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 Single : A 1 MET CE :methyl -101:sc= -2.79! (180deg=-4.83!) USER MOD Single : A 1 MET N :NH3+ -107:sc= -0.29 (180deg=-4.14!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0121 USER MOD Single : A 11 MET CE :methyl 162:sc= -0.379 (180deg=-0.403) 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= 0.0525 USER MOD Single : A 26 ASN : amide:sc= -0.0788 K(o=-0.079,f=-11!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= -0.0515 USER MOD Single : A 32 ASN : amide:sc= -0.142 K(o=-0.14,f=-0.83) USER MOD Single : A 35 ASN :FLIP amide:sc= -0.115 F(o=-0.87,f=-0.12) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -170:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.0331 K(o=-0.033,f=-1.6!) USER MOD Single : A 58 MET CE :methyl -163:sc= -2.68 (180deg=-3.7!) USER MOD Single : A 60 THR OG1 : rot -39:sc= 0.656 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot -76:sc= 1.18 USER MOD Single : A 76 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0131) USER MOD Single : A 79 HIS : no HE2:sc= -1.93 K(o=-1.9,f=-5.5!) USER MOD Single : A 82 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0165) USER MOD Single : A 83 SER OG : rot 180:sc= 0.0712 USER MOD Single : A 84 THR OG1 : rot -20:sc= 0.454 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 81:sc= 0.897 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.24 K(o=1.2,f=-0.0049) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.153 1.856 -17.500 1.00 0.00 N ATOM 2 CA MET A 1 17.958 2.424 -18.114 1.00 0.00 C ATOM 3 C MET A 1 18.000 3.948 -18.079 1.00 0.00 C ATOM 4 O MET A 1 18.963 4.541 -17.593 1.00 0.00 O ATOM 5 CB MET A 1 16.703 1.920 -17.398 1.00 0.00 C ATOM 6 CG MET A 1 16.329 0.492 -17.761 1.00 0.00 C ATOM 7 SD MET A 1 17.235 -0.731 -16.793 1.00 0.00 S ATOM 8 CE MET A 1 18.569 -1.133 -17.919 1.00 0.00 C ATOM 0 H1 MET A 1 19.770 1.464 -18.239 1.00 0.00 H new ATOM 0 H2 MET A 1 19.663 2.599 -16.981 1.00 0.00 H new ATOM 0 H3 MET A 1 18.879 1.099 -16.841 1.00 0.00 H new ATOM 0 HA MET A 1 17.928 2.104 -19.155 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.859 1.984 -16.321 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.868 2.578 -17.639 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.259 0.351 -17.608 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.524 0.328 -18.821 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.351 -2.076 -18.420 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.668 -0.342 -18.662 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.501 -1.226 -17.361 1.00 0.00 H new ATOM 18 N ALA A 2 16.949 4.577 -18.597 1.00 0.00 N ATOM 19 CA ALA A 2 16.866 6.031 -18.623 1.00 0.00 C ATOM 20 C ALA A 2 15.609 6.522 -17.914 1.00 0.00 C ATOM 21 O ALA A 2 15.672 7.022 -16.791 1.00 0.00 O ATOM 22 CB ALA A 2 16.897 6.537 -20.058 1.00 0.00 C ATOM 0 H ALA A 2 16.144 4.101 -19.004 1.00 0.00 H new ATOM 0 HA ALA A 2 17.730 6.428 -18.091 1.00 0.00 H new ATOM 0 HB1 ALA A 2 16.834 7.625 -20.062 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.827 6.226 -20.534 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.052 6.123 -20.608 1.00 0.00 H new ATOM 28 N ARG A 3 14.466 6.376 -18.578 1.00 0.00 N ATOM 29 CA ARG A 3 13.193 6.807 -18.011 1.00 0.00 C ATOM 30 C ARG A 3 12.432 5.623 -17.423 1.00 0.00 C ATOM 31 O ARG A 3 12.810 4.469 -17.620 1.00 0.00 O ATOM 32 CB ARG A 3 12.342 7.495 -19.081 1.00 0.00 C ATOM 33 CG ARG A 3 12.197 6.684 -20.358 1.00 0.00 C ATOM 34 CD ARG A 3 11.134 7.271 -21.272 1.00 0.00 C ATOM 35 NE ARG A 3 11.321 6.864 -22.663 1.00 0.00 N ATOM 36 CZ ARG A 3 10.737 7.469 -23.690 1.00 0.00 C ATOM 37 NH1 ARG A 3 9.931 8.502 -23.486 1.00 0.00 N ATOM 38 NH2 ARG A 3 10.957 7.040 -24.927 1.00 0.00 N ATOM 0 H ARG A 3 14.396 5.963 -19.508 1.00 0.00 H new ATOM 0 HA ARG A 3 13.401 7.517 -17.210 1.00 0.00 H new ATOM 0 HB2 ARG A 3 11.351 7.694 -18.673 1.00 0.00 H new ATOM 0 HB3 ARG A 3 12.787 8.460 -19.322 1.00 0.00 H new ATOM 0 HG2 ARG A 3 13.152 6.654 -20.882 1.00 0.00 H new ATOM 0 HG3 ARG A 3 11.937 5.655 -20.109 1.00 0.00 H new ATOM 0 HD2 ARG A 3 10.148 6.954 -20.931 1.00 0.00 H new ATOM 0 HD3 ARG A 3 11.160 8.359 -21.206 1.00 0.00 H new ATOM 0 HE ARG A 3 11.934 6.072 -22.855 1.00 0.00 H new ATOM 0 HH11 ARG A 3 9.758 8.834 -22.537 1.00 0.00 H new ATOM 0 HH12 ARG A 3 9.484 8.964 -24.278 1.00 0.00 H new ATOM 0 HH21 ARG A 3 11.575 6.245 -25.089 1.00 0.00 H new ATOM 0 HH22 ARG A 3 10.508 7.505 -25.716 1.00 0.00 H new ATOM 52 N GLY A 4 11.357 5.918 -16.699 1.00 0.00 N ATOM 53 CA GLY A 4 10.559 4.868 -16.092 1.00 0.00 C ATOM 54 C GLY A 4 9.226 4.677 -16.789 1.00 0.00 C ATOM 55 O GLY A 4 8.170 4.824 -16.174 1.00 0.00 O ATOM 0 H GLY A 4 11.024 6.866 -16.522 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.116 3.932 -16.117 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.386 5.108 -15.043 1.00 0.00 H new ATOM 59 N SER A 5 9.275 4.348 -18.076 1.00 0.00 N ATOM 60 CA SER A 5 8.062 4.142 -18.858 1.00 0.00 C ATOM 61 C SER A 5 7.158 3.106 -18.196 1.00 0.00 C ATOM 62 O SER A 5 7.532 2.484 -17.202 1.00 0.00 O ATOM 63 CB SER A 5 8.415 3.693 -20.278 1.00 0.00 C ATOM 64 OG SER A 5 7.391 4.045 -21.193 1.00 0.00 O ATOM 0 H SER A 5 10.141 4.219 -18.599 1.00 0.00 H new ATOM 0 HA SER A 5 7.526 5.090 -18.906 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.355 4.152 -20.585 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.567 2.614 -20.295 1.00 0.00 H new ATOM 0 HG SER A 5 7.641 3.749 -22.093 1.00 0.00 H new ATOM 70 N VAL A 6 5.966 2.926 -18.755 1.00 0.00 N ATOM 71 CA VAL A 6 5.008 1.965 -18.221 1.00 0.00 C ATOM 72 C VAL A 6 4.192 1.324 -19.338 1.00 0.00 C ATOM 73 O VAL A 6 3.402 1.990 -20.006 1.00 0.00 O ATOM 74 CB VAL A 6 4.047 2.630 -17.216 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.209 1.579 -16.505 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.824 3.472 -16.215 1.00 0.00 C ATOM 0 H VAL A 6 5.640 3.433 -19.578 1.00 0.00 H new ATOM 0 HA VAL A 6 5.584 1.195 -17.708 1.00 0.00 H new ATOM 0 HB VAL A 6 3.373 3.288 -17.764 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.536 2.066 -15.799 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.625 1.022 -17.238 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.864 0.894 -15.967 1.00 0.00 H new ATOM 0 HG21 VAL A 6 4.130 3.934 -15.513 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.523 2.837 -15.670 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.376 4.249 -16.744 1.00 0.00 H new ATOM 86 N SER A 7 4.389 0.024 -19.535 1.00 0.00 N ATOM 87 CA SER A 7 3.674 -0.709 -20.573 1.00 0.00 C ATOM 88 C SER A 7 2.170 -0.483 -20.461 1.00 0.00 C ATOM 89 O SER A 7 1.668 -0.085 -19.409 1.00 0.00 O ATOM 90 CB SER A 7 3.985 -2.204 -20.479 1.00 0.00 C ATOM 91 OG SER A 7 5.375 -2.426 -20.307 1.00 0.00 O ATOM 0 H SER A 7 5.038 -0.543 -18.989 1.00 0.00 H new ATOM 0 HA SER A 7 4.008 -0.336 -21.541 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.438 -2.641 -19.644 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.642 -2.708 -21.383 1.00 0.00 H new ATOM 0 HG SER A 7 5.548 -3.389 -20.248 1.00 0.00 H new ATOM 97 N ASP A 8 1.456 -0.740 -21.551 1.00 0.00 N ATOM 98 CA ASP A 8 0.008 -0.565 -21.576 1.00 0.00 C ATOM 99 C ASP A 8 -0.649 -1.320 -20.425 1.00 0.00 C ATOM 100 O ASP A 8 -1.373 -0.735 -19.619 1.00 0.00 O ATOM 101 CB ASP A 8 -0.562 -1.047 -22.910 1.00 0.00 C ATOM 102 CG ASP A 8 -0.294 -0.072 -24.040 1.00 0.00 C ATOM 103 OD1 ASP A 8 -0.815 1.062 -23.981 1.00 0.00 O ATOM 104 OD2 ASP A 8 0.436 -0.443 -24.982 1.00 0.00 O ATOM 0 H ASP A 8 1.856 -1.070 -22.429 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.208 0.497 -21.461 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.128 -2.015 -23.159 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.637 -1.196 -22.810 1.00 0.00 H new ATOM 109 N GLU A 9 -0.395 -2.623 -20.356 1.00 0.00 N ATOM 110 CA GLU A 9 -0.964 -3.457 -19.304 1.00 0.00 C ATOM 111 C GLU A 9 -0.596 -2.920 -17.924 1.00 0.00 C ATOM 112 O GLU A 9 -1.470 -2.626 -17.109 1.00 0.00 O ATOM 113 CB GLU A 9 -0.477 -4.901 -19.448 1.00 0.00 C ATOM 114 CG GLU A 9 -0.947 -5.578 -20.724 1.00 0.00 C ATOM 115 CD GLU A 9 -0.286 -6.924 -20.949 1.00 0.00 C ATOM 116 OE1 GLU A 9 -0.977 -7.955 -20.807 1.00 0.00 O ATOM 117 OE2 GLU A 9 0.921 -6.947 -21.266 1.00 0.00 O ATOM 0 H GLU A 9 0.201 -3.123 -21.016 1.00 0.00 H new ATOM 0 HA GLU A 9 -2.049 -3.435 -19.406 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.613 -4.912 -19.421 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.823 -5.479 -18.591 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.028 -5.711 -20.683 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.738 -4.928 -21.574 1.00 0.00 H new ATOM 124 N GLU A 10 0.702 -2.796 -17.670 1.00 0.00 N ATOM 125 CA GLU A 10 1.186 -2.296 -16.389 1.00 0.00 C ATOM 126 C GLU A 10 0.492 -0.987 -16.019 1.00 0.00 C ATOM 127 O GLU A 10 -0.067 -0.854 -14.930 1.00 0.00 O ATOM 128 CB GLU A 10 2.700 -2.087 -16.436 1.00 0.00 C ATOM 129 CG GLU A 10 3.305 -1.711 -15.094 1.00 0.00 C ATOM 130 CD GLU A 10 4.075 -2.853 -14.459 1.00 0.00 C ATOM 131 OE1 GLU A 10 4.788 -3.567 -15.196 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.965 -3.034 -13.229 1.00 0.00 O ATOM 0 H GLU A 10 1.438 -3.035 -18.335 1.00 0.00 H new ATOM 0 HA GLU A 10 0.953 -3.040 -15.627 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.173 -3.001 -16.795 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.928 -1.304 -17.160 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.971 -0.858 -15.226 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.511 -1.393 -14.418 1.00 0.00 H new ATOM 139 N MET A 11 0.533 -0.024 -16.934 1.00 0.00 N ATOM 140 CA MET A 11 -0.092 1.273 -16.705 1.00 0.00 C ATOM 141 C MET A 11 -1.546 1.108 -16.276 1.00 0.00 C ATOM 142 O MET A 11 -2.015 1.788 -15.364 1.00 0.00 O ATOM 143 CB MET A 11 -0.016 2.131 -17.971 1.00 0.00 C ATOM 144 CG MET A 11 0.067 3.622 -17.690 1.00 0.00 C ATOM 145 SD MET A 11 -1.491 4.304 -17.091 1.00 0.00 S ATOM 146 CE MET A 11 -0.950 5.123 -15.593 1.00 0.00 C ATOM 0 H MET A 11 0.992 -0.117 -17.840 1.00 0.00 H new ATOM 0 HA MET A 11 0.451 1.773 -15.903 1.00 0.00 H new ATOM 0 HB2 MET A 11 0.856 1.830 -18.552 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.893 1.934 -18.587 1.00 0.00 H new ATOM 0 HG2 MET A 11 0.847 3.806 -16.951 1.00 0.00 H new ATOM 0 HG3 MET A 11 0.361 4.144 -18.601 1.00 0.00 H new ATOM 0 HE1 MET A 11 -1.704 5.846 -15.281 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.808 4.383 -14.805 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.008 5.639 -15.780 1.00 0.00 H new ATOM 156 N MET A 12 -2.256 0.201 -16.941 1.00 0.00 N ATOM 157 CA MET A 12 -3.657 -0.053 -16.625 1.00 0.00 C ATOM 158 C MET A 12 -3.799 -0.681 -15.244 1.00 0.00 C ATOM 159 O MET A 12 -4.437 -0.114 -14.357 1.00 0.00 O ATOM 160 CB MET A 12 -4.281 -0.968 -17.681 1.00 0.00 C ATOM 161 CG MET A 12 -4.934 -0.214 -18.829 1.00 0.00 C ATOM 162 SD MET A 12 -6.265 -1.151 -19.605 1.00 0.00 S ATOM 163 CE MET A 12 -7.392 0.169 -20.051 1.00 0.00 C ATOM 0 H MET A 12 -1.884 -0.369 -17.701 1.00 0.00 H new ATOM 0 HA MET A 12 -4.182 0.902 -16.625 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.510 -1.626 -18.081 1.00 0.00 H new ATOM 0 HB3 MET A 12 -5.027 -1.604 -17.204 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.328 0.733 -18.460 1.00 0.00 H new ATOM 0 HG3 MET A 12 -4.179 0.026 -19.578 1.00 0.00 H new ATOM 0 HE1 MET A 12 -8.269 -0.252 -20.543 1.00 0.00 H new ATOM 0 HE2 MET A 12 -7.701 0.703 -19.152 1.00 0.00 H new ATOM 0 HE3 MET A 12 -6.892 0.860 -20.730 1.00 0.00 H new ATOM 173 N GLU A 13 -3.198 -1.855 -15.067 1.00 0.00 N ATOM 174 CA GLU A 13 -3.260 -2.559 -13.791 1.00 0.00 C ATOM 175 C GLU A 13 -2.835 -1.646 -12.645 1.00 0.00 C ATOM 176 O GLU A 13 -3.341 -1.759 -11.528 1.00 0.00 O ATOM 177 CB GLU A 13 -2.368 -3.802 -13.828 1.00 0.00 C ATOM 178 CG GLU A 