 1.00 64.13 C ATOM 1604 C GLN A 94 32.660 -9.256 -5.019 1.00 44.33 C ATOM 1605 O GLN A 94 32.487 -10.473 -4.955 1.00 54.22 O ATOM 1606 CB GLN A 94 31.968 -8.050 -2.940 1.00 14.10 C ATOM 1607 CG GLN A 94 33.456 -7.949 -2.650 1.00 24.32 C ATOM 1608 CD GLN A 94 33.768 -6.983 -1.524 1.00 54.32 C ATOM 1609 OE1 GLN A 94 34.330 -5.910 -1.749 1.00 31.51 O ATOM 1610 NE2 GLN A 94 33.403 -7.357 -0.304 1.00 35.43 N ATOM 0 H GLN A 94 30.205 -9.812 -4.454 1.00 11.25 H new ATOM 0 HA GLN A 94 31.710 -7.342 -4.952 1.00 64.13 H new ATOM 0 HB2 GLN A 94 31.480 -7.131 -2.615 1.00 14.10 H new ATOM 0 HB3 GLN A 94 31.545 -8.862 -2.349 1.00 14.10 H new ATOM 0 HG2 GLN A 94 33.840 -8.936 -2.393 1.00 24.32 H new ATOM 0 HG3 GLN A 94 33.977 -7.629 -3.552 1.00 24.32 H new ATOM 0 HE21 GLN A 94 32.940 -8.255 -0.163 1.00 35.43 H new ATOM 0 HE22 GLN A 94 33.586 -6.747 0.493 1.00 35.43 H new ATOM 1619 N ASP A 95 33.719 -8.706 -5.605 1.00 15.13 N ATOM 1620 CA ASP A 95 34.761 -9.519 -6.219 1.00 63.50 C ATOM 1621 C ASP A 95 35.532 -10.304 -5.162 1.00 0.13 C ATOM 1622 O ASP A 95 35.877 -11.468 -5.367 1.00 43.41 O ATOM 1623 CB ASP A 95 35.722 -8.637 -7.018 1.00 74.43 C ATOM 1624 CG ASP A 95 34.995 -7.643 -7.902 1.00 13.32 C ATOM 1625 OD1 ASP A 95 33.853 -7.938 -8.314 1.00 63.22 O ATOM 1626 OD2 ASP A 95 35.567 -6.568 -8.180 1.00 73.31 O ATOM 0 H ASP A 95 33.877 -7.700 -5.667 1.00 15.13 H new ATOM 0 HA ASP A 95 34.283 -10.228 -6.895 1.00 63.50 H new ATOM 0 HB2 ASP A 95 36.374 -8.098 -6.330 1.00 74.43 H new ATOM 0 HB3 ASP A 95 36.362 -9.268 -7.635 1.00 74.43 H new ATOM 1631 N ARG A 96 35.799 -9.658 -4.031 1.00 62.41 N ATOM 1632 CA ARG A 96 36.531 -10.295 -2.943 1.00 2.13 C ATOM 1633 C ARG A 96 35.580 -11.036 -2.008 1.00 14.43 C ATOM 1634 O ARG A 96 35.932 -11.355 -0.871 1.00 51.23 O ATOM 1635 CB ARG A 96 37.327 -9.251 -2.156 1.00 73.51 C ATOM 1636 CG ARG A 96 36.456 -8.305 -1.346 1.00 31.54 C ATOM 1637 CD ARG A 96 37.064 -8.019 0.018 1.00 3.13 C ATOM 1638 NE ARG A 96 37.536 -6.641 0.129 1.00 71.14 N ATOM 1639 CZ ARG A 96 38.712 -6.228 -0.331 1.00 12.14 C ATOM 1640 NH1 ARG A 96 39.531 -7.082 -0.928 1.00 40.15 N ATOM 1641 NH2 ARG A 96 39.070 -4.958 -0.193 1.00 2.25 N ATOM 0 H ARG A 96 35.519 -8.695 -3.845 1.00 62.41 H new ATOM 0 HA ARG A 96 37.222 -11.018 -3.377 1.00 2.13 H new ATOM 0 HB2 ARG A 96 38.016 -9.763 -1.484 1.00 73.51 H new ATOM 0 HB3 ARG A 96 37.933 -8.669 -2.851 1.00 73.51 H new ATOM 0 HG2 ARG A 96 36.327 -7.370 -1.891 1.00 31.54 H new ATOM 0 HG3 ARG A 96 35.464 -8.740 -1.220 1.00 31.54 H new ATOM 0 HD2 ARG A 96 36.322 -8.212 0.793 1.00 3.13 H new ATOM 0 HD3 ARG A 96 37.895 -8.702 0.195 1.00 3.13 H new ATOM 0 HE ARG A 96 36.930 -5.959 0.584 1.00 71.14 H new ATOM 0 HH11 ARG A 96 39.259 -8.059 -1.035 1.00 40.15 H new ATOM 0 HH12 ARG A 96 40.433 -6.762 -1.280 1.00 40.15 H new ATOM 0 HH21 ARG A 96 38.442 -4.298 0.266 1.00 2.25 H new ATOM 0 HH22 ARG A 96 39.973 -4.641 -0.546 1.00 2.25 H new ATOM 1655 N LEU A 97 34.373 -11.306 -2.493 1.00 12.52 N ATOM 1656 CA LEU A 97 33.369 -12.008 -1.701 1.00 24.42 C ATOM 1657 C LEU A 97 33.638 -13.510 -1.690 1.00 51.12 C ATOM 1658 O LEU A 97 33.226 -14.218 -0.771 1.00 54.31 O ATOM 1659 CB LEU A 97 31.970 -11.733 -2.254 1.00 10.14 C ATOM 1660 CG LEU A 97 30.803 -12.271 -1.425 1.00 10.21 C ATOM 1661 CD1 LEU A 97 31.001 -11.949 0.048 1.00 1.41 C ATOM 1662 CD2 LEU A 97 29.485 -11.698 -1.925 1.00 71.44 C ATOM 0 H LEU A 97 34.066 -11.049 -3.431 1.00 12.52 H new ATOM 0 HA LEU A 97 33.426 -11.639 -0.677 1.00 24.42 H new ATOM 0 HB2 LEU A 97 31.848 -10.655 -2.359 1.00 10.14 H new ATOM 0 HB3 LEU A 97 31.906 -12.160 -3.255 1.00 10.14 H new ATOM 0 HG LEU A 97 30.772 -13.355 -1.538 1.00 10.21 H new ATOM 0 HD11 LEU A 97 30.161 -12.340 0.622 1.00 1.41 H new ATOM 0 HD12 LEU A 97 31.925 -12.408 0.400 1.00 1.41 H new ATOM 0 HD13 LEU A 97 31.059 -10.869 0.180 1.00 1.41 H new ATOM 0 HD21 LEU A 97 28.666 -12.092 -1.324 1.00 71.44 H new ATOM 0 HD22 LEU A 97 29.506 -10.611 -1.843 1.00 71.44 H new ATOM 0 HD23 LEU A 97 29.338 -11.980 -2.968 1.00 71.44 H new ATOM 1674 N ARG A 98 34.333 -13.989 -2.717 1.00 0.33 N ATOM 1675 CA ARG A 98 34.658 -15.406 -2.825 1.00 14.11 C ATOM 1676 C ARG A 98 33.391 -16.243 -2.979 1.00 65.45 C ATOM 1677 O ARG A 98 32.278 -15.782 -2.729 1.00 51.44 O ATOM 1678 CB ARG A 98 35.440 -15.867 -1.594 1.00 30.21 C ATOM 1679 CG ARG A 98 36.932 -16.015 -1.841 1.00 5.41 C ATOM 1680 CD ARG A 98 37.739 -15.682 -0.595 1.00 73.21 C ATOM 1681 NE ARG A 98 39.135 -15.389 -0.909 1.00 14.34 N ATOM 1682 CZ ARG A 98 40.115 -15.441 -0.014 1.00 