USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 758 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 Set 1.1: A 88 LYS NZ :NH3+ 141:sc= -0.0968 (180deg=-0.494) USER MOD Set 1.2: A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -174:sc= -0.926 (180deg=-1.14) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0971 USER MOD Single : A 26 ASN : amide:sc= 0.00624 K(o=0.0062,f=-9.8!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN :FLIP amide:sc= -0.0779 F(o=-2!,f=-0.078) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 69:sc= 0.16 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -108:sc= -0.747 USER MOD Single : A 56 ASN :FLIP amide:sc= -0.0556 F(o=-2!,f=-0.056) USER MOD Single : A 58 MET CE :methyl -156:sc= -0.893 (180deg=-2.19) USER MOD Single : A 60 THR OG1 : rot -30:sc= -1.05! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot -120:sc= 0.35 USER MOD Single : A 76 LYS NZ :NH3+ -105:sc= 0 (180deg=-0.576) USER MOD Single : A 79 HIS : no HE2:sc= -1.18 K(o=-1.2,f=-3.6) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 160:sc= -1.96! USER MOD Single : A 89 THR OG1 : rot 80:sc= 0.986 USER MOD Single : A 95 ASN : amide:sc= -0.22 K(o=-0.22,f=-1) USER MOD Single : A 96 LYS NZ :NH3+ 161:sc= -0.025 (180deg=-0.201) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.194 9.691 -16.404 1.00 0.00 N ATOM 2 CA MET A 1 12.909 8.426 -16.283 1.00 0.00 C ATOM 3 C MET A 1 13.100 7.777 -17.650 1.00 0.00 C ATOM 4 O MET A 1 12.160 7.681 -18.438 1.00 0.00 O ATOM 5 CB MET A 1 12.153 7.475 -15.354 1.00 0.00 C ATOM 6 CG MET A 1 13.018 6.357 -14.794 1.00 0.00 C ATOM 7 SD MET A 1 14.122 6.922 -13.486 1.00 0.00 S ATOM 8 CE MET A 1 14.844 5.369 -12.959 1.00 0.00 C ATOM 0 H1 MET A 1 12.076 10.114 -15.461 1.00 0.00 H new ATOM 0 H2 MET A 1 12.736 10.340 -17.009 1.00 0.00 H new ATOM 0 H3 MET A 1 11.259 9.522 -16.828 1.00 0.00 H new ATOM 0 HA MET A 1 13.891 8.631 -15.858 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.732 8.047 -14.527 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.316 7.038 -15.898 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.376 5.566 -14.406 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.609 5.922 -15.600 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.552 5.553 -12.151 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.057 4.702 -12.607 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.363 4.906 -13.798 1.00 0.00 H new ATOM 18 N ALA A 2 14.321 7.332 -17.924 1.00 0.00 N ATOM 19 CA ALA A 2 14.634 6.690 -19.195 1.00 0.00 C ATOM 20 C ALA A 2 13.962 5.325 -19.300 1.00 0.00 C ATOM 21 O ALA A 2 13.187 5.073 -20.222 1.00 0.00 O ATOM 22 CB ALA A 2 16.140 6.554 -19.361 1.00 0.00 C ATOM 0 H ALA A 2 15.111 7.404 -17.283 1.00 0.00 H new ATOM 0 HA ALA A 2 14.247 7.319 -19.997 1.00 0.00 H new ATOM 0 HB1 ALA A 2 16.359 6.073 -20.314 1.00 0.00 H new ATOM 0 HB2 ALA A 2 16.599 7.542 -19.339 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.542 5.949 -18.548 1.00 0.00 H new ATOM 28 N ARG A 3 14.266 4.446 -18.350 1.00 0.00 N ATOM 29 CA ARG A 3 13.694 3.106 -18.337 1.00 0.00 C ATOM 30 C ARG A 3 12.539 3.017 -17.344 1.00 0.00 C ATOM 31 O ARG A 3 12.239 1.946 -16.819 1.00 0.00 O ATOM 32 CB ARG A 3 14.766 2.074 -17.982 1.00 0.00 C ATOM 33 CG ARG A 3 14.515 0.702 -18.586 1.00 0.00 C ATOM 34 CD ARG A 3 14.761 0.700 -20.087 1.00 0.00 C ATOM 35 NE ARG A 3 16.181 0.586 -20.407 1.00 0.00 N ATOM 36 CZ ARG A 3 16.677 0.773 -21.626 1.00 0.00 C ATOM 37 NH1 ARG A 3 15.871 1.085 -22.632 1.00 0.00 N ATOM 38 NH2 ARG A 3 17.981 0.652 -21.839 1.00 0.00 N ATOM 0 H ARG A 3 14.906 4.639 -17.579 1.00 0.00 H new ATOM 0 HA ARG A 3 13.310 2.893 -19.335 1.00 0.00 H new ATOM 0 HB2 ARG A 3 15.736 2.439 -18.321 1.00 0.00 H new ATOM 0 HB3 ARG A 3 14.822 1.979 -16.898 1.00 0.00 H new ATOM 0 HG2 ARG A 3 15.165 -0.031 -18.109 1.00 0.00 H new ATOM 0 HG3 ARG A 3 13.488 0.397 -18.384 1.00 0.00 H new ATOM 0 HD2 ARG A 3 14.219 -0.129 -20.542 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.364 1.618 -20.521 1.00 0.00 H new ATOM 0 HE ARG A 3 16.828 0.350 -19.654 1.00 0.00 H new ATOM 0 HH11 ARG A 3 14.868 1.182 -22.471 1.00 0.00 H new ATOM 0 HH12 ARG A 3 16.254 1.228 -23.567 1.00 0.00 H new ATOM 0 HH21 ARG A 3 18.604 0.415 -21.067 1.00 0.00 H new ATOM 0 HH22 ARG A 3 18.360 0.796 -22.775 1.00 0.00 H new ATOM 52 N GLY A 4 11.894 4.152 -17.092 1.00 0.00 N ATOM 53 CA GLY A 4 10.779 4.181 -16.163 1.00 0.00 C ATOM 54 C GLY A 4 9.437 4.113 -16.864 1.00 0.00 C ATOM 55 O GLY A 4 8.409 4.468 -16.288 1.00 0.00 O ATOM 0 H GLY A 4 12.124 5.052 -17.514 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.866 3.344 -15.470 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.829 5.093 -15.569 1.00 0.00 H new ATOM 59 N SER A 5 9.447 3.657 -18.113 1.00 0.00 N ATOM 60 CA SER A 5 8.221 3.549 -18.896 1.00 0.00 C ATOM 61 C SER A 5 7.243 2.579 -18.242 1.00 0.00 C ATOM 62 O SER A 5 7.559 1.944 -17.236 1.00 0.00 O ATOM 63 CB SER A 5 8.541 3.087 -20.319 1.00 0.00 C ATOM 64 OG SER A 5 8.691 1.679 -20.377 1.00 0.00 O ATOM 0 H SER A 5 10.289 3.357 -18.604 1.00 0.00 H new ATOM 0 HA SER A 5 7.756 4.534 -18.937 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.744 3.399 -20.994 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.457 3.568 -20.663 1.00 0.00 H new ATOM 0 HG SER A 5 8.893 1.409 -21.297 1.00 0.00 H new ATOM 70 N VAL A 6 6.051 2.470 -18.821 1.00 0.00 N ATOM 71 CA VAL A 6 5.025 1.577 -18.296 1.00 0.00 C ATOM 72 C VAL A 6 4.196 0.970 -19.423 1.00 0.00 C ATOM 73 O VAL A 6 3.478 1.677 -20.130 1.00 0.00 O ATOM 74 CB VAL A 6 4.085 2.313 -17.322 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.156 1.328 -16.629 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.890 3.106 -16.303 1.00 0.00 C ATOM 0 H VAL A 6 5.772 2.989 -19.654 1.00 0.00 H new ATOM 0 HA VAL A 6 5.542 0.782 -17.759 1.00 0.00 H new ATOM 0 HB VAL A 6 3.474 3.012 -17.893 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.500 1.866 -15.945 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.555 0.808 -17.375 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.747 0.603 -16.069 1.00 0.00 H new ATOM 0 HG21 VAL A 6 4.211 3.620 -15.623 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.528 2.428 -15.736 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.509 3.839 -16.820 1.00 0.00 H new ATOM 86 N SER A 7 4.300 -0.345 -19.584 1.00 0.00 N ATOM 87 CA SER A 7 3.562 -1.048 -20.627 1.00 0.00 C ATOM 88 C SER A 7 2.068 -0.760 -20.523 1.00 0.00 C ATOM 89 O SER A 7 1.589 -0.259 -19.506 1.00 0.00 O ATOM 90 CB SER A 7 3.810 -2.555 -20.529 1.00 0.00 C ATOM 91 OG SER A 7 4.993 -2.923 -21.218 1.00 0.00 O ATOM 0 H SER A 7 4.888 -0.945 -19.006 1.00 0.00 H new ATOM 0 HA SER A 7 3.917 -0.690 -21.593 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.890 -2.846 -19.482 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.960 -3.095 -20.946 1.00 0.00 H new ATOM 0 HG SER A 7 5.130 -3.890 -21.139 1.00 0.00 H new ATOM 97 N ASP A 8 1.336 -1.081 -21.584 1.00 0.00 N ATOM 98 CA ASP A 8 -0.106 -0.858 -21.614 1.00 0.00 C ATOM 99 C ASP A 8 -0.795 -1.609 -20.479 1.00 0.00 C ATOM 100 O ASP A 8 -1.506 -1.012 -19.671 1.00 0.00 O ATOM 101 CB ASP A 8 -0.684 -1.302 -22.959 1.00 0.00 C ATOM 102 CG ASP A 8 -0.105 -2.621 -23.432 1.00 0.00 C ATOM 103 OD1 ASP A 8 0.981 -2.607 -24.049 1.00 0.00 O ATOM 104 OD2 ASP A 8 -0.738 -3.668 -23.184 1.00 0.00 O ATOM 0 H ASP A 8 1.716 -1.496 -22.434 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.287 0.209 -21.483 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -1.767 -1.394 -22.873 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -0.488 -0.534 -23.707 1.00 0.00 H new ATOM 109 N GLU A 9 -0.580 -2.919 -20.426 1.00 0.00 N ATOM 110 CA GLU A 9 -1.183 -3.750 -19.390 1.00 0.00 C ATOM 111 C GLU A 9 -0.783 -3.263 -18.000 1.00 0.00 C ATOM 112 O GLU A 9 -1.638 -2.928 -17.180 1.00 0.00 O ATOM 113 CB GLU A 9 -0.765 -5.211 -19.570 1.00 0.00 C ATOM 114 CG GLU A 9 -1.056 -5.762 -20.956 1.00 0.00 C ATOM 115 CD GLU A 9 -1.295 -7.259 -20.952 1.00 0.00 C ATOM 116 OE1 GLU A 9 -0.348 -8.011 -21.266 1.00 0.00 O ATOM 117 OE2 GLU A 9 -2.426 -7.679 -20.632 1.00 0.00 O ATOM 0 H GLU A 9 0.007 -3.428 -21.087 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.266 -3.675 -19.485 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.302 -5.302 -19.369 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.282 -5.822 -18.830 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.932 -5.259 -21.366 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.219 -5.533 -21.616 1.00 0.00 H new ATOM 124 N GLU A 10 0.520 -3.227 -17.744 1.00 0.00 N ATOM 125 CA GLU A 10 1.033 -2.783 -16.454 1.00 0.00 C ATOM 126 C GLU A 10 0.442 -1.428 -16.071 1.00 0.00 C ATOM 127 O GLU A 10 -0.061 -1.249 -14.962 1.00 0.00 O ATOM 128 CB GLU A 10 2.559 -2.693 -16.490 1.00 0.00 C ATOM 129 CG GLU A 10 3.193 -2.549 -15.117 1.00 0.00 C ATOM 130 CD GLU A 10 3.367 -3.879 -14.411 1.00 0.00 C ATOM 131 OE1 GLU A 10 3.660 -3.872 -13.197 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.212 -4.927 -15.072 1.00 0.00 O ATOM 0 H GLU A 10 1.240 -3.500 -18.413 1.00 0.00 H new ATOM 0 HA GLU A 10 0.737 -3.516 -15.703 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.956 -3.586 -16.972 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.850 -1.842 -17.106 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.165 -2.066 -15.219 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.575 -1.894 -14.503 1.00 0.00 H new ATOM 139 N MET A 11 0.507 -0.478 -16.997 1.00 0.00 N ATOM 140 CA MET A 11 -0.021 0.860 -16.758 1.00 0.00 C ATOM 141 C MET A 11 -1.460 0.794 -16.257 1.00 0.00 C ATOM 142 O MET A 11 -1.781 1.322 -15.192 1.00 0.00 O ATOM 143 CB MET A 11 0.048 1.696 -18.037 1.00 0.00 C ATOM 144 CG MET A 11 -0.443 3.123 -17.859 1.00 0.00 C ATOM 145 SD MET A 11 0.800 4.197 -17.116 1.00 0.00 S ATOM 146 CE MET A 11 -0.097 4.824 -15.699 1.00 0.00 C ATOM 0 H MET A 11 0.920 -0.610 -17.920 1.00 0.00 H new ATOM 0 HA MET A 11 0.592 1.333 -15.991 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.078 1.717 -18.392 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.546 1.210 -18.811 1.00 0.00 H new ATOM 0 HG2 MET A 11 -0.734 3.527 -18.829 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.336 3.121 -17.234 1.00 0.00 H new ATOM 0 HE1 MET A 11 0.501 5.585 -15.197 1.00 0.00 H new ATOM 0 HE2 MET A 11 -1.039 5.262 -16.029 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.300 4.007 -15.006 1.00 0.00 H new ATOM 156 N MET A 12 -2.323 0.144 -17.031 1.00 0.00 N ATOM 157 CA MET A 12 -3.728 0.009 -16.663 1.00 0.00 C ATOM 158 C MET A 12 -3.870 -0.605 -15.274 1.00 0.00 C ATOM 159 O MET A 12 -4.495 -0.021 -14.390 1.00 0.00 O ATOM 160 CB MET A 12 -4.466 -0.850 -17.692 1.00 0.00 C ATOM 161 CG MET A 12 -5.243 -0.039 -18.716 1.00 0.00 C ATOM 162 SD MET A 12 -4.850 -0.501 -20.413 1.00 0.00 S ATOM 163 CE MET A 12 -5.953 -1.893 -20.651 1.00 0.00 C ATOM 0 H MET A 12 -2.074 -0.297 -17.916 1.00 0.00 H new ATOM 0 HA MET A 12 -4.171 1.005 -16.647 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.744 -1.480 -18.212 1.00 0.00 H new ATOM 0 HB3 MET A 12 -5.154 -1.516 -17.171 1.00 0.00 H new ATOM 0 HG2 MET A 12 -6.311 -0.174 -18.545 1.00 0.00 H new ATOM 0 HG3 MET A 12 -5.028 1.020 -18.573 1.00 0.00 H new ATOM 0 HE1 MET A 12 -5.826 -2.289 -21.658 1.00 0.00 H new ATOM 0 HE2 MET A 12 -5.720 -2.670 -19.923 1.00 0.00 H new ATOM 0 HE3 MET A 12 -6.984 -1.567 -20.516 1.00 0.00 H new ATOM 173 N GLU A 13 -3.286 -1.785 -15.092 1.00 0.00 N ATOM 174 CA GLU A 13 -3.351 -2.478 -13.810 1.00 0.00 C ATOM 175 C GLU A 13 -2.918 -1.557 -12.672 1.00 0.00 C ATOM 176 O GLU A 13 -3.445 -1.634 -11.561 1.00 0.00 O ATOM 177 CB GLU A 13 -2.466 -3.726 -13.835 1.00 0.00 C ATOM 178 CG GLU A 13 -3.225 -5.004 -14.149 1.00 0.00 C ATOM 179 CD GLU A 13 -2.362 -6.040 -14.840 1.00 0.00 C ATOM 180 OE1 