USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 808 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 29 CYS SG : rot 180:sc= 0.268 USER MOD Set 1.2: A 32 CYS SG : rot 71:sc= -0.486 USER MOD Set 2.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 66 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 LYS NZ :NH3+ 161:sc= 1.07 (180deg=0.797) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -89:sc= 1.26 USER MOD Single : A 16 SER OG : rot 95:sc= 1.32 USER MOD Single : A 33 LYS NZ :NH3+ -166:sc= 0.899 (180deg=0.78) USER MOD Single : A 34 MET CE :methyl 174:sc= 0 (180deg=-0.0368) USER MOD Single : A 44 GLN : amide:sc= 0.781 K(o=0.78,f=-0.15) USER MOD Single : A 46 MET CE :methyl 178:sc= 0 (180deg=-0.0111) USER MOD Single : A 49 LYS NZ :NH3+ -149:sc= 0.945 (180deg=0.416) USER MOD Single : A 51 LYS NZ :NH3+ -174:sc= 3.62 (180deg=3.39) USER MOD Single : A 54 LYS NZ :NH3+ 166:sc= 1.23 (180deg=1.22) USER MOD Single : A 60 ASN : amide:sc= 1.46 K(o=1.5,f=-6.5!) USER MOD Single : A 61 GLN : amide:sc= -1.14! C(o=-1.1!,f=-2.3!) USER MOD Single : A 63 THR OG1 : rot -44:sc= 1.07 USER MOD Single : A 67 TYR OH : rot -162:sc= 0.154 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 131:sc= 1.29 USER MOD Single : A 79 LYS NZ :NH3+ -165:sc= 1.19 (180deg=1) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -168:sc= 2.31 (180deg=1.78) USER MOD Single : A 93 LYS NZ :NH3+ 164:sc= 2.44 (180deg=2.31) USER MOD Single : A 97 GLN : amide:sc= -0.0013 K(o=-0.0013,f=-0.58) USER MOD Single : A 101 ASN : amide:sc= 1.2 K(o=1.2,f=-0.034) USER MOD Single : A 102 LYS NZ :NH3+ -161:sc= 1.27 (180deg=1.13) USER MOD Single : A 103 HIS : no HE2:sc= 0 X(o=0,f=-0.43) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.343 -1.854 0.760 1.00 0.00 N ATOM 2 CA MET A 1 2.787 -1.369 -0.527 1.00 0.00 C ATOM 3 C MET A 1 2.656 -2.549 -1.500 1.00 0.00 C ATOM 4 O MET A 1 3.617 -2.912 -2.185 1.00 0.00 O ATOM 5 CB MET A 1 3.631 -0.202 -1.090 1.00 0.00 C ATOM 6 CG MET A 1 3.106 0.364 -2.418 1.00 0.00 C ATOM 7 SD MET A 1 4.023 1.817 -3.006 1.00 0.00 S ATOM 8 CE MET A 1 3.156 3.131 -2.108 1.00 0.00 C ATOM 0 H1 MET A 1 3.433 -1.057 1.422 1.00 0.00 H new ATOM 0 H2 MET A 1 2.707 -2.570 1.165 1.00 0.00 H new ATOM 0 H3 MET A 1 4.280 -2.276 0.597 1.00 0.00 H new ATOM 0 HA MET A 1 1.788 -0.961 -0.371 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.662 0.600 -0.352 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.656 -0.544 -1.232 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.152 -0.416 -3.178 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.056 0.632 -2.299 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.598 4.095 -2.358 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.103 3.131 -2.390 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.245 2.958 -1.035 1.00 0.00 H new ATOM 20 N ALA A 2 1.476 -3.176 -1.532 1.00 0.00 N ATOM 21 CA ALA A 2 1.094 -4.233 -2.463 1.00 0.00 C ATOM 22 C ALA A 2 -0.432 -4.268 -2.534 1.00 0.00 C ATOM 23 O ALA A 2 -1.122 -3.800 -1.621 1.00 0.00 O ATOM 24 CB ALA A 2 1.625 -5.591 -1.976 1.00 0.00 C ATOM 0 H ALA A 2 0.729 -2.947 -0.877 1.00 0.00 H new ATOM 0 HA ALA A 2 1.518 -4.036 -3.447 1.00 0.00 H new ATOM 0 HB1 ALA A 2 1.332 -6.370 -2.680 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.712 -5.553 -1.908 1.00 0.00 H new ATOM 0 HB3 ALA A 2 1.207 -5.814 -0.994 1.00 0.00 H new ATOM 30 N ILE A 3 -0.950 -4.859 -3.608 1.00 0.00 N ATOM 31 CA ILE A 3 -2.377 -5.010 -3.846 1.00 0.00 C ATOM 32 C ILE A 3 -2.896 -6.117 -2.918 1.00 0.00 C ATOM 33 O ILE A 3 -2.180 -7.071 -2.595 1.00 0.00 O ATOM 34 CB ILE A 3 -2.577 -5.301 -5.353 1.00 0.00 C ATOM 35 CG1 ILE A 3 -2.136 -4.049 -6.146 1.00 0.00 C ATOM 36 CG2 ILE A 3 -4.022 -5.695 -5.708 1.00 0.00 C ATOM 37 CD1 ILE A 3 -2.175 -4.205 -7.662 1.00 0.00 C ATOM 0 H ILE A 3 -0.374 -5.254 -4.351 1.00 0.00 H new ATOM 0 HA ILE A 3 -2.950 -4.112 -3.617 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.967 -6.164 -5.621 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.777 -3.214 -5.864 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.121 -3.787 -5.848 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.095 -5.886 -6.779 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.299 -6.595 -5.160 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.697 -4.883 -5.437 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.849 -3.277 -8.132 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.511 -5.016 -7.962 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.193 -4.434 -7.978 1.00 0.00 H new ATOM 49 N VAL A 4 -4.156 -6.001 -2.514 1.00 0.00 N ATOM 50 CA VAL A 4 -4.822 -6.857 -1.540 1.00 0.00 C ATOM 51 C VAL A 4 -5.834 -7.710 -2.314 1.00 0.00 C ATOM 52 O VAL A 4 -6.105 -7.466 -3.492 1.00 0.00 O ATOM 53 CB VAL A 4 -5.428 -5.955 -0.433 1.00 0.00 C ATOM 54 CG1 VAL A 4 -6.113 -6.716 0.713 1.00 0.00 C ATOM 55 CG2 VAL A 4 -4.334 -5.066 0.192 1.00 0.00 C ATOM 0 H VAL A 4 -4.771 -5.271 -2.875 1.00 0.00 H new ATOM 0 HA VAL A 4 -4.154 -7.546 -1.023 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.193 -5.370 -0.944 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.506 -6.004 1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -6.931 -7.316 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -5.389 -7.368 1.201 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -4.774 -4.438 0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.560 -5.696 0.631 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -3.894 -4.434 -0.580 1.00 0.00 H new ATOM 65 N LYS A 5 -6.376 -8.747 -1.682 1.00 0.00 N ATOM 66 CA LYS A 5 -7.292 -9.701 -2.296 1.00 0.00 C ATOM 67 C LYS A 5 -8.377 -9.977 -1.269 1.00 0.00 C ATOM 68 O LYS A 5 -8.059 -10.115 -0.084 1.00 0.00 O ATOM 69 CB LYS A 5 -6.560 -11.004 -2.688 1.00 0.00 C ATOM 70 CG LYS A 5 -5.418 -10.822 -3.706 1.00 0.00 C ATOM 71 CD LYS A 5 -4.033 -10.585 -3.076 1.00 0.00 C ATOM 72 CE LYS A 5 -3.041 -10.129 -4.155 1.00 0.00 C ATOM 73 NZ LYS A 5 -1.732 -9.719 -3.584 1.00 0.00 N ATOM 0 H LYS A 5 -6.184 -8.952 -0.701 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.715 -9.297 -3.216 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.154 -11.462 -1.786 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -7.288 -11.703 -3.100 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.368 -11.708 -4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.657 -9.979 -4.355 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.104 -9.831 -2.293 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.676 -11.501 -2.605 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.886 -10.939 -4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.470 -9.294 -4.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.009 -9.730 -4.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.810 -8.759 -3.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.460 -10.380 -2.829 1.00 0.00 H new ATOM 87 N ALA A 6 -9.637 -10.041 -1.696 1.00 0.00 N ATOM 88 CA ALA A 6 -10.765 -10.292 -0.806 1.00 0.00 C ATOM 89 C ALA A 6 -11.879 -11.043 -1.537 1.00 0.00 C ATOM 90 O ALA A 6 -11.833 -11.219 -2.757 1.00 0.00 O ATOM 91 CB ALA A 6 -11.282 -8.965 -0.233 1.00 0.00 C ATOM 0 H ALA A 6 -9.903 -9.920 -2.673 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.429 -10.921 0.018 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.124 -9.159 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -10.485 -8.475 0.326 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -11.604 -8.318 -1.048 1.00 0.00 H new ATOM 97 N THR A 7 -12.885 -11.475 -0.779 1.00 0.00 N ATOM 98 CA THR A 7 -14.008 -12.275 -1.239 1.00 0.00 C ATOM 99 C THR A 7 -15.279 -11.700 -0.607 1.00 0.00 C ATOM 100 O THR A 7 -15.185 -10.859 0.288 1.00 0.00 O ATOM 101 CB THR A 7 -13.773 -13.745 -0.828 1.00 0.00 C ATOM 102 OG1 THR A 7 -13.477 -13.819 0.557 1.00 0.00 O ATOM 103 CG2 THR A 7 -12.616 -14.386 -1.602 1.00 0.00 C ATOM 0 H THR A 7 -12.938 -11.265 0.218 1.00 0.00 H new ATOM 0 HA THR A 7 -14.111 -12.247 -2.324 1.00 0.00 H new ATOM 0 HB THR A 7 -14.689 -14.288 -1.060 1.00 0.00 H new ATOM 0 HG1 THR A 7 -13.331 -14.754 0.811 1.00 0.00 H new ATOM 0 HG21 THR A 7 -12.490 -15.419 -1.278 1.00 0.00 H new ATOM 0 HG22 THR A 7 -12.836 -14.365 -2.669 1.00 0.00 H new ATOM 0 HG23 THR A 7 -11.698 -13.831 -1.410 1.00 0.00 H new ATOM 111 N ASP A 8 -16.462 -12.184 -0.988 1.00 0.00 N ATOM 112 CA ASP A 8 -17.754 -11.778 -0.417 1.00 0.00 C ATOM 113 C ASP A 8 -17.767 -11.838 1.115 1.00 0.00 C ATOM 114 O ASP A 8 -18.502 -11.102 1.773 1.00 0.00 O ATOM 115 CB ASP A 8 -18.864 -12.704 -0.933 1.00 0.00 C ATOM 116 CG ASP A 8 -20.242 -12.126 -0.579 1.00 0.00 C ATOM 117 OD1 ASP A 8 -20.588 -11.056 -1.131 1.00 0.00 O ATOM 118 OD2 ASP A 8 -20.978 -12.748 0.221 1.00 0.00 O ATOM 0 H ASP A 8 -16.554 -12.887 -1.721 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.920 -10.746 -0.725 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -18.777 -12.822 -2.013 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -18.754 -13.696 -0.495 1.00 0.00 H new ATOM 123 N GLN A 9 -16.929 -12.717 1.673 1.00 0.00 N ATOM 124 CA GLN A 9 -16.798 -12.957 3.095 1.00 0.00 C ATOM 125 C GLN A 9 -16.254 -11.727 3.842 1.00 0.00 C ATOM 126 O GLN A 9 -16.652 -11.510 4.991 1.00 0.00 O ATOM 127 CB GLN A 9 -15.899 -14.187 3.328 1.00 0.00 C ATOM 128 CG GLN A 9 -16.172 -15.403 2.412 1.00 0.00 C ATOM 129 CD GLN A 9 -17.646 -15.822 2.312 1.00 0.00 C ATOM 130 OE1 GLN A 9 -18.373 -15.862 3.302 1.00 0.00 O ATOM 131 NE2 GLN A 9 -18.123 -16.144 1.116 1.00 0.00 N ATOM 0 H GLN A 9 -16.303 -13.299 1.116 1.00 0.00 H new ATOM 0 HA GLN A 9 -17.791 -13.153 3.500 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -14.860 -13.884 3.198 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -16.011 -14.504 4.365 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -15.806 -15.174 1.411 