43.42 C ATOM 1683 NH1 ARG A 98 39.854 -15.773 1.242 1.00 21.43 N ATOM 1684 NH2 ARG A 98 41.361 -15.160 -0.376 1.00 54.33 N ATOM 0 H ARG A 98 34.682 -13.416 -3.486 1.00 0.33 H new ATOM 0 HA ARG A 98 35.276 -15.545 -3.712 1.00 14.11 H new ATOM 0 HB2 ARG A 98 35.283 -15.153 -0.786 1.00 30.21 H new ATOM 0 HB3 ARG A 98 35.040 -16.823 -1.257 1.00 30.21 H new ATOM 0 HG2 ARG A 98 37.150 -17.036 -2.155 1.00 5.41 H new ATOM 0 HG3 ARG A 98 37.234 -15.359 -2.657 1.00 5.41 H new ATOM 0 HD2 ARG A 98 37.293 -14.824 -0.093 1.00 73.21 H new ATOM 0 HD3 ARG A 98 37.692 -16.519 0.102 1.00 73.21 H new ATOM 0 HE ARG A 98 39.370 -15.130 -1.867 1.00 14.34 H new ATOM 0 HH11 ARG A 98 38.898 -15.990 1.524 1.00 21.43 H new ATOM 0 HH12 ARG A 98 40.609 -15.812 1.927 1.00 21.43 H new ATOM 0 HH21 ARG A 98 41.566 -14.904 -1.342 1.00 54.33 H new ATOM 0 HH22 ARG A 98 42.113 -15.200 0.312 1.00 54.33 H new ATOM 1698 N PRO A 99 33.564 -17.505 -3.402 1.00 11.30 N ATOM 1699 CA PRO A 99 32.447 -18.433 -3.599 1.00 73.04 C ATOM 1700 C PRO A 99 31.806 -18.858 -2.282 1.00 44.03 C ATOM 1701 O PRO A 99 31.894 -20.020 -1.885 1.00 54.22 O ATOM 1702 CB PRO A 99 33.101 -19.634 -4.288 1.00 13.41 C ATOM 1703 CG PRO A 99 34.529 -19.580 -3.867 1.00 34.54 C ATOM 1704 CD PRO A 99 34.863 -18.122 -3.719 1.00 13.20 C ATOM 0 HA PRO A 99 31.639 -17.982 -4.175 1.00 73.04 H new ATOM 0 HB2 PRO A 99 32.633 -20.570 -3.982 1.00 13.41 H new ATOM 0 HB3 PRO A 99 33.005 -19.569 -5.372 1.00 13.41 H new ATOM 0 HG2 PRO A 99 34.679 -20.112 -2.927 1.00 34.54 H new ATOM 0 HG3 PRO A 99 35.172 -20.054 -4.608 1.00 34.54 H new ATOM 0 HD2 PRO A 99 35.591 -17.955 -2.925 1.00 13.20 H new ATOM 0 HD3 PRO A 99 35.290 -17.712 -4.635 1.00 13.20 H new ATOM 1712 N SER A 100 31.163 -17.910 -1.609 1.00 53.54 N ATOM 1713 CA SER A 100 30.510 -18.185 -0.335 1.00 23.42 C ATOM 1714 C SER A 100 29.011 -18.394 -0.526 1.00 1.02 C ATOM 1715 O SER A 100 28.365 -19.093 0.256 1.00 43.35 O ATOM 1716 CB SER A 100 30.756 -17.038 0.647 1.00 61.01 C ATOM 1717 OG SER A 100 31.168 -15.865 -0.033 1.00 1.23 O ATOM 0 H SER A 100 31.080 -16.944 -1.925 1.00 53.54 H new ATOM 0 HA SER A 100 30.937 -19.101 0.073 1.00 23.42 H new ATOM 0 HB2 SER A 100 29.845 -16.835 1.210 1.00 61.01 H new ATOM 0 HB3 SER A 100 31.518 -17.330 1.369 1.00 61.01 H new ATOM 0 HG SER A 100 31.632 -15.270 0.592 1.00 1.23 H new ATOM 1723 N PHE A 101 28.464 -17.782 -1.571 1.00 35.51 N ATOM 1724 CA PHE A 101 27.040 -17.899 -1.866 1.00 21.34 C ATOM 1725 C PHE A 101 26.604 -19.361 -1.869 1.00 34.41 C ATOM 1726 O PHE A 101 25.665 -19.742 -1.169 1.00 45.33 O ATOM 1727 CB PHE A 101 26.723 -17.258 -3.218 1.00 43.31 C ATOM 1728 CG PHE A 101 25.369 -16.610 -3.272 1.00 20.41 C ATOM 1729 CD1 PHE A 101 24.264 -17.238 -2.719 1.00 42.23 C ATOM 1730 CD2 PHE A 101 25.201 -15.375 -3.876 1.00 12.32 C ATOM 1731 CE1 PHE A 101 23.017 -16.645 -2.767 1.00 14.22 C ATOM 1732 CE2 PHE A 101 23.956 -14.777 -3.926 1.00 12.31 C ATOM 1733 CZ PHE A 101 22.862 -15.413 -3.372 1.00 2.01 C ATOM 0 H PHE A 101 28.984 -17.200 -2.228 1.00 35.51 H new ATOM 0 HA PHE A 101 26.489 -17.375 -1.085 1.00 21.34 H new ATOM 0 HB2 PHE A 101 27.484 -16.511 -3.444 1.00 43.31 H new ATOM 0 HB3 PHE A 101 26.784 -18.020 -3.995 1.00 43.31 H new ATOM 0 HD1 PHE A 101 24.379 -18.202 -2.245 1.00 42.23 H new ATOM 0 HD2 PHE A 101 26.052 -14.874 -4.313 1.00 12.32 H new ATOM 0 HE1 PHE A 101 22.164 -17.144 -2.332 1.00 14.22 H new ATOM 0 HE2 PHE A 101 23.838 -13.813 -4.398 1.00 12.31 H new ATOM 0 HZ PHE A 101 21.888 -14.948 -3.412 1.00 2.01 H new ATOM 1743 N ALA A 102 27.291 -20.176 -2.662 1.00 63.24 N ATOM 1744 CA ALA A 102 26.976 -21.596 -2.757 1.00 25.25 C ATOM 1745 C ALA A 102 26.978 -22.251 -1.380 1.00 31.35 C ATOM 1746 O ALA A 102 26.356 -23.294 -1.176 1.00 32.04 O ATOM 1747 CB ALA A 102 27.965 -22.296 -3.677 1.00 63.11 C ATOM 0 H ALA A 102 28.070 -19.877 -3.249 1.00 63.24 H new ATOM 0 HA ALA A 102 25.975 -21.694 -3.177 1.00 25.25 H new ATOM 0 HB1 ALA A 102 27.718 -23.356 -3.738 1.00 63.11 H new ATOM 0 HB2 ALA A 102 27.913 -21.853 -4.672 1.00 63.11 H new ATOM 0 HB3 ALA A 102 28.974 -22.181 -3.281 1.00 63.11 H new ATOM 1753 N LYS A 103 27.681 -21.634 -0.436 1.00 44.25 N ATOM 1754 CA LYS A 103 27.764 -22.156 0.922 1.00 1.14 C ATOM 1755 C LYS A 103 26.734 -21.486 1.826 1.00 2.23 C ATOM 1756 O LYS A 103 26.398 -22.004 2.890 1.00 32.34 O ATOM 1757 CB LYS A 103 29.170 -21.943 1.488 1.00 40.20 C ATOM 1758 CG LYS A 103 30.076 -23.153 1.339 1.00 54.04 C ATOM 1759 CD LYS A 103 31.484 -22.749 0.934 1.00 33.44 C ATOM 1760 CE LYS A 103 32.465 -23.898 1.111 1.00 1.22 C ATOM 1761 NZ LYS A 103 32.621 -24.279 2.542 1.00 32.13 N ATOM 0 H LYS A 103 28.202 -20.770 -0.588 1.00 44.25 H new ATOM 0 HA LYS A 103 27.551 -23.224 0.887 1.00 1.14 H new ATOM 0 HB2 LYS A 103 29.629 -21.092 0.986 1.00 40.20 H new ATOM 0 HB3 LYS A 103 29.092 -21.686 2.544 1.00 40.20 H new ATOM 0 HG2 LYS A 103 30.110 -23.701 2.281 1.00 54.04 H new ATOM 0 HG3 LYS A 103 29.661 -23.829 0.592 1.00 54.04 H new ATOM 0 HD2 LYS A 103 31.486 -22.425 -0.107 1.00 33.44 H new ATOM 0 HD3 LYS A 103 31.806 -21.898 1.534 1.00 33.44 H new ATOM 0 HE2 LYS A 103 32.120 -24.761 0.541 1.00 1.22 H new ATOM 0 HE3 LYS A 103 33.435 -23.613 0.703 1.00 1.22 H new ATOM 0 HZ1 LYS A 103 33.526 -24.774 2.673 1.00 32.13 H new ATOM 0 HZ2 LYS A 103 32.606 -23.423 3.133 1.00 32.13 H new ATOM 0 HZ3 LYS A 103 31.840 -24.907 2.821 1.00 32.13 H new ATOM 1775 N ALA A 104 26.236 -20.332 1.394 1.00 3.24 N ATOM 1776 CA ALA A 104 25.242 -19.593 2.163 1.00 22.32 C ATOM 1777 C ALA A 104 23.828 -20.015 1.780 1.00 33.34 C ATOM 1778 O ALA A 104 22.882 -19.814 2.543 1.00 42.20 O ATOM 1779 CB ALA A 104 25.422 -18.096 1.959 1.00 61.45 C ATOM 0 H ALA A 104 26.505 -19.889 0.516 1.00 3.24 H new ATOM 0 HA ALA A 104 25.389 -19.824 3.218 1.00 22.32 H new ATOM 0 HB1 ALA A 104 24.673 -17.557 2.539 1.00 61.45 H new ATOM 0 HB2 ALA A 104 26.418 -17.801 2.289 1.00 61.45 H new ATOM 0 HB3 ALA A 104 25.304 -17.856 0.902 1.00 61.45 H new ATOM 1785 N ILE A 105 23.690 -20.600 0.595 1.00 22.44 N ATOM 1786 CA ILE A 105 22.391 -21.051 0.113 1.00 53.34 C ATOM 1787 C ILE A 105 21.642 -21.825 1.192 1.00 74.24 C ATOM 1788 O ILE A 105 20.493 -21.528 1.520 1.00 52.23 O ATOM 1789 CB ILE A 105 22.532 -21.940 -1.137 1.00 54.52 C ATOM 1790 CG1 ILE A 105 22.992 -21.105 -2.334 1.00 43.01 C ATOM 1791 CG2 ILE A 105 21.213 -22.634 -1.445 1.00 3.22 C ATOM 1792 CD1 ILE A 105 22.211 -19.822 -2.513 1.00 31.22 C ATOM 0 H ILE A 105 24.462 -20.773 -0.049 1.00 22.44 H new ATOM 0 HA ILE A 105 21.824 -20.157 -0.149 1.00 53.34 H new ATOM 0 HB ILE A 105 23.285 -22.703 -0.939 1.00 54.52 H new ATOM 0 HG12 ILE A 105 24.048 -20.864 -2.214 1.00 43.01 H new ATOM 0 HG13 ILE A 105 22.903 -21.704 -3.240 1.00 43.01 H new ATOM 0 HG21 ILE A 105 21.329 -23.258 -2.331 1.00 3.22 H new ATOM 0 HG22 ILE A 105 20.923 -23.256 -0.598 1.00 3.22 H new ATOM 0 HG23 ILE A 105 20.442 -21.885 -1.627 1.00 3.22 H new ATOM 0 HD11 ILE A 105 22.592 -19.282 -3.380 1.00 31.22 H new ATOM 0 HD12 ILE A 105 21.157 -20.056 -2.665 1.00 31.22 H new ATOM 0 HD13 ILE A 105 22.320 -19.202 -1.623 1.00 31.22 H new ATOM 1804 N PRO A 106 22.306 -22.842 1.759 1.00 24.42 N ATOM 1805 CA PRO A 106 21.724 -23.680 2.812 1.00 13.41 C ATOM 1806 C PRO A 106 21.558 -22.926 4.127 1.00 11.50 C ATOM 1807 O PRO A 106 20.783 -23.333 4.994 1.00 42.34 O ATOM 1808 CB PRO A 106 22.742 -24.812 2.970 1.00 40.55 C ATOM 1809 CG PRO A 106 24.032 -24.228 2.507 1.00 41.42 C ATOM 1810 CD PRO A 106 23.679 -23.253 1.417 1.00 35.43 C ATOM 0 HA PRO A 106 20.723 -24.023 2.552 1.00 13.41 H new ATOM 0 HB2 PRO A 106 22.807 -25.144 4.006 1.00 40.55 H new ATOM 0 HB3 PRO A 106 22.464 -25.681 2.373 1.00 40.55 H new ATOM 0 HG2 PRO A 106 24.550 -23.728 3.325 1.00 41.42 H new ATOM 0 HG3 PRO A 106 24.700 -25.004 2.135 1.00 41.42 H new ATOM 0 HD2 PRO A 106 24.361 -22.403 1.402 1.00 35.43 H new ATOM 0 HD3 PRO A 106 23.726 -23.717 0.432 1.00 35.43 H new ATOM 1818 N CYS A 107 22.289 -21.826 4.269 1.00 40.40 N ATOM 1819 CA CYS A 107 22.223 -21.014 5.479 1.00 32.55 C ATOM 1820 C CYS A 107 21.043 -20.050 5.424 1.00 51.45 C ATOM 1821 O CYS A 107 20.429 -19.743 6.446 1.00 35.23 O ATOM 1822 CB CYS A 107 23.525 -20.236 5.668 1.00 5.24 C ATOM 1823 SG CYS A 107 25.016 -21.254 5.563 1.00 10.10 S ATOM 0 H CYS A 107 22.934 -21.476 3.561 1.00 40.40 H new ATOM 0 HA CYS A 107 22.082 -21.683 6.328 1.00 32.55 H new ATOM 0 HB2 CYS A 107 23.580 -19.452 4.913 1.00 5.24 H new ATOM 0 HB3 CYS A 107 23.503 -19.742 6.640 1.00 5.24 H new ATOM 0 HG CYS A 107 25.249 -21.556 4.320 1.00 10.10 H new ATOM 1829 N LEU A 108 20.732 -19.572 4.223 1.00 22.54 N ATOM 1830 CA LEU A 108 19.626 -18.640 4.034 1.00 63.25 C ATOM 1831 C LEU A 108 18.285 -19.339 4.230 1.00 31.21 C ATOM 1832 O LEU A 108 17.456 -18.900 5.028 1.00 60.25 O ATOM 1833 CB LEU A 108 19.691 -18.019 2.637 1.00 31.20 C ATOM 1834 CG LEU A 108 21.024 -17.380 2.248 1.00 64.45 C ATOM 1835 CD1 LEU A 108 20.802 -16.229 1.279 1.00 61.32 C ATOM 1836 CD2 LEU A 108 21.768 -16.902 3.486 1.00 42.32 C ATOM 0 H LEU A 108 21.230 -19.815 3.367 1.00 22.54 H new ATOM 0 HA LEU A 108 