GLU A 13 -2.582 -7.247 -14.606 1.00 0.00 O ATOM 181 OE2 GLU A 13 -1.467 -5.646 -15.617 1.00 0.00 O ATOM 0 H GLU A 13 -2.763 -2.281 -15.814 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.385 -2.778 -13.639 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.680 -3.589 -14.577 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.976 -3.833 -12.867 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.620 -5.424 -13.224 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.080 -4.768 -14.782 1.00 0.00 H new ATOM 188 N LEU A 14 -1.954 -0.687 -12.956 1.00 0.00 N ATOM 189 CA LEU A 14 -1.450 0.249 -11.958 1.00 0.00 C ATOM 190 C LEU A 14 -2.475 1.339 -11.666 1.00 0.00 C ATOM 191 O LEU A 14 -2.932 1.488 -10.532 1.00 0.00 O ATOM 192 CB LEU A 14 -0.141 0.879 -12.436 1.00 0.00 C ATOM 193 CG LEU A 14 1.096 -0.018 -12.378 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.096 0.382 -13.451 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.737 0.045 -11.000 1.00 0.00 C ATOM 0 H LEU A 14 -1.506 -0.611 -13.869 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.265 -0.305 -11.038 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.276 1.212 -13.465 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.051 1.768 -11.836 1.00 0.00 H new ATOM 0 HG LEU A 14 0.784 -1.046 -12.565 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.970 -0.267 -13.394 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.634 0.284 -14.433 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.402 1.417 -13.296 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.616 -0.600 -10.978 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.034 1.071 -10.783 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.021 -0.291 -10.250 1.00 0.00 H new ATOM 207 N ARG A 15 -2.835 2.098 -12.696 1.00 0.00 N ATOM 208 CA ARG A 15 -3.807 3.174 -12.551 1.00 0.00 C ATOM 209 C ARG A 15 -5.108 2.653 -11.945 1.00 0.00 C ATOM 210 O ARG A 15 -5.765 3.349 -11.172 1.00 0.00 O ATOM 211 CB ARG A 15 -4.088 3.823 -13.907 1.00 0.00 C ATOM 212 CG ARG A 15 -5.231 3.173 -14.669 1.00 0.00 C ATOM 213 CD ARG A 15 -6.568 3.804 -14.312 1.00 0.00 C ATOM 214 NE ARG A 15 -7.555 3.631 -15.375 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.846 3.910 -15.232 1.00 0.00 C ATOM 216 NH1 ARG A 15 -9.303 4.372 -14.076 1.00 0.00 N ATOM 217 NH2 ARG A 15 -9.682 3.726 -16.245 1.00 0.00 N ATOM 0 H ARG A 15 -2.467 1.987 -13.641 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.386 3.922 -11.879 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.318 4.878 -13.755 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -3.185 3.778 -14.516 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -5.057 3.269 -15.741 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -5.259 2.107 -14.445 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.945 3.359 -13.391 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.427 4.867 -14.118 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.235 3.277 -16.276 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.663 4.514 -13.295 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -10.295 4.586 -13.968 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.334 3.370 -17.135 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.673 3.941 -16.134 1.00 0.00 H new ATOM 231 N GLU A 16 -5.471 1.425 -12.303 1.00 0.00 N ATOM 232 CA GLU A 16 -6.694 0.813 -11.795 1.00 0.00 C ATOM 233 C GLU A 16 -6.515 0.361 -10.349 1.00 0.00 C ATOM 234 O GLU A 16 -7.469 0.336 -9.572 1.00 0.00 O ATOM 235 CB GLU A 16 -7.094 -0.378 -12.668 1.00 0.00 C ATOM 236 CG GLU A 16 -6.613 -1.716 -12.131 1.00 0.00 C ATOM 237 CD GLU A 16 -7.565 -2.313 -11.114 1.00 0.00 C ATOM 238 OE1 GLU A 16 -7.134 -2.548 -9.966 1.00 0.00 O ATOM 239 OE2 GLU A 16 -8.741 -2.544 -11.465 1.00 0.00 O ATOM 0 H GLU A 16 -4.937 0.835 -12.941 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.486 1.561 -11.828 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.180 -0.402 -12.759 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.693 -0.233 -13.671 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -6.490 -2.413 -12.960 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.632 -1.588 -11.673 1.00 0.00 H new ATOM 246 N ALA A 17 -5.285 0.001 -9.994 1.00 0.00 N ATOM 247 CA ALA A 17 -4.981 -0.450 -8.642 1.00 0.00 C ATOM 248 C ALA A 17 -5.017 0.712 -7.655 1.00 0.00 C ATOM 249 O ALA A 17 -5.398 0.545 -6.497 1.00 0.00 O ATOM 250 CB ALA A 17 -3.621 -1.133 -8.607 1.00 0.00 C ATOM 0 H ALA A 17 -4.483 0.013 -10.625 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.744 -1.169 -8.345 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.407 -1.465 -7.591 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.629 -1.994 -9.276 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.853 -0.430 -8.929 1.00 0.00 H new ATOM 256 N PHE A 18 -4.615 1.891 -8.121 1.00 0.00 N ATOM 257 CA PHE A 18 -4.601 3.081 -7.278 1.00 0.00 C ATOM 258 C PHE A 18 -6.009 3.644 -7.106 1.00 0.00 C ATOM 259 O PHE A 18 -6.448 3.915 -5.989 1.00 0.00 O ATOM 260 CB PHE A 18 -3.683 4.147 -7.881 1.00 0.00 C ATOM 261 CG PHE A 18 -2.389 3.595 -8.408 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.673 2.658 -7.681 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.890 4.015 -9.631 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.481 2.149 -8.164 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.700 3.508 -10.118 1.00 0.00 C ATOM 266 CZ PHE A 18 0.006 2.575 -9.383 1.00 0.00 C ATOM 0 H PHE A 18 -4.295 2.047 -9.077 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.221 2.796 -6.297 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.209 4.653 -8.690 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.466 4.899 -7.123 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.050 2.321 -6.727 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.436 4.746 -10.209 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.068 1.419 -7.588 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.322 3.841 -11.073 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.937 2.180 -9.762 1.00 0.00 H new ATOM 276 N ALA A 19 -6.710 3.817 -8.222 1.00 0.00 N ATOM 277 CA ALA A 19 -8.069 4.346 -8.196 1.00 0.00 C ATOM 278 C ALA A 19 -9.005 3.415 -7.432 1.00 0.00 C ATOM 279 O ALA A 19 -10.066 3.831 -6.965 1.00 0.00 O ATOM 280 CB ALA A 19 -8.577 4.564 -9.613 1.00 0.00 C ATOM 0 H ALA A 19 -6.360 3.599 -9.155 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.051 5.305 -7.678 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.592 4.959 -9.579 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.929 5.274 -10.127 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.575 3.616 -10.150 1.00 0.00 H new ATOM 286 N LYS A 20 -8.607 2.154 -7.310 1.00 0.00 N ATOM 287 CA LYS A 20 -9.411 1.163 -6.603 1.00 0.00 C ATOM 288 C LYS A 20 -9.518 1.506 -5.121 1.00 0.00 C ATOM 289 O LYS A 20 -10.614 1.706 -4.598 1.00 0.00 O ATOM 290 CB LYS A 20 -8.803 -0.232 -6.772 1.00 0.00 C ATOM 291 CG LYS A 20 -9.733 -1.223 -7.449 1.00 0.00 C ATOM 292 CD LYS A 20 -10.033 -0.818 -8.883 1.00 0.00 C ATOM 293 CE LYS A 20 -11.349 -1.407 -9.365 1.00 0.00 C ATOM 294 NZ LYS A 20 -11.629 -1.053 -10.784 1.00 0.00 N ATOM 0 H LYS A 20 -7.732 1.793 -7.691 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.413 1.171 -7.033 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.886 -0.151 -7.355 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.525 -0.619 -5.792 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.280 -2.214 -7.437 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.664 -1.291 -6.887 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.072 0.269 -8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.224 -1.152 -9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.321 -2.492 -9.260 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.161 -1.046 -8.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.535 -1.473 -11.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.681 -0.019 -10.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.867 -1.419 -11.390 1.00 0.00 H new ATOM 308 N VAL A 21 -8.372 1.574 -4.450 1.00 0.00 N ATOM 309 CA VAL A 21 -8.337 1.896 -3.028 1.00 0.00 C ATOM 310 C VAL A 21 -8.669 3.364 -2.789 1.00 0.00 C ATOM 311 O VAL A 21 -8.911 3.780 -1.656 1.00 0.00 O ATOM 312 CB VAL A 21 -6.957 1.587 -2.416 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.732 0.085 -2.339 1.00 0.00 C ATOM 314 CG2 VAL A 21 -5.856 2.258 -3.223 1.00 0.00 C ATOM 0 H VAL A 21 -7.456 1.410 -4.868 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.089 1.273 -2.544 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.930 1.987 -1.402 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.753 -0.114 -1.904 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.504 -0.367 -1.716 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.778 -0.342 -3.341 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.888 2.030 -2.777 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.880 1.889 -4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.010 3.337 -3.222 1.00 0.00 H new ATOM 324 N ASP A 22 -8.682 4.144 -3.864 1.00 0.00 N ATOM 325 CA ASP A 22 -8.987 5.567 -3.771 1.00 0.00 C ATOM 326 C ASP A 22 -10.488 5.811 -3.897 1.00 0.00 C ATOM 327 O ASP A 22 -10.978 6.207 -4.956 1.00 0.00 O ATOM 328 CB ASP A 22 -8.240 6.343 -4.858 1.00 0.00 C ATOM 329 CG ASP A 22 -6.762 6.487 -4.552 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.040 7.083 -5.380 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.327 6.004 -3.487 1.00 0.00 O ATOM 0 H ASP A 22 -8.485 3.815 -4.809 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.660 5.920 -2.793 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.363 5.834 -5.814 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -8.684 7.333 -4.965 1.00 0.00 H new ATOM 336 N THR A 23 -11.215 5.569 -2.810 1.00 0.00 N ATOM 337 CA THR A 23 -12.659 5.760 -2.799 1.00 0.00 C ATOM 338 C THR A 23 -13.019 7.241 -2.803 1.00 0.00 C ATOM 339 O THR A 23 -14.120 7.622 -3.201 1.00 0.00 O ATOM 340 CB THR A 23 -13.305 5.090 -1.571 1.00 0.00 C ATOM 341 OG1 THR A 23 -12.353 5.002 -0.504 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.816 3.700 -1.919 1.00 0.00 C ATOM 0 H THR A 23 -10.826 5.240 -1.926 1.00 0.00 H new ATOM 0 HA THR A 23 -13.046 5.293 -3.705 1.00 0.00 H new ATOM 0 HB THR A 23 -14.150 5.701 -1.253 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.771 4.577 0.273 1.00 0.00 H new ATOM 0 HG21 THR A 23 -14.268 3.247 -1.037 1.00 0.00 H new ATOM 0 HG22 THR A 23 -14.561 3.774 -2.711 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.985 3.082 -2.259 1.00 0.00 H new ATOM 350 N ASP A 24 -12.084 8.074 -2.357 1.00 0.00 N ATOM 351 CA ASP A 24 -12.302 9.514 -2.312 1.00 0.00 C ATOM 352 C ASP A 24 -12.013 10.152 -3.667 1.00 0.00 C ATOM 353 O ASP A 24 -12.335 11.316 -3.900 1.00 0.00 O ATOM 354 CB ASP A 24 -11.419 10.152 -1.237 1.00 0.00 C ATOM 355 CG ASP A 24 -11.171 9.221 -0.067 1.00 0.00 C ATOM 356 OD1 ASP A 24 -12.051 9.128 0.815 1.00 0.00 O ATOM 357 OD2 ASP A 24 -10.096 8.586 -0.032 1.00 0.00 O ATOM 0 H ASP A 24 -11.168 7.776 -2.022 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.349 9.689 -2.064 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -10.465 10.439 -1.678 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -11.892 11.066 -0.877 1.00 0.00 H new ATOM 362 N GLY A 25 -11.401 9.379 -4.561 1.00 0.00 N ATOM 363 CA GLY A 25 -11.078 9.885 -5.882 1.00 0.00 C ATOM 364 C GLY A 25 -10.122 11.061 -5.834 1.00 0.00 C ATOM 365 O GLY A 25 -10.386 12.107 -6.425 1.00 0.00 O ATOM 0 H GLY A 25 -11.124 8.412 -4.393 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.636 9.085 -6.476 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.996 10.187 -6.387 1.00 0.00 H new ATOM 369 N ASN A 26 -9.010 