13 -3.096 -5.062 -14.263 1.00 0.00 C ATOM 179 CD GLU A 13 -3.855 -5.720 -13.128 1.00 0.00 C ATOM 180 OE1 GLU A 13 -4.214 -6.908 -13.266 1.00 0.00 O ATOM 181 OE2 GLU A 13 -4.089 -5.049 -12.101 1.00 0.00 O ATOM 0 H GLU A 13 -2.664 -2.337 -15.790 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.292 -2.866 -13.622 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.535 -3.621 -14.508 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.942 -3.962 -12.838 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.792 -4.816 -15.065 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.375 -5.770 -14.672 1.00 0.00 H new ATOM 188 N LEU A 14 -1.903 -0.744 -12.930 1.00 0.00 N ATOM 189 CA LEU A 14 -1.409 0.189 -11.922 1.00 0.00 C ATOM 190 C LEU A 14 -2.412 1.311 -11.681 1.00 0.00 C ATOM 191 O LEU A 14 -2.901 1.491 -10.566 1.00 0.00 O ATOM 192 CB LEU A 14 -0.065 0.776 -12.359 1.00 0.00 C ATOM 193 CG LEU A 14 1.157 -0.120 -12.150 1.00 0.00 C ATOM 194 CD1 LEU A 14 2.400 0.526 -12.743 1.00 0.00 C ATOM 195 CD2 LEU A 14 1.360 -0.409 -10.670 1.00 0.00 C ATOM 0 H LEU A 14 -1.474 -0.638 -13.849 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.274 -0.359 -10.989 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.128 1.029 -13.417 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.095 1.708 -11.817 1.00 0.00 H new ATOM 0 HG LEU A 14 0.982 -1.065 -12.664 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.259 -0.126 -12.585 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.254 0.682 -13.812 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.578 1.486 -12.258 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.234 -1.048 -10.541 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.513 0.528 -10.134 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.479 -0.914 -10.274 1.00 0.00 H new ATOM 207 N ARG A 15 -2.714 2.064 -12.733 1.00 0.00 N ATOM 208 CA ARG A 15 -3.661 3.170 -12.636 1.00 0.00 C ATOM 209 C ARG A 15 -4.978 2.705 -12.020 1.00 0.00 C ATOM 210 O ARG A 15 -5.611 3.438 -11.261 1.00 0.00 O ATOM 211 CB ARG A 15 -3.917 3.773 -14.018 1.00 0.00 C ATOM 212 CG ARG A 15 -5.033 3.084 -14.787 1.00 0.00 C ATOM 213 CD ARG A 15 -6.387 3.704 -14.480 1.00 0.00 C ATOM 214 NE ARG A 15 -7.339 3.506 -15.570 1.00 0.00 N ATOM 215 CZ ARG A 15 -8.602 3.912 -15.524 1.00 0.00 C ATOM 216 NH1 ARG A 15 -9.063 4.535 -14.449 1.00 0.00 N ATOM 217 NH2 ARG A 15 -9.408 3.696 -16.556 1.00 0.00 N ATOM 0 H ARG A 15 -2.317 1.929 -13.663 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.226 3.932 -11.990 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.164 4.829 -13.904 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -2.999 3.722 -14.603 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.835 3.152 -15.857 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -5.051 2.024 -14.533 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.787 3.267 -13.565 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.264 4.771 -14.296 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.016 3.030 -16.412 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -8.447 4.704 -13.654 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -10.034 4.846 -14.417 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.057 3.218 -17.386 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.378 4.008 -16.519 1.00 0.00 H new ATOM 231 N GLU A 16 -5.383 1.484 -12.354 1.00 0.00 N ATOM 232 CA GLU A 16 -6.624 0.924 -11.834 1.00 0.00 C ATOM 233 C GLU A 16 -6.461 0.495 -10.379 1.00 0.00 C ATOM 234 O GLU A 16 -7.386 0.618 -9.577 1.00 0.00 O ATOM 235 CB GLU A 16 -7.066 -0.272 -12.683 1.00 0.00 C ATOM 236 CG GLU A 16 -6.291 -1.545 -12.389 1.00 0.00 C ATOM 237 CD GLU A 16 -6.800 -2.733 -13.182 1.00 0.00 C ATOM 238 OE1 GLU A 16 -6.493 -3.880 -12.794 1.00 0.00 O ATOM 239 OE2 GLU A 16 -7.504 -2.517 -14.190 1.00 0.00 O ATOM 0 H GLU A 16 -4.870 0.865 -12.982 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.389 1.698 -11.883 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.127 -0.455 -12.514 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.950 -0.021 -13.737 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.237 -1.385 -12.617 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.357 -1.768 -11.324 1.00 0.00 H new ATOM 246 N ALA A 17 -5.278 -0.010 -10.047 1.00 0.00 N ATOM 247 CA ALA A 17 -4.992 -0.455 -8.688 1.00 0.00 C ATOM 248 C ALA A 17 -5.089 0.701 -7.699 1.00 0.00 C ATOM 249 O ALA A 17 -5.550 0.528 -6.571 1.00 0.00 O ATOM 250 CB ALA A 17 -3.612 -1.095 -8.622 1.00 0.00 C ATOM 0 H ALA A 17 -4.502 -0.121 -10.700 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.739 -1.198 -8.411 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.411 -1.423 -7.602 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.577 -1.954 -9.293 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.859 -0.367 -8.924 1.00 0.00 H new ATOM 256 N PHE A 18 -4.650 1.879 -8.129 1.00 0.00 N ATOM 257 CA PHE A 18 -4.686 3.065 -7.280 1.00 0.00 C ATOM 258 C PHE A 18 -6.107 3.607 -7.164 1.00 0.00 C ATOM 259 O PHE A 18 -6.604 3.845 -6.063 1.00 0.00 O ATOM 260 CB PHE A 18 -3.759 4.146 -7.838 1.00 0.00 C ATOM 261 CG PHE A 18 -2.469 3.606 -8.387 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.744 2.659 -7.682 1.00 0.00 C ATOM 263 CD2 PHE A 18 -1.982 4.045 -9.608 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.557 2.159 -8.184 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.796 3.549 -10.115 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.082 2.605 -9.402 1.00 0.00 C ATOM 0 H PHE A 18 -4.265 2.038 -9.060 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.342 2.780 -6.286 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.281 4.689 -8.626 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.536 4.865 -7.049 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.111 2.307 -6.729 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.536 4.783 -10.170 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -0.002 1.421 -7.625 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.427 3.899 -11.068 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.845 2.217 -9.796 1.00 0.00 H new ATOM 276 N ALA A 19 -6.756 3.802 -8.307 1.00 0.00 N ATOM 277 CA ALA A 19 -8.119 4.315 -8.334 1.00 0.00 C ATOM 278 C ALA A 19 -9.079 3.362 -7.629 1.00 0.00 C ATOM 279 O ALA A 19 -10.164 3.759 -7.203 1.00 0.00 O ATOM 280 CB ALA A 19 -8.566 4.550 -9.770 1.00 0.00 C ATOM 0 H ALA A 19 -6.359 3.612 -9.227 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.134 5.265 -7.800 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.586 4.933 -9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.904 5.275 -10.243 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.529 3.610 -10.321 1.00 0.00 H new ATOM 286 N LYS A 20 -8.672 2.103 -7.508 1.00 0.00 N ATOM 287 CA LYS A 20 -9.495 1.093 -6.853 1.00 0.00 C ATOM 288 C LYS A 20 -9.723 1.444 -5.386 1.00 0.00 C ATOM 289 O LYS A 20 -10.860 1.616 -4.947 1.00 0.00 O ATOM 290 CB LYS A 20 -8.833 -0.283 -6.963 1.00 0.00 C ATOM 291 CG LYS A 20 -9.683 -1.310 -7.690 1.00 0.00 C ATOM 292 CD LYS A 20 -10.068 -0.831 -9.081 1.00 0.00 C ATOM 293 CE LYS A 20 -9.611 -1.808 -10.153 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.422 -3.056 -10.148 1.00 0.00 N ATOM 0 H LYS A 20 -7.777 1.758 -7.855 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.462 1.066 -7.356 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.881 -0.178 -7.483 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.611 -0.651 -5.961 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.135 -2.249 -7.766 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.584 -1.513 -7.112 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -11.149 -0.707 -9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.624 0.147 -9.266 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.682 -1.333 -11.131 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.562 -2.056 -9.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.079 -3.696 -10.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.334 -3.523 -9.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.420 -2.822 -10.325 1.00 0.00 H new ATOM 308 N VAL A 21 -8.633 1.550 -4.632 1.00 0.00 N ATOM 309 CA VAL A 21 -8.714 1.882 -3.214 1.00 0.00 C ATOM 310 C VAL A 21 -9.110 3.341 -3.015 1.00 0.00 C ATOM 311 O VAL A 21 -9.483 3.748 -1.914 1.00 0.00 O ATOM 312 CB VAL A 21 -7.375 1.623 -2.500 1.00 0.00 C ATOM 313 CG1 VAL A 21 -7.106 0.130 -2.395 1.00 0.00 C ATOM 314 CG2 VAL A 21 -6.238 2.327 -3.226 1.00 0.00 C ATOM 0 H VAL A 21 -7.684 1.411 -4.979 1.00 0.00 H new ATOM 0 HA VAL A 21 -9.479 1.238 -2.780 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.438 2.029 -1.491 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.155 -0.034 -1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.907 -0.345 -1.828 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.063 -0.303 -3.394 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.299 2.133 -2.707 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.172 1.953 -4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.427 3.400 -3.244 1.00 0.00 H new ATOM 324 N ASP A 22 -9.027 4.123 -4.085 1.00 0.00 N ATOM 325 CA ASP A 22 -9.379 5.537 -4.029 1.00 0.00 C ATOM 326 C ASP A 22 -10.874 5.716 -3.790 1.00 0.00 C ATOM 327 O ASP A 22 -11.659 5.810 -4.734 1.00 0.00 O ATOM 328 CB ASP A 22 -8.969 6.238 -5.324 1.00 0.00 C ATOM 329 CG ASP A 22 -7.491 6.574 -5.359 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.946 6.743 -6.471 1.00 0.00 O ATOM 331 OD2 ASP A 22 -6.879 6.670 -4.275 1.00 0.00 O ATOM 0 H ASP A 22 -8.719 3.802 -5.003 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.840 5.987 -3.195 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.213 5.599 -6.172 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.549 7.154 -5.437 1.00 0.00 H new ATOM 336 N THR A 23 -11.265 5.761 -2.519 1.00 0.00 N ATOM 337 CA THR A 23 -12.666 5.926 -2.155 1.00 0.00 C ATOM 338 C THR A 23 -13.143 7.348 -2.434 1.00 0.00 C ATOM 339 O THR A 23 -14.321 7.575 -2.708 1.00 0.00 O ATOM 340 CB THR A 23 -12.903 5.599 -0.669 1.00 0.00 C ATOM 341 OG1 THR A 23 -11.785 6.034 0.112 1.00 0.00 O ATOM 342 CG2 THR A 23 -13.117 4.107 -0.470 1.00 0.00 C ATOM 0 H THR A 23 -10.629 5.685 -1.725 1.00 0.00 H new ATOM 0 HA THR A 23 -13.236 5.228 -2.768 1.00 0.00 H new ATOM 0 HB THR A 23 -13.800 6.125 -0.343 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.944 5.824 1.056 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.282 3.901 0.588 1.00 0.00 H new ATOM 0 HG22 THR A 23 -13.987 3.785 -1.043 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.236 3.564 -0.812 1.00 0.00 H new ATOM 350 N ASP A 24 -12.219 8.301 -2.362 1.00 0.00 N ATOM 351 CA ASP A 24 -12.546 9.701 -2.609 1.00 0.00 C ATOM 352 C ASP A 24 -12.132 10.116 -4.017 1.00 0.00 C ATOM 353 O ASP A 24 -12.501 11.188 -4.493 1.00 0.00 O ATOM 354 CB ASP A 24 -11.858 10.596 -1.577 1.00 0.00 C ATOM 355 CG ASP A 24 -10.363 10.349 -1.501 1.00 0.00 C ATOM 356 OD1 ASP A 24 -9.829 10.288 -0.374 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.730 10.215 -2.568 1.00 0.00 O ATOM 0 H ASP A 24 -11.239 8.130 -2.135 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.626 9.818 -2.519 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.038 11.641 -1.829 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.302 10.423 -0.597 1.00 0.00 H new ATOM 362 N GLY A 25 -11.361 9.257 -4.679 1.00 0.00 N ATOM 363 CA GLY A 25 -10.908 9.553 -6.025 1.00 0.00 C ATOM 364 C GLY A 25 -10.097 10.832 -6.096 1.00 0.00 C ATOM 365 O GLY A 25 -10.481 11.780 -6.779 1.00 0.00 O ATOM 0 H GLY A 25 -11.043 8.362 -4.307 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.305 8.723 -6.393 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.771 9.637 -6.685 1.00 0.00 H new ATOM 369 N ASN A 26 -8.973 