19.716 -17.851 4.781 1.00 63.25 H new ATOM 0 HB2 LEU A 108 19.455 -18.792 1.906 1.00 31.20 H new ATOM 0 HB3 LEU A 108 18.912 -17.261 2.562 1.00 31.20 H new ATOM 0 HG LEU A 108 21.635 -18.134 1.751 1.00 64.45 H new ATOM 0 HD11 LEU A 108 21.762 -15.787 1.014 1.00 61.32 H new ATOM 0 HD12 LEU A 108 20.312 -16.601 0.379 1.00 61.32 H new ATOM 0 HD13 LEU A 108 20.172 -15.474 1.749 1.00 61.32 H new ATOM 0 HD21 LEU A 108 22.715 -16.450 3.190 1.00 42.32 H new ATOM 0 HD22 LEU A 108 21.162 -16.164 4.012 1.00 42.32 H new ATOM 0 HD23 LEU A 108 21.961 -17.749 4.144 1.00 42.32 H new ATOM 1848 N ARG A 109 18.079 -20.430 3.500 1.00 64.24 N ATOM 1849 CA ARG A 109 16.839 -21.191 3.594 1.00 2.25 C ATOM 1850 C ARG A 109 16.634 -21.721 5.010 1.00 31.53 C ATOM 1851 O ARG A 109 15.501 -21.873 5.470 1.00 64.34 O ATOM 1852 CB ARG A 109 16.851 -22.353 2.600 1.00 42.24 C ATOM 1853 CG ARG A 109 15.502 -22.613 1.951 1.00 54.25 C ATOM 1854 CD ARG A 109 15.307 -24.089 1.643 1.00 74.21 C ATOM 1855 NE ARG A 109 13.946 -24.381 1.201 1.00 35.24 N ATOM 1856 CZ ARG A 109 13.592 -25.518 0.613 1.00 72.41 C ATOM 1857 NH1 ARG A 109 14.494 -26.465 0.397 1.00 62.51 N ATOM 1858 NH2 ARG A 109 12.333 -25.710 0.240 1.00 60.14 N ATOM 0 H ARG A 109 18.755 -20.807 2.836 1.00 64.24 H new ATOM 0 HA ARG A 109 16.013 -20.523 3.350 1.00 2.25 H new ATOM 0 HB2 ARG A 109 17.585 -22.146 1.822 1.00 42.24 H new ATOM 0 HB3 ARG A 109 17.177 -23.257 3.115 1.00 42.24 H new ATOM 0 HG2 ARG A 109 14.707 -22.270 2.613 1.00 54.25 H new ATOM 0 HG3 ARG A 109 15.422 -22.035 1.031 1.00 54.25 H new ATOM 0 HD2 ARG A 109 16.012 -24.394 0.870 1.00 74.21 H new ATOM 0 HD3 ARG A 109 15.534 -24.678 2.532 1.00 74.21 H new ATOM 0 HE ARG A 109 13.228 -23.673 1.352 1.00 35.24 H new ATOM 0 HH11 ARG A 109 15.463 -26.321 0.683 1.00 62.51 H new ATOM 0 HH12 ARG A 109 14.219 -27.337 -0.055 1.00 62.51 H new ATOM 0 HH21 ARG A 109 11.636 -24.984 0.405 1.00 60.14 H new ATOM 0 HH22 ARG A 109 12.062 -26.584 -0.212 1.00 60.14 H new ATOM 1872 N HIS A 110 17.737 -22.002 5.697 1.00 33.52 N ATOM 1873 CA HIS A 110 17.678 -22.516 7.061 1.00 32.41 C ATOM 1874 C HIS A 110 16.946 -21.541 7.978 1.00 74.11 C ATOM 1875 O HIS A 110 16.460 -21.922 9.043 1.00 15.03 O ATOM 1876 CB HIS A 110 19.088 -22.774 7.593 1.00 51.31 C ATOM 1877 CG HIS A 110 19.121 -23.162 9.039 1.00 70.40 C ATOM 1878 ND1 HIS A 110 18.368 -24.046 9.736 1.00 15.44 N flip ATOM 1879 CD2 HIS A 110 20.008 -22.619 9.944 1.00 45.13 C flip ATOM 1880 CE1 HIS A 110 18.810 -24.021 11.036 1.00 1.00 C flip ATOM 1881 NE2 HIS A 110 19.800 -23.152 11.135 1.00 43.14 N flip ATOM 0 H HIS A 110 18.682 -21.883 5.332 1.00 33.52 H new ATOM 0 HA HIS A 110 17.126 -23.456 7.045 1.00 32.41 H new ATOM 0 HB2 HIS A 110 19.551 -23.565 7.003 1.00 51.31 H new ATOM 0 HB3 HIS A 110 19.690 -21.877 7.452 1.00 51.31 H new ATOM 0 HD1 HIS A 110 17.613 -24.623 9.365 1.00 15.44 H new ATOM 0 HD2 HIS A 110 20.756 -21.874 9.715 1.00 45.13 H new ATOM 0 HE1 HIS A 110 18.413 -24.615 11.846 1.00 1.00 H new ATOM 1889 N ILE A 111 16.872 -20.283 7.557 1.00 14.01 N ATOM 1890 CA ILE A 111 16.199 -19.254 8.340 1.00 33.34 C ATOM 1891 C ILE A 111 14.809 -18.963 7.786 1.00 55.51 C ATOM 1892 O ILE A 111 14.058 -18.167 8.351 1.00 31.24 O ATOM 1893 CB ILE A 111 17.012 -17.947 8.370 1.00 42.11 C ATOM 1894 CG1 ILE A 111 16.630 -17.056 7.186 1.00 20.10 C ATOM 1895 CG2 ILE A 111 18.503 -18.250 8.352 1.00 31.11 C ATOM 1896 CD1 ILE A 111 17.777 -16.218 6.666 1.00 55.50 C ATOM 0 H ILE A 111 17.270 -19.952 6.678 1.00 14.01 H new ATOM 0 HA ILE A 111 16.109 -19.639 9.356 1.00 33.34 H new ATOM 0 HB ILE A 111 16.780 -17.414 9.292 1.00 42.11 H new ATOM 0 HG12 ILE A 111 16.252 -17.682 6.378 1.00 20.10 H new ATOM 0 HG13 ILE A 111 15.816 -16.397 7.486 1.00 20.10 H new ATOM 0 HG21 ILE A 111 19.064 -17.316 8.374 1.00 31.11 H new ATOM 0 HG22 ILE A 111 18.763 -18.850 9.224 1.00 31.11 H new ATOM 0 HG23 ILE A 111 18.751 -18.802 7.445 1.00 31.11 H new ATOM 0 HD11 ILE A 111 17.434 -15.612 5.828 1.00 55.50 H new ATOM 0 HD12 ILE A 111 18.141 -15.566 7.460 1.00 55.50 H new ATOM 0 HD13 ILE A 111 18.584 -16.871 6.335 1.00 55.50 H new ATOM 1908 N ARG A 112 14.471 -19.613 6.677 1.00 43.30 N ATOM 1909 CA ARG A 112 13.171 -19.424 6.046 1.00 53.30 C ATOM 1910 C ARG A 112 13.051 -18.021 5.457 1.00 70.21 C ATOM 1911 O ARG A 112 12.067 -17.320 5.694 1.00 43.35 O ATOM 1912 CB ARG A 112 12.049 -19.660 7.059 1.00 23.22 C ATOM 1913 CG ARG A 112 12.275 -20.875 7.945 1.00 52.13 C ATOM 1914 CD ARG A 112 12.303 -22.160 7.132 1.00 40.54 C ATOM 1915 NE ARG A 112 10.974 -22.538 6.660 1.00 72.12 N ATOM 1916 CZ ARG A 112 10.751 -23.537 5.813 1.00 44.12 C ATOM 1917 NH1 ARG A 112 11.765 -24.254 5.348 1.00 71.05 N ATOM 1918 NH2 ARG A 112 9.513 -23.821 5.430 1.00 11.40 N ATOM 0 H ARG A 112 15.080 -20.275 6.197 1.00 43.30 H new ATOM 0 HA ARG A 112 13.080 -20.149 5.237 1.00 53.30 H new ATOM 0 HB2 ARG A 112 11.947 -18.776 7.688 1.00 23.22 H new ATOM 0 HB3 ARG A 112 11.107 -19.781 6.524 1.00 23.22 H new ATOM 0 HG2 ARG A 112 13.216 -20.764 8.484 1.00 52.13 H new ATOM 0 HG3 ARG A 112 11.484 -20.933 8.693 1.00 52.13 H new ATOM 0 HD2 ARG A 112 12.969 -22.034 6.278 1.00 40.54 H new ATOM 0 HD3 ARG A 112 12.714 -22.965 7.741 1.00 40.54 H new ATOM 0 HE ARG A 112 10.173 -22.006 6.999 1.00 72.12 H new ATOM 0 HH11 ARG A 112 12.718 -24.039 5.641 1.00 71.05 H new ATOM 0 HH12 ARG A 112 11.592 -25.021 4.698 1.00 71.05 H new ATOM 0 HH21 ARG A 112 8.730 -23.272 5.786 1.00 11.40 H new ATOM 0 HH22 ARG A 112 9.344 -24.588 4.780 1.00 11.40 H new ATOM 1932 N ARG A 113 14.059 -17.619 4.689 1.00 32.34 N ATOM 1933 CA ARG A 113 14.067 -16.300 4.068 1.00 23.51 C ATOM 1934 C ARG A 113 13.877 -16.410 2.558 1.00 14.41 C ATOM 1935 O ARG A 113 13.159 -15.612 1.954 1.00 42.40 O ATOM 1936 CB ARG A 113 15.379 -15.577 4.376 1.00 2.52 C ATOM 1937 CG ARG A 113 15.444 -14.167 3.811 1.00 23.02 C ATOM 1938 CD ARG A 113 14.553 -13.213 4.590 1.00 11.34 C ATOM 1939 NE ARG A 113 14.845 -13.236 6.021 1.00 0.11 N ATOM 1940 CZ ARG A 113 14.027 -12.746 6.946 1.00 21.32 C ATOM 1941 NH1 ARG A 113 12.873 -12.199 6.592 1.00 14.34 N ATOM 1942 NH2 ARG A 113 14.363 -12.804 8.229 1.00 62.44 N ATOM 0 H ARG A 113 14.880 -18.188 4.482 1.00 32.34 H new ATOM 0 HA ARG A 113 13.238 -15.726 4.481 1.00 23.51 H new ATOM 0 HB2 ARG A 113 15.515 -15.533 5.457 1.00 2.52 H new ATOM 0 HB3 ARG A 113 16.208 -16.159 3.974 1.00 2.52 H new ATOM 0 HG2 ARG A 113 16.473 -13.810 3.839 1.00 23.02 H new ATOM 0 HG3 ARG A 113 15.139 -14.179 2.765 1.00 23.02 H new ATOM 0 HD2 ARG A 113 14.686 -12.200 4.209 1.00 11.34 H new ATOM 0 HD3 ARG A 113 13.508 -13.480 4.429 1.00 11.34 H new ATOM 0 HE ARG A 113 15.725 -13.651 6.327 1.00 0.11 H new ATOM 0 HH11 ARG A 113 12.611 -12.153 5.607 1.00 14.34 H new ATOM 0 HH12 ARG A 113 12.247 -11.824 7.304 1.00 14.34 H new ATOM 0 HH21 ARG A 113 15.250 -13.225 8.505 1.00 62.44 H new ATOM 0 HH22 ARG A 113 13.734 -12.427 8.938 1.00 62.44 H new ATOM 1956 N ILE A 114 14.524 -17.401 1.955 1.00 34.44 N ATOM 1957 CA ILE A 114 14.425 -17.615 0.517 1.00 54.41 C ATOM 1958 C ILE A 114 14.547 -19.095 0.171 1.00 44.31 C ATOM 1959 O ILE A 114 14.669 -19.942 1.056 1.00 2.51 O ATOM 1960 CB ILE A 114 15.509 -16.829 -0.245 1.00 32.34 C ATOM 1961 CG1 ILE A 114 16.879 -17.479 -0.040 1.00 33.13 C ATOM 1962 CG2 ILE A 114 15.531 -15.378 0.212 1.00 20.34 C ATOM 1963 CD1 ILE A 114 17.407 -18.177 -1.273 1.00 41.14 C ATOM 0 H ILE A 114 15.123 -18.069 2.440 1.00 34.44 H new ATOM 0 HA ILE A 114 13.443 -17.253 0.211 1.00 54.41 H new ATOM 0 HB ILE A 114 15.273 -16.850 -1.309 1.00 32.34 H new ATOM 0 HG12 ILE A 114 17.592 -16.715 0.268 1.00 33.13 H new ATOM 0 HG13 ILE A 114 16.812 -18.200 0.775 1.00 33.13 H new ATOM 0 HG21 ILE A 114 16.302 -14.836 -0.335 1.00 20.34 H new ATOM 0 HG22 ILE A 114 14.560 -14.921 0.020 1.00 20.34 H new ATOM 0 HG23 ILE A 114 15.747 -15.336 1.280 1.00 20.34 H new ATOM 0 HD11 ILE A 114 18.381 -18.614 -1.054 1.00 41.14 H new ATOM 0 HD12 ILE A 114 16.714 -18.964 -1.570 1.00 41.14 H new ATOM 0 HD13 ILE A 114 17.507 -17.456 -2.085 1.00 41.14 H new ATOM 1975 N ARG A 115 14.516 -19.399 -1.122 1.00 43.15 N ATOM 1976 CA ARG A 115 14.625 -20.777 -1.586 1.00 53.11 C ATOM 1977 C ARG A 115 15.550 -20.872 -2.796 1.00 20.34 C ATOM 1978 O ARG A 115 15.963 -19.857 -3.354 1.00 3.30 O ATOM 1979 CB ARG A 115 13.243 -21.328 -1.943 1.00 12.40 C ATOM 1980 CG ARG A 115 12.191 -21.072 -0.876 1.00 22.13 C ATOM 1981 CD ARG A 115 11.141 -22.172 -0.854 1.00 1.12 C ATOM 1982 NE ARG A 115 10.900 -22.671 0.497 1.00 33.32 N ATOM 1983 CZ ARG A 115 9.792 -23.310 0.858 1.00 63.35 C ATOM 1984 NH1 ARG A 115 8.830 -23.527 -0.028 1.00 51.13 N ATOM 1985 NH2 ARG A 115 9.646 -23.735 2.106 1.00 2.32 N ATOM 0 H ARG A 115 14.416 -18.710 -1.867 1.00 43.15 H new ATOM 0 HA ARG A 115 15.049 -21.373 -0.778 1.00 53.11 H new ATOM 0 HB2 ARG A 115 12.914 -20.880 -2.881 1.00 12.40 H new ATOM 0 HB3 ARG A 115 13.322 -22.402 -2.113 1.00 12.40 H new ATOM 0 HG2 ARG A 115 12.670 -21.005 0.101 1.00 22.13 H new ATOM 0 HG3 ARG A 115 11.710 -20.112 -1.061 1.00 22.13 H new ATOM 0 HD2 ARG A 115 10.209 -21.792 -1.272 1.00 1.12 H