10.888 -5.128 1.00 0.00 N ATOM 370 CA ASN A 26 -8.012 11.946 -5.003 1.00 0.00 C ATOM 371 C ASN A 26 -6.778 11.629 -5.841 1.00 0.00 C ATOM 372 O ASN A 26 -5.956 12.504 -6.111 1.00 0.00 O ATOM 373 CB ASN A 26 -7.614 12.129 -3.537 1.00 0.00 C ATOM 374 CG ASN A 26 -6.967 10.888 -2.953 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.953 9.829 -3.580 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.425 11.015 -1.747 1.00 0.00 N ATOM 0 H ASN A 26 -8.776 10.027 -4.634 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.452 12.873 -5.371 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.924 12.969 -3.453 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.498 12.383 -2.953 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -5.974 10.215 -1.304 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.460 11.913 -1.264 1.00 0.00 H new ATOM 383 N GLY A 27 -6.654 10.370 -6.251 1.00 0.00 N ATOM 384 CA GLY A 27 -5.517 9.960 -7.055 1.00 0.00 C ATOM 385 C GLY A 27 -4.285 9.680 -6.217 1.00 0.00 C ATOM 386 O GLY A 27 -3.223 9.357 -6.750 1.00 0.00 O ATOM 0 H GLY A 27 -7.320 9.627 -6.041 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.779 9.066 -7.620 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.289 10.740 -7.781 1.00 0.00 H new ATOM 390 N TYR A 28 -4.426 9.802 -4.901 1.00 0.00 N ATOM 391 CA TYR A 28 -3.315 9.563 -3.988 1.00 0.00 C ATOM 392 C TYR A 28 -3.636 8.423 -3.027 1.00 0.00 C ATOM 393 O TYR A 28 -4.786 8.002 -2.908 1.00 0.00 O ATOM 394 CB TYR A 28 -2.992 10.834 -3.200 1.00 0.00 C ATOM 395 CG TYR A 28 -2.686 12.028 -4.076 1.00 0.00 C ATOM 396 CD1 TYR A 28 -2.978 13.319 -3.651 1.00 0.00 C ATOM 397 CD2 TYR A 28 -2.105 11.866 -5.327 1.00 0.00 C ATOM 398 CE1 TYR A 28 -2.701 14.413 -4.448 1.00 0.00 C ATOM 399 CE2 TYR A 28 -1.822 12.954 -6.129 1.00 0.00 C ATOM 400 CZ TYR A 28 -2.121 14.226 -5.686 1.00 0.00 C ATOM 401 OH TYR A 28 -1.843 15.312 -6.483 1.00 0.00 O ATOM 0 H TYR A 28 -5.299 10.065 -4.443 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.445 9.281 -4.581 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -3.836 11.075 -2.554 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.138 10.642 -2.551 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -3.429 13.469 -2.681 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -1.871 10.872 -5.679 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.937 15.409 -4.104 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -1.369 12.810 -7.099 1.00 0.00 H new ATOM 0 HH TYR A 28 -1.435 15.007 -7.320 1.00 0.00 H new ATOM 411 N ILE A 29 -2.609 7.928 -2.344 1.00 0.00 N ATOM 412 CA ILE A 29 -2.780 6.838 -1.391 1.00 0.00 C ATOM 413 C ILE A 29 -2.003 7.103 -0.107 1.00 0.00 C ATOM 414 O ILE A 29 -0.831 7.475 -0.144 1.00 0.00 O ATOM 415 CB ILE A 29 -2.322 5.493 -1.987 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.164 5.142 -3.215 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.416 4.392 -0.941 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.675 3.913 -3.951 1.00 0.00 C ATOM 0 H ILE A 29 -1.650 8.264 -2.433 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.844 6.782 -1.163 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.281 5.585 -2.298 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.197 4.983 -2.904 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.164 5.990 -3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -2.089 3.448 -1.376 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.778 4.641 -0.093 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.448 4.298 -0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.319 3.723 -4.810 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.653 4.076 -4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.701 3.053 -3.281 1.00 0.00 H new ATOM 430 N SER A 30 -2.665 6.907 1.030 1.00 0.00 N ATOM 431 CA SER A 30 -2.037 7.126 2.327 1.00 0.00 C ATOM 432 C SER A 30 -1.677 5.800 2.988 1.00 0.00 C ATOM 433 O SER A 30 -1.780 4.738 2.373 1.00 0.00 O ATOM 434 CB SER A 30 -2.969 7.927 3.239 1.00 0.00 C ATOM 435 OG SER A 30 -4.077 7.146 3.651 1.00 0.00 O ATOM 0 H SER A 30 -3.636 6.597 1.078 1.00 0.00 H new ATOM 0 HA SER A 30 -1.120 7.693 2.168 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.418 8.272 4.114 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.321 8.815 2.714 1.00 0.00 H new ATOM 0 HG SER A 30 -4.656 7.681 4.234 1.00 0.00 H new ATOM 441 N PHE A 31 -1.255 5.868 4.247 1.00 0.00 N ATOM 442 CA PHE A 31 -0.879 4.674 4.993 1.00 0.00 C ATOM 443 C PHE A 31 -2.112 3.972 5.557 1.00 0.00 C ATOM 444 O PHE A 31 -2.094 2.769 5.810 1.00 0.00 O ATOM 445 CB PHE A 31 0.079 5.037 6.129 1.00 0.00 C ATOM 446 CG PHE A 31 0.043 4.067 7.276 1.00 0.00 C ATOM 447 CD1 PHE A 31 -0.857 4.235 8.316 1.00 0.00 C ATOM 448 CD2 PHE A 31 0.912 2.988 7.315 1.00 0.00 C ATOM 449 CE1 PHE A 31 -0.893 3.345 9.372 1.00 0.00 C ATOM 450 CE2 PHE A 31 0.881 2.094 8.369 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.021 2.274 9.398 1.00 0.00 C ATOM 0 H PHE A 31 -1.165 6.738 4.771 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.377 3.992 4.307 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.095 5.085 5.736 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.168 6.033 6.498 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.539 5.072 8.301 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.621 2.844 6.513 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.601 3.486 10.175 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.562 1.256 8.387 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.045 1.578 10.223 1.00 0.00 H new ATOM 461 N ASN A 32 -3.182 4.737 5.751 1.00 0.00 N ATOM 462 CA ASN A 32 -4.424 4.191 6.285 1.00 0.00 C ATOM 463 C ASN A 32 -5.023 3.164 5.329 1.00 0.00 C ATOM 464 O ASN A 32 -5.186 1.996 5.681 1.00 0.00 O ATOM 465 CB ASN A 32 -5.431 5.314 6.540 1.00 0.00 C ATOM 466 CG ASN A 32 -6.535 4.895 7.492 1.00 0.00 C ATOM 467 OD1 ASN A 32 -6.358 4.909 8.710 1.00 0.00 O ATOM 468 ND2 ASN A 32 -7.683 4.520 6.939 1.00 0.00 N ATOM 0 H ASN A 32 -3.213 5.736 5.546 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.197 3.694 7.228 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.910 6.179 6.950 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.871 5.626 5.593 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.462 4.228 7.529 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.786 4.524 5.924 1.00 0.00 H new ATOM 475 N GLU A 33 -5.348 3.608 4.119 1.00 0.00 N ATOM 476 CA GLU A 33 -5.928 2.727 3.112 1.00 0.00 C ATOM 477 C GLU A 33 -4.962 1.602 2.750 1.00 0.00 C ATOM 478 O GLU A 33 -5.380 0.501 2.390 1.00 0.00 O ATOM 479 CB GLU A 33 -6.295 3.522 1.857 1.00 0.00 C ATOM 480 CG GLU A 33 -5.141 4.333 1.291 1.00 0.00 C ATOM 481 CD GLU A 33 -5.603 5.415 0.335 1.00 0.00 C ATOM 482 OE1 GLU A 33 -5.355 6.605 0.623 1.00 0.00 O ATOM 483 OE2 GLU A 33 -6.212 5.073 -0.700 1.00 0.00 O ATOM 0 H GLU A 33 -5.220 4.572 3.812 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.832 2.285 3.531 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.653 2.833 1.092 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -7.120 4.195 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.586 4.790 2.111 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.452 3.666 0.773 1.00 0.00 H new ATOM 490 N LEU A 34 -3.668 1.888 2.850 1.00 0.00 N ATOM 491 CA LEU A 34 -2.641 0.901 2.534 1.00 0.00 C ATOM 492 C LEU A 34 -2.703 -0.279 3.498 1.00 0.00 C ATOM 493 O LEU A 34 -2.847 -1.427 3.081 1.00 0.00 O ATOM 494 CB LEU A 34 -1.254 1.544 2.586 1.00 0.00 C ATOM 495 CG LEU A 34 -0.715 2.088 1.262 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.543 2.909 1.495 1.00 0.00 C ATOM 497 CD2 LEU A 34 -0.440 0.949 0.292 1.00 0.00 C ATOM 0 H LEU A 34 -3.306 2.794 3.147 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.826 0.532 1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.281 2.361 3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.548 0.806 2.967 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.471 2.739 0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.912 3.288 0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.314 3.746 2.154 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.306 2.282 1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.057 1.353 -0.645 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.298 0.273 0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.364 0.403 0.101 1.00 0.00 H new ATOM 509 N ASN A 35 -2.595 0.014 4.790 1.00 0.00 N ATOM 510 CA ASN A 35 -2.640 -1.023 5.815 1.00 0.00 C ATOM 511 C ASN A 35 -3.995 -1.725 5.819 1.00 0.00 C ATOM 512 O ASN A 35 -4.076 -2.938 6.012 1.00 0.00 O ATOM 513 CB ASN A 35 -2.363 -0.419 7.193 1.00 0.00 C ATOM 514 CG ASN A 35 -2.732 -1.362 8.322 1.00 0.00 C ATOM 515 OD1 ASN A 35 -2.122 -2.542 8.333 1.00 0.00 O flip ATOM 516 ND2 ASN A 35 -3.557 -1.033 9.175 1.00 0.00 N flip ATOM 0 H ASN A 35 -2.476 0.960 5.152 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.869 -1.759 5.586 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.306 -0.162 7.268 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -2.925 0.509 7.300 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.001 -0.116 9.128 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -3.796 -1.677 9.929 1.00 0.00 H new ATOM 523 N ASP A 36 -5.056 -0.954 5.603 1.00 0.00 N ATOM 524 CA ASP A 36 -6.407 -1.502 5.579 1.00 0.00 C ATOM 525 C ASP A 36 -6.599 -2.422 4.378 1.00 0.00 C ATOM 526 O ASP A 36 -7.263 -3.455 4.473 1.00 0.00 O ATOM 527 CB ASP A 36 -7.437 -0.372 5.542 1.00 0.00 C ATOM 528 CG ASP A 36 -8.767 -0.782 6.141 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.698 -1.091 5.368 1.00 0.00 O ATOM 530 OD2 ASP A 36 -8.877 -0.796 7.386 1.00 0.00 O ATOM 0 H ASP A 36 -5.006 0.052 5.442 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.552 -2.086 6.488 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.047 0.489 6.085 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.589 -0.056 4.510 1.00 0.00 H new ATOM 535 N LEU A 37 -6.015 -2.041 3.248 1.00 0.00 N ATOM 536 CA LEU A 37 -6.123 -2.832 2.026 1.00 0.00 C ATOM 537 C LEU A 37 -5.383 -4.158 2.169 1.00 0.00 C ATOM 538 O LEU A 37 -5.936 -5.222 1.893 1.00 0.00 O ATOM 539 CB LEU A 37 -5.562 -2.049 0.837 1.00 0.00 C ATOM 540 CG LEU A 37 -5.594 -2.766 -0.513 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.322 -3.575 -0.718 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.820 -3.661 -0.613 1.00 0.00 C ATOM 0 H LEU A 37 -5.462 -1.190 3.152 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.178 -3.042 1.851 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.121 -1.118 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.529 -1.780 1.059 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.653 -2.015 -1.300 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.363 -4.078 -1.684 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.459 -2.909 -0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.231 -4.318 0.075 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.826 -4.163 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.793 -4.406 0.182 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.721 -3.056 -0.513 1.00 0.00 H new ATOM 554 N PHE A 38 -4.130 -4.087 2.605 1.00 0.00 N ATOM 555 CA PHE A 38 -3.314 -5.282 2.786 1.00 0.00 C ATOM 556 C PHE A 38 -3.912 -6.191 3.858 1.00 0.00 C ATOM 557 O PHE A 38 -3.883 -7.416 3.736 1.00 0.00 O ATOM 558 CB PHE A 38 -1.885 -4.897 3.170 1.00 0.00 C ATOM 559 CG PHE A 38 -1.229 -3.971 2.185 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.280 -3.052 2.604 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.562 -4.020 0.841 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.325 -2.199 1.699 1.00 0.00 C ATOM 563 CE2 PHE A 38 -0.959 -3.170 -0.068 