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.593 -16.251 2.777 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -17.515 -16.109 0.298 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -19.098 -16.427 1.015 1.00 0.00 H new ATOM 140 N SER A 10 -15.387 -10.920 3.210 1.00 0.00 N ATOM 141 CA SER A 10 -14.671 -9.836 3.897 1.00 0.00 C ATOM 142 C SER A 10 -14.464 -8.566 3.067 1.00 0.00 C ATOM 143 O SER A 10 -14.004 -7.564 3.614 1.00 0.00 O ATOM 144 CB SER A 10 -13.309 -10.353 4.395 1.00 0.00 C ATOM 145 OG SER A 10 -13.424 -11.572 5.117 1.00 0.00 O ATOM 0 H SER A 10 -15.165 -11.000 2.218 1.00 0.00 H new ATOM 0 HA SER A 10 -15.315 -9.541 4.726 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.645 -10.500 3.543 1.00 0.00 H new ATOM 0 HB3 SER A 10 -12.848 -9.598 5.032 1.00 0.00 H new ATOM 0 HG SER A 10 -12.536 -11.863 5.412 1.00 0.00 H new ATOM 151 N PHE A 11 -14.828 -8.554 1.782 1.00 0.00 N ATOM 152 CA PHE A 11 -14.690 -7.395 0.903 1.00 0.00 C ATOM 153 C PHE A 11 -15.364 -6.160 1.503 1.00 0.00 C ATOM 154 O PHE A 11 -14.845 -5.050 1.375 1.00 0.00 O ATOM 155 CB PHE A 11 -15.287 -7.745 -0.468 1.00 0.00 C ATOM 156 CG PHE A 11 -15.179 -6.660 -1.520 1.00 0.00 C ATOM 157 CD1 PHE A 11 -14.023 -6.575 -2.319 1.00 0.00 C ATOM 158 CD2 PHE A 11 -16.241 -5.759 -1.733 1.00 0.00 C ATOM 159 CE1 PHE A 11 -13.931 -5.605 -3.329 1.00 0.00 C ATOM 160 CE2 PHE A 11 -16.148 -4.793 -2.750 1.00 0.00 C ATOM 161 CZ PHE A 11 -15.001 -4.722 -3.553 1.00 0.00 C ATOM 0 H PHE A 11 -15.234 -9.366 1.317 1.00 0.00 H new ATOM 0 HA PHE A 11 -13.634 -7.151 0.787 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -14.792 -8.641 -0.843 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -16.340 -7.994 -0.334 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -13.204 -7.259 -2.154 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -17.126 -5.810 -1.116 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -13.039 -5.537 -3.934 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -16.963 -4.103 -2.913 1.00 0.00 H new ATOM 0 HZ PHE A 11 -14.940 -3.989 -4.344 1.00 0.00 H new ATOM 171 N SER A 12 -16.487 -6.341 2.202 1.00 0.00 N ATOM 172 CA SER A 12 -17.223 -5.237 2.792 1.00 0.00 C ATOM 173 C SER A 12 -16.423 -4.577 3.916 1.00 0.00 C ATOM 174 O SER A 12 -16.373 -3.352 3.999 1.00 0.00 O ATOM 175 CB SER A 12 -18.577 -5.743 3.305 1.00 0.00 C ATOM 176 OG SER A 12 -19.207 -6.592 2.354 1.00 0.00 O ATOM 0 H SER A 12 -16.905 -7.256 2.371 1.00 0.00 H new ATOM 0 HA SER A 12 -17.393 -4.478 2.028 1.00 0.00 H new ATOM 0 HB2 SER A 12 -18.434 -6.284 4.240 1.00 0.00 H new ATOM 0 HB3 SER A 12 -19.225 -4.894 3.524 1.00 0.00 H new ATOM 0 HG SER A 12 -20.067 -6.900 2.709 1.00 0.00 H new ATOM 182 N ALA A 13 -15.762 -5.376 4.758 1.00 0.00 N ATOM 183 CA ALA A 13 -14.907 -4.865 5.815 1.00 0.00 C ATOM 184 C ALA A 13 -13.680 -4.188 5.203 1.00 0.00 C ATOM 185 O ALA A 13 -13.301 -3.092 5.617 1.00 0.00 O ATOM 186 CB ALA A 13 -14.490 -6.004 6.753 1.00 0.00 C ATOM 0 H ALA A 13 -15.809 -6.394 4.720 1.00 0.00 H new ATOM 0 HA ALA A 13 -15.457 -4.127 6.399 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -13.849 -5.610 7.542 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -15.378 -6.453 7.198 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.946 -6.760 6.187 1.00 0.00 H new ATOM 192 N GLU A 14 -13.080 -4.823 4.193 1.00 0.00 N ATOM 193 CA GLU A 14 -11.867 -4.341 3.548 1.00 0.00 C ATOM 194 C GLU A 14 -12.097 -2.985 2.892 1.00 0.00 C ATOM 195 O GLU A 14 -11.227 -2.119 2.970 1.00 0.00 O ATOM 196 CB GLU A 14 -11.375 -5.364 2.510 1.00 0.00 C ATOM 197 CG GLU A 14 -10.724 -6.589 3.169 1.00 0.00 C ATOM 198 CD GLU A 14 -9.383 -6.293 3.871 1.00 0.00 C ATOM 199 OE1 GLU A 14 -8.755 -5.245 3.594 1.00 0.00 O ATOM 200 OE2 GLU A 14 -8.951 -7.117 4.709 1.00 0.00 O ATOM 0 H GLU A 14 -13.431 -5.696 3.799 1.00 0.00 H new ATOM 0 HA GLU A 14 -11.100 -4.218 4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.214 -5.687 1.894 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.656 -4.887 1.844 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.418 -7.007 3.898 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -10.562 -7.353 2.409 1.00 0.00 H new ATOM 207 N THR A 15 -13.261 -2.764 2.284 1.00 0.00 N ATOM 208 CA THR A 15 -13.564 -1.518 1.598 1.00 0.00 C ATOM 209 C THR A 15 -14.021 -0.407 2.562 1.00 0.00 C ATOM 210 O THR A 15 -14.325 0.700 2.110 1.00 0.00 O ATOM 211 CB THR A 15 -14.547 -1.793 0.447 1.00 0.00 C ATOM 212 OG1 THR A 15 -15.670 -2.540 0.865 1.00 0.00 O ATOM 213 CG2 THR A 15 -13.862 -2.559 -0.695 1.00 0.00 C ATOM 0 H THR A 15 -14.018 -3.447 2.255 1.00 0.00 H new ATOM 0 HA THR A 15 -12.648 -1.122 1.158 1.00 0.00 H new ATOM 0 HB THR A 15 -14.881 -0.815 0.100 1.00 0.00 H new ATOM 0 HG1 THR A 15 -15.476 -3.497 0.781 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.581 -2.739 -1.494 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.030 -1.970 -1.081 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.488 -3.512 -0.321 1.00 0.00 H new ATOM 221 N SER A 16 -14.023 -0.659 3.878 1.00 0.00 N ATOM 222 CA SER A 16 -14.629 0.212 4.885 1.00 0.00 C ATOM 223 C SER A 16 -13.606 0.701 5.918 1.00 0.00 C ATOM 224 O SER A 16 -13.923 0.836 7.101 1.00 0.00 O ATOM 225 CB SER A 16 -15.842 -0.485 5.517 1.00 0.00 C ATOM 226 OG SER A 16 -16.803 -0.821 4.536 1.00 0.00 O ATOM 0 H SER A 16 -13.593 -1.493 4.277 1.00 0.00 H new ATOM 0 HA SER A 16 -14.989 1.116 4.394 1.00 0.00 H new ATOM 0 HB2 SER A 16 -15.518 -1.387 6.037 1.00 0.00 H new ATOM 0 HB3 SER A 16 -16.293 0.169 6.264 1.00 0.00 H new ATOM 0 HG SER A 16 -16.668 -1.748 4.250 1.00 0.00 H new ATOM 232 N GLU A 17 -12.374 0.975 5.477 1.00 0.00 N ATOM 233 CA GLU A 17 -11.314 1.512 6.338 1.00 0.00 C ATOM 234 C GLU A 17 -10.415 2.544 5.627 1.00 0.00 C ATOM 235 O GLU A 17 -9.359 2.904 6.152 1.00 0.00 O ATOM 236 CB GLU A 17 -10.511 0.354 6.964 1.00 0.00 C ATOM 237 CG GLU A 17 -9.870 -0.584 5.930 1.00 0.00 C ATOM 238 CD GLU A 17 -8.802 -1.511 6.535 1.00 0.00 C ATOM 239 OE1 GLU A 17 -8.984 -2.053 7.649 1.00 0.00 O ATOM 240 OE2 GLU A 17 -7.777 -1.738 5.852 1.00 0.00 O ATOM 0 H GLU A 17 -12.083 0.830 4.510 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.791 2.073 7.142 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.728 0.768 7.600 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.171 -0.227 7.608 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.648 -1.190 5.467 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.418 0.013 5.138 1.00 0.00 H new ATOM 247 N GLY A 18 -10.805 3.037 4.445 1.00 0.00 N ATOM 248 CA GLY A 18 -10.029 4.031 3.710 1.00 0.00 C ATOM 249 C GLY A 18 -10.631 4.316 2.354 1.00 0.00 C ATOM 250 O GLY A 18 -11.781 3.953 2.099 1.00 0.00 O ATOM 0 H GLY A 18 -11.666 2.756 3.976 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.979 4.954 4.288 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.006 3.676 3.587 1.00 0.00 H new ATOM 254 N VAL A 19 -9.867 4.989 1.496 1.00 0.00 N ATOM 255 CA VAL A 19 -10.203 5.102 0.091 1.00 0.00 C ATOM 256 C VAL A 19 -9.733 3.765 -0.492 1.00 0.00 C ATOM 257 O VAL A 19 -8.578 3.376 -0.283 1.00 0.00 O ATOM 258 CB VAL A 19 -9.490 6.313 -0.550 1.00 0.00 C ATOM 259 CG1 VAL A 19 -10.263 6.774 -1.798 1.00 0.00 C ATOM 260 CG2 VAL A 19 -9.343 7.531 0.380 1.00 0.00 C ATOM 0 H VAL A 19 -9.005 5.466 1.759 1.00 0.00 H new ATOM 0 HA VAL A 19 -11.263 5.278 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 19 -8.487 5.959 -0.790 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.755 7.628 -2.246 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -10.307 5.959 -2.520 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -11.275 7.062 -1.513 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.832 8.334 -0.151 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.330 7.872 0.691 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -8.763 7.250 1.259 1.00 0.00 H new ATOM 270 N VAL A 20 -10.608 3.026 -1.167 1.00 0.00 N ATOM 271 CA VAL A 20 -10.309 1.673 -1.609 1.00 0.00 C ATOM 272 C VAL A 20 -10.818 1.525 -3.036 1.00 0.00 C ATOM 273 O VAL A 20 -12.009 1.678 -3.309 1.00 0.00 O ATOM 274 CB VAL A 20 -10.903 0.622 -0.642 1.00 0.00 C ATOM 275 CG1 VAL A 20 -10.421 -0.783 -1.029 1.00 0.00 C ATOM 276 CG2 VAL A 20 -10.497 0.867 0.823 1.00 0.00 C ATOM 0 H VAL A 20 -11.541 3.349 -1.421 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.234 1.494 -1.599 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.986 0.708 -0.725 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.845 -1.515 -0.342 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.742 -1.011 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.333 -0.822 -0.975 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.942 0.100 1.457 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.411 0.826 0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.850 1.849 1.139 1.00 0.00 H new ATOM 286 N LEU A 21 -9.891 1.249 -3.948 1.00 0.00 N ATOM 287 CA LEU A 21 -10.190 0.829 -5.304 1.00 0.00 C ATOM 288 C LEU A 21 -10.317 -0.693 -5.235 1.00 0.00 C ATOM 289 O LEU A 21 -9.624 -1.359 -4.465 1.00 0.00 O ATOM 290 CB LEU A 21 -9.028 1.260 -6.222 1.00 0.00 C ATOM 291 CG LEU A 21 -8.998 0.685 -7.653 1.00 0.00 C ATOM 292 CD1 LEU A 21 -10.197 1.119 -8.498 1.00 0.00 C ATOM 293 CD2 LEU A 21 -7.727 1.167 -8.363 1.00 0.00 C ATOM 0 H LEU A 21 -8.891 1.314 -3.756 1.00 0.00 H new ATOM 0 HA LEU A 21 -11.102 1.273 -5.704 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -9.045 2.347 -6.297 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.093 0.989 -5.731 1.00 0.00 H new ATOM 0 HG LEU A 21 -9.027 -0.400 -7.555 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -10.118 0.682 -9.493 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.118 0.779 -8.025 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.211 2.206 -8.579 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.700 0.764 -9.375 