10.858 -5.388 1.00 0.00 N ATOM 370 CA ASN A 26 -8.107 12.030 -5.372 1.00 0.00 C ATOM 371 C ASN A 26 -6.787 11.741 -6.080 1.00 0.00 C ATOM 372 O ASN A 26 -6.045 12.658 -6.432 1.00 0.00 O ATOM 373 CB ASN A 26 -7.839 12.474 -3.932 1.00 0.00 C ATOM 374 CG ASN A 26 -7.077 11.431 -3.138 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.912 10.295 -3.582 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.606 11.814 -1.957 1.00 0.00 N ATOM 0 H ASN A 26 -8.641 10.080 -4.818 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.617 12.833 -5.904 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.272 13.405 -3.941 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.787 12.683 -3.437 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.084 11.156 -1.379 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -6.766 12.766 -1.628 1.00 0.00 H new ATOM 383 N GLY A 27 -6.501 10.459 -6.287 1.00 0.00 N ATOM 384 CA GLY A 27 -5.271 10.072 -6.953 1.00 0.00 C ATOM 385 C GLY A 27 -4.103 9.960 -5.993 1.00 0.00 C ATOM 386 O GLY A 27 -2.943 9.978 -6.409 1.00 0.00 O ATOM 0 H GLY A 27 -7.099 9.682 -6.005 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.418 9.115 -7.454 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.034 10.804 -7.725 1.00 0.00 H new ATOM 390 N TYR A 28 -4.406 9.846 -4.705 1.00 0.00 N ATOM 391 CA TYR A 28 -3.373 9.736 -3.683 1.00 0.00 C ATOM 392 C TYR A 28 -3.661 8.571 -2.739 1.00 0.00 C ATOM 393 O TYR A 28 -4.813 8.177 -2.557 1.00 0.00 O ATOM 394 CB TYR A 28 -3.271 11.038 -2.887 1.00 0.00 C ATOM 395 CG TYR A 28 -2.395 12.081 -3.543 1.00 0.00 C ATOM 396 CD1 TYR A 28 -1.015 11.926 -3.592 1.00 0.00 C ATOM 397 CD2 TYR A 28 -2.947 13.223 -4.111 1.00 0.00 C ATOM 398 CE1 TYR A 28 -0.210 12.878 -4.189 1.00 0.00 C ATOM 399 CE2 TYR A 28 -2.150 14.179 -4.712 1.00 0.00 C ATOM 400 CZ TYR A 28 -0.783 14.001 -4.748 1.00 0.00 C ATOM 401 OH TYR A 28 0.014 14.951 -5.344 1.00 0.00 O ATOM 0 H TYR A 28 -5.360 9.827 -4.344 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.423 9.549 -4.183 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.271 11.450 -2.750 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -2.878 10.818 -1.894 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -0.564 11.047 -3.156 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.017 13.366 -4.082 1.00 0.00 H new ATOM 0 HE1 TYR A 28 0.861 12.743 -4.218 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -2.595 15.060 -5.151 1.00 0.00 H new ATOM 0 HH TYR A 28 -0.546 15.678 -5.689 1.00 0.00 H new ATOM 411 N ILE A 29 -2.607 8.027 -2.143 1.00 0.00 N ATOM 412 CA ILE A 29 -2.745 6.909 -1.217 1.00 0.00 C ATOM 413 C ILE A 29 -1.946 7.149 0.058 1.00 0.00 C ATOM 414 O ILE A 29 -0.771 7.514 0.007 1.00 0.00 O ATOM 415 CB ILE A 29 -2.284 5.587 -1.858 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.192 5.221 -3.034 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.275 4.472 -0.823 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.943 3.833 -3.581 1.00 0.00 C ATOM 0 H ILE A 29 -1.647 8.342 -2.284 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.804 6.833 -0.970 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.269 5.717 -2.233 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.232 5.296 -2.717 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.049 5.949 -3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -1.947 3.544 -1.291 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.592 4.732 -0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.280 4.340 -0.421 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.622 3.642 -4.412 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.913 3.759 -3.930 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -3.114 3.096 -2.796 1.00 0.00 H new ATOM 430 N SER A 30 -2.589 6.940 1.203 1.00 0.00 N ATOM 431 CA SER A 30 -1.938 7.136 2.493 1.00 0.00 C ATOM 432 C SER A 30 -1.577 5.796 3.127 1.00 0.00 C ATOM 433 O SER A 30 -1.687 4.746 2.493 1.00 0.00 O ATOM 434 CB SER A 30 -2.848 7.929 3.432 1.00 0.00 C ATOM 435 OG SER A 30 -3.726 7.069 4.139 1.00 0.00 O ATOM 0 H SER A 30 -3.560 6.635 1.263 1.00 0.00 H new ATOM 0 HA SER A 30 -1.020 7.700 2.328 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.241 8.495 4.139 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.427 8.652 2.858 1.00 0.00 H new ATOM 0 HG SER A 30 -4.296 7.600 4.734 1.00 0.00 H new ATOM 441 N PHE A 31 -1.146 5.840 4.383 1.00 0.00 N ATOM 442 CA PHE A 31 -0.767 4.631 5.105 1.00 0.00 C ATOM 443 C PHE A 31 -2.001 3.829 5.509 1.00 0.00 C ATOM 444 O PHE A 31 -1.989 2.600 5.490 1.00 0.00 O ATOM 445 CB PHE A 31 0.050 4.988 6.347 1.00 0.00 C ATOM 446 CG PHE A 31 -0.042 3.964 7.443 1.00 0.00 C ATOM 447 CD1 PHE A 31 0.854 2.909 7.502 1.00 0.00 C ATOM 448 CD2 PHE A 31 -1.028 4.055 8.413 1.00 0.00 C ATOM 449 CE1 PHE A 31 0.770 1.965 8.507 1.00 0.00 C ATOM 450 CE2 PHE A 31 -1.117 3.115 9.420 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.216 2.068 9.467 1.00 0.00 C ATOM 0 H PHE A 31 -1.050 6.700 4.922 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.158 4.018 4.441 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.095 5.109 6.062 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.290 5.950 6.731 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.628 2.824 6.753 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.735 4.871 8.381 1.00 0.00 H new ATOM 0 HE1 PHE A 31 1.475 1.148 8.541 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.890 3.198 10.170 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.284 1.331 10.254 1.00 0.00 H new ATOM 461 N ASN A 32 -3.066 4.537 5.872 1.00 0.00 N ATOM 462 CA ASN A 32 -4.309 3.892 6.282 1.00 0.00 C ATOM 463 C ASN A 32 -4.901 3.077 5.136 1.00 0.00 C ATOM 464 O ASN A 32 -5.355 1.950 5.333 1.00 0.00 O ATOM 465 CB ASN A 32 -5.320 4.939 6.753 1.00 0.00 C ATOM 466 CG ASN A 32 -6.620 4.316 7.222 1.00 0.00 C ATOM 467 OD1 ASN A 32 -7.432 3.863 6.414 1.00 0.00 O ATOM 468 ND2 ASN A 32 -6.825 4.291 8.534 1.00 0.00 N ATOM 0 H ASN A 32 -3.093 5.556 5.891 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.084 3.217 7.108 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -4.885 5.521 7.566 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -5.526 5.634 5.939 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.682 3.885 8.909 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -6.125 4.678 9.167 1.00 0.00 H new ATOM 475 N GLU A 33 -4.893 3.655 3.938 1.00 0.00 N ATOM 476 CA GLU A 33 -5.430 2.982 2.762 1.00 0.00 C ATOM 477 C GLU A 33 -4.718 1.653 2.523 1.00 0.00 C ATOM 478 O GLU A 33 -5.351 0.597 2.472 1.00 0.00 O ATOM 479 CB GLU A 33 -5.292 3.876 1.529 1.00 0.00 C ATOM 480 CG GLU A 33 -5.693 5.320 1.775 1.00 0.00 C ATOM 481 CD GLU A 33 -6.042 6.056 0.496 1.00 0.00 C ATOM 482 OE1 GLU A 33 -6.736 5.463 -0.357 1.00 0.00 O ATOM 483 OE2 GLU A 33 -5.623 7.223 0.347 1.00 0.00 O ATOM 0 H GLU A 33 -4.521 4.587 3.757 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.486 2.781 2.940 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.258 3.849 1.185 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.906 3.469 0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.549 5.345 2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.877 5.839 2.277 1.00 0.00 H new ATOM 490 N LEU A 34 -3.399 1.714 2.377 1.00 0.00 N ATOM 491 CA LEU A 34 -2.599 0.515 2.143 1.00 0.00 C ATOM 492 C LEU A 34 -2.774 -0.486 3.280 1.00 0.00 C ATOM 493 O LEU A 34 -2.989 -1.674 3.045 1.00 0.00 O ATOM 494 CB LEU A 34 -1.123 0.885 1.995 1.00 0.00 C ATOM 495 CG LEU A 34 -0.696 1.410 0.623 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.805 1.655 0.588 1.00 0.00 C ATOM 497 CD2 LEU A 34 -1.104 0.434 -0.471 1.00 0.00 C ATOM 0 H LEU A 34 -2.861 2.579 2.416 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.945 0.051 1.219 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.882 1.641 2.742 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.523 0.005 2.228 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.202 2.359 0.444 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.090 2.028 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.071 2.391 1.346 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.331 0.721 0.788 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.793 0.823 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.625 -0.530 -0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.187 0.308 -0.461 1.00 0.00 H new ATOM 509 N ASN A 35 -2.680 0.003 4.512 1.00 0.00 N ATOM 510 CA ASN A 35 -2.829 -0.849 5.686 1.00 0.00 C ATOM 511 C ASN A 35 -4.109 -1.675 5.600 1.00 0.00 C ATOM 512 O ASN A 35 -4.093 -2.888 5.812 1.00 0.00 O ATOM 513 CB ASN A 35 -2.841 -0.001 6.959 1.00 0.00 C ATOM 514 CG ASN A 35 -2.539 -0.818 8.201 1.00 0.00 C ATOM 515 OD1 ASN A 35 -3.468 -1.689 8.577 1.00 0.00 O flip ATOM 516 ND2 ASN A 35 -1.482 -0.668 8.814 1.00 0.00 N flip ATOM 0 H ASN A 35 -2.501 0.985 4.723 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.979 -1.531 5.719 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -2.107 0.799 6.866 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.817 0.473 7.067 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.796 0.013 8.489 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.292 -1.225 9.647 1.00 0.00 H new ATOM 523 N ASP A 36 -5.216 -1.011 5.287 1.00 0.00 N ATOM 524 CA ASP A 36 -6.505 -1.682 5.170 1.00 0.00 C ATOM 525 C ASP A 36 -6.543 -2.574 3.934 1.00 0.00 C ATOM 526 O ASP A 36 -7.245 -3.586 3.906 1.00 0.00 O ATOM 527 CB ASP A 36 -7.636 -0.654 5.108 1.00 0.00 C ATOM 528 CG ASP A 36 -8.884 -1.124 5.830 1.00 0.00 C ATOM 529 OD1 ASP A 36 -8.984 -2.334 6.118 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.762 -0.280 6.106 1.00 0.00 O ATOM 0 H ASP A 36 -5.246 -0.007 5.109 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.642 -2.308 6.052 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.296 0.283 5.548 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.879 -0.447 4.066 1.00 0.00 H new ATOM 535 N LEU A 37 -5.784 -2.193 2.912 1.00 0.00 N ATOM 536 CA LEU A 37 -5.732 -2.958 1.670 1.00 0.00 C ATOM 537 C LEU A 37 -5.028 -4.294 1.884 1.00 0.00 C ATOM 538 O LEU A 37 -5.486 -5.333 1.406 1.00 0.00 O ATOM 539 CB LEU A 37 -5.012 -2.157 0.585 1.00 0.00 C ATOM 540 CG LEU A 37 -5.206 -2.647 -0.851 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.433 -3.936 -1.085 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.685 -2.846 -1.151 1.00 0.00 C ATOM 0 H LEU A 37 -5.196 -1.359 2.919 1.00 0.00 H new ATOM 0 HA LEU A 37 -6.755 -3.154 1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.348 -1.122 0.643 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -3.945 -2.159 0.807 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.817 -1.888 -1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.583 -4.269 -2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.371 -3.760 -0.912 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.790 -4.704 -0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.804 -3.195 -2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.099 -3.586 -0.466 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.212 -1.900 -1.026 1.00 0.00 H new ATOM 554 N PHE A 38 -3.914 -4.262 2.608 1.00 0.00 N ATOM 555 CA PHE A 38 -3.147 -5.470 2.886 1.00 0.00 C ATOM 556 C PHE A 38 -3.759 -6.247 4.049 1.00 0.00 C ATOM 557 O PHE A 38 -3.592 -7.462 4.156 1.00 0.00 O ATOM 558 CB PHE A 38 -1.693 -5.116 3.204 1.00 0.00 C ATOM 559 CG PHE A 38 -1.069 -4.190 2.200 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.115 -3.264 2.591 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.437 -4.244 0.865 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.462 -2.410 1.669 1.00 0.00 C ATOM 563 CE2 PHE A 38 -0.864 -3.393 -0.061 1.00 0.00 C ATOM 564 CZ PHE A 38 0.086 -2.475 0.342 1.00 0.00 C ATOM 0 H PHE A 38 -3.522 -3.412 3.013 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.174 -6.099 1.996 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.647 -4.654 4.190 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.107 -6.033 3.254 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.181 -3.209 3.628 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.180 -4.959 0.545 1.00 0.00 H new ATOM 0 HE1 PHE A 38 1.205 -1.694 1.986 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.159 -3.446 -1.099 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.534 -1.809 -0.380 1.00 0.00 H new ATOM 574 N LYS A 39 -4.468 -5.536 4.919 1.00 0.00 N ATOM 575 CA LYS A 39 -5.106 -6.156 6.074 1.00 0.00 C ATOM 576 C LYS A 39 -6.410 -6.838 5.674 1.00 0.00 C ATOM 577 O LYS A 39 -6.697 -7.953 6.109 1.00 0.00 O ATOM 578 CB LYS A 39 -5.378 -5.108 7.156 1.00 0.00 C ATOM 579 CG LYS A 39 -5.859 -5.700 8.470 1.00 0.00 C ATOM 580 CD LYS A 39 -4.705 -5.947 9.426 1.00 0.00 C ATOM 581 CE LYS A 39 -4.818 -5.079 10.671 1.00 0.00 C ATOM 582 NZ LYS A 39 -4.117 -5.686 11.836 1.00 0.00 N ATOM 0 H LYS A 39 -4.615 -4.529 4.846 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.428 -6.911 6.470 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.466 -4.539 7.336 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.125 -4.405 6.789 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.578 -5.024 8.933 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.381 -6.638 8.278 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.688 -6.998 9.714 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.762 -5.740 8.921 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.397 -4.094 10.467 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.870 -4.931 10.