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.016 -2.258 0.362 1.00 0.00 C ATOM 0 H PHE A 38 -3.657 -3.214 2.840 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.295 -5.825 1.841 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.896 -4.422 4.151 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.285 -5.802 3.261 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.010 -3.001 3.648 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.301 -4.730 0.499 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.063 -1.487 2.038 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.226 -3.220 -1.113 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.454 -1.592 -0.346 1.00 0.00 H new ATOM 574 N LYS A 39 -4.453 -5.582 4.907 1.00 0.00 N ATOM 575 CA LYS A 39 -5.059 -6.333 6.000 1.00 0.00 C ATOM 576 C LYS A 39 -6.422 -6.884 5.592 1.00 0.00 C ATOM 577 O LYS A 39 -6.860 -7.918 6.094 1.00 0.00 O ATOM 578 CB LYS A 39 -5.205 -5.445 7.237 1.00 0.00 C ATOM 579 CG LYS A 39 -5.354 -6.224 8.532 1.00 0.00 C ATOM 580 CD LYS A 39 -4.082 -6.981 8.877 1.00 0.00 C ATOM 581 CE LYS A 39 -4.180 -8.446 8.481 1.00 0.00 C ATOM 582 NZ LYS A 39 -4.706 -9.287 9.592 1.00 0.00 N ATOM 0 H LYS A 39 -4.484 -4.569 5.024 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.405 -7.172 6.238 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.333 -4.795 7.312 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.074 -4.799 7.110 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.602 -5.539 9.343 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.183 -6.926 8.442 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.235 -6.521 8.368 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.891 -6.904 9.947 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.830 -8.544 7.612 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.196 -8.809 8.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -4.758 -10.278 9.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.072 -9.213 10.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -5.656 -8.957 9.857 1.00 0.00 H new ATOM 596 N ALA A 40 -7.088 -6.185 4.679 1.00 0.00 N ATOM 597 CA ALA A 40 -8.399 -6.606 4.201 1.00 0.00 C ATOM 598 C ALA A 40 -8.290 -7.846 3.321 1.00 0.00 C ATOM 599 O ALA A 40 -9.297 -8.465 2.976 1.00 0.00 O ATOM 600 CB ALA A 40 -9.073 -5.474 3.441 1.00 0.00 C ATOM 0 H ALA A 40 -6.741 -5.324 4.255 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.010 -6.860 5.067 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.051 -5.803 3.090 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.194 -4.615 4.100 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.457 -5.192 2.587 1.00 0.00 H new ATOM 606 N ALA A 41 -7.063 -8.205 2.960 1.00 0.00 N ATOM 607 CA ALA A 41 -6.822 -9.372 2.120 1.00 0.00 C ATOM 608 C ALA A 41 -7.425 -10.627 2.741 1.00 0.00 C ATOM 609 O ALA A 41 -7.737 -11.590 2.038 1.00 0.00 O ATOM 610 CB ALA A 41 -5.331 -9.559 1.890 1.00 0.00 C ATOM 0 H ALA A 41 -6.219 -7.704 3.236 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.307 -9.204 1.159 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.167 -10.434 1.261 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -4.925 -8.676 1.396 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.830 -9.701 2.848 1.00 0.00 H new ATOM 616 N CYS A 42 -7.587 -10.611 4.059 1.00 0.00 N ATOM 617 CA CYS A 42 -8.152 -11.749 4.774 1.00 0.00 C ATOM 618 C CYS A 42 -7.337 -13.012 4.516 1.00 0.00 C ATOM 619 O CYS A 42 -7.872 -14.031 4.076 1.00 0.00 O ATOM 620 CB CYS A 42 -9.606 -11.971 4.355 1.00 0.00 C ATOM 621 SG CYS A 42 -10.753 -10.721 4.977 1.00 0.00 S ATOM 0 H CYS A 42 -7.335 -9.822 4.654 1.00 0.00 H new ATOM 0 HA CYS A 42 -8.119 -11.529 5.841 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.660 -11.989 3.267 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -9.928 -12.951 4.706 1.00 0.00 H new ATOM 0 HG CYS A 42 -10.520 -9.586 4.387 1.00 0.00 H new ATOM 627 N LEU A 43 -6.039 -12.939 4.792 1.00 0.00 N ATOM 628 CA LEU A 43 -5.148 -14.077 4.588 1.00 0.00 C ATOM 629 C LEU A 43 -4.489 -14.494 5.899 1.00 0.00 C ATOM 630 O LEU A 43 -4.423 -13.727 6.859 1.00 0.00 O ATOM 631 CB LEU A 43 -4.077 -13.731 3.552 1.00 0.00 C ATOM 632 CG LEU A 43 -4.267 -14.337 2.162 1.00 0.00 C ATOM 633 CD1 LEU A 43 -5.070 -13.397 1.275 1.00 0.00 C ATOM 634 CD2 LEU A 43 -2.920 -14.650 1.528 1.00 0.00 C ATOM 0 H LEU A 43 -5.580 -12.104 5.157 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.743 -14.913 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -4.035 -12.647 3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.110 -14.053 3.938 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.823 -15.269 2.266 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.195 -13.845 0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.049 -13.223 1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.542 -12.449 1.178 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.075 -15.081 0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.339 -13.732 1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.380 -15.361 2.153 1.00 0.00 H new ATOM 646 N PRO A 44 -3.989 -15.738 5.941 1.00 0.00 N ATOM 647 CA PRO A 44 -3.324 -16.284 7.126 1.00 0.00 C ATOM 648 C PRO A 44 -1.973 -15.626 7.388 1.00 0.00 C ATOM 649 O PRO A 44 -0.923 -16.213 7.120 1.00 0.00 O ATOM 650 CB PRO A 44 -3.141 -17.764 6.780 1.00 0.00 C ATOM 651 CG PRO A 44 -3.116 -17.805 5.292 1.00 0.00 C ATOM 652 CD PRO A 44 -4.034 -16.706 4.832 1.00 0.00 C ATOM 0 HA PRO A 44 -3.903 -16.113 8.033 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.217 -18.158 7.202 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.956 -18.368 7.179 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -2.105 -17.653 4.914 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -3.452 -18.774 4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -3.692 -16.262 3.897 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.046 -17.073 4.660 1.00 0.00 H new ATOM 660 N LEU A 45 -2.006 -14.406 7.913 1.00 0.00 N ATOM 661 CA LEU A 45 -0.783 -13.669 8.211 1.00 0.00 C ATOM 662 C LEU A 45 -0.942 -12.841 9.482 1.00 0.00 C ATOM 663 O LEU A 45 -2.040 -12.411 9.839 1.00 0.00 O ATOM 664 CB LEU A 45 -0.414 -12.759 7.039 1.00 0.00 C ATOM 665 CG LEU A 45 0.818 -13.170 6.231 1.00 0.00 C ATOM 666 CD1 LEU A 45 0.495 -14.351 5.329 1.00 0.00 C ATOM 667 CD2 LEU A 45 1.335 -11.997 5.413 1.00 0.00 C ATOM 0 H LEU A 45 -2.866 -13.907 8.141 1.00 0.00 H new ATOM 0 HA LEU A 45 0.018 -14.392 8.368 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.267 -12.708 6.362 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.252 -11.752 7.424 1.00 0.00 H new ATOM 0 HG LEU A 45 1.600 -13.474 6.927 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.383 -14.629 4.762 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.173 -15.196 5.937 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.303 -14.075 4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 45 2.212 -12.308 4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.558 -11.662 4.726 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.607 -11.179 6.081 1.00 0.00 H new ATOM 679 N PRO A 46 0.177 -12.608 10.182 1.00 0.00 N ATOM 680 CA PRO A 46 0.188 -11.828 11.422 1.00 0.00 C ATOM 681 C PRO A 46 -0.083 -10.347 11.178 1.00 0.00 C ATOM 682 O PRO A 46 -0.544 -9.959 10.105 1.00 0.00 O ATOM 683 CB PRO A 46 1.608 -12.029 11.957 1.00 0.00 C ATOM 684 CG PRO A 46 2.426 -12.338 10.751 1.00 0.00 C ATOM 685 CD PRO A 46 1.520 -13.090 9.816 1.00 0.00 C ATOM 0 HA PRO A 46 -0.592 -12.151 12.112 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.971 -11.134 12.463 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.647 -12.843 12.681 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.795 -11.424 10.285 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.298 -12.936 11.014 1.00 0.00 H new ATOM 0 HD2 PRO A 46 1.753 -12.877 8.773 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.610 -14.168 9.949 1.00 0.00 H new ATOM 693 N GLY A 47 0.205 -9.523 12.180 1.00 0.00 N ATOM 694 CA GLY A 47 -0.014 -8.094 12.053 1.00 0.00 C ATOM 695 C GLY A 47 1.248 -7.345 11.675 1.00 0.00 C ATOM 696 O GLY A 47 1.223 -6.470 10.809 1.00 0.00 O ATOM 0 H GLY A 47 0.586 -9.820 13.078 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.780 -7.913 11.299 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.396 -7.703 12.996 1.00 0.00 H new ATOM 700 N TYR A 48 2.355 -7.688 12.325 1.00 0.00 N ATOM 701 CA TYR A 48 3.632 -7.038 12.055 1.00 0.00 C ATOM 702 C TYR A 48 3.941 -7.045 10.560 1.00 0.00 C ATOM 703 O TYR A 48 4.525 -6.099 10.032 1.00 0.00 O ATOM 704 CB TYR A 48 4.755 -7.738 12.822 1.00 0.00 C ATOM 705 CG TYR A 48 5.242 -9.007 12.161 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.190 -8.966 11.147 1.00 0.00 C ATOM 707 CD2 TYR A 48 4.751 -10.248 12.549 1.00 0.00 C ATOM 708 CE1 TYR A 48 6.637 -10.124 10.539 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.194 -11.410 11.949 1.00 0.00 C ATOM 710 CZ TYR A 48 6.136 -11.343 10.943 1.00 0.00 C ATOM 711 OH TYR A 48 6.578 -12.499 10.342 1.00 0.00 O ATOM 0 H TYR A 48 2.394 -8.412 13.042 1.00 0.00 H new ATOM 0 HA TYR A 48 3.563 -6.003 12.389 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.593 -7.050 12.930 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.405 -7.973 13.827 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.585 -8.013 10.828 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.010 -10.304 13.333 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.375 -10.074 9.752 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.805 -12.367 12.266 1.00 0.00 H new ATOM 0 HH TYR A 48 6.126 -13.270 10.744 1.00 0.00 H new ATOM 721 N ARG A 49 3.543 -8.119 9.886 1.00 0.00 N ATOM 722 CA ARG A 49 3.778 -8.249 8.453 1.00 0.00 C ATOM 723 C ARG A 49 3.069 -7.139 7.683 1.00 0.00 C ATOM 724 O ARG A 49 3.705 -6.355 6.977 1.00 0.00 O ATOM 725 CB ARG A 49 3.295 -9.614 7.958 1.00 0.00 C ATOM 726 CG ARG A 49 4.241 -10.271 6.966 1.00 0.00 C ATOM 727 CD ARG A 49 5.475 -10.828 7.658 1.00 0.00 C ATOM 728 NE ARG A 49 6.261 -11.681 6.771 1.00 0.00 N ATOM 729 CZ ARG A 49 7.109 -11.214 5.862 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.279 -9.907 5.719 1.00 0.00 N ATOM 731 NH2 ARG A 49 7.788 -12.055 5.091 1.00 0.00 N ATOM 0 H ARG A 49 3.057 -8.910 10.308 1.00 0.00 H new ATOM 0 HA ARG A 49 4.850 -8.163 8.277 1.00 0.00 H new ATOM 0 HB2 ARG A 49 3.163 -10.276 8.814 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.317 -9.497 7.492 1.00 0.00 H new ATOM 0 HG2 ARG A 49 3.722 -11.074 6.444 1.00 0.00 H new ATOM 0 HG3 ARG A 49 4.542 -9.543 6.212 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.095 -10.004 8.012 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.172 -11.399 8.536 1.00 0.00 H new ATOM 0 HE ARG A 49 6.153 -12.692 6.854 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.758 -9.257 6.308 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.931 -9.551 5.020 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.659 -13.061 5.196 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.439 -11.695 4.393 1.00 0.00 H new ATOM 745 N VAL A 50 1.749 -7.077 7.821 1.00 0.00 N ATOM 746 CA VAL A 50 0.954 -6.062 7.140 1.00 0.00 C ATOM 747 C VAL A 50 1.483 -4.663 7.430 1.00 0.00 C ATOM 748 O VAL A 50 1.701 -3.868 6.516 1.00 0.00 O ATOM 749 CB VAL A 50 -0.526 -6.136 7.557 1.00 0.00 C ATOM 750 CG1 VAL A 50 -1.368 -5.196 6.706 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.039 -7.565 7.451 1.00 0.00 C ATOM 0 H VAL A 50 1.207 -7.719 8.399 1.00 0.00 H new ATOM 0 HA VAL A 50 1.033 -6.262 6.072 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.608 -5.820 8.597 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.411 -5.262 7.015 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.015 -4.173 6.836 