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.725 2.256 -8.406 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -6.851 0.824 -7.813 1.00 0.00 H new ATOM 305 N ALA A 22 -11.175 -1.260 -6.063 1.00 0.00 N ATOM 306 CA ALA A 22 -11.375 -2.683 -6.193 1.00 0.00 C ATOM 307 C ALA A 22 -11.436 -3.005 -7.679 1.00 0.00 C ATOM 308 O ALA A 22 -11.814 -2.153 -8.485 1.00 0.00 O ATOM 309 CB ALA A 22 -12.671 -3.079 -5.484 1.00 0.00 C ATOM 0 H ALA A 22 -11.773 -0.716 -6.686 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.561 -3.244 -5.733 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.825 -4.154 -5.581 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.603 -2.815 -4.428 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.510 -2.550 -5.937 1.00 0.00 H new ATOM 315 N ASP A 23 -11.086 -4.236 -8.026 1.00 0.00 N ATOM 316 CA ASP A 23 -10.987 -4.727 -9.394 1.00 0.00 C ATOM 317 C ASP A 23 -11.676 -6.090 -9.423 1.00 0.00 C ATOM 318 O ASP A 23 -11.126 -7.093 -8.952 1.00 0.00 O ATOM 319 CB ASP A 23 -9.516 -4.825 -9.817 1.00 0.00 C ATOM 320 CG ASP A 23 -9.339 -5.585 -11.144 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.176 -5.426 -12.059 1.00 0.00 O ATOM 322 OD2 ASP A 23 -8.320 -6.302 -11.271 1.00 0.00 O ATOM 0 H ASP A 23 -10.854 -4.949 -7.334 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.469 -4.049 -10.099 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.102 -3.822 -9.917 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.948 -5.328 -9.034 1.00 0.00 H new ATOM 327 N PHE A 24 -12.928 -6.085 -9.880 1.00 0.00 N ATOM 328 CA PHE A 24 -13.692 -7.277 -10.196 1.00 0.00 C ATOM 329 C PHE A 24 -13.150 -7.822 -11.515 1.00 0.00 C ATOM 330 O PHE A 24 -13.232 -7.141 -12.546 1.00 0.00 O ATOM 331 CB PHE A 24 -15.193 -6.962 -10.278 1.00 0.00 C ATOM 332 CG PHE A 24 -15.868 -6.905 -8.921 1.00 0.00 C ATOM 333 CD1 PHE A 24 -16.236 -8.104 -8.277 1.00 0.00 C ATOM 334 CD2 PHE A 24 -16.090 -5.672 -8.278 1.00 0.00 C ATOM 335 CE1 PHE A 24 -16.829 -8.072 -7.004 1.00 0.00 C ATOM 336 CE2 PHE A 24 -16.676 -5.643 -6.998 1.00 0.00 C ATOM 337 CZ PHE A 24 -17.041 -6.842 -6.362 1.00 0.00 C ATOM 0 H PHE A 24 -13.448 -5.223 -10.043 1.00 0.00 H new ATOM 0 HA PHE A 24 -13.585 -8.027 -9.412 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.330 -6.007 -10.785 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.684 -7.720 -10.889 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -16.061 -9.052 -8.765 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -15.811 -4.750 -8.766 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -17.121 -8.992 -6.520 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -16.845 -4.698 -6.504 1.00 0.00 H new ATOM 0 HZ PHE A 24 -17.485 -6.817 -5.378 1.00 0.00 H new ATOM 347 N TRP A 25 -12.596 -9.036 -11.476 1.00 0.00 N ATOM 348 CA TRP A 25 -11.851 -9.617 -12.590 1.00 0.00 C ATOM 349 C TRP A 25 -12.059 -11.134 -12.665 1.00 0.00 C ATOM 350 O TRP A 25 -12.777 -11.708 -11.841 1.00 0.00 O ATOM 351 CB TRP A 25 -10.354 -9.284 -12.419 1.00 0.00 C ATOM 352 CG TRP A 25 -9.600 -10.115 -11.421 1.00 0.00 C ATOM 353 CD1 TRP A 25 -9.785 -10.096 -10.084 1.00 0.00 C ATOM 354 CD2 TRP A 25 -8.560 -11.116 -11.657 1.00 0.00 C ATOM 355 NE1 TRP A 25 -8.985 -11.045 -9.483 1.00 0.00 N ATOM 356 CE2 TRP A 25 -8.193 -11.695 -10.404 1.00 0.00 C ATOM 357 CE3 TRP A 25 -7.883 -11.592 -12.802 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -7.218 -12.697 -10.294 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -6.888 -12.585 -12.700 1.00 0.00 C ATOM 360 CH2 TRP A 25 -6.560 -13.143 -11.453 1.00 0.00 C ATOM 0 H TRP A 25 -12.654 -9.647 -10.662 1.00 0.00 H new ATOM 0 HA TRP A 25 -12.218 -9.191 -13.524 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.867 -9.387 -13.389 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -10.267 -8.237 -12.129 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -10.460 -9.435 -9.562 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.980 -11.241 -8.482 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -8.132 -11.188 -13.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -6.976 -13.121 -9.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -6.373 -12.920 -13.588 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -5.805 -13.912 -11.385 1.00 0.00 H new ATOM 371 N ALA A 26 -11.432 -11.776 -13.654 1.00 0.00 N ATOM 372 CA ALA A 26 -11.270 -13.221 -13.768 1.00 0.00 C ATOM 373 C ALA A 26 -10.097 -13.468 -14.732 1.00 0.00 C ATOM 374 O ALA A 26 -9.870 -12.642 -15.623 1.00 0.00 O ATOM 375 CB ALA A 26 -12.547 -13.884 -14.294 1.00 0.00 C ATOM 0 H ALA A 26 -11.004 -11.275 -14.433 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.070 -13.657 -12.789 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -12.394 -14.961 -14.368 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -13.371 -13.680 -13.610 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.786 -13.483 -15.279 1.00 0.00 H new ATOM 381 N PRO A 27 -9.356 -14.584 -14.613 1.00 0.00 N ATOM 382 CA PRO A 27 -8.106 -14.786 -15.340 1.00 0.00 C ATOM 383 C PRO A 27 -8.313 -15.127 -16.819 1.00 0.00 C ATOM 384 O PRO A 27 -7.381 -14.985 -17.614 1.00 0.00 O ATOM 385 CB PRO A 27 -7.397 -15.924 -14.598 1.00 0.00 C ATOM 386 CG PRO A 27 -8.552 -16.751 -14.035 1.00 0.00 C ATOM 387 CD PRO A 27 -9.616 -15.699 -13.717 1.00 0.00 C ATOM 0 HA PRO A 27 -7.519 -13.868 -15.358 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -6.771 -16.512 -15.268 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -6.750 -15.546 -13.807 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -8.913 -17.482 -14.758 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -8.254 -17.304 -13.144 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -10.618 -16.098 -13.872 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -9.555 -15.385 -12.675 1.00 0.00 H new ATOM 395 N TRP A 28 -9.509 -15.570 -17.214 1.00 0.00 N ATOM 396 CA TRP A 28 -9.811 -15.899 -18.601 1.00 0.00 C ATOM 397 C TRP A 28 -10.116 -14.646 -19.438 1.00 0.00 C ATOM 398 O TRP A 28 -10.184 -14.740 -20.664 1.00 0.00 O ATOM 399 CB TRP A 28 -10.947 -16.935 -18.639 1.00 0.00 C ATOM 400 CG TRP A 28 -12.131 -16.726 -17.735 1.00 0.00 C ATOM 401 CD1 TRP A 28 -12.774 -15.557 -17.512 1.00 0.00 C ATOM 402 CD2 TRP A 28 -12.839 -17.717 -16.922 1.00 0.00 C ATOM 403 NE1 TRP A 28 -13.842 -15.761 -16.663 1.00 0.00 N ATOM 404 CE2 TRP A 28 -13.917 -17.070 -16.246 1.00 0.00 C ATOM 405 CE3 TRP A 28 -12.674 -19.099 -16.682 1.00 0.00 C ATOM 406 CZ2 TRP A 28 -14.781 -17.754 -15.379 1.00 0.00 C ATOM 407 CZ3 TRP A 28 -13.536 -19.797 -15.812 1.00 0.00 C ATOM 408 CH2 TRP A 28 -14.587 -19.128 -15.160 1.00 0.00 C ATOM 0 H TRP A 28 -10.293 -15.709 -16.577 1.00 0.00 H new ATOM 0 HA TRP A 28 -8.929 -16.343 -19.063 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -11.316 -16.987 -19.663 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -10.517 -17.909 -18.405 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -12.493 -14.604 -17.936 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -14.496 -15.031 -16.379 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -11.873 -19.631 -17.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -15.586 -17.231 -14.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -13.388 -20.854 -15.645 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -15.243 -19.668 -14.493 1.00 0.00 H new ATOM 419 N CYS A 29 -10.295 -13.475 -18.809 1.00 0.00 N ATOM 420 CA CYS A 29 -10.564 -12.231 -19.511 1.00 0.00 C ATOM 421 C CYS A 29 -9.220 -11.580 -19.849 1.00 0.00 C ATOM 422 O CYS A 29 -8.448 -11.250 -18.946 1.00 0.00 O ATOM 423 CB CYS A 29 -11.443 -11.336 -18.628 1.00 0.00 C ATOM 424 SG CYS A 29 -11.794 -9.765 -19.467 1.00 0.00 S ATOM 0 H CYS A 29 -10.255 -13.374 -17.795 1.00 0.00 H new ATOM 0 HA CYS A 29 -11.107 -12.400 -20.441 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -12.377 -11.848 -18.396 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -10.941 -11.145 -17.680 1.00 0.00 H new ATOM 0 HG CYS A 29 -12.540 -9.023 -18.704 1.00 0.00 H new ATOM 430 N GLY A 30 -8.940 -11.384 -21.141 1.00 0.00 N ATOM 431 CA GLY A 30 -7.731 -10.715 -21.616 1.00 0.00 C ATOM 432 C GLY A 30 -7.581 -9.313 -21.020 1.00 0.00 C ATOM 433 O GLY A 30 -6.590 -9.063 -20.334 1.00 0.00 O ATOM 0 H GLY A 30 -9.556 -11.690 -21.894 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.859 -11.315 -21.356 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.758 -10.646 -22.703 1.00 0.00 H new ATOM 437 N PRO A 31 -8.555 -8.401 -21.203 1.00 0.00 N ATOM 438 CA PRO A 31 -8.516 -7.059 -20.631 1.00 0.00 C ATOM 439 C PRO A 31 -8.235 -6.987 -19.122 1.00 0.00 C ATOM 440 O PRO A 31 -7.559 -6.053 -18.692 1.00 0.00 O ATOM 441 CB PRO A 31 -9.847 -6.416 -21.017 1.00 0.00 C ATOM 442 CG PRO A 31 -10.156 -7.068 -22.362 1.00 0.00 C ATOM 443 CD PRO A 31 -9.633 -8.493 -22.180 1.00 0.00 C ATOM 0 HA PRO A 31 -7.660 -6.518 -21.035 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.624 -6.620 -20.280 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -9.764 -5.332 -21.102 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -11.224 -7.055 -22.581 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -9.655 -6.556 -23.184 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.423 -9.157 -21.829 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -9.271 -8.900 -23.124 1.00 0.00 H new ATOM 451 N CYS A 32 -8.676 -7.962 -18.312 1.00 0.00 N ATOM 452 CA CYS A 32 -8.307 -8.013 -16.892 1.00 0.00 C ATOM 453 C CYS A 32 -6.787 -8.110 -16.714 1.00 0.00 C ATOM 454 O CYS A 32 -6.210 -7.431 -15.865 1.00 0.00 O ATOM 455 CB CYS A 32 -8.970 -9.203 -16.186 1.00 0.00 C ATOM 456 SG CYS A 32 -10.767 -8.983 -16.074 1.00 0.00 S ATOM 0 H CYS A 32 -9.285 -8.721 -18.616 1.00 0.00 H new ATOM 0 HA CYS A 32 -8.662 -7.086 -16.441 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -8.747 -10.121 -16.729 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -8.552 -9.314 -15.186 1.00 0.00 H new ATOM 0 HG CYS A 32 -11.293 -9.102 -17.257 1.00 0.00 H new ATOM 462 N LYS A 33 -6.123 -8.935 -17.524 1.00 0.00 N ATOM 463 CA LYS A 33 -4.670 -9.074 -17.483 1.00 0.00 C ATOM 464 C LYS A 33 -3.998 -7.851 -18.107 1.00 0.00 C ATOM 465 O LYS A 33 -2.920 -7.471 -17.658 1.00 0.00 O ATOM 466 CB LYS A 33 -4.254 -10.384 -18.171 1.00 0.00 C ATOM 467 CG LYS A 33 -4.757 -11.596 -17.361 1.00 0.00 C ATOM 468 CD LYS A 33 -4.569 -12.942 -18.070 1.00 0.00 C ATOM 469 CE LYS A 33 -5.447 -13.037 -19.327 1.00 0.00 C ATOM 470 NZ LYS A 33 -5.623 -14.440 -19.770 1.00 0.00 N ATOM 0 H LYS A 33 -6.576 -9.523 -18.224 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.336 -9.124 -16.447 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.662 -10.418 -19.181 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.169 -10.425 -18.264 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.233 -11.624 -16.406 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.815 -11.458 -17.140 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.522 -13.068 -18.345 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.819 -13.754 -17.387 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.422 -12.595 -19.123 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.995 -12.456 -20.