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -4.217 -5.065 12.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.535 -6.615 12.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.108 -5.803 11.612 1.00 0.00 H new ATOM 596 N ALA A 40 -7.197 -6.162 4.842 1.00 0.00 N ATOM 597 CA ALA A 40 -8.468 -6.705 4.382 1.00 0.00 C ATOM 598 C ALA A 40 -8.260 -7.981 3.574 1.00 0.00 C ATOM 599 O ALA A 40 -9.185 -8.773 3.395 1.00 0.00 O ATOM 600 CB ALA A 40 -9.216 -5.670 3.554 1.00 0.00 C ATOM 0 H ALA A 40 -6.976 -5.237 4.473 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.066 -6.954 5.258 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.164 -6.090 3.217 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.406 -4.786 4.162 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.614 -5.392 2.689 1.00 0.00 H new ATOM 606 N ALA A 41 -7.038 -8.174 3.085 1.00 0.00 N ATOM 607 CA ALA A 41 -6.709 -9.355 2.297 1.00 0.00 C ATOM 608 C ALA A 41 -7.028 -10.634 3.063 1.00 0.00 C ATOM 609 O ALA A 41 -7.244 -11.689 2.466 1.00 0.00 O ATOM 610 CB ALA A 41 -5.240 -9.329 1.896 1.00 0.00 C ATOM 0 H ALA A 41 -6.261 -7.528 3.221 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.321 -9.342 1.395 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.008 -10.217 1.308 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.041 -8.437 1.301 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.619 -9.314 2.791 1.00 0.00 H new ATOM 616 N CYS A 42 -7.054 -10.532 4.388 1.00 0.00 N ATOM 617 CA CYS A 42 -7.346 -11.682 5.236 1.00 0.00 C ATOM 618 C CYS A 42 -6.334 -12.800 5.004 1.00 0.00 C ATOM 619 O CYS A 42 -6.618 -13.972 5.258 1.00 0.00 O ATOM 620 CB CYS A 42 -8.761 -12.195 4.968 1.00 0.00 C ATOM 621 SG CYS A 42 -10.048 -11.334 5.901 1.00 0.00 S ATOM 0 H CYS A 42 -6.877 -9.666 4.897 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.275 -11.362 6.276 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -8.974 -12.101 3.903 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.802 -13.257 5.208 1.00 0.00 H new ATOM 0 HG CYS A 42 -11.209 -11.838 5.605 1.00 0.00 H new ATOM 627 N LEU A 43 -5.154 -12.431 4.519 1.00 0.00 N ATOM 628 CA LEU A 43 -4.099 -13.403 4.250 1.00 0.00 C ATOM 629 C LEU A 43 -3.569 -14.003 5.548 1.00 0.00 C ATOM 630 O LEU A 43 -3.635 -13.393 6.616 1.00 0.00 O ATOM 631 CB LEU A 43 -2.957 -12.743 3.475 1.00 0.00 C ATOM 632 CG LEU A 43 -1.933 -11.976 4.313 1.00 0.00 C ATOM 633 CD1 LEU A 43 -0.830 -11.419 3.427 1.00 0.00 C ATOM 634 CD2 LEU A 43 -2.611 -10.857 5.089 1.00 0.00 C ATOM 0 H LEU A 43 -4.903 -11.466 4.304 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.522 -14.206 3.647 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.432 -13.515 2.913 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.388 -12.056 2.746 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.485 -12.667 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.110 -10.876 4.040 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.326 -12.239 2.915 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.262 -10.742 2.690 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.868 -10.322 5.680 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.086 -10.167 4.392 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.366 -11.280 5.752 1.00 0.00 H new ATOM 646 N PRO A 44 -3.027 -15.227 5.456 1.00 0.00 N ATOM 647 CA PRO A 44 -2.472 -15.936 6.613 1.00 0.00 C ATOM 648 C PRO A 44 -1.184 -15.297 7.120 1.00 0.00 C ATOM 649 O PRO A 44 -0.087 -15.787 6.849 1.00 0.00 O ATOM 650 CB PRO A 44 -2.195 -17.339 6.069 1.00 0.00 C ATOM 651 CG PRO A 44 -2.010 -17.148 4.603 1.00 0.00 C ATOM 652 CD PRO A 44 -2.916 -16.013 4.216 1.00 0.00 C ATOM 0 HA PRO A 44 -3.151 -15.921 7.465 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.306 -17.773 6.527 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.024 -18.015 6.279 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.971 -16.916 4.368 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.266 -18.055 4.056 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.495 -15.422 3.402 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.889 -16.372 3.879 1.00 0.00 H new ATOM 660 N LEU A 45 -1.323 -14.201 7.858 1.00 0.00 N ATOM 661 CA LEU A 45 -0.169 -13.495 8.404 1.00 0.00 C ATOM 662 C LEU A 45 -0.553 -12.710 9.654 1.00 0.00 C ATOM 663 O LEU A 45 -1.709 -12.338 9.853 1.00 0.00 O ATOM 664 CB LEU A 45 0.419 -12.550 7.355 1.00 0.00 C ATOM 665 CG LEU A 45 1.217 -13.208 6.230 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.699 -12.164 5.234 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.393 -13.990 6.797 1.00 0.00 C ATOM 0 H LEU A 45 -2.223 -13.782 8.092 1.00 0.00 H new ATOM 0 HA LEU A 45 0.582 -14.235 8.679 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.397 -11.981 6.910 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.066 -11.835 7.862 1.00 0.00 H new ATOM 0 HG LEU A 45 0.562 -13.904 5.706 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.265 -12.652 4.441 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.841 -11.649 4.803 1.00 0.00 H new ATOM 0 HD13 LEU A 45 2.337 -11.442 5.744 1.00 0.00 H new ATOM 0 HD21 LEU A 45 2.950 -14.452 5.982 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.048 -13.314 7.347 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.024 -14.765 7.469 1.00 0.00 H new ATOM 679 N PRO A 46 0.440 -12.450 10.518 1.00 0.00 N ATOM 680 CA PRO A 46 0.232 -11.704 11.762 1.00 0.00 C ATOM 681 C PRO A 46 -0.068 -10.230 11.512 1.00 0.00 C ATOM 682 O PRO A 46 -0.311 -9.821 10.378 1.00 0.00 O ATOM 683 CB PRO A 46 1.565 -11.862 12.499 1.00 0.00 C ATOM 684 CG PRO A 46 2.566 -12.100 11.421 1.00 0.00 C ATOM 685 CD PRO A 46 1.843 -12.863 10.346 1.00 0.00 C ATOM 0 HA PRO A 46 -0.626 -12.077 12.321 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.808 -10.969 13.075 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.533 -12.695 13.201 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.956 -11.158 11.036 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.417 -12.667 11.797 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.217 -12.611 9.354 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.963 -13.940 10.468 1.00 0.00 H new ATOM 693 N GLY A 47 -0.049 -9.437 12.579 1.00 0.00 N ATOM 694 CA GLY A 47 -0.320 -8.017 12.453 1.00 0.00 C ATOM 695 C GLY A 47 0.905 -7.228 12.034 1.00 0.00 C ATOM 696 O GLY A 47 0.860 -6.466 11.069 1.00 0.00 O ATOM 0 H GLY A 47 0.149 -9.753 13.528 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.114 -7.865 11.722 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.687 -7.634 13.405 1.00 0.00 H new ATOM 700 N TYR A 48 2.001 -7.409 12.763 1.00 0.00 N ATOM 701 CA TYR A 48 3.242 -6.705 12.466 1.00 0.00 C ATOM 702 C TYR A 48 3.624 -6.873 10.998 1.00 0.00 C ATOM 703 O TYR A 48 4.218 -5.979 10.394 1.00 0.00 O ATOM 704 CB TYR A 48 4.371 -7.219 13.359 1.00 0.00 C ATOM 705 CG TYR A 48 5.053 -8.458 12.824 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.150 -8.360 11.977 1.00 0.00 C ATOM 707 CD2 TYR A 48 4.598 -9.726 13.162 1.00 0.00 C ATOM 708 CE1 TYR A 48 6.775 -9.489 11.484 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.218 -10.861 12.674 1.00 0.00 C ATOM 710 CZ TYR A 48 6.306 -10.737 11.836 1.00 0.00 C ATOM 711 OH TYR A 48 6.925 -11.865 11.347 1.00 0.00 O ATOM 0 H TYR A 48 2.055 -8.038 13.564 1.00 0.00 H new ATOM 0 HA TYR A 48 3.085 -5.645 12.664 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.113 -6.430 13.481 1.00 0.00 H new ATOM 0 HB3 TYR A 48 3.970 -7.435 14.349 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.520 -7.384 11.699 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.745 -9.827 13.817 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.626 -9.395 10.826 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.852 -11.840 12.948 1.00 0.00 H new ATOM 0 HH TYR A 48 6.472 -12.662 11.692 1.00 0.00 H new ATOM 721 N ARG A 49 3.278 -8.022 10.431 1.00 0.00 N ATOM 722 CA ARG A 49 3.584 -8.309 9.034 1.00 0.00 C ATOM 723 C ARG A 49 2.922 -7.289 8.112 1.00 0.00 C ATOM 724 O ARG A 49 3.574 -6.695 7.254 1.00 0.00 O ATOM 725 CB ARG A 49 3.124 -9.720 8.667 1.00 0.00 C ATOM 726 CG ARG A 49 4.263 -10.717 8.529 1.00 0.00 C ATOM 727 CD ARG A 49 5.229 -10.309 7.428 1.00 0.00 C ATOM 728 NE ARG A 49 5.699 -11.457 6.658 1.00 0.00 N ATOM 729 CZ ARG A 49 6.431 -11.354 5.554 1.00 0.00 C ATOM 730 NH1 ARG A 49 6.776 -10.159 5.095 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.819 -12.446 4.910 1.00 0.00 N ATOM 0 H ARG A 49 2.785 -8.771 10.917 1.00 0.00 H new ATOM 0 HA ARG A 49 4.664 -8.243 8.904 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.431 -10.077 9.429 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.572 -9.680 7.728 1.00 0.00 H new ATOM 0 HG2 ARG A 49 4.799 -10.792 9.475 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.859 -11.706 8.312 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.739 -9.601 6.760 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.083 -9.794 7.868 1.00 0.00 H new ATOM 0 HE ARG A 49 5.451 -12.391 6.986 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.479 -9.318 5.590 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.338 -10.081 4.247 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.556 -13.366 5.262 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.381 -12.366 4.063 1.00 0.00 H new ATOM 745 N VAL A 50 1.620 -7.092 8.296 1.00 0.00 N ATOM 746 CA VAL A 50 0.868 -6.144 7.482 1.00 0.00 C ATOM 747 C VAL A 50 1.348 -4.717 7.716 1.00 0.00 C ATOM 748 O VAL A 50 1.596 -3.971 6.769 1.00 0.00 O ATOM 749 CB VAL A 50 -0.641 -6.223 7.779 1.00 0.00 C ATOM 750 CG1 VAL A 50 -1.431 -5.428 6.750 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.102 -7.672 7.814 1.00 0.00 C ATOM 0 H VAL A 50 1.064 -7.576 9.001 1.00 0.00 H new ATOM 0 HA VAL A 50 1.040 -6.415 6.440 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.824 -5.784 8.760 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.495 -5.496 6.977 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.120 -4.384 6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.245 -5.834 5.756 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.171 -7.709 8.025 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.906 -8.139 6.849 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.560 -8.208 8.593 1.00 0.00 H new ATOM 761 N ARG A 51 1.477 -4.343 8.985 1.00 0.00 N ATOM 762 CA ARG A 51 1.926 -3.003 9.344 1.00 0.00 C ATOM 763 C ARG A 51 3.345 -2.752 8.840 1.00 0.00 C ATOM 764 O ARG A 51 3.739 -1.609 8.613 1.00 0.00 O ATOM 765 CB ARG A 51 1.873 -2.814 10.861 1.00 0.00 C ATOM 766 CG ARG A 51 2.001 -1.364 11.299 1.00 0.00 C ATOM 767 CD ARG A 51 0.706 -0.850 11.908 1.00 0.00 C ATOM 768 NE ARG A 51 0.681 -1.010 13.359 1.00 0.00 N ATOM 769 CZ ARG A 51 1.383 -0.252 14.194 1.00 0.00 C ATOM 770 NH1 ARG A 51 2.160 0.714 13.724 1.00 0.00 N ATOM 771 NH2 ARG A 51 1.308 -0.459 15.503 1.00 0.00 N ATOM 0 H ARG A 51 1.277 -4.949 9.781 1.00 0.00 H new ATOM 0 HA ARG A 51 1.257 -2.284 8.871 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.932 -3.216 11.236 1.00 0.00 H new ATOM 0 HB3 ARG A 51 2.673 -3.395 11.319 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.808 -1.272 12.026 1.00 0.00 H new ATOM 0 HG3 ARG A 51 2.272 -0.747 10.443 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.581 0.203 11.658 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.137 -1.384 11.470 1.00 0.00 H new ATOM 0 HE ARG A 51 0.092 -1.744 13.753 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.220 0.877 12.719 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.698 1.294 14.368 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.711 -1.201 15.869 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.848 0.124 16.143 1.00 0.00 H new ATOM 785 N GLU A 52 4.105 -3.829 8.668 1.00 0.00 N ATOM 786 CA GLU A 52 5.480 -3.724 8.191 1.00 0.00 C ATOM 787 C GLU A 52 5.517 -3.465 6.689 1.00 0.00 C ATOM 788 O GLU A 52 6.125 -2.497 6.229 1.00 0.00 O ATOM 789 CB GLU A 52 6.254 -5.002 8.518 1.00 0.00 C ATOM 790 CG GLU A 52 7.658 -5.028 7.937 1.00 0.00 C ATOM 791 CD GLU A 52 8.572 -4.000 8.575 1.00 0.00 C ATOM 792 OE1 GLU A 52 8.400 -2.796 8.290 1.00 0.00 O ATOM 793 OE2 GLU A 52 9.461 -4.398 9.356 1.00 0.00 O ATOM 0 H GLU A 52 3.793 -4.783 8.851 1.00 0.00 H new ATOM 0 HA GLU A 52 5.950 -2.882 8.698 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.316 -5.113 9.601 1.00 0.00 H new ATOM 0 HB3 GLU A 52 5.698 -5.860 8.141 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.085 -6.022 8.072 1.00 0.00 H new ATOM 0 HG3 GLU A 52 7.606 -4.846 6.863 1.00 0.00 H new ATOM 800 N ILE A 53 4.862 -4.334 5.927 1.00 0.00 N ATOM 801 CA ILE A 53 4.819 -4.200 4.477 1.00 0.00 C ATOM 802 C ILE A 53 4.256 -2.843 4.067 1.00 0.00 C ATOM 803 O ILE A 53 4.741 -2.215 3.125 1.00 0.00 O ATOM 804 CB ILE A 53 3.969 -5.310 3.832 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.581 -5.359 4.476 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.667 -6.655 3.964 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.704 -6.469 3.940 1.00 0.00 C ATOM 0 H ILE A 53 4.353 -5.140 6.291 1.00 0.00 H new ATOM 0 HA ILE A 53 5.846 -4.288 4.123 1.00 0.00 H new ATOM 0 HB ILE A 53 3.850 -5.086 2.772 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.693 -5.484 5.553 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.082 -4.403 4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.054 -7.430 3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.635 -6.613 3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 53 4.813 -6.887 5.019 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.737 -6.443 4.442 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.561 -6.334 2.868 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.182 -7.431 4.124 1.00 0.00 H new ATOM 819 N THR A 54 3.231 -2.392 4.784 1.00 0.00 N ATOM 820 CA THR A 54 2.603 -1.109 4.496 1.00 0.00 C ATOM 821 C THR A 54 3.502 0.049 4.911 1.00 0.00 C ATOM 822 O THR A 54 3.572 1.069 4.225 1.00 0.00 O ATOM 823 CB THR A 54 1.247 -0.973 5.215 1.00 0.00 C ATOM 824 OG1 THR A 54 0.567 0.202 4.761 1.00 0.00 O ATOM 825 CG2 THR A 54 1.439 -0.903 6.723 1.00 0.00 C ATOM 0 H THR A 54 2.818 -2.897 5.568 1.00 0.00 H new ATOM 0 HA THR A 54 2.441 -1.072 3.419 1.00 0.00 H new ATOM 0 HB THR A 54 0.647 -1.852 4.981 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.214 0.368 5.330 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.468 -0.807 7.209 1.00 0.00 H new ATOM 0 HG22 THR A 54 1.930 -1.812 7.070 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.056 -0.040 6.972 1.00 0.00 H new ATOM 833 N GLU A 55 4.191 -0.115 6.037 1.00 0.00 N ATOM 834 CA GLU A 55 5.087 0.919 6.542 1.00 0.00 C ATOM 835 C GLU A 55 6.266 1.125 5.596 1.00 0.00 C ATOM 836 O GLU A 55 6.657 2.257 5.313 1.00 0.00 O ATOM 837 CB GLU A 55 5.596 0.548 7.936 1.00 0.00 C ATOM 838 CG GLU A 55 4.720 1.071 9.063 1.00 0.00 C ATOM 839 CD GLU A 55 5.206 0.631 10.430 1.00 0.00 C ATOM 840 OE1 GLU A 55 5.538 -0.564 10.585 1.00 0.00 O ATOM 841 OE2 GLU A 55 5.252 1.479 11.345 1.00 0.00 O ATOM 0 H GLU A 55 4.146 -0.954 6.616 1.00 0.00 H new ATOM 0 HA GLU A 55 4.526 1.851 6.605 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.662 -0.537 8.012 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.606 0.939 8.061 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.695 2.160 9.023 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.698 0.723 8.915 1.00 0.00 H new ATOM 848 N ASN A 56 6.828 0.023 5.111 1.00 0.00 N ATOM 849 CA ASN A 56 7.965 0.082 4.197 1.00 0.00 C ATOM 850 C ASN A 56 7.543 0.638 2.841 1.00 0.00 C ATOM 851 O ASN A 56 8.192 1.529 2.294 1.00 0.00 O ATOM 852 CB ASN A 56 8.579 -1.309 4.024 1.00 0.00 C ATOM 853 CG ASN A 56 9.417 -1.722 5.218 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.670 -0.925 6.121 1.00 0.00 O ATOM 855 ND2 ASN A 56 9.856 -2.976 5.227 1.00 0.00 N ATOM 0 H ASN A 56 6.516 -0.922 5.335 1.00 0.00 H new ATOM 0 HA ASN A 56 8.712 0.750 4.626 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.783 -2.038 3.872 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.198 -1.321 3.127 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.426 -3.311 6.003 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.623 -3.604 4.458 1.00 0.00 H new ATOM 862 N LEU A 57 6.452 0.104 2.303 1.00 0.00 N ATOM 863 CA LEU A 57 5.943 0.545 1.009 1.00 0.00 C ATOM 864 C LEU A 57 5.646 2.041 1.023 1.00 0.00 C ATOM 865 O LEU A 57 5.970 2.758 0.076 1.00 0.00 O ATOM 866 CB LEU A 57 4.679 -0.234 0.643 1.00 0.00 C ATOM 867 CG LEU A 57 4.438 -0.461 -0.850 1.00 0.00 C ATOM 868 CD1 LEU A 57 3.052 -1.043 -1.085 1.00 0.00 C ATOM 869 CD2 LEU A 57 4.610 0.839 -1.621 1.00 0.00 C ATOM 0 H LEU A 57 5.903 -0.635 2.743 1.00 0.00 H new ATOM 0 HA LEU A 57 6.710 0.352 0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.720 -1.205 1.136 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.819 0.295 1.053 1.00 0.00 H new ATOM 0 HG LEU A 57 5.176 -1.176 -1.213 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.899 -1.198 -2.153 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.965 -1.996 -0.564 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.298 -0.352 -0.707 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.435 0.659 -2.682 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.895 1.576 -1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.623 1.215 -1.479 1.00 0.00 H new ATOM 881 N MET A 58 5.027 2.507 2.104 1.00 0.00 N ATOM 882 CA MET A 58 4.689 3.919 2.243 1.00 0.00 C ATOM 883 C MET A 58 5.949 4.766 2.395 1.00 0.00 C ATOM 884 O MET A 58 6.067 5.834 1.794 1.00 0.00 O ATOM 885 CB MET A 58 3.770 4.129 3.446 1.00 0.00 C ATOM 886 CG MET A 58 2.341 3.670 3.208 1.00 0.00 C ATOM 887 SD MET A 58 1.495 4.657 1.957 1.00 0.00 S ATOM 888 CE MET A 58 1.510 6.272 2.733 1.00 0.00 C ATOM 0 H MET A 58 4.750 1.927 2.896 1.00 0.00 H new ATOM 0 HA MET A 58 4.168 4.234 1.339 1.00 0.00 H new ATOM 0 HB2 MET A 58 4.178 3.591 4.302 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.764 5.187 3.708 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.346 2.625 2.899 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.785 3.723 4.144 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.779 6.917 2.246 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.258 6.171 3.789 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.502 6.712 2.637 1.00 0.00 H new ATOM 898 N ALA A 59 6.887 4.284 3.204 1.00 0.00 N ATOM 899 CA ALA A 59 8.138 4.997 3.433 1.00 0.00 C ATOM 900 C ALA A 59 8.955 5.099 2.150 1.00 0.00 C ATOM 901 O ALA A 59 9.482 6.162 1.820 1.00 0.00 O ATOM 902 CB ALA A 59 8.946 4.307 4.522 1.00 0.00 C ATOM 0 H ALA A 59 6.804 3.403 3.712 1.00 0.00 H new ATOM 0 HA ALA A 59 7.897 6.008 3.760 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.878 4.850 4.683 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.370 4.292 5.448 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.170 3.285 4.217 1.00 0.00 H new ATOM 908 N THR A 60 9.057 3.988 1.428 1.00 0.00 N ATOM 909 CA THR A 60 9.811 3.952 0.182 1.00 0.00 C ATOM 910 C THR A 60 8.932 4.326 -1.004 1.00 0.00 C ATOM 911 O THR A 60 9.356 4.243 -2.156 1.00 0.00 O ATOM 912 CB THR A 60 10.423 2.560 -0.065 1.00 0.00 C ATOM 913 OG1 THR A 60 11.337 2.614 -1.166 1.00 0.00 O ATOM 914 CG2 THR A 60 9.336 1.535 -0.352 1.00 0.00 C ATOM 0 H THR A 60 8.626 3.100 1.685 1.00 0.00 H new ATOM 0 HA THR A 60 10.615 4.682 0.279 1.00 0.00 H new ATOM 0 HB THR A 60 10.958 2.258 0.835 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.974 3.198 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.792 0.560 -0.523 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.659 1.475 0.500 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.778 1.835 -1.239 1.00 0.00 H new ATOM 922 N GLY A 61 7.701 4.740 -0.716 1.00 0.00 N ATOM 923 CA GLY A 61 6.781 5.121 -1.771 1.00 0.00 C ATOM 924 C GLY A 61 6.512 6.613 -1.794 1.00 0.00 C ATOM 925 O GLY A 61 5.914 7.129 -2.739 1.00 0.00 O ATOM 0 H GLY A 61 7.325 4.818 0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 61 7.189 4.814 -2.734 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.840 4.587 -1.639 1.00 0.00 H new ATOM 929 N ASP A 62 6.951 7.308 -0.750 1.00 0.00 N ATOM 930 CA ASP A 62 6.754 8.750 -0.654 1.00 0.00 C ATOM 931 C ASP A 62 8.069 9.494 -0.863 1.00 0.00 C ATOM 932 O ASP A 62 8.957 9.457 -0.011 1.00 0.00 O ATOM 933 CB ASP A 62 6.158 9.115 0.706 1.00 0.00 C ATOM 934 CG ASP A 62 5.526 10.492 0.711 1.00 0.00 C ATOM 935 OD1 ASP A 62 5.544 11.158 -0.347 1.00 0.00 O ATOM 936 OD2 ASP A 62 5.011 10.906 1.771 1.00 0.00 O ATOM 0 H ASP A 62 7.445 6.896 0.041 1.00 0.00 H new ATOM 0 HA ASP A 62 6.060 9.050 -1.439 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.408 8.373 0.981 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.940 9.075 1.464 1.00 0.00 H new ATOM 941 N LEU A 63 8.188 10.167 -2.002 1.00 0.00 N ATOM 942 CA LEU A 63 9.396 10.918 -2.325 1.00 0.00 C ATOM 943 C LEU A 63 9.335 12.324 -1.737 1.00 0.00 C ATOM 944 O LEU A 63 10.258 12.760 -1.049 1.00 0.00 O ATOM 945 CB LEU A 63 9.583 10.995 -3.841 1.00 0.00 C ATOM 946 CG LEU A 63 10.053 9.710 -4.525 1.00 0.00 C ATOM 947 CD1 LEU A 63 8.908 8.714 -4.633 1.00 0.00 C ATOM 948 CD2 LEU A 63 10.626 10.017 -5.901 1.00 0.00 C ATOM 0 H LEU A 63 7.462 10.208 -2.718 1.00 0.00 H new ATOM 0 HA LEU A 63 10.247 10.396 -1.887 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.636 11.296 -4.289 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.304 11.783 -4.059 1.00 0.00 H new ATOM 0 HG LEU A 63 10.840 9.264 -3.917 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.261 7.806 -5.122 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.542 8.470 -3.635 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.100 9.151 -5.219 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.955 9.091 -6.373 1.00 0.00 H new ATOM 0 HD22 LEU A 63 9.860 10.486 -6.518 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.474 