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.282 -5.479 5.657 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.087 -7.599 7.750 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.944 -7.910 6.422 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.454 -8.211 8.106 1.00 0.00 H new ATOM 761 N ARG A 51 1.690 -4.368 8.709 1.00 0.00 N ATOM 762 CA ARG A 51 2.195 -3.064 9.121 1.00 0.00 C ATOM 763 C ARG A 51 3.604 -2.831 8.585 1.00 0.00 C ATOM 764 O ARG A 51 4.026 -1.690 8.398 1.00 0.00 O ATOM 765 CB ARG A 51 2.193 -2.952 10.648 1.00 0.00 C ATOM 766 CG ARG A 51 2.285 -1.521 11.152 1.00 0.00 C ATOM 767 CD ARG A 51 0.946 -1.029 11.680 1.00 0.00 C ATOM 768 NE ARG A 51 0.957 -0.867 13.132 1.00 0.00 N ATOM 769 CZ ARG A 51 0.019 -0.209 13.805 1.00 0.00 C ATOM 770 NH1 ARG A 51 -0.999 0.344 13.161 1.00 0.00 N ATOM 771 NH2 ARG A 51 0.099 -0.105 15.126 1.00 0.00 N ATOM 0 H ARG A 51 1.516 -5.015 9.478 1.00 0.00 H new ATOM 0 HA ARG A 51 1.537 -2.300 8.706 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.282 -3.408 11.036 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.031 -3.524 11.047 1.00 0.00 H new ATOM 0 HG2 ARG A 51 3.034 -1.460 11.942 1.00 0.00 H new ATOM 0 HG3 ARG A 51 2.620 -0.870 10.344 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.699 -0.077 11.211 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.164 -1.735 11.400 1.00 0.00 H new ATOM 0 HE ARG A 51 1.727 -1.282 13.658 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -1.064 0.265 12.146 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -1.718 0.848 13.680 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.881 -0.530 15.625 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.621 0.400 15.642 1.00 0.00 H new ATOM 785 N GLU A 52 4.326 -3.921 8.340 1.00 0.00 N ATOM 786 CA GLU A 52 5.688 -3.834 7.827 1.00 0.00 C ATOM 787 C GLU A 52 5.687 -3.519 6.333 1.00 0.00 C ATOM 788 O GLU A 52 6.345 -2.579 5.886 1.00 0.00 O ATOM 789 CB GLU A 52 6.437 -5.143 8.083 1.00 0.00 C ATOM 790 CG GLU A 52 7.811 -5.194 7.437 1.00 0.00 C ATOM 791 CD GLU A 52 8.774 -4.186 8.033 1.00 0.00 C ATOM 792 OE1 GLU A 52 8.461 -2.977 8.004 1.00 0.00 O ATOM 793 OE2 GLU A 52 9.842 -4.604 8.528 1.00 0.00 O ATOM 0 H GLU A 52 3.991 -4.873 8.488 1.00 0.00 H new ATOM 0 HA GLU A 52 6.196 -3.025 8.351 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.545 -5.286 9.158 1.00 0.00 H new ATOM 0 HB3 GLU A 52 5.838 -5.974 7.709 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.224 -6.196 7.550 1.00 0.00 H new ATOM 0 HG3 GLU A 52 7.713 -5.008 6.367 1.00 0.00 H new ATOM 800 N ILE A 53 4.946 -4.313 5.568 1.00 0.00 N ATOM 801 CA ILE A 53 4.859 -4.120 4.126 1.00 0.00 C ATOM 802 C ILE A 53 4.314 -2.736 3.789 1.00 0.00 C ATOM 803 O ILE A 53 4.779 -2.083 2.852 1.00 0.00 O ATOM 804 CB ILE A 53 3.964 -5.186 3.468 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.587 -5.209 4.133 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.622 -6.554 3.551 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.664 -6.270 3.576 1.00 0.00 C ATOM 0 H ILE A 53 4.397 -5.096 5.923 1.00 0.00 H new ATOM 0 HA ILE A 53 5.871 -4.215 3.733 1.00 0.00 H new ATOM 0 HB ILE A 53 3.834 -4.931 2.416 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.712 -5.373 5.203 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.118 -4.232 4.013 1.00 0.00 H new ATOM 0 HG21 ILE A 53 3.977 -7.297 3.082 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.582 -6.528 3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.780 -6.819 4.596 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.706 -6.228 4.095 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.508 -6.095 2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.111 -7.253 3.720 1.00 0.00 H new ATOM 819 N THR A 54 3.325 -2.291 4.558 1.00 0.00 N ATOM 820 CA THR A 54 2.717 -0.985 4.342 1.00 0.00 C ATOM 821 C THR A 54 3.668 0.137 4.742 1.00 0.00 C ATOM 822 O THR A 54 3.773 1.150 4.050 1.00 0.00 O ATOM 823 CB THR A 54 1.405 -0.838 5.136 1.00 0.00 C ATOM 824 OG1 THR A 54 0.751 0.385 4.780 1.00 0.00 O ATOM 825 CG2 THR A 54 1.674 -0.858 6.634 1.00 0.00 C ATOM 0 H THR A 54 2.928 -2.817 5.337 1.00 0.00 H new ATOM 0 HA THR A 54 2.499 -0.910 3.277 1.00 0.00 H new ATOM 0 HB THR A 54 0.759 -1.680 4.887 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.826 1.023 5.520 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.733 -0.753 7.174 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.145 -1.802 6.906 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.337 -0.033 6.896 1.00 0.00 H new ATOM 833 N GLU A 55 4.359 -0.050 5.862 1.00 0.00 N ATOM 834 CA GLU A 55 5.301 0.949 6.353 1.00 0.00 C ATOM 835 C GLU A 55 6.417 1.190 5.339 1.00 0.00 C ATOM 836 O GLU A 55 6.767 2.332 5.046 1.00 0.00 O ATOM 837 CB GLU A 55 5.900 0.505 7.689 1.00 0.00 C ATOM 838 CG GLU A 55 5.164 1.054 8.899 1.00 0.00 C ATOM 839 CD GLU A 55 5.980 0.956 10.174 1.00 0.00 C ATOM 840 OE1 GLU A 55 5.418 0.538 11.207 1.00 0.00 O ATOM 841 OE2 GLU A 55 7.181 1.297 10.137 1.00 0.00 O ATOM 0 H GLU A 55 4.284 -0.883 6.446 1.00 0.00 H new ATOM 0 HA GLU A 55 4.757 1.882 6.499 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.896 -0.584 7.735 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.942 0.822 7.734 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.903 2.097 8.718 1.00 0.00 H new ATOM 0 HG3 GLU A 55 4.229 0.509 9.028 1.00 0.00 H new ATOM 848 N ASN A 56 6.969 0.104 4.808 1.00 0.00 N ATOM 849 CA ASN A 56 8.045 0.197 3.828 1.00 0.00 C ATOM 850 C ASN A 56 7.544 0.819 2.527 1.00 0.00 C ATOM 851 O ASN A 56 8.111 1.795 2.035 1.00 0.00 O ATOM 852 CB ASN A 56 8.631 -1.188 3.550 1.00 0.00 C ATOM 853 CG ASN A 56 9.576 -1.646 4.645 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.207 -1.382 5.893 1.00 0.00 O flip ATOM 855 ND2 ASN A 56 10.624 -2.229 4.372 1.00 0.00 N flip ATOM 0 H ASN A 56 6.690 -0.849 5.039 1.00 0.00 H new ATOM 0 HA ASN A 56 8.824 0.838 4.241 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.820 -1.909 3.449 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.163 -1.170 2.599 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.868 -2.411 3.398 1.00 0.00 H new ATOM 0 HD22 ASN A 56 11.249 -2.531 5.119 1.00 0.00 H new ATOM 862 N LEU A 57 6.479 0.247 1.976 1.00 0.00 N ATOM 863 CA LEU A 57 5.901 0.745 0.733 1.00 0.00 C ATOM 864 C LEU A 57 5.673 2.252 0.804 1.00 0.00 C ATOM 865 O LEU A 57 5.930 2.974 -0.159 1.00 0.00 O ATOM 866 CB LEU A 57 4.580 0.031 0.441 1.00 0.00 C ATOM 867 CG LEU A 57 3.962 0.299 -0.932 1.00 0.00 C ATOM 868 CD1 LEU A 57 4.948 -0.044 -2.037 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.673 -0.493 -1.100 1.00 0.00 C ATOM 0 H LEU A 57 5.998 -0.562 2.370 1.00 0.00 H new ATOM 0 HA LEU A 57 6.604 0.540 -0.074 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.740 -1.042 0.542 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.858 0.319 1.205 1.00 0.00 H new ATOM 0 HG LEU A 57 3.725 1.361 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.491 0.153 -3.007 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.844 0.567 -1.927 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.217 -1.098 -1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.247 -0.290 -2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.886 -1.558 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.962 -0.198 -0.328 1.00 0.00 H new ATOM 881 N MET A 58 5.193 2.719 1.951 1.00 0.00 N ATOM 882 CA MET A 58 4.934 4.141 2.147 1.00 0.00 C ATOM 883 C MET A 58 6.237 4.933 2.166 1.00 0.00 C ATOM 884 O MET A 58 6.415 5.873 1.393 1.00 0.00 O ATOM 885 CB MET A 58 4.167 4.366 3.453 1.00 0.00 C ATOM 886 CG MET A 58 2.859 5.115 3.267 1.00 0.00 C ATOM 887 SD MET A 58 3.094 6.766 2.582 1.00 0.00 S ATOM 888 CE MET A 58 1.404 7.216 2.194 1.00 0.00 C ATOM 0 H MET A 58 4.975 2.135 2.758 1.00 0.00 H new ATOM 0 HA MET A 58 4.328 4.493 1.312 1.00 0.00 H new ATOM 0 HB2 MET A 58 3.961 3.400 3.915 1.00 0.00 H new ATOM 0 HB3 MET A 58 4.799 4.922 4.145 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.207 4.542 2.607 1.00 0.00 H new ATOM 0 HG3 MET A 58 2.350 5.194 4.228 1.00 0.00 H new ATOM 0 HE1 MET A 58 1.400 7.973 1.409 1.00 0.00 H new ATOM 0 HE2 MET A 58 0.862 6.335 1.851 1.00 0.00 H new ATOM 0 HE3 MET A 58 0.920 7.615 3.085 1.00 0.00 H new ATOM 898 N ALA A 59 7.147 4.546 3.055 1.00 0.00 N ATOM 899 CA ALA A 59 8.434 5.219 3.174 1.00 0.00 C ATOM 900 C ALA A 59 9.151 5.273 1.828 1.00 0.00 C ATOM 901 O ALA A 59 9.676 6.314 1.433 1.00 0.00 O ATOM 902 CB ALA A 59 9.302 4.520 4.209 1.00 0.00 C ATOM 0 H ALA A 59 7.016 3.769 3.703 1.00 0.00 H new ATOM 0 HA ALA A 59 8.252 6.243 3.501 1.00 0.00 H new ATOM 0 HB1 ALA A 59 10.260 5.034 4.287 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.801 4.538 5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.468 3.486 3.906 1.00 0.00 H new ATOM 908 N THR A 60 9.171 4.143 1.129 1.00 0.00 N ATOM 909 CA THR A 60 9.825 4.060 -0.171 1.00 0.00 C ATOM 910 C THR A 60 8.880 4.479 -1.290 1.00 0.00 C ATOM 911 O THR A 60 9.210 4.367 -2.470 1.00 0.00 O ATOM 912 CB THR A 60 10.336 2.634 -0.453 1.00 0.00 C ATOM 913 OG1 THR A 60 11.104 2.620 -1.662 1.00 0.00 O ATOM 914 CG2 THR A 60 9.176 1.657 -0.572 1.00 0.00 C ATOM 0 H THR A 60 8.742 3.272 1.441 1.00 0.00 H new ATOM 0 HA THR A 60 10.674 4.743 -0.141 1.00 0.00 H new ATOM 0 HB THR A 60 10.966 2.325 0.381 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.767 3.309 -2.272 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.561 0.657 -0.771 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.610 1.649 0.360 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.524 1.964 -1.390 1.00 0.00 H new ATOM 922 N GLY A 61 7.700 4.965 -0.912 1.00 0.00 N ATOM 923 CA GLY A 61 6.725 5.394 -1.897 1.00 0.00 C ATOM 924 C GLY A 61 6.355 6.856 -1.746 1.00 0.00 C ATOM 925 O GLY A 61 5.368 7.317 -2.320 1.00 0.00 O ATOM 0 H GLY A 61 7.403 5.069 0.058 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.124 5.225 -2.897 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.827 4.783 -1.805 1.00 0.00 H new ATOM 929 N ASP A 62 7.147 7.589 -0.970 1.00 0.00 N ATOM 930 CA ASP A 62 6.897 9.007 -0.744 1.00 0.00 C ATOM 931 C ASP A 62 8.157 9.829 -1.003 1.00 0.00 C ATOM 932 O ASP A 62 9.122 9.760 -0.243 1.00 0.00 O ATOM 933 CB ASP A 62 6.406 9.240 0.685 1.00 0.00 C ATOM 934 CG ASP A 62 5.723 10.584 0.852 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.672 11.350 -0.134 1.00 0.00 O ATOM 936 OD2 ASP A 62 5.240 10.868 1.967 1.00 0.00 O ATOM 0 H ASP A 62 7.968 7.224 -0.487 1.00 0.00 H new ATOM 0 HA ASP A 62 6.124 9.330 -1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.712 8.446 0.961 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.251 9.178 1.371 1.00 0.00 H new ATOM 941 N LEU A 63 8.139 10.605 -2.081 1.00 0.00 N ATOM 942 CA LEU A 63 9.280 11.439 -2.441 1.00 0.00 C ATOM 943 C LEU A 63 9.218 12.785 -1.725 1.00 0.00 C ATOM 944 O LEU A 63 10.202 13.232 -1.136 1.00 0.00 O ATOM 945 CB LEU A 63 9.322 11.656 -3.955 1.00 0.00 C ATOM 946 CG LEU A 63 9.971 10.541 -4.775 1.00 0.00 C ATOM 947 CD1 LEU A 63 11.417 10.338 -4.350 1.00 0.00 C ATOM 948 CD2 LEU A 63 9.185 9.245 -4.631 1.00 0.00 C ATOM 0 H LEU A 63 7.347 10.674 -2.721 1.00 0.00 H new ATOM 0 HA LEU A 63 10.188 10.923 -2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.301 11.794 -4.311 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.857 12.585 -4.154 1.00 0.00 H new ATOM 0 HG LEU A 63 9.959 10.835 -5.824 1.00 0.00 H new ATOM 0 HD11 LEU A 63 11.862 9.540 -4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 63 11.975 11.261 -4.505 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.451 10.066 -3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.662 8.463 -5.222 1.00 0.00 H new ATOM 0 HD22 LEU A 63 9.164 8.947 -3.583 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.165 9.397 -4.985 1.00 0.00 H