new ATOM 0 HD3 ARG A 115 11.464 -22.995 -1.492 1.00 1.12 H new ATOM 0 HE ARG A 115 11.621 -22.521 1.202 1.00 33.32 H new ATOM 0 HH11 ARG A 115 8.939 -23.203 -0.989 1.00 51.13 H new ATOM 0 HH12 ARG A 115 7.981 -24.018 0.251 1.00 51.13 H new ATOM 0 HH21 ARG A 115 10.385 -23.572 2.790 1.00 2.32 H new ATOM 0 HH22 ARG A 115 8.795 -24.225 2.382 1.00 2.32 H new ATOM 1999 N GLU A 116 15.871 -22.100 -3.194 1.00 12.55 N ATOM 2000 CA GLU A 116 16.748 -22.327 -4.336 1.00 4.52 C ATOM 2001 C GLU A 116 16.227 -23.467 -5.205 1.00 35.45 C ATOM 2002 O GLU A 116 15.912 -24.547 -4.705 1.00 14.11 O ATOM 2003 CB GLU A 116 18.169 -22.641 -3.861 1.00 52.45 C ATOM 2004 CG GLU A 116 18.218 -23.582 -2.670 1.00 64.41 C ATOM 2005 CD GLU A 116 19.155 -24.754 -2.892 1.00 34.54 C ATOM 2006 OE1 GLU A 116 19.186 -25.285 -4.022 1.00 15.43 O ATOM 2007 OE2 GLU A 116 19.857 -25.141 -1.934 1.00 33.21 O ATOM 0 H GLU A 116 15.537 -22.951 -2.742 1.00 12.55 H new ATOM 0 HA GLU A 116 16.765 -21.416 -4.935 1.00 4.52 H new ATOM 0 HB2 GLU A 116 18.729 -23.082 -4.685 1.00 52.45 H new ATOM 0 HB3 GLU A 116 18.669 -21.709 -3.598 1.00 52.45 H new ATOM 0 HG2 GLU A 116 18.537 -23.028 -1.787 1.00 64.41 H new ATOM 0 HG3 GLU A 116 17.215 -23.957 -2.466 1.00 64.41 H new ATOM 2014 N GLU A 117 16.138 -23.219 -6.507 1.00 52.44 N ATOM 2015 CA GLU A 117 15.653 -24.224 -7.445 1.00 72.32 C ATOM 2016 C GLU A 117 16.773 -24.691 -8.370 1.00 24.43 C ATOM 2017 O GLU A 117 17.179 -23.973 -9.283 1.00 52.24 O ATOM 2018 CB GLU A 117 14.494 -23.665 -8.273 1.00 33.21 C ATOM 2019 CG GLU A 117 13.466 -24.713 -8.667 1.00 2.10 C ATOM 2020 CD GLU A 117 12.110 -24.467 -8.034 1.00 24.40 C ATOM 2021 OE1 GLU A 117 11.612 -23.326 -8.125 1.00 11.21 O ATOM 2022 OE2 GLU A 117 11.548 -25.416 -7.448 1.00 1.21 O ATOM 0 H GLU A 117 16.395 -22.330 -6.937 1.00 52.44 H new ATOM 0 HA GLU A 117 15.300 -25.079 -6.869 1.00 72.32 H new ATOM 0 HB2 GLU A 117 13.999 -22.878 -7.704 1.00 33.21 H new ATOM 0 HB3 GLU A 117 14.893 -23.203 -9.176 1.00 33.21 H new ATOM 0 HG2 GLU A 117 13.360 -24.723 -9.752 1.00 2.10 H new ATOM 0 HG3 GLU A 117 13.827 -25.699 -8.373 1.00 2.10 H new ATOM 2029 N ARG A 118 17.270 -25.900 -8.125 1.00 12.34 N ATOM 2030 CA ARG A 118 18.345 -26.463 -8.933 1.00 55.51 C ATOM 2031 C ARG A 118 17.819 -26.928 -10.288 1.00 41.31 C ATOM 2032 O ARG A 118 17.186 -27.979 -10.392 1.00 14.23 O ATOM 2033 CB ARG A 118 19.003 -27.633 -8.200 1.00 43.25 C ATOM 2034 CG ARG A 118 19.756 -28.581 -9.120 1.00 34.01 C ATOM 2035 CD ARG A 118 20.797 -27.845 -9.948 1.00 53.34 C ATOM 2036 NE ARG A 118 21.807 -27.202 -9.112 1.00 60.13 N ATOM 2037 CZ ARG A 118 22.831 -27.850 -8.568 1.00 43.15 C ATOM 2038 NH1 ARG A 118 22.980 -29.151 -8.772 1.00 64.43 N ATOM 2039 NH2 ARG A 118 23.709 -27.195 -7.819 1.00 65.44 N ATOM 0 H ARG A 118 16.945 -26.508 -7.373 1.00 12.34 H new ATOM 0 HA ARG A 118 19.088 -25.683 -9.099 1.00 55.51 H new ATOM 0 HB2 ARG A 118 19.693 -27.241 -7.453 1.00 43.25 H new ATOM 0 HB3 ARG A 118 18.236 -28.193 -7.664 1.00 43.25 H new ATOM 0 HG2 ARG A 118 20.243 -29.355 -8.527 1.00 34.01 H new ATOM 0 HG3 ARG A 118 19.051 -29.083 -9.783 1.00 34.01 H new ATOM 0 HD2 ARG A 118 21.282 -28.546 -10.627 1.00 53.34 H new ATOM 0 HD3 ARG A 118 20.304 -27.093 -10.564 1.00 53.34 H new ATOM 0 HE ARG A 118 21.722 -26.201 -8.936 1.00 60.13 H new ATOM 0 HH11 ARG A 118 22.307 -29.657 -9.348 1.00 64.43 H new ATOM 0 HH12 ARG A 118 23.767 -29.646 -8.353 1.00 64.43 H new ATOM 0 HH21 ARG A 118 23.598 -26.194 -7.661 1.00 65.44 H new ATOM 0 HH22 ARG A 118 24.495 -27.693 -7.401 1.00 65.44 H new ATOM 2053 N CYS A 119 18.086 -26.138 -11.323 1.00 32.54 N ATOM 2054 CA CYS A 119 17.639 -26.468 -12.671 1.00 72.53 C ATOM 2055 C CYS A 119 18.828 -26.663 -13.606 1.00 23.11 C ATOM 2056 O CYS A 119 19.206 -25.754 -14.344 1.00 23.22 O ATOM 2057 CB CYS A 119 16.725 -25.368 -13.212 1.00 11.23 C ATOM 2058 SG CYS A 119 15.369 -24.923 -12.101 1.00 41.33 S ATOM 0 H CYS A 119 18.609 -25.265 -11.254 1.00 32.54 H new ATOM 0 HA CYS A 119 17.081 -27.403 -12.623 1.00 72.53 H new ATOM 0 HB2 CYS A 119 17.323 -24.479 -13.412 1.00 11.23 H new ATOM 0 HB3 CYS A 119 16.308 -25.693 -14.165 1.00 11.23 H new ATOM 0 HG CYS A 119 15.244 -23.630 -12.065 1.00 41.33 H new ATOM 2064 N GLY A 120 19.416 -27.855 -13.567 1.00 71.35 N ATOM 2065 CA GLY A 120 20.558 -28.147 -14.414 1.00 72.22 C ATOM 2066 C GLY A 120 21.805 -27.402 -13.982 1.00 64.51 C ATOM 2067 O GLY A 120 22.083 -27.251 -12.792 1.00 61.22 O ATOM 0 H GLY A 120 19.122 -28.623 -12.964 1.00 71.35 H new ATOM 0 HA2 GLY A 120 20.755 -29.219 -14.397 1.00 72.22 H new ATOM 0 HA3 GLY A 120 20.319 -27.883 -15.444 1.00 72.22 H new ATOM 2071 N PRO A 121 22.583 -26.924 -14.964 1.00 43.51 N ATOM 2072 CA PRO A 121 23.822 -26.184 -14.703 1.00 53.35 C ATOM 2073 C PRO A 121 23.559 -24.806 -14.106 1.00 51.53 C ATOM 2074 O PRO A 121 24.489 -24.035 -13.864 1.00 12.02 O ATOM 2075 CB PRO A 121 24.456 -26.053 -16.091 1.00 33.34 C ATOM 2076 CG PRO A 121 23.311 -26.138 -17.040 1.00 14.41 C ATOM 2077 CD PRO A 121 22.314 -27.067 -16.405 1.00 14.13 C ATOM 0 HA PRO A 121 24.455 -26.693 -13.976 1.00 53.35 H new ATOM 0 HB2 PRO A 121 24.988 -25.107 -16.196 1.00 33.34 H new ATOM 0 HB3 PRO A 121 25.180 -26.847 -16.272 1.00 33.34 H new ATOM 0 HG2 PRO A 121 22.873 -25.155 -17.212 1.00 14.41 H new ATOM 0 HG3 PRO A 121 23.635 -26.517 -18.009 1.00 14.41 H new ATOM 0 HD2 PRO A 121 21.290 -26.787 -16.652 1.00 14.13 H new ATOM 0 HD3 PRO A 121 22.453 -28.095 -16.740 1.00 14.13 H new ATOM 2085 N LEU A 122 22.288 -24.501 -13.871 1.00 15.33 N ATOM 2086 CA LEU A 122 21.902 -23.214 -13.301 1.00 21.43 C ATOM 2087 C LEU A 122 21.220 -23.400 -11.949 1.00 24.11 C ATOM 2088 O LEU A 122 20.905 -24.521 -11.548 1.00 65.43 O ATOM 2089 CB LEU A 122 20.969 -22.469 -14.257 1.00 62.51 C ATOM 2090 CG LEU A 122 21.494 -22.258 -15.678 1.00 12.03 C ATOM 2091 CD1 LEU A 122 20.376 -21.785 -16.595 1.00 24.35 C ATOM 2092 CD2 LEU A 122 22.644 -21.262 -15.679 1.00 2.25 C ATOM 0 H LEU A 122 21.507 -25.127 -14.066 1.00 15.33 H new ATOM 0 HA LEU A 122 22.807 -22.624 -13.153 1.00 21.43 H new ATOM 0 HB2 LEU A 122 20.029 -23.017 -14.316 1.00 62.51 H new ATOM 0 HB3 LEU A 122 20.743 -21.494 -13.826 1.00 62.51 H new ATOM 0 HG LEU A 122 21.865 -23.212 -16.053 1.00 12.03 H new ATOM 0 HD11 LEU A 122 20.768 -21.640 -17.602 1.00 24.35 H new ATOM 0 HD12 LEU A 122 19.584 -22.533 -16.618 1.00 24.35 H new ATOM 0 HD13 LEU A 122 19.974 -20.842 -16.223 1.00 24.35 H new ATOM 0 HD21 LEU A 122 23.005 -21.124 -16.698 1.00 2.25 H new ATOM 0 HD22 LEU A 122 22.298 -20.307 -15.284 1.00 2.25 H new ATOM 0 HD23 LEU A 122 23.454 -21.641 -15.055 1.00 2.25 H new ATOM 2104 N THR A 123 20.993 -22.293 -11.249 1.00 52.33 N ATOM 2105 CA THR A 123 20.347 -22.333 -9.943 1.00 44.22 C ATOM 2106 C THR A 123 19.522 -21.074 -9.699 1.00 24.52 C ATOM 2107 O THR A 123 20.052 -19.963 -9.700 1.00 52.12 O ATOM 2108 CB THR A 123 21.380 -22.484 -8.811 1.00 4.24 C ATOM 2109 OG1 THR A 123 22.497 -23.256 -9.266 1.00 2.22 O ATOM 2110 CG2 THR A 123 20.757 -23.153 -7.595 1.00 53.11 C ATOM 0 H THR A 123 21.247 -21.357 -11.565 1.00 52.33 H new ATOM 0 HA THR A 123 19.688 -23.201 -9.942 1.00 44.22 H new ATOM 0 HB THR A 123 21.719 -21.489 -8.524 1.00 4.24 H new ATOM 0 HG1 THR A 123 23.150 -23.346 -8.541 1.00 2.22 H new ATOM 0 HG21 THR A 123 21.506 -23.249 -6.809 1.00 53.11 H new ATOM 0 HG22 THR A 123 19.926 -22.548 -7.233 1.00 53.11 H new ATOM 0 HG23 THR A 123 20.392 -24.142 -7.871 1.00 53.11 H new ATOM 2118 N PHE A 124 18.223 -21.256 -9.488 1.00 71.23 N ATOM 2119 CA PHE A 124 17.324 -20.134 -9.242 1.00 62.53 C ATOM 2120 C PHE A 124 17.027 -19.992 -7.752 1.00 61.23 C ATOM 2121 O PHE A 124 17.411 -20.841 -6.948 1.00 21.42 O ATOM 2122 CB PHE A 124 16.019 -20.320 -10.019 1.00 13.33 C ATOM 2123 CG PHE A 124 16.207 -20.354 -11.508 1.00 40.14 C ATOM 2124 CD1 PHE A 124 16.478 -21.547 -12.159 1.00 35.03 C ATOM 2125 CD2 PHE A 124 16.114 -19.193 -12.258 1.00 50.45 C ATOM 2126 CE1 PHE A 124 16.651 -21.582 -13.530 1.00 30.15 C ATOM 2127 CE2 PHE A 124 16.286 -19.221 -13.629 1.00 70.55 C ATOM 2128 CZ PHE A 124 16.556 -20.417 -14.266 1.00 20.43 C ATOM 0 H PHE A 124 17.769 -22.169 -9.482 1.00 71.23 H new ATOM 0 HA PHE A 124 17.816 -19.224 -9.584 1.00 62.53 H new ATOM 0 HB2 PHE A 124 15.545 -21.248 -9.700 1.00 13.33 H new ATOM 0 HB3 PHE A 124 15.336 -19.509 -9.766 1.00 13.33 H new ATOM 0 HD1 PHE A 124 16.555 -22.461 -11.588 1.00 35.03 H new ATOM 0 HD2 PHE A 124 15.905 -18.255 -11.766 1.00 50.45 H new ATOM 0 HE1 PHE A 124 16.860 -22.519 -14.025 1.00 30.15 H new ATOM 0 HE2 PHE A 124 16.209 -18.309 -14.202 1.00 70.55 H new ATOM 0 HZ PHE A 124 16.692 -20.441 -15.337 1.00 20.43 H new ATOM 2138 N TYR A 125 16.342 -18.913 -7.393 1.00 12.35 N ATOM 2139 CA TYR A 125 15.995 -18.656 -6.000 1.00 24.54 C ATOM 2140 C TYR A 125 14.724 -17.819 -5.900 1.00 21.04 C ATOM 2141 O TYR A 125 14.613 -16.761 -6.520 1.00 63.30 O ATOM 2142 CB TYR A 125 17.147 -17.943 -5.289 1.00 34.02 C ATOM 2143 CG TYR A 125 18.507 -18.518 -5.612 1.00 41.13 C ATOM 2144 CD1 TYR A 125 19.206 -18.108 -6.741 1.00 54.33 C ATOM 2145 CD2 TYR A 125 