10.694 -5.799 1.00 0.00 H new ATOM 960 N ASP A 64 8.243 13.028 -2.012 1.00 0.00 N ATOM 961 CA ASP A 64 8.059 14.384 -1.507 1.00 0.00 C ATOM 962 C ASP A 64 7.791 14.374 -0.005 1.00 0.00 C ATOM 963 O ASP A 64 7.873 15.408 0.656 1.00 0.00 O ATOM 964 CB ASP A 64 6.906 15.072 -2.239 1.00 0.00 C ATOM 965 CG ASP A 64 6.924 14.803 -3.731 1.00 0.00 C ATOM 966 OD1 ASP A 64 7.684 15.488 -4.448 1.00 0.00 O ATOM 967 OD2 ASP A 64 6.181 13.907 -4.182 1.00 0.00 O ATOM 0 H ASP A 64 7.471 12.682 -2.582 1.00 0.00 H new ATOM 0 HA ASP A 64 8.978 14.940 -1.690 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.959 14.729 -1.822 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.960 16.147 -2.066 1.00 0.00 H new ATOM 972 N GLN A 65 7.468 13.198 0.525 1.00 0.00 N ATOM 973 CA GLN A 65 7.186 13.054 1.948 1.00 0.00 C ATOM 974 C GLN A 65 5.949 13.855 2.342 1.00 0.00 C ATOM 975 O GLN A 65 5.806 14.271 3.491 1.00 0.00 O ATOM 976 CB GLN A 65 8.388 13.511 2.777 1.00 0.00 C ATOM 977 CG GLN A 65 9.710 12.925 2.307 1.00 0.00 C ATOM 978 CD GLN A 65 10.900 13.500 3.048 1.00 0.00 C ATOM 979 OE1 GLN A 65 11.422 12.885 3.978 1.00 0.00 O ATOM 980 NE2 GLN A 65 11.335 14.687 2.641 1.00 0.00 N ATOM 0 H GLN A 65 7.395 12.332 -0.009 1.00 0.00 H new ATOM 0 HA GLN A 65 6.994 12.000 2.149 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.450 14.599 2.743 1.00 0.00 H new ATOM 0 HB3 GLN A 65 8.227 13.233 3.819 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.692 11.843 2.441 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.827 13.112 1.240 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.872 15.161 1.866 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.132 15.124 3.104 1.00 0.00 H new ATOM 989 N ASP A 66 5.057 14.065 1.380 1.00 0.00 N ATOM 990 CA ASP A 66 3.830 14.815 1.625 1.00 0.00 C ATOM 991 C ASP A 66 2.867 14.012 2.494 1.00 0.00 C ATOM 992 O ASP A 66 1.950 14.567 3.098 1.00 0.00 O ATOM 993 CB ASP A 66 3.158 15.182 0.302 1.00 0.00 C ATOM 994 CG ASP A 66 4.094 15.913 -0.640 1.00 0.00 C ATOM 995 OD1 ASP A 66 5.051 16.549 -0.150 1.00 0.00 O ATOM 996 OD2 ASP A 66 3.870 15.850 -1.867 1.00 0.00 O ATOM 0 H ASP A 66 5.160 13.727 0.423 1.00 0.00 H new ATOM 0 HA ASP A 66 4.093 15.730 2.155 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.796 14.275 -0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 66 2.287 15.807 0.501 1.00 0.00 H new ATOM 1001 N GLY A 67 3.082 12.701 2.552 1.00 0.00 N ATOM 1002 CA GLY A 67 2.225 11.842 3.347 1.00 0.00 C ATOM 1003 C GLY A 67 1.268 11.031 2.498 1.00 0.00 C ATOM 1004 O GLY A 67 0.362 10.380 3.020 1.00 0.00 O ATOM 0 H GLY A 67 3.835 12.219 2.062 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.842 11.166 3.939 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.656 12.451 4.049 1.00 0.00 H new ATOM 1008 N ARG A 68 1.467 11.069 1.184 1.00 0.00 N ATOM 1009 CA ARG A 68 0.612 10.333 0.260 1.00 0.00 C ATOM 1010 C ARG A 68 1.400 9.879 -0.964 1.00 0.00 C ATOM 1011 O ARG A 68 2.491 10.382 -1.235 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.571 11.201 -0.174 1.00 0.00 C ATOM 1013 CG ARG A 68 -1.299 11.862 0.984 1.00 0.00 C ATOM 1014 CD ARG A 68 -2.605 12.497 0.532 1.00 0.00 C ATOM 1015 NE ARG A 68 -2.389 13.786 -0.122 1.00 0.00 N ATOM 1016 CZ ARG A 68 -3.373 14.606 -0.471 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -4.634 14.274 -0.231 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -3.097 15.762 -1.062 1.00 0.00 N ATOM 0 H ARG A 68 2.213 11.601 0.736 1.00 0.00 H new ATOM 0 HA ARG A 68 0.236 9.450 0.776 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -0.213 11.973 -0.855 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.277 10.586 -0.732 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.502 11.122 1.758 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -0.659 12.623 1.431 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -3.117 11.823 -0.155 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -3.259 12.632 1.393 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.430 14.071 -0.321 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.850 13.387 0.223 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -5.388 14.906 -0.500 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.128 16.021 -1.248 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -3.854 16.391 -1.330 1.00 0.00 H new ATOM 1032 N ILE A 69 0.842 8.924 -1.701 1.00 0.00 N ATOM 1033 CA ILE A 69 1.492 8.403 -2.896 1.00 0.00 C ATOM 1034 C ILE A 69 0.627 8.622 -4.134 1.00 0.00 C ATOM 1035 O ILE A 69 -0.547 8.249 -4.156 1.00 0.00 O ATOM 1036 CB ILE A 69 1.801 6.901 -2.759 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.424 6.608 -1.393 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.727 6.446 -3.877 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.788 5.154 -1.192 1.00 0.00 C ATOM 0 H ILE A 69 -0.059 8.496 -1.491 1.00 0.00 H new ATOM 0 HA ILE A 69 2.428 8.950 -3.009 1.00 0.00 H new ATOM 0 HB ILE A 69 0.867 6.345 -2.838 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.320 7.218 -1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.726 6.910 -0.612 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.936 5.382 -3.766 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.249 6.623 -4.840 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.661 7.006 -3.827 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.224 5.022 -0.202 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.892 4.539 -1.279 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.510 4.852 -1.950 1.00 0.00 H new ATOM 1051 N SER A 70 1.214 9.227 -5.160 1.00 0.00 N ATOM 1052 CA SER A 70 0.496 9.497 -6.400 1.00 0.00 C ATOM 1053 C SER A 70 0.711 8.373 -7.409 1.00 0.00 C ATOM 1054 O SER A 70 1.555 7.499 -7.210 1.00 0.00 O ATOM 1055 CB SER A 70 0.953 10.829 -6.999 1.00 0.00 C ATOM 1056 OG SER A 70 2.358 10.847 -7.189 1.00 0.00 O ATOM 0 H SER A 70 2.185 9.540 -5.158 1.00 0.00 H new ATOM 0 HA SER A 70 -0.568 9.556 -6.169 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.452 10.994 -7.953 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.661 11.647 -6.340 1.00 0.00 H new ATOM 0 HG SER A 70 2.803 10.986 -6.327 1.00 0.00 H new ATOM 1062 N PHE A 71 -0.058 8.403 -8.492 1.00 0.00 N ATOM 1063 CA PHE A 71 0.046 7.386 -9.532 1.00 0.00 C ATOM 1064 C PHE A 71 1.497 7.205 -9.972 1.00 0.00 C ATOM 1065 O PHE A 71 2.029 6.095 -9.948 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.819 7.766 -10.735 1.00 0.00 C ATOM 1067 CG PHE A 71 -2.260 7.369 -10.586 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.957 6.825 -11.652 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.919 7.542 -9.379 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.283 6.458 -11.518 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -4.245 7.178 -9.238 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.928 6.636 -10.310 1.00 0.00 C ATOM 0 H PHE A 71 -0.760 9.120 -8.673 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.311 6.442 -9.120 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.761 8.844 -10.888 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.411 7.295 -11.629 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.458 6.686 -12.600 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.390 7.966 -8.538 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.814 6.033 -12.357 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.746 7.317 -8.292 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.965 6.352 -10.203 1.00 0.00 H new ATOM 1082 N ASP A 72 2.128 8.302 -10.373 1.00 0.00 N ATOM 1083 CA ASP A 72 3.516 8.267 -10.818 1.00 0.00 C ATOM 1084 C ASP A 72 4.422 7.705 -9.727 1.00 0.00 C ATOM 1085 O ASP A 72 5.331 6.923 -10.003 1.00 0.00 O ATOM 1086 CB ASP A 72 3.983 9.667 -11.216 1.00 0.00 C ATOM 1087 CG ASP A 72 3.765 10.685 -10.115 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.608 11.117 -9.926 1.00 0.00 O ATOM 1089 OD2 ASP A 72 4.750 11.049 -9.439 1.00 0.00 O ATOM 0 H ASP A 72 1.700 9.228 -10.399 1.00 0.00 H new ATOM 0 HA ASP A 72 3.576 7.613 -11.688 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.042 9.634 -11.472 1.00 0.00 H new ATOM 0 HB3 ASP A 72 3.448 9.984 -12.111 1.00 0.00 H new ATOM 1094 N GLU A 73 4.168 8.112 -8.487 1.00 0.00 N ATOM 1095 CA GLU A 73 4.963 7.651 -7.355 1.00 0.00 C ATOM 1096 C GLU A 73 4.949 6.128 -7.264 1.00 0.00 C ATOM 1097 O GLU A 73 5.988 5.478 -7.384 1.00 0.00 O ATOM 1098 CB GLU A 73 4.434 8.254 -6.052 1.00 0.00 C ATOM 1099 CG GLU A 73 5.065 9.593 -5.701 1.00 0.00 C ATOM 1100 CD GLU A 73 4.422 10.240 -4.490 1.00 0.00 C ATOM 1101 OE1 GLU A 73 3.355 10.870 -4.651 1.00 0.00 O ATOM 1102 OE2 GLU A 73 4.984 10.119 -3.383 1.00 0.00 O ATOM 0 H GLU A 73 3.419 8.759 -8.241 1.00 0.00 H new ATOM 0 HA GLU A 73 5.991 7.980 -7.509 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.354 8.380 -6.132 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.614 7.552 -5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.129 9.451 -5.511 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.981 10.265 -6.555 1.00 0.00 H new ATOM 1109 N PHE A 74 3.764 5.565 -7.051 1.00 0.00 N ATOM 1110 CA PHE A 74 3.614 4.118 -6.942 1.00 0.00 C ATOM 1111 C PHE A 74 4.196 3.417 -8.167 1.00 0.00 C ATOM 1112 O PHE A 74 5.085 2.574 -8.047 1.00 0.00 O ATOM 1113 CB PHE A 74 2.137 3.748 -6.784 1.00 0.00 C ATOM 1114 CG PHE A 74 1.828 3.061 -5.484 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.895 3.592 -4.609 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.471 1.883 -5.140 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.609 2.962 -3.413 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.186 1.247 -3.945 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.255 1.788 -3.080 1.00 0.00 C ATOM 0 H PHE A 74 2.894 6.088 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 74 4.162 3.786 -6.060 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.534 4.653 -6.860 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.843 3.098 -7.608 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.385 4.509 -4.864 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.202 1.457 -5.811 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.120 3.388 -2.739 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.691 0.328 -3.689 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.033 1.294 -2.146 1.00 0.00 H new ATOM 1129 N ILE A 75 3.688 3.773 -9.342 1.00 0.00 N ATOM 1130 CA ILE A 75 4.159 3.179 -10.587 1.00 0.00 C ATOM 1131 C ILE A 75 5.679 3.241 -10.687 1.00 0.00 C ATOM 1132 O ILE A 75 6.325 2.278 -11.100 1.00 0.00 O ATOM 1133 CB ILE A 75 3.546 3.883 -11.813 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.018 3.836 -11.746 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.046 3.239 -13.097 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.341 4.825 -12.667 1.00 0.00 C ATOM 0 H ILE A 75 2.951 4.469 -9.458 1.00 0.00 H new ATOM 0 HA ILE A 75 3.841 2.136 -10.579 1.00 0.00 H new ATOM 0 HB ILE A 75 3.858 4.927 -11.808 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.682 2.830 -11.997 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.701 4.031 -10.721 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.605 3.747 -13.955 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.132 3.321 -13.146 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.760 2.187 -13.112 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.259 4.735 -12.566 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.647 5.837 -12.402 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.628 4.617 -13.698 1.00 0.00 H new ATOM 1148 N LYS A 76 6.245 4.379 -10.303 1.00 0.00 N ATOM 1149 CA LYS A 76 7.691 4.568 -10.344 1.00 0.00 C ATOM 1150 C LYS A 76 8.400 3.524 -9.487 1.00 0.00 C ATOM 1151 O LYS A 76 9.389 2.926 -9.913 1.00 0.00 O ATOM 1152 CB LYS A 76 8.057 5.973 -9.862 1.00 0.00 C ATOM 1153 CG LYS A 76 8.060 7.014 -10.969 1.00 0.00 C ATOM 1154 CD LYS A 76 7.860 8.416 -10.418 1.00 0.00 C ATOM 1155 CE LYS A 76 9.188 9.081 -10.090 1.00 0.00 C ATOM 1156 NZ LYS A 76 9.886 9.560 -11.315 1.00 0.00 N ATOM 0 H LYS A 76 5.724 5.186 -9.959 1.00 0.00 H new ATOM 0 HA LYS A 76 8.019 4.449 -11.377 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.351 6.278 -9.089 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.043 5.944 -9.399 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.004 6.967 -11.511 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.270 6.787 -11.685 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.319 9.021 -11.146 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.243 8.371 -9.520 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.017 9.922 -9.417 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.827 8.374 -9.