new ATOM 960 N ASP A 64 8.055 13.425 -1.778 1.00 0.00 N ATOM 961 CA ASP A 64 7.864 14.717 -1.132 1.00 0.00 C ATOM 962 C ASP A 64 7.778 14.560 0.383 1.00 0.00 C ATOM 963 O ASP A 64 7.962 15.524 1.127 1.00 0.00 O ATOM 964 CB ASP A 64 6.596 15.393 -1.659 1.00 0.00 C ATOM 965 CG ASP A 64 6.531 15.398 -3.174 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.604 15.423 -3.815 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.408 15.379 -3.719 1.00 0.00 O ATOM 0 H ASP A 64 7.231 13.069 -2.262 1.00 0.00 H new ATOM 0 HA ASP A 64 8.725 15.343 -1.367 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.721 14.878 -1.262 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.555 16.419 -1.293 1.00 0.00 H new ATOM 972 N GLN A 65 7.498 13.341 0.831 1.00 0.00 N ATOM 973 CA GLN A 65 7.386 13.059 2.258 1.00 0.00 C ATOM 974 C GLN A 65 6.223 13.827 2.875 1.00 0.00 C ATOM 975 O GLN A 65 6.392 14.542 3.864 1.00 0.00 O ATOM 976 CB GLN A 65 8.689 13.421 2.974 1.00 0.00 C ATOM 977 CG GLN A 65 9.933 12.904 2.271 1.00 0.00 C ATOM 978 CD GLN A 65 11.214 13.404 2.909 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.907 12.660 3.604 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.537 14.671 2.676 1.00 0.00 N ATOM 0 H GLN A 65 7.345 12.533 0.228 1.00 0.00 H new ATOM 0 HA GLN A 65 7.197 11.992 2.378 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.756 14.505 3.063 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.661 13.020 3.987 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.927 11.814 2.284 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.909 13.211 1.225 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.934 15.252 2.094 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.388 15.063 3.079 1.00 0.00 H new ATOM 989 N ASP A 66 5.041 13.676 2.286 1.00 0.00 N ATOM 990 CA ASP A 66 3.849 14.355 2.778 1.00 0.00 C ATOM 991 C ASP A 66 2.847 13.353 3.343 1.00 0.00 C ATOM 992 O ASP A 66 1.970 13.711 4.128 1.00 0.00 O ATOM 993 CB ASP A 66 3.199 15.169 1.658 1.00 0.00 C ATOM 994 CG ASP A 66 3.256 14.459 0.320 1.00 0.00 C ATOM 995 OD1 ASP A 66 3.349 15.150 -0.716 1.00 0.00 O ATOM 996 OD2 ASP A 66 3.208 13.210 0.308 1.00 0.00 O ATOM 0 H ASP A 66 4.884 13.089 1.467 1.00 0.00 H new ATOM 0 HA ASP A 66 4.151 15.031 3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.159 15.370 1.915 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.700 16.134 1.576 1.00 0.00 H new ATOM 1001 N GLY A 67 2.982 12.095 2.936 1.00 0.00 N ATOM 1002 CA GLY A 67 2.082 11.060 3.409 1.00 0.00 C ATOM 1003 C GLY A 67 1.073 10.644 2.357 1.00 0.00 C ATOM 1004 O GLY A 67 0.005 10.125 2.683 1.00 0.00 O ATOM 0 H GLY A 67 3.700 11.774 2.286 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.663 10.190 3.715 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.554 11.418 4.293 1.00 0.00 H new ATOM 1008 N ARG A 68 1.410 10.873 1.093 1.00 0.00 N ATOM 1009 CA ARG A 68 0.524 10.520 -0.010 1.00 0.00 C ATOM 1010 C ARG A 68 1.324 10.043 -1.219 1.00 0.00 C ATOM 1011 O ARG A 68 2.335 10.643 -1.583 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.341 11.720 -0.400 1.00 0.00 C ATOM 1013 CG ARG A 68 0.450 12.999 -0.614 1.00 0.00 C ATOM 1014 CD ARG A 68 -0.271 13.951 -1.554 1.00 0.00 C ATOM 1015 NE ARG A 68 0.639 14.921 -2.157 1.00 0.00 N ATOM 1016 CZ ARG A 68 1.403 14.656 -3.210 1.00 0.00 C ATOM 1017 NH1 ARG A 68 1.366 13.458 -3.776 1.00 0.00 N ATOM 1018 NH2 ARG A 68 2.206 15.592 -3.701 1.00 0.00 N ATOM 0 H ARG A 68 2.290 11.301 0.807 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.121 9.706 0.321 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -0.885 11.483 -1.314 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.085 11.889 0.379 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.616 13.490 0.345 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.431 12.757 -1.022 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.764 13.379 -2.340 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -1.052 14.479 -1.006 1.00 0.00 H new ATOM 0 HE ARG A 68 0.690 15.853 -1.747 1.00 0.00 H new ATOM 0 HH11 ARG A 68 0.749 12.736 -3.403 1.00 0.00 H new ATOM 0 HH12 ARG A 68 1.954 13.258 -4.585 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.236 16.516 -3.269 1.00 0.00 H new ATOM 0 HH22 ARG A 68 2.793 15.388 -4.510 1.00 0.00 H new ATOM 1032 N ILE A 69 0.864 8.959 -1.835 1.00 0.00 N ATOM 1033 CA ILE A 69 1.536 8.402 -3.002 1.00 0.00 C ATOM 1034 C ILE A 69 0.719 8.632 -4.269 1.00 0.00 C ATOM 1035 O ILE A 69 -0.444 8.235 -4.351 1.00 0.00 O ATOM 1036 CB ILE A 69 1.792 6.892 -2.837 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.394 6.602 -1.461 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.709 6.386 -3.941 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.753 5.148 -1.253 1.00 0.00 C ATOM 0 H ILE A 69 0.029 8.450 -1.545 1.00 0.00 H new ATOM 0 HA ILE A 69 2.493 8.917 -3.091 1.00 0.00 H new ATOM 0 HB ILE A 69 0.840 6.367 -2.914 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.288 7.211 -1.329 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.685 6.906 -0.692 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.880 5.317 -3.810 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.243 6.563 -4.910 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.661 6.915 -3.894 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.174 5.016 -0.256 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.858 4.534 -1.353 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.486 4.844 -2.000 1.00 0.00 H new ATOM 1051 N SER A 70 1.336 9.273 -5.256 1.00 0.00 N ATOM 1052 CA SER A 70 0.665 9.558 -6.519 1.00 0.00 C ATOM 1053 C SER A 70 0.835 8.400 -7.498 1.00 0.00 C ATOM 1054 O SER A 70 1.672 7.520 -7.297 1.00 0.00 O ATOM 1055 CB SER A 70 1.216 10.846 -7.135 1.00 0.00 C ATOM 1056 OG SER A 70 0.432 11.260 -8.240 1.00 0.00 O ATOM 0 H SER A 70 2.299 9.605 -5.206 1.00 0.00 H new ATOM 0 HA SER A 70 -0.398 9.687 -6.316 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.233 11.634 -6.382 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.246 10.688 -7.455 1.00 0.00 H new ATOM 0 HG SER A 70 0.992 11.295 -9.044 1.00 0.00 H new ATOM 1062 N PHE A 71 0.034 8.407 -8.558 1.00 0.00 N ATOM 1063 CA PHE A 71 0.094 7.358 -9.569 1.00 0.00 C ATOM 1064 C PHE A 71 1.528 7.140 -10.043 1.00 0.00 C ATOM 1065 O PHE A 71 2.034 6.018 -10.031 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.800 7.714 -10.758 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.241 7.341 -10.559 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.984 6.811 -11.601 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.852 7.521 -9.328 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.311 6.466 -11.420 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.178 7.178 -9.141 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.909 6.650 -10.189 1.00 0.00 C ATOM 0 H PHE A 71 -0.665 9.128 -8.739 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.265 6.433 -9.118 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.733 8.786 -10.944 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.423 7.212 -11.649 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.522 6.665 -12.566 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.286 7.934 -8.506 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.879 6.053 -12.241 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.643 7.322 -8.177 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.945 6.382 -10.045 1.00 0.00 H new ATOM 1082 N ASP A 72 2.177 8.221 -10.459 1.00 0.00 N ATOM 1083 CA ASP A 72 3.553 8.150 -10.938 1.00 0.00 C ATOM 1084 C ASP A 72 4.477 7.601 -9.855 1.00 0.00 C ATOM 1085 O ASP A 72 5.372 6.806 -10.135 1.00 0.00 O ATOM 1086 CB ASP A 72 4.033 9.533 -11.382 1.00 0.00 C ATOM 1087 CG ASP A 72 3.953 10.560 -10.270 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.827 10.991 -9.941 1.00 0.00 O ATOM 1089 OD2 ASP A 72 5.013 10.931 -9.728 1.00 0.00 O ATOM 0 H ASP A 72 1.773 9.157 -10.474 1.00 0.00 H new ATOM 0 HA ASP A 72 3.580 7.473 -11.792 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.063 9.461 -11.733 1.00 0.00 H new ATOM 0 HB3 ASP A 72 3.431 9.869 -12.226 1.00 0.00 H new ATOM 1094 N GLU A 73 4.253 8.034 -8.618 1.00 0.00 N ATOM 1095 CA GLU A 73 5.067 7.588 -7.493 1.00 0.00 C ATOM 1096 C GLU A 73 5.055 6.066 -7.384 1.00 0.00 C ATOM 1097 O GLU A 73 6.093 5.414 -7.510 1.00 0.00 O ATOM 1098 CB GLU A 73 4.560 8.208 -6.190 1.00 0.00 C ATOM 1099 CG GLU A 73 5.307 9.468 -5.784 1.00 0.00 C ATOM 1100 CD GLU A 73 4.732 10.110 -4.536 1.00 0.00 C ATOM 1101 OE1 GLU A 73 3.615 10.664 -4.615 1.00 0.00 O ATOM 1102 OE2 GLU A 73 5.399 10.059 -3.481 1.00 0.00 O ATOM 0 H GLU A 73 3.515 8.693 -8.370 1.00 0.00 H new ATOM 0 HA GLU A 73 6.092 7.915 -7.667 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.501 8.442 -6.297 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.644 7.472 -5.390 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.356 9.225 -5.613 1.00 0.00 H new ATOM 0 HG3 GLU A 73 5.276 10.185 -6.604 1.00 0.00 H new ATOM 1109 N PHE A 74 3.874 5.505 -7.148 1.00 0.00 N ATOM 1110 CA PHE A 74 3.726 4.059 -7.020 1.00 0.00 C ATOM 1111 C PHE A 74 4.308 3.344 -8.235 1.00 0.00 C ATOM 1112 O PHE A 74 5.211 2.515 -8.106 1.00 0.00 O ATOM 1113 CB PHE A 74 2.250 3.690 -6.854 1.00 0.00 C ATOM 1114 CG PHE A 74 1.926 3.105 -5.509 1.00 0.00 C ATOM 1115 CD1 PHE A 74 2.615 2.000 -5.035 1.00 0.00 C ATOM 1116 CD2 PHE A 74 0.932 3.661 -4.719 1.00 0.00 C ATOM 1117 CE1 PHE A 74 2.319 1.460 -3.797 1.00 0.00 C ATOM 1118 CE2 PHE A 74 0.634 3.125 -3.481 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.327 2.022 -3.020 1.00 0.00 C ATOM 0 H PHE A 74 3.005 6.029 -7.041 1.00 0.00 H new ATOM 0 HA PHE A 74 4.275 3.738 -6.135 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.641 4.581 -7.010 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.973 2.975 -7.629 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.392 1.556 -5.639 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.385 4.522 -5.075 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.864 0.599 -3.439 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.141 3.568 -2.873 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.093 1.601 -2.054 1.00 0.00 H new ATOM 1129 N ILE A 75 3.785 3.668 -9.412 1.00 0.00 N ATOM 1130 CA ILE A 75 4.253 3.057 -10.650 1.00 0.00 C ATOM 1131 C ILE A 75 5.771 3.134 -10.762 1.00 0.00 C ATOM 1132 O ILE A 75 6.430 2.160 -11.128 1.00 0.00 O ATOM 1133 CB ILE A 75 3.624 3.730 -11.883 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.098 3.628 -11.824 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.152 3.096 -13.161 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.395 4.462 -12.872 1.00 0.00 C ATOM 0 H ILE A 75 3.037 4.350 -9.535 1.00 0.00 H new ATOM 0 HA ILE A 75 3.946 2.012 -10.621 1.00 0.00 H new ATOM 0 HB ILE A 75 3.900 4.784 -11.882 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.807 2.585 -11.946 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.759 3.940 -10.836 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.697 3.583 -14.024 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.235 3.215 -13.206 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.903 2.035 -13.171 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.317 4.341 -12.770 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.656 5.512 -12.737 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.705 4.136 -13.865 1.00 0.00 H new ATOM 1148 N LYS A 76 6.324 4.300 -10.442 1.00 0.00 N ATOM 1149 CA LYS A 76 7.766 4.507 -10.503 1.00 0.00 C ATOM 1150 C LYS A 76 8.498 3.488 -9.636 1.00 0.00 C ATOM 1151 O LYS A 76 9.528 2.944 -10.036 1.00 0.00 O ATOM 1152 CB LYS A 76 8.118 5.926 -10.050 1.00 0.00 C ATOM 1153 CG LYS A 76 8.071 6.951 -11.170 1.00 0.00 C ATOM 1154 CD LYS A 76 7.980 8.366 -10.627 1.00 0.00 C ATOM 1155 CE LYS A 76 8.450 9.389 -11.651 1.00 0.00 C ATOM 1156 NZ LYS A 76 7.695 9.280 -12.929 1.00 0.00 N ATOM 0 H LYS A 76 5.794 5.117 -10.137 1.00 0.00 H new ATOM 0 HA LYS A 76 8.084 4.374 -11.537 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.428 6.229 -9.263 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.117 5.922 -9.614 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.962 6.855 -11.790 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.213 6.751 -11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.950 8.582 -10.342 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.585 8.450 -9.724 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.331 10.393 -11.243 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.513 9.248 -11.