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.011 -14.453 -20.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.703 -14.925 -19.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.278 -14.928 -19.126 1.00 0.00 H new ATOM 484 N MET A 34 -4.630 -7.192 -19.086 1.00 0.00 N ATOM 485 CA MET A 34 -4.102 -5.961 -19.674 1.00 0.00 C ATOM 486 C MET A 34 -4.083 -4.821 -18.651 1.00 0.00 C ATOM 487 O MET A 34 -3.114 -4.065 -18.620 1.00 0.00 O ATOM 488 CB MET A 34 -4.909 -5.531 -20.908 1.00 0.00 C ATOM 489 CG MET A 34 -4.830 -6.547 -22.055 1.00 0.00 C ATOM 490 SD MET A 34 -5.955 -6.230 -23.447 1.00 0.00 S ATOM 491 CE MET A 34 -5.326 -4.635 -24.045 1.00 0.00 C ATOM 0 H MET A 34 -5.516 -7.497 -19.489 1.00 0.00 H new ATOM 0 HA MET A 34 -3.080 -6.175 -19.986 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.952 -5.392 -20.624 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.542 -4.566 -21.258 1.00 0.00 H new ATOM 0 HG2 MET A 34 -3.807 -6.567 -22.432 1.00 0.00 H new ATOM 0 HG3 MET A 34 -5.042 -7.539 -21.656 1.00 0.00 H new ATOM 0 HE1 MET A 34 -5.846 -4.360 -24.963 1.00 0.00 H new ATOM 0 HE2 MET A 34 -5.497 -3.870 -23.288 1.00 0.00 H new ATOM 0 HE3 MET A 34 -4.257 -4.717 -24.244 1.00 0.00 H new ATOM 501 N ILE A 35 -5.118 -4.680 -17.811 1.00 0.00 N ATOM 502 CA ILE A 35 -5.165 -3.606 -16.814 1.00 0.00 C ATOM 503 C ILE A 35 -4.338 -3.957 -15.563 1.00 0.00 C ATOM 504 O ILE A 35 -3.992 -3.057 -14.802 1.00 0.00 O ATOM 505 CB ILE A 35 -6.630 -3.182 -16.526 1.00 0.00 C ATOM 506 CG1 ILE A 35 -6.671 -1.776 -15.881 1.00 0.00 C ATOM 507 CG2 ILE A 35 -7.409 -4.226 -15.710 1.00 0.00 C ATOM 508 CD1 ILE A 35 -8.079 -1.211 -15.670 1.00 0.00 C ATOM 0 H ILE A 35 -5.931 -5.296 -17.803 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.681 -2.719 -17.224 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.146 -3.127 -17.484 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -6.163 -1.818 -14.918 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.107 -1.086 -16.509 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.426 -3.871 -15.542 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.439 -5.168 -16.258 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -6.915 -4.380 -14.751 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.010 -0.224 -15.214 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.587 -1.132 -16.631 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.643 -1.875 -15.015 1.00 0.00 H new ATOM 520 N ALA A 36 -3.968 -5.225 -15.345 1.00 0.00 N ATOM 521 CA ALA A 36 -3.176 -5.635 -14.185 1.00 0.00 C ATOM 522 C ALA A 36 -1.896 -4.797 -13.970 1.00 0.00 C ATOM 523 O ALA A 36 -1.731 -4.285 -12.862 1.00 0.00 O ATOM 524 CB ALA A 36 -2.883 -7.141 -14.234 1.00 0.00 C ATOM 0 H ALA A 36 -4.211 -5.994 -15.970 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.789 -5.432 -13.307 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.293 -7.425 -13.363 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.822 -7.695 -14.233 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.326 -7.374 -15.141 1.00 0.00 H new ATOM 530 N PRO A 37 -1.015 -4.566 -14.967 1.00 0.00 N ATOM 531 CA PRO A 37 0.152 -3.710 -14.767 1.00 0.00 C ATOM 532 C PRO A 37 -0.226 -2.245 -14.504 1.00 0.00 C ATOM 533 O PRO A 37 0.505 -1.553 -13.798 1.00 0.00 O ATOM 534 CB PRO A 37 1.014 -3.864 -16.025 1.00 0.00 C ATOM 535 CG PRO A 37 0.026 -4.336 -17.089 1.00 0.00 C ATOM 536 CD PRO A 37 -0.958 -5.180 -16.284 1.00 0.00 C ATOM 0 HA PRO A 37 0.699 -4.014 -13.875 1.00 0.00 H new ATOM 0 HB2 PRO A 37 1.484 -2.921 -16.306 1.00 0.00 H new ATOM 0 HB3 PRO A 37 1.815 -4.587 -15.875 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -0.468 -3.499 -17.582 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.518 -4.920 -17.867 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.941 -5.191 -16.754 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.624 -6.216 -16.219 1.00 0.00 H new ATOM 544 N VAL A 38 -1.361 -1.764 -15.024 1.00 0.00 N ATOM 545 CA VAL A 38 -1.850 -0.422 -14.736 1.00 0.00 C ATOM 546 C VAL A 38 -2.247 -0.338 -13.257 1.00 0.00 C ATOM 547 O VAL A 38 -1.949 0.655 -12.596 1.00 0.00 O ATOM 548 CB VAL A 38 -3.024 -0.044 -15.670 1.00 0.00 C ATOM 549 CG1 VAL A 38 -3.342 1.449 -15.541 1.00 0.00 C ATOM 550 CG2 VAL A 38 -2.727 -0.345 -17.150 1.00 0.00 C ATOM 0 H VAL A 38 -1.961 -2.297 -15.654 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.057 0.301 -14.926 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.872 -0.653 -15.358 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.170 1.703 -16.203 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.619 1.674 -14.511 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.464 2.033 -15.817 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -3.585 -0.060 -17.759 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.852 0.222 -17.468 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.533 -1.411 -17.273 1.00 0.00 H new ATOM 560 N LEU A 39 -2.884 -1.381 -12.717 1.00 0.00 N ATOM 561 CA LEU A 39 -3.244 -1.450 -11.309 1.00 0.00 C ATOM 562 C LEU A 39 -1.994 -1.537 -10.436 1.00 0.00 C ATOM 563 O LEU A 39 -1.975 -0.922 -9.374 1.00 0.00 O ATOM 564 CB LEU A 39 -4.198 -2.626 -11.046 1.00 0.00 C ATOM 565 CG LEU A 39 -5.611 -2.369 -11.607 1.00 0.00 C ATOM 566 CD1 LEU A 39 -6.377 -3.686 -11.723 1.00 0.00 C ATOM 567 CD2 LEU A 39 -6.411 -1.405 -10.722 1.00 0.00 C ATOM 0 H LEU A 39 -3.163 -2.203 -13.253 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.771 -0.534 -11.043 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -3.789 -3.530 -11.497 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.263 -2.806 -9.973 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.490 -1.914 -12.590 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.374 -3.493 -12.120 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.843 -4.360 -12.393 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.461 -4.146 -10.738 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.400 -1.251 -11.153 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.513 -1.828 -9.723 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.890 -0.450 -10.660 1.00 0.00 H new ATOM 579 N GLU A 40 -0.941 -2.240 -10.869 1.00 0.00 N ATOM 580 CA GLU A 40 0.325 -2.239 -10.137 1.00 0.00 C ATOM 581 C GLU A 40 0.967 -0.852 -10.160 1.00 0.00 C ATOM 582 O GLU A 40 1.460 -0.397 -9.133 1.00 0.00 O ATOM 583 CB GLU A 40 1.307 -3.302 -10.647 1.00 0.00 C ATOM 584 CG GLU A 40 0.823 -4.728 -10.350 1.00 0.00 C ATOM 585 CD GLU A 40 1.858 -5.776 -10.795 1.00 0.00 C ATOM 586 OE1 GLU A 40 2.736 -6.153 -9.984 1.00 0.00 O ATOM 587 OE2 GLU A 40 1.798 -6.252 -11.952 1.00 0.00 O ATOM 0 H GLU A 40 -0.942 -2.811 -11.714 1.00 0.00 H new ATOM 0 HA GLU A 40 0.089 -2.499 -9.105 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.443 -3.183 -11.722 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.281 -3.147 -10.183 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.632 -4.834 -9.282 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.122 -4.907 -10.863 1.00 0.00 H new ATOM 594 N GLU A 41 0.928 -0.138 -11.287 1.00 0.00 N ATOM 595 CA GLU A 41 1.386 1.244 -11.342 1.00 0.00 C ATOM 596 C GLU A 41 0.584 2.111 -10.369 1.00 0.00 C ATOM 597 O GLU A 41 1.162 2.925 -9.651 1.00 0.00 O ATOM 598 CB GLU A 41 1.286 1.797 -12.774 1.00 0.00 C ATOM 599 CG GLU A 41 2.558 1.556 -13.594 1.00 0.00 C ATOM 600 CD GLU A 41 3.768 2.341 -13.049 1.00 0.00 C ATOM 601 OE1 GLU A 41 3.682 3.584 -12.919 1.00 0.00 O ATOM 602 OE2 GLU A 41 4.816 1.719 -12.762 1.00 0.00 O ATOM 0 H GLU A 41 0.582 -0.500 -12.175 1.00 0.00 H new ATOM 0 HA GLU A 41 2.434 1.270 -11.044 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.440 1.332 -13.280 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.084 2.867 -12.732 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.790 0.491 -13.594 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.379 1.844 -14.630 1.00 0.00 H new ATOM 609 N LEU A 42 -0.734 1.916 -10.302 1.00 0.00 N ATOM 610 CA LEU A 42 -1.600 2.627 -9.373 1.00 0.00 C ATOM 611 C LEU A 42 -1.252 2.296 -7.924 1.00 0.00 C ATOM 612 O LEU A 42 -1.314 3.178 -7.074 1.00 0.00 O ATOM 613 CB LEU A 42 -3.076 2.294 -9.658 1.00 0.00 C ATOM 614 CG LEU A 42 -3.916 3.467 -10.182 1.00 0.00 C ATOM 615 CD1 LEU A 42 -4.034 4.599 -9.155 1.00 0.00 C ATOM 616 CD2 LEU A 42 -3.379 4.012 -11.513 1.00 0.00 C ATOM 0 H LEU A 42 -1.230 1.253 -10.898 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.443 3.696 -9.519 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.116 1.484 -10.386 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.532 1.921 -8.741 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.914 3.066 -10.358 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.637 5.406 -9.571 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.509 4.221 -8.250 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.040 4.976 -8.913 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.004 4.841 -11.846 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.356 4.362 -11.377 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -3.395 3.221 -12.263 1.00 0.00 H new ATOM 628 N ASP A 43 -0.866 1.058 -7.625 1.00 0.00 N ATOM 629 CA ASP A 43 -0.409 0.652 -6.301 1.00 0.00 C ATOM 630 C ASP A 43 0.891 1.373 -5.956 1.00 0.00 C ATOM 631 O ASP A 43 1.012 1.941 -4.875 1.00 0.00 O ATOM 632 CB ASP A 43 -0.230 -0.869 -6.231 1.00 0.00 C ATOM 633 CG ASP A 43 0.719 -1.285 -5.099 1.00 0.00 C ATOM 634 OD1 ASP A 43 0.287 -1.292 -3.926 1.00 0.00 O ATOM 635 OD2 ASP A 43 1.885 -1.627 -5.407 1.00 0.00 O ATOM 0 H ASP A 43 -0.862 0.299 -8.306 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.165 0.930 -5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.201 -1.342 -6.082 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.159 -1.232 -7.182 1.00 0.00 H new ATOM 640 N GLN A 44 1.839 1.426 -6.889 1.00 0.00 N ATOM 641 CA GLN A 44 3.101 2.116 -6.683 1.00 0.00 C ATOM 642 C GLN A 44 2.907 3.634 -6.522 1.00 0.00 C ATOM 643 O GLN A 44 3.711 4.288 -5.856 1.00 0.00 O ATOM 644 CB GLN A 44 4.050 1.778 -7.842 1.00 0.00 C ATOM 645 CG GLN A 44 4.481 0.298 -7.872 1.00 0.00 C ATOM 646 CD GLN A 44 5.222 -0.149 -6.611 1.00 0.00 C ATOM 647 OE1 GLN A 44 6.381 0.200 -6.396 1.00 0.00 O ATOM 648 NE2 GLN A 44 4.591 -0.941 -5.758 1.00 0.00 N ATOM 0 H GLN A 44 1.750 0.991 -7.807 1.00 0.00 H new ATOM 0 HA GLN A 44 3.545 1.772 -5.749 1.00 0.00 H new ATOM 0 HB2 GLN A 44 3.562 2.025 -8.785 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.938 2.406 -7.769 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.598 -0.326 -8.005 1.00 0.00 H new ATOM 0 HG3 GLN A 44 5.122 0.132 -8.738 1.00 0.00 H new ATOM 0 HE21 GLN A 44 3.629 -1.227 -5.943 1.00 0.00 H new ATOM 0 HE22 GLN A 44 5.066 -1.266 -4.916 1.00 0.00 H new ATOM 657 N GLU A 45 1.851 4.203 -7.112 1.00 0.00 N ATOM 658 CA GLU A 45 1.591 5.638 -7.128 1.00 0.00 C ATOM 659 C GLU A 45 0.702 6.081 -5.952 1.00 0.00 C ATOM 660 O GLU A 45 0.926 7.144 -5.367 1.00 0.00 O ATOM 661 CB GLU A 45 0.916 5.965 -8.473 1.00 0.00 C ATOM 662 CG GLU A 45 0.897 7.457 -8.820 1.00 0.00 C ATOM 663 CD GLU A 45 2.299 7.970 -9.194 1.00 0.00 C ATOM 664 OE1 GLU A 45 2.814 7.579 -10.267 1.00 0.00 O ATOM 665 OE2 GLU A 45 2.888 8.765 -8.427 1.00 0.00 O ATOM 0 H GLU A 45 1.139 3.662 -7.602 1.00 0.00 H new ATOM 0 HA GLU A 45 2.530 6.180 -7.018 1.00 0.00 H new ATOM 0 HB2 GLU A 45 1.433 5.425 -9.267 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.109 5.595 -8.452 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.212 7.629 -9.651 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.516 8.024 -7.970 1.00 0.00 H new ATOM 672 N MET A 46 -0.285 5.264 -5.571 1.00 0.00 N ATOM 673 CA MET A 46 -1.365 5.646 -4.659 1.00 0.00 C ATOM 674 C MET A 46 -1.554 4.667 -3.498 1.00 0.00 C ATOM 675 O MET A 46 -2.258 5.020 -2.555 1.00 0.00 O ATOM 676 CB MET A 46 -2.688 5.792 -5.439 1.00 0.00 C ATOM 677 CG MET A 46 -2.644 6.786 -6.609 1.00 0.00 C ATOM 678 SD MET A 46 -2.366 8.517 -6.149 1.00 0.00 S ATOM 679 CE MET A 46 -2.675 9.326 -7.741 1.00 0.00 C ATOM 0 H MET A 46 -0.356 4.299 -5.895 1.00 0.00 H new ATOM 0 HA MET A 46 -1.076 6.601 -4.221 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.976 4.814 -5.824 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.469 6.104 -4.746 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.855 6.479 -7.295 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.585 6.720 -7.155 1.00 0.00 H new ATOM 0 HE1 MET A 46 -2.580 10.406 -7.625 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.949 8.975 -8.475 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.682 9.085 -8.082 1.00 0.00 H new ATOM 689 N GLY A 47 -0.902 3.498 -3.506 1.00 0.00 N ATOM 690 CA GLY A 47 -1.051 2.415 -2.527 1.00 0.00 C ATOM 691 C GLY A 47 -0.948 2.839 -1.060 1.00 0.00 C ATOM 692 O GLY A 47 -1.474 2.168 -0.173 1.00 0.00 O ATOM 0 H GLY A 47 -0.222 3.271 -4.232 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.018 1.938 -2.683 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.288 1.662 -2.725 1.00 0.00 H new ATOM 696 N ASP A 48 -0.251 3.947 -0.798 1.00 0.00 N ATOM 697 CA ASP A 48 0.010 4.471 0.539 1.00 0.00 C ATOM 698 C ASP A 48 -1.222 5.150 1.141 1.00 0.00 C ATOM 699 O ASP A 48 -1.395 5.151 2.362 1.00 0.00 O ATOM 700 CB ASP A 48 1.174 5.468 0.484 1.00 0.00 C ATOM 701 CG ASP A 48 1.468 6.069 1.870 1.00 0.00 C ATOM 702 OD1 ASP A 48 2.006 5.351 2.743 1.00 0.00 O ATOM 703 OD2 ASP A 48 1.203 7.273 2.079 1.00 0.00 O ATOM 0 H ASP A 48 0.159 4.520 -1.536 1.00 0.00 H new ATOM 0 HA ASP A 48 0.268 3.628 1.180 1.00 0.00 H new ATOM 0 HB2 ASP A 48 2.066 4.967 0.107 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.937 6.268 -0.218 1.00 0.00 H new ATOM 708 N LYS A 49 -2.098 5.696 0.290 1.00 0.00 N ATOM 709 CA LYS A 49 -3.273 6.461 0.661 1.00 0.00 C ATOM 710 C LYS A 49 -4.560 5.916 0.042 1.00 0.00 C ATOM 711 O LYS A 49 -5.642 6.396 0.381 1.00 0.00 O ATOM 712 CB LYS A 49 -3.033 7.943 0.345 1.00 0.00 C ATOM 713 CG LYS A 49 -2.820 8.332 -1.133 1.00 0.00 C ATOM 714 CD LYS A 49 -1.348 8.330 -1.595 1.00 0.00 C ATOM 715 CE LYS A 49 -1.223 9.138 -2.899 1.00 0.00 C ATOM 716 NZ LYS A 49 0.155 9.157 -3.462 1.00 0.00 N ATOM 0 H LYS A 49 -1.994 5.607 -0.721 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.427 6.359 1.735 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.885 8.509 0.722 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.159 8.269 0.908 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -3.384 7.643 -1.761 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.236 9.326 -1.297 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.712 8.763 -0.823 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.006 7.307 -1.753 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.903 8.721 -3.641 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.544 10.163 -2.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.313 10.054 -3.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.846 9.066 -2.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.270 8.364 -4.126 1.00 0.00 H new ATOM 730 N LEU A 50 -4.465 4.900 -0.818 1.00 0.00 N ATOM 731 CA LEU A 50 -5.600 4.182 -1.372 1.00 0.00 C ATOM 732 C LEU A 50 -5.203 2.723 -1.533 1.00 0.00 C ATOM 733 O LEU A 50 -4.221 2.410 -2.199 1.00 0.00 O ATOM 734 CB LEU A 50 -6.072 4.838 -2.682 1.00 0.00 C ATOM 735 CG LEU A 50 -6.872 3.917 -3.639 1.00 0.00 C ATOM 736 CD1 LEU A 50 -8.218 4.547 -4.001 1.00 0.00 C ATOM 737 CD2 LEU A 50 -6.069 3.596 -4.904 1.00 0.00 C ATOM 0 H LEU A 50 -3.568 4.549 -1.154 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.458 4.228 -0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -6.691 5.700 -2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.199 5.215 -3.214 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.060 2.980 -3.115 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.762 3.883 -4.673 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.802 4.703 -3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.051 5.505 -4.494 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.658 2.949 -5.554 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -5.834 4.521 -5.430 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.144 3.090 -4.629 1.00 0.00 H new ATOM 749 N LYS A 51 -5.977 1.834 -0.914 1.00 0.00 N ATOM 750 CA LYS A 51 -5.783 0.390 -1.020 1.00 0.00 C ATOM 751 C LYS A 51 -6.396 -0.096 -2.335 1.00 0.00 C ATOM 752 O LYS A 51 -7.333 0.525 -2.837 1.00 0.00 O ATOM 753 CB LYS A 51 -6.422 -0.250 0.220 1.00 0.00 C ATOM 754 CG LYS A 51 -6.228 -1.771 0.324 1.00 0.00 C ATOM 755 CD LYS A 51 -6.647 -2.305 1.703 1.00 0.00 C ATOM 756 CE LYS A 51 -8.094 -1.944 2.048 1.00 0.00 C ATOM 757 NZ LYS A 51 -8.519 -2.540 3.329 1.00 0.00 N ATOM 0 H LYS A 51 -6.763 2.098 -0.320 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.730 0.109 -1.043 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.004 0.219 1.111 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.490 -0.032 0.216 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.813 -2.266 -0.451 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.182 -2.018 0.141 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -6.530 -3.389 1.722 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.982 -1.900 2.465 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.195 -0.860 2.101 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -8.754 -2.287 1.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.532 -2.358 3.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.351 -3.566 3.