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.914 9.529 -11.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.636 8.949 -12.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.596 10.537 -11.520 1.00 0.00 H new ATOM 1170 N ILE A 77 7.888 3.310 -8.280 1.00 0.00 N ATOM 1171 CA ILE A 77 8.473 2.337 -7.365 1.00 0.00 C ATOM 1172 C ILE A 77 8.395 0.926 -7.940 1.00 0.00 C ATOM 1173 O ILE A 77 9.286 0.105 -7.721 1.00 0.00 O ATOM 1174 CB ILE A 77 7.770 2.360 -5.994 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.400 3.423 -5.093 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.845 0.989 -5.339 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.080 4.840 -5.515 1.00 0.00 C ATOM 0 H ILE A 77 7.070 3.797 -7.913 1.00 0.00 H new ATOM 0 HA ILE A 77 9.518 2.616 -7.233 1.00 0.00 H new ATOM 0 HB ILE A 77 6.720 2.613 -6.143 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.056 3.271 -4.070 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.482 3.289 -5.089 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.344 1.020 -4.371 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.355 0.254 -5.977 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.889 0.710 -5.198 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.560 5.540 -4.831 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.449 5.010 -6.526 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.001 4.992 -5.492 1.00 0.00 H new ATOM 1189 N PHE A 78 7.325 0.653 -8.679 1.00 0.00 N ATOM 1190 CA PHE A 78 7.130 -0.658 -9.287 1.00 0.00 C ATOM 1191 C PHE A 78 8.136 -0.891 -10.410 1.00 0.00 C ATOM 1192 O PHE A 78 8.677 -1.988 -10.557 1.00 0.00 O ATOM 1193 CB PHE A 78 5.705 -0.786 -9.828 1.00 0.00 C ATOM 1194 CG PHE A 78 4.762 -1.468 -8.878 1.00 0.00 C ATOM 1195 CD1 PHE A 78 3.827 -2.378 -9.342 1.00 0.00 C ATOM 1196 CD2 PHE A 78 4.811 -1.196 -7.519 1.00 0.00 C ATOM 1197 CE1 PHE A 78 2.958 -3.006 -8.470 1.00 0.00 C ATOM 1198 CE2 PHE A 78 3.945 -1.822 -6.643 1.00 0.00 C ATOM 1199 CZ PHE A 78 3.016 -2.727 -7.119 1.00 0.00 C ATOM 0 H PHE A 78 6.580 1.322 -8.871 1.00 0.00 H new ATOM 0 HA PHE A 78 7.288 -1.415 -8.519 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.321 0.208 -10.057 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.729 -1.342 -10.765 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.776 -2.600 -10.398 1.00 0.00 H new ATOM 0 HD2 PHE A 78 5.533 -0.488 -7.141 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.234 -3.714 -8.845 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.994 -1.604 -5.586 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.337 -3.215 -6.436 1.00 0.00 H new ATOM 1209 N HIS A 79 8.382 0.149 -11.201 1.00 0.00 N ATOM 1210 CA HIS A 79 9.323 0.058 -12.312 1.00 0.00 C ATOM 1211 C HIS A 79 10.757 0.250 -11.828 1.00 0.00 C ATOM 1212 O HIS A 79 11.710 -0.088 -12.527 1.00 0.00 O ATOM 1213 CB HIS A 79 8.989 1.103 -13.378 1.00 0.00 C ATOM 1214 CG HIS A 79 8.016 0.617 -14.408 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.406 0.056 -15.605 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.662 0.610 -14.413 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.334 -0.274 -16.304 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.263 0.051 -15.603 1.00 0.00 N ATOM 0 H HIS A 79 7.943 1.064 -11.093 1.00 0.00 H new ATOM 0 HA HIS A 79 9.236 -0.937 -12.748 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.579 1.988 -12.892 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.909 1.410 -13.875 1.00 0.00 H new ATOM 0 HD1 HIS A 79 9.371 -0.083 -15.905 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.016 0.976 -13.628 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.334 -0.732 -17.282 1.00 0.00 H new ATOM 1226 N GLY A 80 10.901 0.796 -10.624 1.00 0.00 N ATOM 1227 CA GLY A 80 12.222 1.024 -10.066 1.00 0.00 C ATOM 1228 C GLY A 80 12.706 -0.141 -9.225 1.00 0.00 C ATOM 1229 O GLY A 80 13.427 -1.011 -9.714 1.00 0.00 O ATOM 0 H GLY A 80 10.127 1.084 -10.025 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.929 1.202 -10.876 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.204 1.926 -9.455 1.00 0.00 H new ATOM 1233 N LEU A 81 12.309 -0.159 -7.958 1.00 0.00 N ATOM 1234 CA LEU A 81 12.708 -1.225 -7.047 1.00 0.00 C ATOM 1235 C LEU A 81 12.413 -2.595 -7.649 1.00 0.00 C ATOM 1236 O LEU A 81 11.324 -2.834 -8.171 1.00 0.00 O ATOM 1237 CB LEU A 81 11.983 -1.077 -5.708 1.00 0.00 C ATOM 1238 CG LEU A 81 12.074 0.298 -5.044 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.182 0.358 -3.814 1.00 0.00 C ATOM 1240 CD2 LEU A 81 13.515 0.619 -4.676 1.00 0.00 C ATOM 0 H LEU A 81 11.711 0.553 -7.538 1.00 0.00 H new ATOM 0 HA LEU A 81 13.782 -1.145 -6.882 1.00 0.00 H new ATOM 0 HB2 LEU A 81 10.930 -1.316 -5.859 1.00 0.00 H new ATOM 0 HB3 LEU A 81 12.383 -1.819 -5.017 1.00 0.00 H new ATOM 0 HG LEU A 81 11.727 1.047 -5.756 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.260 1.344 -3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 81 10.148 0.174 -4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 81 11.498 -0.401 -3.098 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.560 1.601 -4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 81 13.890 -0.134 -3.983 1.00 0.00 H new ATOM 0 HD23 LEU A 81 14.129 0.620 -5.577 1.00 0.00 H new ATOM 1252 N LYS A 82 13.390 -3.492 -7.570 1.00 0.00 N ATOM 1253 CA LYS A 82 13.234 -4.841 -8.104 1.00 0.00 C ATOM 1254 C LYS A 82 12.043 -5.546 -7.463 1.00 0.00 C ATOM 1255 O LYS A 82 11.342 -4.969 -6.632 1.00 0.00 O ATOM 1256 CB LYS A 82 14.510 -5.654 -7.869 1.00 0.00 C ATOM 1257 CG LYS A 82 14.804 -5.912 -6.402 1.00 0.00 C ATOM 1258 CD LYS A 82 16.197 -6.485 -6.205 1.00 0.00 C ATOM 1259 CE LYS A 82 16.250 -7.961 -6.568 1.00 0.00 C ATOM 1260 NZ LYS A 82 15.645 -8.814 -5.508 1.00 0.00 N ATOM 0 H LYS A 82 14.298 -3.310 -7.142 1.00 0.00 H new ATOM 0 HA LYS A 82 13.052 -4.763 -9.176 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.423 -6.609 -8.387 1.00 0.00 H new ATOM 0 HB3 LYS A 82 15.354 -5.126 -8.313 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.710 -4.982 -5.842 1.00 0.00 H new ATOM 0 HG3 LYS A 82 14.065 -6.604 -5.998 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.909 -5.933 -6.819 1.00 0.00 H new ATOM 0 HD3 LYS A 82 16.502 -6.354 -5.167 1.00 0.00 H new ATOM 0 HE2 LYS A 82 15.724 -8.123 -7.509 1.00 0.00 H new ATOM 0 HE3 LYS A 82 17.286 -8.259 -6.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 15.805 -9.816 -5.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 16.084 -8.592 -4.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 14.623 -8.630 -5.456 1.00 0.00 H new ATOM 1274 N SER A 83 11.821 -6.797 -7.854 1.00 0.00 N ATOM 1275 CA SER A 83 10.714 -7.580 -7.319 1.00 0.00 C ATOM 1276 C SER A 83 10.735 -7.578 -5.793 1.00 0.00 C ATOM 1277 O SER A 83 11.528 -8.284 -5.170 1.00 0.00 O ATOM 1278 CB SER A 83 10.780 -9.017 -7.840 1.00 0.00 C ATOM 1279 OG SER A 83 11.367 -9.066 -9.129 1.00 0.00 O ATOM 0 H SER A 83 12.393 -7.290 -8.540 1.00 0.00 H new ATOM 0 HA SER A 83 9.783 -7.123 -7.653 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.359 -9.631 -7.150 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.776 -9.440 -7.878 1.00 0.00 H new ATOM 0 HG SER A 83 11.399 -9.995 -9.439 1.00 0.00 H new ATOM 1285 N THR A 84 9.856 -6.778 -5.196 1.00 0.00 N ATOM 1286 CA THR A 84 9.773 -6.683 -3.744 1.00 0.00 C ATOM 1287 C THR A 84 8.546 -7.414 -3.214 1.00 0.00 C ATOM 1288 O THR A 84 7.691 -7.850 -3.986 1.00 0.00 O ATOM 1289 CB THR A 84 9.723 -5.215 -3.281 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.330 -4.369 -4.264 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.434 -5.043 -1.947 1.00 0.00 C ATOM 0 H THR A 84 9.192 -6.187 -5.696 1.00 0.00 H new ATOM 0 HA THR A 84 10.672 -7.153 -3.344 1.00 0.00 H new ATOM 0 HB THR A 84 8.678 -4.933 -3.156 1.00 0.00 H new ATOM 0 HG1 THR A 84 10.915 -4.904 -4.840 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.385 -3.998 -1.641 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.950 -5.665 -1.194 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.477 -5.343 -2.049 1.00 0.00 H new ATOM 1299 N ASP A 85 8.464 -7.546 -1.895 1.00 0.00 N ATOM 1300 CA ASP A 85 7.339 -8.223 -1.261 1.00 0.00 C ATOM 1301 C ASP A 85 6.111 -7.321 -1.227 1.00 0.00 C ATOM 1302 O ASP A 85 4.997 -7.758 -1.518 1.00 0.00 O ATOM 1303 CB ASP A 85 7.711 -8.655 0.157 1.00 0.00 C ATOM 1304 CG ASP A 85 9.142 -9.145 0.259 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.403 -10.301 -0.137 1.00 0.00 O ATOM 1306 OD2 ASP A 85 10.001 -8.372 0.731 1.00 0.00 O ATOM 0 H ASP A 85 9.164 -7.193 -1.243 1.00 0.00 H new ATOM 0 HA ASP A 85 7.100 -9.108 -1.851 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.568 -7.816 0.838 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.035 -9.447 0.481 1.00 0.00 H new ATOM 1311 N VAL A 86 6.320 -6.058 -0.867 1.00 0.00 N ATOM 1312 CA VAL A 86 5.230 -5.093 -0.794 1.00 0.00 C ATOM 1313 C VAL A 86 4.594 -4.876 -2.163 1.00 0.00 C ATOM 1314 O VAL A 86 3.377 -4.751 -2.281 1.00 0.00 O ATOM 1315 CB VAL A 86 5.715 -3.738 -0.246 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.147 -3.873 1.207 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.851 -3.194 -1.100 1.00 0.00 C ATOM 0 H VAL A 86 7.235 -5.680 -0.621 1.00 0.00 H new ATOM 0 HA VAL A 86 4.487 -5.507 -0.113 1.00 0.00 H new ATOM 0 HB VAL A 86 4.887 -3.031 -0.290 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.487 -2.906 1.577 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.304 -4.215 1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 86 6.961 -4.595 1.279 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.181 -2.236 -0.698 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.683 -3.898 -1.090 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.503 -3.058 -2.124 1.00 0.00 H new ATOM 1327 N ALA A 87 5.430 -4.833 -3.196 1.00 0.00 N ATOM 1328 CA ALA A 87 4.949 -4.634 -4.559 1.00 0.00 C ATOM 1329 C ALA A 87 4.002 -5.753 -4.976 1.00 0.00 C ATOM 1330 O ALA A 87 2.856 -5.503 -5.349 1.00 0.00 O ATOM 1331 CB ALA A 87 6.122 -4.545 -5.523 1.00 0.00 C ATOM 0 H ALA A 87 6.442 -4.933 -3.116 1.00 0.00 H new ATOM 0 HA ALA A 87 4.395 -3.696 -4.590 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.750 -4.397 -6.537 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.759 -3.706 -5.244 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.699 -5.469 -5.480 1.00 0.00 H new ATOM 1337 N LYS A 88 4.487 -6.988 -4.910 1.00 0.00 N ATOM 1338 CA LYS A 88 3.684 -8.147 -5.279 1.00 0.00 C ATOM 1339 C LYS A 88 2.403 -8.208 -4.453 1.00 0.00 C ATOM 1340 O LYS A 88 1.313 -8.408 -4.991 1.00 0.00 O ATOM 1341 CB LYS A 88 4.489 -9.435 -5.087 1.00 0.00 C ATOM 1342 CG LYS A 88 3.783 -10.676 -5.604 1.00 0.00 C ATOM 1343 CD LYS A 88 4.318 -11.936 -4.945 1.00 0.00 C ATOM 1344 CE LYS A 88 3.619 -13.180 -5.471 1.00 0.00 C ATOM 1345 NZ LYS A 88 4.013 -14.400 -4.714 1.00 0.00 N ATOM 0 H LYS A 88 5.434 -7.212 -4.604 1.00 0.00 H new ATOM 0 HA LYS A 88 3.413 -8.049 -6.330 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.447 -9.334 -5.596 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.704 -9.565 -4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.713 -10.592 -5.416 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.912 -10.746 -6.684 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.390 -12.016 -5.126 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.181 -11.869 -3.866 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.539 -13.045 -5.405 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.860 -13.313 -6.