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.294 8.827 -13.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.840 8.707 -12.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.423 10.230 -13.253 1.00 0.00 H new ATOM 1170 N ILE A 77 7.961 3.234 -8.447 1.00 0.00 N ATOM 1171 CA ILE A 77 8.563 2.279 -7.526 1.00 0.00 C ATOM 1172 C ILE A 77 8.454 0.855 -8.061 1.00 0.00 C ATOM 1173 O ILE A 77 9.331 0.023 -7.824 1.00 0.00 O ATOM 1174 CB ILE A 77 7.903 2.345 -6.135 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.579 3.413 -5.275 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.969 0.986 -5.453 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.276 4.827 -5.717 1.00 0.00 C ATOM 0 H ILE A 77 7.110 3.677 -8.099 1.00 0.00 H new ATOM 0 HA ILE A 77 9.615 2.550 -7.433 1.00 0.00 H new ATOM 0 HB ILE A 77 6.855 2.617 -6.259 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.261 3.289 -4.240 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.658 3.257 -5.298 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.499 1.048 -4.472 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.445 0.248 -6.060 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.011 0.687 -5.338 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.789 5.531 -5.061 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.619 4.969 -6.742 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.201 5.001 -5.667 1.00 0.00 H new ATOM 1189 N PHE A 78 7.374 0.582 -8.784 1.00 0.00 N ATOM 1190 CA PHE A 78 7.152 -0.742 -9.355 1.00 0.00 C ATOM 1191 C PHE A 78 8.133 -1.016 -10.491 1.00 0.00 C ATOM 1192 O PHE A 78 8.628 -2.134 -10.640 1.00 0.00 O ATOM 1193 CB PHE A 78 5.715 -0.864 -9.867 1.00 0.00 C ATOM 1194 CG PHE A 78 4.779 -1.502 -8.880 1.00 0.00 C ATOM 1195 CD1 PHE A 78 3.815 -2.403 -9.303 1.00 0.00 C ATOM 1196 CD2 PHE A 78 4.864 -1.202 -7.530 1.00 0.00 C ATOM 1197 CE1 PHE A 78 2.953 -2.993 -8.397 1.00 0.00 C ATOM 1198 CE2 PHE A 78 4.005 -1.789 -6.621 1.00 0.00 C ATOM 1199 CZ PHE A 78 3.047 -2.685 -7.055 1.00 0.00 C ATOM 0 H PHE A 78 6.639 1.259 -8.989 1.00 0.00 H new ATOM 0 HA PHE A 78 7.316 -1.481 -8.571 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.342 0.129 -10.120 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.714 -1.449 -10.787 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.736 -2.647 -10.352 1.00 0.00 H new ATOM 0 HD2 PHE A 78 5.610 -0.502 -7.184 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.207 -3.694 -8.739 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.082 -1.547 -5.571 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.373 -3.143 -6.346 1.00 0.00 H new ATOM 1209 N HIS A 79 8.408 0.010 -11.289 1.00 0.00 N ATOM 1210 CA HIS A 79 9.331 -0.120 -12.411 1.00 0.00 C ATOM 1211 C HIS A 79 10.764 0.161 -11.972 1.00 0.00 C ATOM 1212 O HIS A 79 11.716 -0.163 -12.679 1.00 0.00 O ATOM 1213 CB HIS A 79 8.934 0.834 -13.538 1.00 0.00 C ATOM 1214 CG HIS A 79 7.929 0.256 -14.486 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.277 -0.361 -15.669 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.577 0.201 -14.419 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.185 -0.768 -16.289 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.140 -0.440 -15.552 1.00 0.00 N ATOM 0 H HIS A 79 8.005 0.941 -11.180 1.00 0.00 H new ATOM 0 HA HIS A 79 9.277 -1.145 -12.777 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.528 1.747 -13.103 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.827 1.116 -14.096 1.00 0.00 H new ATOM 0 HD1 HIS A 79 9.230 -0.484 -16.012 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.958 0.589 -13.623 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.152 -1.282 -17.238 1.00 0.00 H new ATOM 1226 N GLY A 80 10.910 0.770 -10.798 1.00 0.00 N ATOM 1227 CA GLY A 80 12.230 1.087 -10.285 1.00 0.00 C ATOM 1228 C GLY A 80 12.740 0.040 -9.315 1.00 0.00 C ATOM 1229 O GLY A 80 13.526 -0.833 -9.687 1.00 0.00 O ATOM 0 H GLY A 80 10.137 1.049 -10.194 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.928 1.178 -11.117 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.200 2.056 -9.787 1.00 0.00 H new ATOM 1233 N LEU A 81 12.297 0.129 -8.065 1.00 0.00 N ATOM 1234 CA LEU A 81 12.715 -0.817 -7.036 1.00 0.00 C ATOM 1235 C LEU A 81 12.530 -2.254 -7.510 1.00 0.00 C ATOM 1236 O LEU A 81 11.688 -2.536 -8.363 1.00 0.00 O ATOM 1237 CB LEU A 81 11.920 -0.585 -5.750 1.00 0.00 C ATOM 1238 CG LEU A 81 11.901 0.849 -5.221 1.00 0.00 C ATOM 1239 CD1 LEU A 81 10.954 0.969 -4.038 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.304 1.293 -4.832 1.00 0.00 C ATOM 0 H LEU A 81 11.649 0.846 -7.740 1.00 0.00 H new ATOM 0 HA LEU A 81 13.774 -0.654 -6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 81 10.891 -0.901 -5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 81 12.328 -1.232 -4.973 1.00 0.00 H new ATOM 0 HG LEU A 81 11.542 1.504 -6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.954 1.997 -3.675 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.946 0.694 -4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.282 0.303 -3.240 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.271 2.316 -4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.692 0.634 -4.055 1.00 0.00 H new ATOM 0 HD23 LEU A 81 13.955 1.247 -5.705 1.00 0.00 H new ATOM 1252 N LYS A 82 13.322 -3.163 -6.950 1.00 0.00 N ATOM 1253 CA LYS A 82 13.244 -4.573 -7.312 1.00 0.00 C ATOM 1254 C LYS A 82 11.860 -5.138 -7.007 1.00 0.00 C ATOM 1255 O LYS A 82 10.928 -4.392 -6.707 1.00 0.00 O ATOM 1256 CB LYS A 82 14.310 -5.374 -6.560 1.00 0.00 C ATOM 1257 CG LYS A 82 15.712 -4.808 -6.706 1.00 0.00 C ATOM 1258 CD LYS A 82 16.215 -4.927 -8.135 1.00 0.00 C ATOM 1259 CE LYS A 82 16.990 -6.218 -8.347 1.00 0.00 C ATOM 1260 NZ LYS A 82 17.586 -6.290 -9.709 1.00 0.00 N ATOM 0 H LYS A 82 14.025 -2.948 -6.243 1.00 0.00 H new ATOM 0 HA LYS A 82 13.423 -4.657 -8.384 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.049 -5.407 -5.502 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.303 -6.402 -6.922 1.00 0.00 H new ATOM 0 HG2 LYS A 82 15.716 -3.761 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS A 82 16.390 -5.336 -6.035 1.00 0.00 H new ATOM 0 HD2 LYS A 82 15.371 -4.891 -8.823 1.00 0.00 H new ATOM 0 HD3 LYS A 82 16.854 -4.075 -8.369 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.780 -6.294 -7.600 1.00 0.00 H new ATOM 0 HE3 LYS A 82 16.326 -7.069 -8.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.106 -7.185 -9.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 16.830 -6.243 -10.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 18.239 -5.492 -9.845 1.00 0.00 H new ATOM 1274 N SER A 83 11.735 -6.459 -7.084 1.00 0.00 N ATOM 1275 CA SER A 83 10.464 -7.123 -6.818 1.00 0.00 C ATOM 1276 C SER A 83 10.227 -7.262 -5.318 1.00 0.00 C ATOM 1277 O SER A 83 10.036 -8.366 -4.806 1.00 0.00 O ATOM 1278 CB SER A 83 10.437 -8.502 -7.480 1.00 0.00 C ATOM 1279 OG SER A 83 10.502 -8.391 -8.891 1.00 0.00 O ATOM 0 H SER A 83 12.498 -7.090 -7.328 1.00 0.00 H new ATOM 0 HA SER A 83 9.667 -6.510 -7.239 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.275 -9.098 -7.120 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.526 -9.028 -7.195 1.00 0.00 H new ATOM 0 HG SER A 83 10.485 -9.286 -9.291 1.00 0.00 H new ATOM 1285 N THR A 84 10.241 -6.134 -4.616 1.00 0.00 N ATOM 1286 CA THR A 84 10.029 -6.128 -3.173 1.00 0.00 C ATOM 1287 C THR A 84 8.762 -6.889 -2.801 1.00 0.00 C ATOM 1288 O THR A 84 7.876 -7.084 -3.634 1.00 0.00 O ATOM 1289 CB THR A 84 9.931 -4.692 -2.625 1.00 0.00 C ATOM 1290 OG1 THR A 84 9.349 -4.705 -1.318 1.00 0.00 O ATOM 1291 CG2 THR A 84 9.098 -3.815 -3.549 1.00 0.00 C ATOM 0 H THR A 84 10.397 -5.212 -5.023 1.00 0.00 H new ATOM 0 HA THR A 84 10.891 -6.622 -2.725 1.00 0.00 H new ATOM 0 HB THR A 84 10.938 -4.279 -2.569 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.575 -3.873 -0.851 1.00 0.00 H new ATOM 0 HG21 THR A 84 9.043 -2.806 -3.141 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.561 -3.783 -4.535 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.093 -4.227 -3.633 1.00 0.00 H new ATOM 1299 N ASP A 85 8.682 -7.316 -1.545 1.00 0.00 N ATOM 1300 CA ASP A 85 7.521 -8.054 -1.061 1.00 0.00 C ATOM 1301 C ASP A 85 6.285 -7.160 -1.024 1.00 0.00 C ATOM 1302 O ASP A 85 5.162 -7.627 -1.218 1.00 0.00 O ATOM 1303 CB ASP A 85 7.796 -8.624 0.331 1.00 0.00 C ATOM 1304 CG ASP A 85 7.243 -10.024 0.503 1.00 0.00 C ATOM 1305 OD1 ASP A 85 6.145 -10.298 -0.024 1.00 0.00 O ATOM 1306 OD2 ASP A 85 7.909 -10.848 1.164 1.00 0.00 O ATOM 0 H ASP A 85 9.407 -7.164 -0.844 1.00 0.00 H new ATOM 0 HA ASP A 85 7.331 -8.877 -1.750 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.871 -8.637 0.509 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.356 -7.968 1.082 1.00 0.00 H new ATOM 1311 N VAL A 86 6.500 -5.873 -0.773 1.00 0.00 N ATOM 1312 CA VAL A 86 5.404 -4.913 -0.710 1.00 0.00 C ATOM 1313 C VAL A 86 4.759 -4.726 -2.078 1.00 0.00 C ATOM 1314 O VAL A 86 3.550 -4.517 -2.182 1.00 0.00 O ATOM 1315 CB VAL A 86 5.884 -3.545 -0.189 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.621 -3.705 1.132 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.768 -2.863 -1.223 1.00 0.00 C ATOM 0 H VAL A 86 7.423 -5.471 -0.610 1.00 0.00 H new ATOM 0 HA VAL A 86 4.668 -5.319 -0.016 1.00 0.00 H new ATOM 0 HB VAL A 86 5.012 -2.914 -0.016 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.952 -2.728 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.953 -4.149 1.870 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.486 -4.352 0.990 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.099 -1.898 -0.839 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.637 -3.489 -1.429 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.203 -2.713 -2.143 1.00 0.00 H new ATOM 1327 N ALA A 87 5.572 -4.801 -3.126 1.00 0.00 N ATOM 1328 CA ALA A 87 5.081 -4.643 -4.489 1.00 0.00 C ATOM 1329 C ALA A 87 4.143 -5.783 -4.870 1.00 0.00 C ATOM 1330 O ALA A 87 3.033 -5.554 -5.351 1.00 0.00 O ATOM 1331 CB ALA A 87 6.245 -4.566 -5.465 1.00 0.00 C ATOM 0 H ALA A 87 6.575 -4.971 -3.057 1.00 0.00 H new ATOM 0 HA ALA A 87 4.518 -3.711 -4.540 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.863 -4.448 -6.479 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.875 -3.713 -5.213 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.833 -5.482 -5.403 1.00 0.00 H new ATOM 1337 N LYS A 88 4.595 -7.013 -4.654 1.00 0.00 N ATOM 1338 CA LYS A 88 3.797 -8.190 -4.974 1.00 0.00 C ATOM 1339 C LYS A 88 2.518 -8.222 -4.143 1.00 0.00 C ATOM 1340 O LYS A 88 1.437 -8.506 -4.660 1.00 0.00 O ATOM 1341 CB LYS A 88 4.609 -9.464 -4.729 1.00 0.00 C ATOM 1342 CG LYS A 88 3.817 -10.742 -4.950 1.00 0.00 C ATOM 1343 CD LYS A 88 3.877 -11.652 -3.735 1.00 0.00 C ATOM 1344 CE LYS A 88 3.141 -12.960 -3.981 1.00 0.00 C ATOM 1345 NZ LYS A 88 3.636 -13.654 -5.202 1.00 0.00 N ATOM 0 H LYS A 88 5.512 -7.221 -4.258 1.00 0.00 H new ATOM 0 HA LYS A 88 3.524 -8.138 -6.028 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.476 -9.465 -5.390 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.987 -9.453 -3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.778 -10.494 -5.169 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.210 -11.269 -5.820 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.918 -11.860 -3.486 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.439 -11.143 -2.876 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.263 -13.613 -3.117 1.00 0.00 H new ATOM 0 HE3 LYS A 88 2.074 -12.763 -4.