19.094 -19.472 -4.790 1.00 13.21 C ATOM 2146 CE1 TYR A 125 20.449 -18.631 -7.041 1.00 53.44 C ATOM 2147 CE2 TYR A 125 20.337 -19.999 -5.081 1.00 72.04 C ATOM 2148 CZ TYR A 125 21.010 -19.575 -6.208 1.00 62.52 C ATOM 2149 OH TYR A 125 22.248 -20.099 -6.503 1.00 21.33 O ATOM 0 H TYR A 125 16.016 -18.202 -8.047 1.00 12.35 H new ATOM 0 HA TYR A 125 15.815 -19.615 -5.514 1.00 24.54 H new ATOM 0 HB2 TYR A 125 17.134 -16.888 -5.562 1.00 34.02 H new ATOM 0 HB3 TYR A 125 16.986 -17.995 -4.212 1.00 34.02 H new ATOM 0 HD1 TYR A 125 18.770 -17.368 -7.395 1.00 54.33 H new ATOM 0 HD2 TYR A 125 18.569 -19.807 -3.908 1.00 13.21 H new ATOM 0 HE1 TYR A 125 20.978 -18.302 -7.923 1.00 53.44 H new ATOM 0 HE2 TYR A 125 20.779 -20.739 -4.430 1.00 72.04 H new ATOM 0 HH TYR A 125 22.945 -19.529 -6.116 1.00 21.33 H new ATOM 2159 N TYR A 126 13.767 -18.300 -5.114 1.00 3.15 N ATOM 2160 CA TYR A 126 12.502 -17.598 -4.932 1.00 43.13 C ATOM 2161 C TYR A 126 12.214 -17.368 -3.452 1.00 1.12 C ATOM 2162 O TYR A 126 12.705 -18.084 -2.579 1.00 12.02 O ATOM 2163 CB TYR A 126 11.359 -18.391 -5.569 1.00 3.44 C ATOM 2164 CG TYR A 126 11.368 -19.860 -5.210 1.00 43.54 C ATOM 2165 CD1 TYR A 126 12.252 -20.739 -5.824 1.00 2.20 C ATOM 2166 CD2 TYR A 126 10.493 -20.368 -4.259 1.00 73.54 C ATOM 2167 CE1 TYR A 126 12.264 -22.082 -5.501 1.00 13.25 C ATOM 2168 CE2 TYR A 126 10.498 -21.710 -3.929 1.00 1.44 C ATOM 2169 CZ TYR A 126 11.385 -22.562 -4.552 1.00 22.31 C ATOM 2170 OH TYR A 126 11.393 -23.899 -4.226 1.00 72.22 O ATOM 0 H TYR A 126 13.843 -19.173 -4.593 1.00 3.15 H new ATOM 0 HA TYR A 126 12.580 -16.628 -5.423 1.00 43.13 H new ATOM 0 HB2 TYR A 126 10.409 -17.956 -5.259 1.00 3.44 H new ATOM 0 HB3 TYR A 126 11.418 -18.290 -6.653 1.00 3.44 H new ATOM 0 HD1 TYR A 126 12.942 -20.366 -6.567 1.00 2.20 H new ATOM 0 HD2 TYR A 126 9.797 -19.703 -3.769 1.00 73.54 H new ATOM 0 HE1 TYR A 126 12.957 -22.752 -5.988 1.00 13.25 H new ATOM 0 HE2 TYR A 126 9.811 -22.089 -3.187 1.00 1.44 H new ATOM 0 HH TYR A 126 10.714 -24.073 -3.541 1.00 72.22 H new ATOM 2180 N PRO A 127 11.398 -16.344 -3.161 1.00 73.13 N ATOM 2181 CA PRO A 127 11.024 -15.995 -1.787 1.00 74.35 C ATOM 2182 C PRO A 127 10.105 -17.035 -1.155 1.00 21.20 C ATOM 2183 O PRO A 127 8.956 -17.195 -1.566 1.00 4.25 O ATOM 2184 CB PRO A 127 10.291 -14.661 -1.947 1.00 74.04 C ATOM 2185 CG PRO A 127 9.768 -14.681 -3.342 1.00 41.34 C ATOM 2186 CD PRO A 127 10.776 -15.449 -4.151 1.00 45.45 C ATOM 0 HA PRO A 127 11.891 -15.944 -1.129 1.00 74.35 H new ATOM 0 HB2 PRO A 127 9.482 -14.564 -1.222 1.00 74.04 H new ATOM 0 HB3 PRO A 127 10.964 -13.818 -1.788 1.00 74.04 H new ATOM 0 HG2 PRO A 127 8.789 -15.157 -3.385 1.00 41.34 H new ATOM 0 HG3 PRO A 127 9.647 -13.669 -3.728 1.00 41.34 H new ATOM 0 HD2 PRO A 127 10.302 -16.009 -4.957 1.00 45.45 H new ATOM 0 HD3 PRO A 127 11.510 -14.787 -4.611 1.00 45.45 H new ATOM 2194 N GLY A 128 10.619 -17.741 -0.152 1.00 43.21 N ATOM 2195 CA GLY A 128 9.831 -18.756 0.521 1.00 20.50 C ATOM 2196 C GLY A 128 8.391 -18.782 0.047 1.00 4.41 C ATOM 2197 O GLY A 128 7.566 -17.993 0.507 1.00 35.31 O ATOM 0 H GLY A 128 11.567 -17.628 0.206 1.00 43.21 H new ATOM 0 HA2 GLY A 128 10.283 -19.733 0.353 1.00 20.50 H new ATOM 0 HA3 GLY A 128 9.853 -18.575 1.596 1.00 20.50 H new ATOM 2201 N SER A 129 8.090 -19.689 -0.877 1.00 12.45 N ATOM 2202 CA SER A 129 6.741 -19.810 -1.417 1.00 40.44 C ATOM 2203 C SER A 129 5.712 -19.899 -0.295 1.00 14.22 C ATOM 2204 O SER A 129 6.053 -20.179 0.854 1.00 14.13 O ATOM 2205 CB SER A 129 6.638 -21.042 -2.318 1.00 25.22 C ATOM 2206 OG SER A 129 6.588 -22.232 -1.550 1.00 22.01 O ATOM 0 H SER A 129 8.762 -20.350 -1.267 1.00 12.45 H new ATOM 0 HA SER A 129 6.532 -18.918 -2.008 1.00 40.44 H new ATOM 0 HB2 SER A 129 5.745 -20.969 -2.939 1.00 25.22 H new ATOM 0 HB3 SER A 129 7.494 -21.076 -2.992 1.00 25.22 H new ATOM 0 HG SER A 129 6.521 -23.005 -2.149 1.00 22.01 H new ATOM 2212 N SER A 130 4.450 -19.658 -0.637 1.00 71.30 N ATOM 2213 CA SER A 130 3.370 -19.707 0.342 1.00 71.25 C ATOM 2214 C SER A 130 2.185 -20.503 -0.197 1.00 13.11 C ATOM 2215 O SER A 130 1.788 -20.341 -1.350 1.00 0.33 O ATOM 2216 CB SER A 130 2.923 -18.291 0.710 1.00 31.33 C ATOM 2217 OG SER A 130 3.952 -17.592 1.389 1.00 72.20 O ATOM 0 H SER A 130 4.150 -19.427 -1.584 1.00 71.30 H new ATOM 0 HA SER A 130 3.744 -20.206 1.236 1.00 71.25 H new ATOM 0 HB2 SER A 130 2.645 -17.748 -0.193 1.00 31.33 H new ATOM 0 HB3 SER A 130 2.035 -18.339 1.340 1.00 31.33 H new ATOM 0 HG SER A 130 3.642 -16.689 1.612 1.00 72.20 H new TER 2223 SER A 130