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.515 -15.226 -5.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.040 -14.544 -4.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.760 -14.284 -3.712 1.00 0.00 H new ATOM 1359 N THR A 89 2.541 -8.032 -3.143 1.00 0.00 N ATOM 1360 CA THR A 89 1.395 -8.068 -2.242 1.00 0.00 C ATOM 1361 C THR A 89 0.375 -6.997 -2.610 1.00 0.00 C ATOM 1362 O THR A 89 -0.831 -7.204 -2.482 1.00 0.00 O ATOM 1363 CB THR A 89 1.826 -7.868 -0.777 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.711 -8.922 -0.379 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.616 -7.841 0.144 1.00 0.00 C ATOM 0 H THR A 89 3.435 -7.863 -2.682 1.00 0.00 H new ATOM 0 HA THR A 89 0.940 -9.053 -2.348 1.00 0.00 H new ATOM 0 HB THR A 89 2.343 -6.911 -0.700 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.616 -8.729 -0.702 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.945 -7.699 1.173 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.042 -7.021 -0.143 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.076 -8.784 0.063 1.00 0.00 H new ATOM 1373 N PHE A 90 0.866 -5.849 -3.067 1.00 0.00 N ATOM 1374 CA PHE A 90 -0.004 -4.745 -3.454 1.00 0.00 C ATOM 1375 C PHE A 90 -0.813 -5.099 -4.697 1.00 0.00 C ATOM 1376 O PHE A 90 -2.043 -5.122 -4.665 1.00 0.00 O ATOM 1377 CB PHE A 90 0.823 -3.483 -3.710 1.00 0.00 C ATOM 1378 CG PHE A 90 0.038 -2.372 -4.349 1.00 0.00 C ATOM 1379 CD1 PHE A 90 -0.570 -1.400 -3.573 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.091 -2.303 -5.727 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -1.293 -0.377 -4.158 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -0.811 -1.281 -6.318 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.413 -0.318 -5.533 1.00 0.00 C ATOM 0 H PHE A 90 1.862 -5.660 -3.178 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.697 -4.557 -2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.234 -3.130 -2.764 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.668 -3.735 -4.351 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -0.478 -1.441 -2.498 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.376 -3.055 -6.346 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.763 0.375 -3.541 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.902 -1.236 -7.393 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.977 0.480 -5.993 1.00 0.00 H new ATOM 1393 N ARG A 91 -0.112 -5.374 -5.793 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.765 -5.725 -7.049 1.00 0.00 C ATOM 1395 C ARG A 91 -1.770 -6.854 -6.842 1.00 0.00 C ATOM 1396 O ARG A 91 -2.865 -6.835 -7.402 1.00 0.00 O ATOM 1397 CB ARG A 91 0.276 -6.138 -8.090 1.00 0.00 C ATOM 1398 CG ARG A 91 0.116 -5.429 -9.426 1.00 0.00 C ATOM 1399 CD ARG A 91 1.289 -5.711 -10.351 1.00 0.00 C ATOM 1400 NE ARG A 91 1.191 -4.966 -11.603 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.835 -5.307 -12.714 1.00 0.00 C ATOM 1402 NH1 ARG A 91 2.618 -6.377 -12.729 1.00 0.00 N ATOM 1403 NH2 ARG A 91 1.694 -4.578 -13.814 1.00 0.00 N ATOM 0 H ARG A 91 0.907 -5.360 -5.836 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.301 -4.847 -7.410 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.272 -5.934 -7.697 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.211 -7.214 -8.249 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.810 -5.752 -9.902 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.031 -4.355 -9.261 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.219 -5.450 -9.846 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.332 -6.779 -10.567 1.00 0.00 H new ATOM 0 HE ARG A 91 0.595 -4.138 -11.626 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.727 -6.941 -11.886 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.111 -6.636 -13.583 1.00 0.00 H new ATOM 0 HH21 ARG A 91 1.091 -3.755 -13.807 1.00 0.00 H new ATOM 0 HH22 ARG A 91 2.189 -4.840 -14.667 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.388 -7.838 -6.035 1.00 0.00 N ATOM 1418 CA LYS A 92 -2.253 -8.977 -5.753 1.00 0.00 C ATOM 1419 C LYS A 92 -3.436 -8.559 -4.884 1.00 0.00 C ATOM 1420 O LYS A 92 -4.590 -8.669 -5.296 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.462 -10.086 -5.057 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.901 -11.125 -6.013 1.00 0.00 C ATOM 1423 CD LYS A 92 -1.345 -12.528 -5.634 1.00 0.00 C ATOM 1424 CE LYS A 92 -0.644 -13.015 -4.375 1.00 0.00 C ATOM 1425 NZ LYS A 92 -0.871 -14.468 -4.141 1.00 0.00 N ATOM 0 H LYS A 92 -0.484 -7.869 -5.564 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.636 -9.354 -6.701 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.641 -9.639 -4.497 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.108 -10.582 -4.333 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.228 -10.901 -7.028 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.188 -11.074 -6.010 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.424 -12.539 -5.478 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.134 -13.212 -6.456 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.426 -12.823 -4.458 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.004 -12.448 -3.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.377 -14.761 -3.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.890 -14.648 -4.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.505 -15.011 -4.949 1.00 0.00 H new ATOM 1439 N ALA A 93 -3.139 -8.080 -3.680 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.177 -7.642 -2.755 1.00 0.00 C ATOM 1441 C ALA A 93 -5.139 -6.669 -3.429 1.00 0.00 C ATOM 1442 O ALA A 93 -6.349 -6.897 -3.457 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.553 -7.002 -1.525 1.00 0.00 C ATOM 0 H ALA A 93 -2.188 -7.986 -3.323 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.746 -8.519 -2.446 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.340 -6.680 -0.843 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.913 -7.727 -1.023 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.958 -6.140 -1.826 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.594 -5.586 -3.971 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.404 -4.578 -4.645 1.00 0.00 C ATOM 1451 C ILE A 94 -6.295 -5.211 -5.709 1.00 0.00 C ATOM 1452 O ILE A 94 -7.368 -4.698 -6.018 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.526 -3.498 -5.304 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.208 -2.132 -5.212 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.241 -3.858 -6.753 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.388 -1.096 -4.475 1.00 0.00 C ATOM 0 H ILE A 94 -3.594 -5.383 -3.957 1.00 0.00 H new ATOM 0 HA ILE A 94 -6.027 -4.112 -3.882 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.577 -3.446 -4.771 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.416 -1.770 -6.219 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.169 -2.248 -4.710 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.619 -3.085 -7.205 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.719 -4.814 -6.794 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.180 -3.934 -7.301 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.933 -0.152 -4.448 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.202 -1.437 -3.456 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.437 -0.952 -4.989 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.841 -6.331 -6.262 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.598 -7.037 -7.290 1.00 0.00 C ATOM 1470 C ASN A 95 -7.810 -7.740 -6.688 1.00 0.00 C ATOM 1471 O ASN A 95 -8.954 -7.388 -6.979 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.705 -8.055 -8.002 1.00 0.00 C ATOM 1473 CG ASN A 95 -5.459 -7.694 -9.453 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -6.188 -8.127 -10.346 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -4.427 -6.895 -9.697 1.00 0.00 N ATOM 0 H ASN A 95 -4.953 -6.769 -6.016 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.950 -6.303 -8.015 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.750 -8.124 -7.481 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.168 -9.040 -7.949 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.212 -6.617 -10.655 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.849 -6.559 -8.927 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.552 -8.734 -5.845 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.621 -9.486 -5.199 1.00 0.00 C ATOM 1484 C LYS A 96 -9.575 -8.552 -4.461 1.00 0.00 C ATOM 1485 O LYS A 96 -10.781 -8.797 -4.405 1.00 0.00 O ATOM 1486 CB LYS A 96 -8.035 -10.508 -4.222 1.00 0.00 C ATOM 1487 CG LYS A 96 -7.213 -9.883 -3.108 1.00 0.00 C ATOM 1488 CD LYS A 96 -6.518 -10.941 -2.267 1.00 0.00 C ATOM 1489 CE LYS A 96 -7.493 -11.637 -1.330 1.00 0.00 C ATOM 1490 NZ LYS A 96 -7.098 -13.049 -1.068 1.00 0.00 N ATOM 0 H LYS A 96 -6.611 -9.038 -5.593 1.00 0.00 H new ATOM 0 HA LYS A 96 -9.181 -10.011 -5.973 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -8.848 -11.085 -3.782 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -7.409 -11.209 -4.774 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -6.469 -9.211 -3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.860 -9.279 -2.472 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.051 -11.678 -2.920 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -5.720 -10.479 -1.686 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.542 -11.093 -0.387 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.493 -11.614 -1.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -7.787 -13.489 -0.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -7.076 -13.575 -1.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -6.155 -13.070 -0.631 1.00 0.00 H new ATOM 1504 N LYS A 97 -9.028 -7.480 -3.898 1.00 0.00 N ATOM 1505 CA LYS A 97 -9.830 -6.507 -3.166 1.00 0.00 C ATOM 1506 C LYS A 97 -9.762 -5.136 -3.830 1.00 0.00 C ATOM 1507 O LYS A 97 -10.558 -4.263 -3.490 1.00 0.00 O ATOM 1508 CB LYS A 97 -9.351 -6.408 -1.715 1.00 0.00 C ATOM 1509 CG LYS A 97 -10.363 -5.766 -0.783 1.00 0.00 C ATOM 1510 CD LYS A 97 -11.560 -6.673 -0.549 1.00 0.00 C ATOM 1511 CE LYS A 97 -11.163 -7.935 0.201 1.00 0.00 C ATOM 1512 NZ LYS A 97 -12.300 -8.497 0.981 1.00 0.00 N ATOM 0 H LYS A 97 -8.032 -7.263 -3.935 1.00 0.00 H new ATOM 0 HA LYS A 97 -10.866 -6.845 -3.178 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.116 -7.408 -1.350 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.426 -5.832 -1.685 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.887 -5.537 0.170 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -10.700 -4.820 -1.206 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -12.320 -6.135 0.018 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -12.007 -6.942 -1.506 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.805 -8.681 -0.508 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.335 -7.712 0.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.989 -9.356 1.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -12.626 -7.794 1.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -13.080 -8.734 0.336 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.746 8.047 -1.681 1.00 0.00 CA HETATM 1528 CA CA A 102 3.950 12.825 -2.367 1.00 0.00 CA