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.671 -14.679 -5.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.994 -13.459 -5.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.589 -13.309 -5.435 1.00 0.00 H new ATOM 1359 N THR A 89 2.647 -7.929 -2.853 1.00 0.00 N ATOM 1360 CA THR A 89 1.501 -7.923 -1.953 1.00 0.00 C ATOM 1361 C THR A 89 0.476 -6.876 -2.373 1.00 0.00 C ATOM 1362 O THR A 89 -0.731 -7.100 -2.272 1.00 0.00 O ATOM 1363 CB THR A 89 1.932 -7.649 -0.499 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.838 -8.665 -0.056 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.722 -7.605 0.423 1.00 0.00 C ATOM 0 H THR A 89 3.534 -7.693 -2.408 1.00 0.00 H new ATOM 0 HA THR A 89 1.048 -8.913 -2.011 1.00 0.00 H new ATOM 0 HB THR A 89 2.431 -6.680 -0.467 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.737 -8.472 -0.395 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.050 -7.410 1.444 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.048 -6.812 0.101 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.201 -8.562 0.385 1.00 0.00 H new ATOM 1373 N PHE A 90 0.963 -5.733 -2.844 1.00 0.00 N ATOM 1374 CA PHE A 90 0.088 -4.651 -3.279 1.00 0.00 C ATOM 1375 C PHE A 90 -0.694 -5.053 -4.526 1.00 0.00 C ATOM 1376 O PHE A 90 -1.925 -5.097 -4.513 1.00 0.00 O ATOM 1377 CB PHE A 90 0.905 -3.388 -3.561 1.00 0.00 C ATOM 1378 CG PHE A 90 0.108 -2.289 -4.204 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.483 -1.301 -3.432 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.052 -2.245 -5.580 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.216 -0.289 -4.021 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.784 -1.234 -6.174 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.369 -0.256 -5.394 1.00 0.00 C ATOM 0 H PHE A 90 1.959 -5.532 -2.934 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.621 -4.445 -2.477 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.326 -3.021 -2.625 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.743 -3.644 -4.209 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.369 -1.323 -2.358 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.400 -3.009 -6.195 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.669 0.476 -3.409 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.898 -1.209 -7.248 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.945 0.533 -5.856 1.00 0.00 H new ATOM 1393 N ARG A 91 0.029 -5.344 -5.603 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.597 -5.741 -6.858 1.00 0.00 C ATOM 1395 C ARG A 91 -1.576 -6.891 -6.640 1.00 0.00 C ATOM 1396 O ARG A 91 -2.666 -6.909 -7.209 1.00 0.00 O ATOM 1397 CB ARG A 91 0.469 -6.151 -7.877 1.00 0.00 C ATOM 1398 CG ARG A 91 0.244 -5.568 -9.262 1.00 0.00 C ATOM 1399 CD ARG A 91 1.449 -5.790 -10.162 1.00 0.00 C ATOM 1400 NE ARG A 91 1.336 -5.057 -11.421 1.00 0.00 N ATOM 1401 CZ ARG A 91 0.536 -5.425 -12.416 1.00 0.00 C ATOM 1402 NH1 ARG A 91 -0.216 -6.510 -12.299 1.00 0.00 N ATOM 1403 NH2 ARG A 91 0.487 -4.706 -13.530 1.00 0.00 N ATOM 0 H ARG A 91 1.048 -5.312 -5.631 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.150 -4.885 -7.244 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.447 -5.835 -7.514 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.491 -7.238 -7.949 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.637 -6.026 -9.712 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.042 -4.500 -9.180 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.353 -5.477 -9.640 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.554 -6.855 -10.371 1.00 0.00 H new ATOM 0 HE ARG A 91 1.902 -4.217 -11.543 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -0.181 -7.065 -11.444 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -0.829 -6.790 -13.064 1.00 0.00 H new ATOM 0 HH21 ARG A 91 1.064 -3.870 -13.623 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -0.127 -4.989 -14.293 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.177 -7.850 -5.811 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.018 -9.005 -5.515 1.00 0.00 C ATOM 1419 C LYS A 92 -3.233 -8.594 -4.688 1.00 0.00 C ATOM 1420 O LYS A 92 -4.372 -8.746 -5.126 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.213 -10.069 -4.766 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.421 -10.987 -5.680 1.00 0.00 C ATOM 1423 CD LYS A 92 -0.483 -12.430 -5.209 1.00 0.00 C ATOM 1424 CE LYS A 92 0.053 -13.385 -6.266 1.00 0.00 C ATOM 1425 NZ LYS A 92 0.288 -14.748 -5.714 1.00 0.00 N ATOM 0 H LYS A 92 -0.276 -7.851 -5.332 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.367 -9.422 -6.460 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.527 -9.576 -4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.894 -10.670 -4.163 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.812 -10.917 -6.695 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.618 -10.659 -5.715 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.095 -12.540 -4.291 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.514 -12.692 -4.970 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.654 -13.445 -7.093 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.985 -12.992 -6.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.653 -15.368 -6.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.982 -14.695 -4.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.606 -15.134 -5.350 1.00 0.00 H new ATOM 1439 N ALA A 93 -2.980 -8.074 -3.491 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.053 -7.640 -2.605 1.00 0.00 C ATOM 1441 C ALA A 93 -5.039 -6.738 -3.340 1.00 0.00 C ATOM 1442 O ALA A 93 -6.240 -7.009 -3.365 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.478 -6.920 -1.395 1.00 0.00 C ATOM 0 H ALA A 93 -2.042 -7.943 -3.113 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.592 -8.524 -2.266 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.290 -6.601 -0.742 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.817 -7.594 -0.850 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.914 -6.048 -1.725 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.526 -5.667 -3.934 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.364 -4.726 -4.668 1.00 0.00 C ATOM 1451 C ILE A 94 -6.182 -5.440 -5.740 1.00 0.00 C ATOM 1452 O ILE A 94 -7.250 -4.972 -6.132 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.520 -3.622 -5.332 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.216 -2.267 -5.194 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.277 -3.951 -6.797 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.536 -1.336 -4.214 1.00 0.00 C ATOM 0 H ILE A 94 -3.534 -5.428 -3.922 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.038 -4.270 -3.943 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.556 -3.568 -4.827 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.256 -1.787 -6.172 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.246 -2.427 -4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.679 -3.162 -7.253 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.745 -4.899 -6.874 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.232 -4.028 -7.316 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.083 -0.395 -4.167 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.520 -1.796 -3.226 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.514 -1.146 -4.542 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.673 -6.575 -6.206 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.357 -7.354 -7.232 1.00 0.00 C ATOM 1470 C ASN A 95 -7.462 -8.209 -6.619 1.00 0.00 C ATOM 1471 O ASN A 95 -8.615 -8.153 -7.046 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.360 -8.245 -7.975 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.987 -7.688 -9.335 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.820 -7.103 -10.028 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.730 -7.866 -9.723 1.00 0.00 N ATOM 0 H ASN A 95 -4.790 -6.976 -5.890 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.810 -6.659 -7.939 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.459 -8.358 -7.372 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.788 -9.240 -8.098 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.421 -7.512 -10.628 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.074 -8.357 -9.116 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.101 -9.000 -5.613 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.060 -9.866 -4.939 1.00 0.00 C ATOM 1484 C LYS A 96 -9.205 -9.052 -4.345 1.00 0.00 C ATOM 1485 O LYS A 96 -10.369 -9.443 -4.429 1.00 0.00 O ATOM 1486 CB LYS A 96 -7.366 -10.669 -3.836 1.00 0.00 C ATOM 1487 CG LYS A 96 -6.221 -11.530 -4.341 1.00 0.00 C ATOM 1488 CD LYS A 96 -6.662 -12.965 -4.575 1.00 0.00 C ATOM 1489 CE LYS A 96 -5.499 -13.936 -4.437 1.00 0.00 C ATOM 1490 NZ LYS A 96 -5.067 -14.085 -3.020 1.00 0.00 N ATOM 0 H LYS A 96 -6.151 -9.058 -5.247 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.471 -10.554 -5.678 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -6.987 -9.981 -3.081 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -8.101 -11.307 -3.345 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -5.833 -11.112 -5.270 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -5.405 -11.513 -3.618 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.443 -13.228 -3.861 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.096 -13.055 -5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -5.789 -14.909 -4.832 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -4.660 -13.585 -5.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -4.516 -14.961 -2.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -4.478 -13.272 -2.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.904 -14.127 -2.404 1.00 0.00 H new ATOM 1504 N LYS A 97 -8.867 -7.916 -3.744 1.00 0.00 N ATOM 1505 CA LYS A 97 -9.865 -7.043 -3.138 1.00 0.00 C ATOM 1506 C LYS A 97 -10.059 -5.779 -3.968 1.00 0.00 C ATOM 1507 O LYS A 97 -11.018 -5.702 -4.735 1.00 0.00 O ATOM 1508 CB LYS A 97 -9.451 -6.672 -1.713 1.00 0.00 C ATOM 1509 CG LYS A 97 -9.958 -7.643 -0.660 1.00 0.00 C ATOM 1510 CD LYS A 97 -9.374 -9.032 -0.854 1.00 0.00 C ATOM 1511 CE LYS A 97 -9.966 -10.028 0.131 1.00 0.00 C ATOM 1512 NZ LYS A 97 -9.993 -11.409 -0.427 1.00 0.00 N ATOM 0 H LYS A 97 -7.908 -7.578 -3.664 1.00 0.00 H new ATOM 0 HA LYS A 97 -10.811 -7.583 -3.105 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -8.363 -6.627 -1.660 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -9.823 -5.673 -1.484 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.698 -7.273 0.332 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -11.046 -7.695 -0.706 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.565 -9.369 -1.873 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.292 -8.994 -0.728 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.382 -10.019 1.052 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.979 -9.722 0.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.403 -12.059 0.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.571 -11.423 -1.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.024 -11.711 -0.653 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.377 7.857 -1.284 1.00 0.00 CA HETATM 1528 CA CA A 102 4.352 12.764 -2.508 1.00 0.00 CA