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.974 -2.117 4.107 1.00 0.00 H new ATOM 771 N ILE A 52 -5.918 -1.215 -2.878 1.00 0.00 N ATOM 772 CA ILE A 52 -6.413 -1.790 -4.129 1.00 0.00 C ATOM 773 C ILE A 52 -6.738 -3.243 -3.809 1.00 0.00 C ATOM 774 O ILE A 52 -5.900 -3.913 -3.206 1.00 0.00 O ATOM 775 CB ILE A 52 -5.372 -1.623 -5.264 1.00 0.00 C ATOM 776 CG1 ILE A 52 -5.023 -0.121 -5.414 1.00 0.00 C ATOM 777 CG2 ILE A 52 -5.888 -2.233 -6.585 1.00 0.00 C ATOM 778 CD1 ILE A 52 -4.113 0.240 -6.584 1.00 0.00 C ATOM 0 H ILE A 52 -5.164 -1.756 -2.455 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.304 -1.283 -4.501 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.462 -2.166 -5.008 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.952 0.439 -5.516 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.548 0.215 -4.492 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.137 -2.102 -7.364 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.082 -3.296 -6.444 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.810 -1.732 -6.881 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.937 1.316 -6.590 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.162 -0.283 -6.480 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.589 -0.055 -7.519 1.00 0.00 H new ATOM 790 N VAL A 53 -7.925 -3.727 -4.182 1.00 0.00 N ATOM 791 CA VAL A 53 -8.415 -5.043 -3.768 1.00 0.00 C ATOM 792 C VAL A 53 -8.893 -5.827 -4.996 1.00 0.00 C ATOM 793 O VAL A 53 -9.849 -5.437 -5.668 1.00 0.00 O ATOM 794 CB VAL A 53 -9.546 -4.888 -2.723 1.00 0.00 C ATOM 795 CG1 VAL A 53 -9.950 -6.243 -2.128 1.00 0.00 C ATOM 796 CG2 VAL A 53 -9.167 -3.957 -1.563 1.00 0.00 C ATOM 0 H VAL A 53 -8.574 -3.216 -4.781 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.604 -5.602 -3.300 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.380 -4.448 -3.270 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -10.746 -6.097 -1.398 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -10.303 -6.899 -2.924 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.088 -6.697 -1.639 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.000 -3.889 -0.864 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.293 -4.355 -1.048 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.938 -2.965 -1.952 1.00 0.00 H new ATOM 806 N LYS A 54 -8.246 -6.950 -5.295 1.00 0.00 N ATOM 807 CA LYS A 54 -8.720 -7.895 -6.301 1.00 0.00 C ATOM 808 C LYS A 54 -9.911 -8.666 -5.754 1.00 0.00 C ATOM 809 O LYS A 54 -9.899 -9.048 -4.579 1.00 0.00 O ATOM 810 CB LYS A 54 -7.598 -8.892 -6.628 1.00 0.00 C ATOM 811 CG LYS A 54 -6.385 -8.260 -7.313 1.00 0.00 C ATOM 812 CD LYS A 54 -6.755 -7.814 -8.728 1.00 0.00 C ATOM 813 CE LYS A 54 -5.527 -7.250 -9.428 1.00 0.00 C ATOM 814 NZ LYS A 54 -5.745 -7.167 -10.893 1.00 0.00 N ATOM 0 H LYS A 54 -7.375 -7.231 -4.845 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.012 -7.349 -7.198 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.272 -9.372 -5.705 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -7.998 -9.676 -7.271 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.034 -7.406 -6.734 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.565 -8.977 -7.352 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.152 -8.657 -9.293 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.541 -7.060 -8.688 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.301 -6.259 -9.033 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -4.663 -7.881 -9.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.008 -6.571 -11.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.701 -8.121 -11.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.679 -6.751 -11.082 1.00 0.00 H new ATOM 828 N ILE A 55 -10.883 -8.973 -6.613 1.00 0.00 N ATOM 829 CA ILE A 55 -11.977 -9.878 -6.279 1.00 0.00 C ATOM 830 C ILE A 55 -12.448 -10.585 -7.563 1.00 0.00 C ATOM 831 O ILE A 55 -12.651 -9.959 -8.605 1.00 0.00 O ATOM 832 CB ILE A 55 -13.065 -9.103 -5.488 1.00 0.00 C ATOM 833 CG1 ILE A 55 -14.273 -10.013 -5.188 1.00 0.00 C ATOM 834 CG2 ILE A 55 -13.464 -7.771 -6.154 1.00 0.00 C ATOM 835 CD1 ILE A 55 -15.156 -9.496 -4.044 1.00 0.00 C ATOM 0 H ILE A 55 -10.932 -8.599 -7.561 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.666 -10.679 -5.608 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.628 -8.814 -4.532 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.878 -10.110 -6.089 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.913 -11.011 -4.937 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -14.228 -7.278 -5.553 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -12.589 -7.126 -6.230 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -13.858 -7.967 -7.151 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -15.987 -10.184 -3.886 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -14.565 -9.426 -3.131 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -15.545 -8.511 -4.301 1.00 0.00 H new ATOM 847 N ASP A 56 -12.556 -11.914 -7.518 1.00 0.00 N ATOM 848 CA ASP A 56 -12.914 -12.733 -8.680 1.00 0.00 C ATOM 849 C ASP A 56 -14.438 -12.830 -8.793 1.00 0.00 C ATOM 850 O ASP A 56 -15.083 -13.187 -7.807 1.00 0.00 O ATOM 851 CB ASP A 56 -12.296 -14.126 -8.534 1.00 0.00 C ATOM 852 CG ASP A 56 -12.679 -15.030 -9.715 1.00 0.00 C ATOM 853 OD1 ASP A 56 -13.829 -15.517 -9.744 1.00 0.00 O ATOM 854 OD2 ASP A 56 -11.822 -15.251 -10.601 1.00 0.00 O ATOM 0 H ASP A 56 -12.397 -12.457 -6.669 1.00 0.00 H new ATOM 0 HA ASP A 56 -12.527 -12.271 -9.588 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.211 -14.041 -8.475 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.632 -14.580 -7.601 1.00 0.00 H new ATOM 859 N VAL A 57 -15.033 -12.509 -9.948 1.00 0.00 N ATOM 860 CA VAL A 57 -16.496 -12.465 -10.079 1.00 0.00 C ATOM 861 C VAL A 57 -17.169 -13.838 -9.968 1.00 0.00 C ATOM 862 O VAL A 57 -18.294 -13.915 -9.478 1.00 0.00 O ATOM 863 CB VAL A 57 -16.948 -11.770 -11.383 1.00 0.00 C ATOM 864 CG1 VAL A 57 -16.698 -10.261 -11.311 1.00 0.00 C ATOM 865 CG2 VAL A 57 -16.300 -12.345 -12.654 1.00 0.00 C ATOM 0 H VAL A 57 -14.527 -12.277 -10.803 1.00 0.00 H new ATOM 0 HA VAL A 57 -16.826 -11.871 -9.227 1.00 0.00 H new ATOM 0 HB VAL A 57 -18.017 -11.967 -11.462 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.024 -9.793 -12.240 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.258 -9.839 -10.476 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.634 -10.075 -11.165 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.668 -11.805 -13.526 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -15.217 -12.238 -12.591 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -16.555 -13.401 -12.747 1.00 0.00 H new ATOM 875 N ASP A 58 -16.526 -14.918 -10.413 1.00 0.00 N ATOM 876 CA ASP A 58 -17.157 -16.238 -10.431 1.00 0.00 C ATOM 877 C ASP A 58 -17.201 -16.808 -9.018 1.00 0.00 C ATOM 878 O ASP A 58 -18.184 -17.433 -8.624 1.00 0.00 O ATOM 879 CB ASP A 58 -16.413 -17.197 -11.366 1.00 0.00 C ATOM 880 CG ASP A 58 -17.061 -18.591 -11.339 1.00 0.00 C ATOM 881 OD1 ASP A 58 -18.161 -18.761 -11.911 1.00 0.00 O ATOM 882 OD2 ASP A 58 -16.460 -19.535 -10.779 1.00 0.00 O ATOM 0 H ASP A 58 -15.569 -14.905 -10.766 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.174 -16.126 -10.808 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -16.425 -16.804 -12.383 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -15.368 -17.270 -11.064 1.00 0.00 H new ATOM 887 N GLU A 59 -16.172 -16.531 -8.217 1.00 0.00 N ATOM 888 CA GLU A 59 -16.123 -16.922 -6.813 1.00 0.00 C ATOM 889 C GLU A 59 -16.963 -15.986 -5.927 1.00 0.00 C ATOM 890 O GLU A 59 -17.264 -16.351 -4.790 1.00 0.00 O ATOM 891 CB GLU A 59 -14.661 -16.956 -6.335 1.00 0.00 C ATOM 892 CG GLU A 59 -13.862 -18.094 -6.985 1.00 0.00 C ATOM 893 CD GLU A 59 -12.441 -18.194 -6.401 1.00 0.00 C ATOM 894 OE1 GLU A 59 -12.247 -18.896 -5.381 1.00 0.00 O ATOM 895 OE2 GLU A 59 -11.497 -17.595 -6.964 1.00 0.00 O ATOM 0 H GLU A 59 -15.344 -16.025 -8.529 1.00 0.00 H new ATOM 0 HA GLU A 59 -16.555 -17.919 -6.724 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -14.184 -16.003 -6.564 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.638 -17.072 -5.251 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -14.385 -19.038 -6.835 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -13.803 -17.930 -8.061 1.00 0.00 H new ATOM 902 N ASN A 60 -17.365 -14.804 -6.420 1.00 0.00 N ATOM 903 CA ASN A 60 -17.960 -13.736 -5.605 1.00 0.00 C ATOM 904 C ASN A 60 -19.099 -13.052 -6.364 1.00 0.00 C ATOM 905 O ASN A 60 -19.141 -11.827 -6.505 1.00 0.00 O ATOM 906 CB ASN A 60 -16.888 -12.732 -5.155 1.00 0.00 C ATOM 907 CG ASN A 60 -15.748 -13.407 -4.411 1.00 0.00 C ATOM 908 OD1 ASN A 60 -15.872 -13.745 -3.241 1.00 0.00 O ATOM 909 ND2 ASN A 60 -14.629 -13.643 -5.073 1.00 0.00 N ATOM 0 H ASN A 60 -17.285 -14.561 -7.407 1.00 0.00 H new ATOM 0 HA ASN A 60 -18.386 -14.180 -4.705 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -16.493 -12.210 -6.026 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -17.344 -11.979 -4.512 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.852 -14.114 -4.609 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.542 -13.355 -6.048 1.00 0.00 H new ATOM 916 N GLN A 61 -20.018 -13.872 -6.884 1.00 0.00 N ATOM 917 CA GLN A 61 -21.119 -13.442 -7.735 1.00 0.00 C ATOM 918 C GLN A 61 -21.976 -12.421 -6.984 1.00 0.00 C ATOM 919 O GLN A 61 -22.377 -11.397 -7.537 1.00 0.00 O ATOM 920 CB GLN A 61 -22.000 -14.641 -8.166 1.00 0.00 C ATOM 921 CG GLN A 61 -21.358 -16.044 -8.205 1.00 0.00 C ATOM 922 CD GLN A 61 -21.178 -16.647 -6.801 1.00 0.00 C ATOM 923 OE1 GLN A 61 -22.077 -16.621 -5.967 1.00 0.00 O ATOM 924 NE2 GLN A 61 -19.990 -17.125 -6.477 1.00 0.00 N ATOM 0 H GLN A 61 -20.012 -14.878 -6.717 1.00 0.00 H new ATOM 0 HA GLN A 61 -20.699 -12.989 -8.633 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -22.855 -14.685 -7.491 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -22.390 -14.426 -9.161 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -21.980 -16.708 -8.806 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -20.388 -15.983 -8.698 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -19.242 -17.147 -7.171 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -19.820 -17.473 -5.533 1.00 0.00 H new ATOM 933 N GLU A 62 -22.238 -12.708 -5.705 1.00 0.00 N ATOM 934 CA GLU A 62 -23.095 -11.912 -4.847 1.00 0.00 C ATOM 935 C GLU A 62 -22.505 -10.519 -4.635 1.00 0.00 C ATOM 936 O GLU A 62 -23.243 -9.537 -4.691 1.00 0.00 O ATOM 937 CB GLU A 62 -23.283 -12.639 -3.507 1.00 0.00 C ATOM 938 CG GLU A 62 -24.193 -13.868 -3.648 1.00 0.00 C ATOM 939 CD GLU A 62 -24.440 -14.553 -2.292 1.00 0.00 C ATOM 940 OE1 GLU A 62 -25.394 -14.171 -1.576 1.00 0.00 O ATOM 941 OE2 GLU A 62 -23.702 -15.500 -1.937 1.00 0.00 O ATOM 0 H GLU A 62 -21.846 -13.523 -5.234 1.00 0.00 H new ATOM 0 HA GLU A 62 -24.067 -11.787 -5.324 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -22.311 -12.948 -3.122 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -23.711 -11.952 -2.777 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -25.146 -13.567 -4.082 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -23.739 -14.580 -4.338 1.00 0.00 H new ATOM 948 N THR A 63 -21.189 -10.405 -4.432 1.00 0.00 N ATOM 949 CA THR A 63 -20.561 -9.119 -4.171 1.00 0.00 C ATOM 950 C THR A 63 -20.585 -8.267 -5.433 1.00 0.00 C ATOM 951 O THR A 63 -20.928 -7.096 -5.360 1.00 0.00 O ATOM 952 CB THR A 63 -19.115 -9.279 -3.687 1.00 0.00 C ATOM 953 OG1 THR A 63 -18.911 -10.551 -3.127 1.00 0.00 O ATOM 954 CG2 THR A 63 -18.715 -8.225 -2.655 1.00 0.00 C ATOM 0 H THR A 63 -20.542 -11.193 -4.445 1.00 0.00 H new ATOM 0 HA THR A 63 -21.128 -8.629 -3.379 1.00 0.00 H new ATOM 0 HB THR A 63 -18.490 -9.149 -4.571 1.00 0.00 H new ATOM 0 HG1 THR A 63 -19.667 -10.778 -2.546 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.682 -8.389 -2.349 1.00 0.00 H new ATOM 0 HG22 THR A 63 -18.811 -7.232 -3.094 1.00 0.00 H new ATOM 0 HG23 THR A 63 -19.367 -8.302 -1.785 1.00 0.00 H new ATOM 962 N ALA A 64 -20.273 -8.833 -6.600 1.00 0.00 N ATOM 963 CA ALA A 64 -20.345 -8.077 -7.840 1.00 0.00 C ATOM 964 C ALA A 64 -21.796 -7.630 -8.084 1.00 0.00 C ATOM 965 O ALA A 64 -22.061 -6.455 -8.356 1.00 0.00 O ATOM 966 CB ALA A 64 -19.794 -8.940 -8.980 1.00 0.00 C ATOM 0 H ALA A 64 -19.972 -9.802 -6.707 1.00 0.00 H new ATOM 0 HA ALA A 64 -19.736 -7.175 -7.783 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -19.843 -8.382 -9.915 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.758 -9.203 -8.769 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.389 -9.849 -9.068 1.00 0.00 H new ATOM 972 N GLY A 65 -22.756 -8.539 -7.871 1.00 0.00 N ATOM 973 CA GLY A 65 -24.183 -8.257 -7.937 1.00 0.00 C ATOM 974 C GLY A 65 -24.610 -7.144 -6.972 1.00 0.00 C ATOM 975 O GLY A 65 -25.548 -6.405 -7.276 1.00 0.00 O ATOM 0 H GLY A 65 -22.550 -9.512 -7.643 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -24.446 -7.971 -8.955 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -24.740 -9.165 -7.707 1.00 0.00 H new ATOM 979 N LYS A 66 -23.892 -6.959 -5.857 1.00 0.00 N ATOM 980 CA LYS A 66 -24.135 -5.907 -4.866 1.00 0.00 C ATOM 981 C LYS A 66 -24.038 -4.506 -5.487 1.00 0.00 C ATOM 982 O LYS A 66 -24.630 -3.569 -4.950 1.00 0.00 O ATOM 983 CB LYS A 66 -23.148 -6.071 -3.689 1.00 0.00 C ATOM 984 CG LYS A 66 -23.712 -5.570 -2.351 1.00 0.00 C ATOM 985 CD LYS A 66 -22.695 -5.630 -1.197 1.00 0.00 C ATOM 986 CE LYS A 66 -22.132 -7.041 -0.943 1.00 0.00 C ATOM 987 NZ LYS A 66 -21.403 -7.139 0.347 1.00 0.00 N ATOM 0 H LYS A 66 -23.102 -7.557 -5.614 1.00 0.00 H new ATOM 0 HA LYS A 66 -25.154 -6.011 -4.492 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -22.880 -7.123 -3.592 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -22.230 -5.528 -3.915 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -24.053 -4.542 -2.471 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -24.585 -6.167 -2.087 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -21.870 -4.953 -1.416 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -23.171 -5.268 -0.285 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -22.950 -7.762 -0.950 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -21.461 -7.313 -1.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -21.044 -8.107 0.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -20.605 -6.472 0.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -22.048 -6.907 1.129 1.00 0.00 H new ATOM 1001 N TYR A 67 -23.349 -4.366 -6.627 1.00 0.00 N ATOM 1002 CA TYR A 67 -23.158 -3.104 -7.342 1.00 0.00 C ATOM 1003 C TYR A 67 -23.729 -3.186 -8.767 1.00 0.00 C ATOM 1004 O TYR A 67 -23.481 -2.297 -9.582 1.00 0.00 O ATOM 1005 CB TYR A 67 -21.664 -2.731 -7.342 1.00 0.00 C ATOM 1006 CG TYR A 67 -20.956 -3.023 -6.033 1.00 0.00 C ATOM 1007 CD1 TYR A 67 -21.244 -2.268 -4.880 1.00 0.00 C ATOM 1008 CD2 TYR A 67 -20.107 -4.139 -5.946 1.00 0.00 C ATOM 1009 CE1 TYR A 67 -20.700 -2.639 -3.637 1.00 0.00 C ATOM 1010 CE2 TYR A 67 -19.575 -4.526 -4.708 1.00 0.00 C ATOM 1011 CZ TYR A 67 -19.879 -3.788 -3.541 1.00 0.00 C ATOM 1012 OH TYR A 67 -19.417 -4.209 -2.331 1.00 0.00 O ATOM 0 H TYR A 67 -22.896 -5.155 -7.089 1.00 0.00 H new ATOM 0 HA TYR A 67 -23.707 -2.314 -6.828 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -21.164 -3.275 -8.143 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -21.565 -1.669 -7.568 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -21.885 -1.401 -4.950 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -19.863 -4.701 -6.836 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -20.908 -2.048 -2.757 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -18.931 -5.391 -4.646 1.00 0.00 H new ATOM 0 HH TYR A 67 -18.659 -4.815 -2.463 1.00 0.00 H new ATOM 1022 N GLY A 68 -24.484 -4.246 -9.087 1.00 0.00 N ATOM 1023 CA GLY A 68 -25.039 -4.472 -10.416 1.00 0.00 C ATOM 1024 C GLY A 68 -23.961 -4.833 -11.443 1.00 0.00 C ATOM 1025 O GLY A 68 -24.091 -4.471 -12.614 1.00 0.00 O ATOM 0 H GLY A 68 -24.726 -4.976 -8.417 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -25.775 -5.274 -10.368 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -25.565 -3.576 -10.745 1.00 0.00 H new ATOM 1029 N VAL A 69 -22.896 -5.518 -11.019 1.00 0.00 N ATOM 1030 CA VAL A 69 -21.767 -5.903 -11.858 1.00 0.00 C ATOM 1031 C VAL A 69 -21.805 -7.423 -12.030 1.00 0.00 C ATOM 1032 O VAL A 69 -21.997 -8.157 -11.063 1.00 0.00 O ATOM 1033 CB VAL A 69 -20.453 -5.421 -11.194 1.00 0.00 C ATOM 1034 CG1 VAL A 69 -19.205 -5.894 -11.956 1.00 0.00 C ATOM 1035 CG2 VAL A 69 -20.419 -3.882 -11.085 1.00 0.00 C ATOM 0 H VAL A 69 -22.796 -5.828 -10.052 1.00 0.00 H new ATOM 0 HA VAL A 69 -21.821 -5.441 -12.844 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.437 -5.863 -10.198 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -18.310 -5.530 -11.451 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -19.188 -6.983 -11.985 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -19.231 -5.504 -12.974 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -19.486 -3.571 -10.615 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.487 -3.445 -12.081 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.260 -3.541 -10.481 1.00 0.00 H new ATOM 1045 N MET A 70 -21.614 -7.890 -13.265 1.00 0.00 N ATOM 1046 CA MET A 70 -21.351 -9.294 -13.586 1.00 0.00 C ATOM 1047 C MET A 70 -20.604 -9.369 -14.933 1.00 0.00 C ATOM 1048 O MET A 70 -20.772 -10.310 -15.711 1.00 0.00 O ATOM 1049 CB MET A 70 -22.642 -10.139 -13.533 1.00 0.00 C ATOM 1050 CG MET A 70 -22.334 -11.614 -13.223 1.00 0.00 C ATOM 1051 SD MET A 70 -21.553 -11.908 -11.603 1.00 0.00 S ATOM 1052 CE MET A 70 -21.112 -13.658 -11.766 1.00 0.00 C ATOM 0 H MET A 70 -21.638 -7.289 -14.089 1.00 0.00 H new ATOM 0 HA MET A 70 -20.703 -9.737 -12.830 1.00 0.00 H new ATOM 0 HB2 MET A 70 -23.311 -9.737 -12.772 1.00 0.00 H new ATOM 0 HB3 MET A 70 -23.165 -10.067 -14.487 1.00 0.00 H new ATOM 0 HG2 MET A 70 -23.263 -12.182 -13.271 1.00 0.00 H new ATOM 0 HG3 MET A 70 -21.680 -12.005 -14.002 1.00 0.00 H new ATOM 0 HE1 MET A 70 -20.622 -13.996 -10.853 1.00 0.00 H new ATOM 0 HE2 MET A 70 -22.014 -14.247 -11.933 1.00 0.00 H new ATOM 0 HE3 MET A 70 -20.435 -13.785 -12.610 1.00 0.00 H new ATOM 1062 N SER A 71 -19.785 -8.349 -15.206 1.00 0.00 N ATOM 1063 CA SER A 71 -18.957 -8.190 -16.391 1.00 0.00 C ATOM 1064 C SER A 71 -17.599 -7.675 -15.913 1.00 0.00 C ATOM 1065 O SER A 71 -17.519 -7.084 -14.830 1.00 0.00 O ATOM 1066 CB SER A 71 -19.616 -7.210 -17.373 1.00 0.00 C ATOM 1067 OG SER A 71 -20.946 -7.603 -17.689 1.00 0.00 O ATOM 0 H SER A 71 -19.681 -7.566 -14.560 1.00 0.00 H new ATOM 0 HA SER A 71 -18.837 -9.134 -16.923 1.00 0.00 H new ATOM 0 HB2 SER A 71 -19.624 -6.210 -16.940 1.00 0.00 H new ATOM 0 HB3 SER A 71 -19.025 -7.156 -18.287 1.00 0.00 H new ATOM 0 HG SER A 71 -21.338 -6.958 -18.314 1.00 0.00 H new ATOM 1073 N ILE A 72 -16.531 -7.900 -16.682 1.00 0.00 N ATOM 1074 CA ILE A 72 -15.160 -7.671 -16.234 1.00 0.00 C ATOM 1075 C ILE A 72 -14.272 -7.184 -17.395 1.00 0.00 C ATOM 1076 O ILE A 72 -14.595 -7.474 -18.551 1.00 0.00 O ATOM 1077 CB ILE A 72 -14.594 -8.978 -15.627 1.00 0.00 C ATOM 1078 CG1 ILE A 72 -14.732 -10.181 -16.592 1.00 0.00 C ATOM 1079 CG2 ILE A 72 -15.259 -9.278 -14.276 1.00 0.00 C ATOM 1080 CD1 ILE A 72 -14.032 -11.444 -16.097 1.00 0.00 C ATOM 0 H ILE A 72 -16.596 -8.248 -17.638 1.00 0.00 H new ATOM 0 HA ILE A 72 -15.164 -6.891 -15.473 1.00 0.00 H new ATOM 0 HB ILE A 72 -13.527 -8.824 -15.464 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -15.790 -10.397 -16.742 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -14.322 -9.906 -17.564 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -14.848 -10.200 -13.865 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -15.068 -8.456 -13.586 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -16.334 -9.391 -14.417 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -14.171 -12.245 -16.823 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -12.967 -11.246 -15.974 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -14.458 -11.744 -15.140 1.00 0.00 H new ATOM 1092 N PRO A 73 -13.142 -6.501 -17.123 1.00 0.00 N ATOM 1093 CA PRO A 73 -12.760 -5.962 -15.823 1.00 0.00 C ATOM 1094 C PRO A 73 -13.720 -4.835 -15.450 1.00 0.00 C ATOM 1095 O PRO A 73 -14.105 -4.036 -16.308 1.00 0.00 O ATOM 1096 CB PRO A 73 -11.331 -5.432 -15.976 1.00 0.00 C ATOM 1097 CG PRO A 73 -11.184 -5.167 -17.473 1.00 0.00 C ATOM 1098 CD PRO A 73 -12.150 -6.155 -18.125 1.00 0.00 C ATOM 0 HA PRO A 73 -12.804 -6.715 -15.036 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -11.180 -4.523 -15.394 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -10.598 -6.159 -15.627 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -11.439 -4.137 -17.722 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -10.160 -5.331 -17.808 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -12.624 -5.711 -19.000 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -11.620 -7.044 -18.467 1.00 0.00 H new ATOM 1106 N THR A 74 -14.075 -4.756 -14.172 1.00 0.00 N ATOM 1107 CA THR A 74 -14.915 -3.690 -13.658 1.00 0.00 C ATOM 1108 C THR A 74 -14.295 -3.235 -12.354 1.00 0.00 C ATOM 1109 O THR A 74 -13.934 -4.039 -11.496 1.00 0.00 O ATOM 1110 CB THR A 74 -16.366 -4.172 -13.499 1.00 0.00 C ATOM 1111 OG1 THR A 74 -16.902 -4.496 -14.764 1.00 0.00 O ATOM 1112 CG2 THR A 74 -17.273 -3.116 -12.858 1.00 0.00 C ATOM 0 H THR A 74 -13.786 -5.432 -13.465 1.00 0.00 H new ATOM 0 HA THR A 74 -14.965 -2.847 -14.347 1.00 0.00 H new ATOM 0 HB THR A 74 -16.335 -5.043 -12.844 1.00 0.00 H new ATOM 0 HG1 THR A 74 -17.330 -5.377 -14.722 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.285 -3.511 -12.770 1.00 0.00 H new ATOM 0 HG22 THR A 74 -16.895 -2.864 -11.867 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.285 -2.221 -13.480 1.00 0.00 H new ATOM 1120 N LEU A 75 -14.139 -1.929 -12.229 1.00 0.00 N ATOM 1121 CA LEU A 75 -13.510 -1.300 -11.101 1.00 0.00 C ATOM 1122 C LEU A 75 -14.620 -0.715 -10.251 1.00 0.00 C ATOM 1123 O LEU A 75 -15.614 -0.205 -10.773 1.00 0.00 O ATOM 1124 CB LEU A 75 -12.516 -0.227 -11.550 1.00 0.00 C ATOM 1125 CG LEU A 75 -11.336 -0.730 -12.409 1.00 0.00 C ATOM 1126 CD1 LEU A 75 -10.733 -2.066 -11.974 1.00 0.00 C ATOM 1127 CD2 LEU A 75 -11.662 -0.750 -13.912 1.00 0.00 C ATOM 0 H LEU A 75 -14.459 -1.265 -12.935 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.931 -2.022 -10.525 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.058 0.531 -12.116 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -12.114 0.264 -10.664 1.00 0.00 H new ATOM 0 HG LEU A 75 -10.562 0.016 -12.228 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.912 -2.329 -12.641 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -10.358 -1.981 -10.954 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.498 -2.841 -12.016 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -10.797 -1.112 -14.467 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.510 -1.410 -14.092 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.910 0.258 -14.244 1.00 0.00 H new ATOM 1139 N LEU A 76 -14.422 -0.770 -8.943 1.00 0.00 N ATOM 1140 CA LEU A 76 -15.322 -0.241 -7.933 1.00 0.00 C ATOM 1141 C LEU A 76 -14.454 0.683 -7.102 1.00 0.00 C ATOM 1142 O LEU A 76 -13.322 0.317 -6.790 1.00 0.00 O ATOM 1143 CB LEU A 76 -15.889 -1.402 -7.080 1.00 0.00 C ATOM 1144 CG LEU A 76 -17.414 -1.590 -7.137 1.00 0.00 C ATOM 1145 CD1 LEU A 76 -18.147 -0.410 -6.496 1.00 0.00 C ATOM 1146 CD2 LEU A 76 -17.894 -1.843 -8.570 1.00 0.00 C ATOM 0 H LEU A 76 -13.592 -1.204 -8.540 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.180 0.283 -8.353 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.415 -2.329 -7.402 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.600 -1.240 -6.042 1.00 0.00 H new ATOM 0 HG LEU A 76 -17.657 -2.478 -6.553 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -19.223 -0.575 -6.553 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -17.849 -0.321 -5.451 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -17.892 0.508 -7.026 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -18.976 -1.971 -8.574 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -17.627 -0.993 -9.198 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -17.420 -2.745 -8.959 1.00 0.00 H new ATOM 1158 N VAL A 77 -14.943 1.860 -6.734 1.00 0.00 N ATOM 1159 CA VAL A 77 -14.187 2.774 -5.898 1.00 0.00 C ATOM 1160 C VAL A 77 -15.110 3.111 -4.752 1.00 0.00 C ATOM 1161 O VAL A 77 -16.269 3.485 -4.968 1.00 0.00 O ATOM 1162 CB VAL A 77 -13.717 4.016 -6.676 1.00 0.00 C ATOM 1163 CG1 VAL A 77 -12.680 4.802 -5.859 1.00 0.00 C ATOM 1164 CG2 VAL A 77 -13.097 3.654 -8.034 1.00 0.00 C ATOM 0 H VAL A 77 -15.865 2.202 -7.005 1.00 0.00 H new ATOM 0 HA VAL A 77 -13.261 2.326 -5.537 1.00 0.00 H new ATOM 0 HB VAL A 77 -14.604 4.625 -6.852 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -12.359 5.677 -6.424 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -13.126 5.122 -4.917 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -11.819 4.165 -5.655 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.781 4.564 -8.544 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.234 3.007 -7.879 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -13.835 3.134 -8.644 1.00 0.00 H new ATOM 1174 N LEU A 78 -14.591 2.941 -3.542 1.00 0.00 N ATOM 1175 CA LEU A 78 -15.304 3.156 -2.300 1.00 0.00 C ATOM 1176 C LEU A 78 -14.434 4.042 -1.415 1.00 0.00 C ATOM 1177 O LEU A 78 -13.212 4.094 -1.582 1.00 0.00 O ATOM 1178 CB LEU A 78 -15.635 1.825 -1.590 1.00 0.00 C ATOM 1179 CG LEU A 78 -16.475 0.824 -2.420 1.00 0.00 C ATOM 1180 CD1 LEU A 78 -15.597 -0.171 -3.197 1.00 0.00 C ATOM 1181 CD2 LEU A 78 -17.431 0.042 -1.512 1.00 0.00 C ATOM 0 H LEU A 78 -13.627 2.639 -3.399 1.00 0.00 H new ATOM 0 HA LEU A 78 -16.259 3.639 -2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -14.700 1.342 -1.306 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -16.172 2.048 -0.668 1.00 0.00 H new ATOM 0 HG LEU A 78 -17.041 1.414 -3.140 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.232 -0.852 -3.763 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.948 0.374 -3.882 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.987 -0.742 -2.497 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -18.013 -0.657 -2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -16.856 -0.510 -0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -18.104 0.736 -1.009 1.00 0.00 H new ATOM 1193 N LYS A 79 -15.046 4.723 -0.452 1.00 0.00 N ATOM 1194 CA LYS A 79 -14.350 5.531 0.535 1.00 0.00 C ATOM 1195 C LYS A 79 -15.088 5.358 1.847 1.00 0.00 C ATOM 1196 O LYS A 79 -16.291 5.609 1.902 1.00 0.00 O ATOM 1197 CB LYS A 79 -14.295 6.992 0.065 1.00 0.00 C ATOM 1198 CG LYS A 79 -13.463 7.859 1.021 1.00 0.00 C ATOM 1199 CD LYS A 79 -13.197 9.233 0.394 1.00 0.00 C ATOM 1200 CE LYS A 79 -12.280 10.084 1.283 1.00 0.00 C ATOM 1201 NZ LYS A 79 -11.895 11.353 0.620 1.00 0.00 N ATOM 0 H LYS A 79 -16.059 4.727 -0.336 1.00 0.00 H new ATOM 0 HA LYS A 79 -13.314 5.218 0.668 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.866 7.038 -0.936 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.307 7.392 -0.003 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.991 7.979 1.967 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.518 7.364 1.244 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.739 9.105 -0.587 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.142 9.754 0.239 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.786 10.304 2.223 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.383 9.516 1.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -11.091 11.778 1.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -11.624 11.161 -0.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.700 12.011 0.636 1.00 0.00 H new ATOM 1215 N ASP A 80 -14.379 4.886 2.875 1.00 0.00 N ATOM 1216 CA ASP A 80 -14.945 4.503 4.175 1.00 0.00 C ATOM 1217 C ASP A 80 -16.243 3.680 4.034 1.00 0.00 C ATOM 1218 O ASP A 80 -17.199 3.846 4.792 1.00 0.00 O ATOM 1219 CB ASP A 80 -15.087 5.750 5.066 1.00 0.00 C ATOM 1220 CG ASP A 80 -15.474 5.403 6.516 1.00 0.00 C ATOM 1221 OD1 ASP A 80 -14.863 4.486 7.110 1.00 0.00 O ATOM 1222 OD2 ASP A 80 -16.346 6.092 7.095 1.00 0.00 O ATOM 0 H ASP A 80 -13.369 4.755 2.827 1.00 0.00 H new ATOM 0 HA ASP A 80 -14.254 3.825 4.676 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -14.146 6.300 5.067 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -15.842 6.411 4.641 1.00 0.00 H new ATOM 1227 N GLY A 81 -16.294 2.801 3.023 1.00 0.00 N ATOM 1228 CA GLY A 81 -17.385 1.856 2.810 1.00 0.00 C ATOM 1229 C GLY A 81 -18.517 2.384 1.930 1.00 0.00 C ATOM 1230 O GLY A 81 -19.416 1.612 1.591 1.00 0.00 O ATOM 0 H GLY A 81 -15.559 2.731 2.319 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.981 0.951 2.357 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.797 1.571 3.778 1.00 0.00 H new ATOM 1234 N GLU A 82 -18.502 3.661 1.538 1.00 0.00 N ATOM 1235 CA GLU A 82 -19.486 4.218 0.617 1.00 0.00 C ATOM 1236 C GLU A 82 -18.931 4.032 -0.788 1.00 0.00 C ATOM 1237 O GLU A 82 -17.791 4.421 -1.026 1.00 0.00 O ATOM 1238 CB GLU A 82 -19.699 5.721 0.874 1.00 0.00 C ATOM 1239 CG GLU A 82 -20.227 6.019 2.281 1.00 0.00 C ATOM 1240 CD GLU A 82 -20.632 7.497 2.433 1.00 0.00 C ATOM 1241 OE1 GLU A 82 -21.802 7.844 2.153 1.00 0.00 O ATOM 1242 OE2 GLU A 82 -19.797 8.328 2.857 1.00 0.00 O ATOM 0 H GLU A 82 -17.805 4.335 1.853 1.00 0.00 H new ATOM 0 HA GLU A 82 -20.444 3.716 0.750 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -18.755 6.246 0.727 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -20.400 6.114 0.138 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -21.087 5.382 2.490 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.462 5.773 3.017 1.00 0.00 H new ATOM 1249 N VAL A 83 -19.693 3.457 -1.718 1.00 0.00 N ATOM 1250 CA VAL A 83 -19.326 3.467 -3.131 1.00 0.00 C ATOM 1251 C VAL A 83 -19.337 4.927 -3.578 1.00 0.00 C ATOM 1252 O VAL A 83 -20.276 5.676 -3.289 1.00 0.00 O ATOM 1253 CB VAL A 83 -20.288 2.588 -3.958 1.00 0.00 C ATOM 1254 CG1 VAL A 83 -19.923 2.600 -5.452 1.00 0.00 C ATOM 1255 CG2 VAL A 83 -20.292 1.128 -3.480 1.00 0.00 C ATOM 0 H VAL A 83 -20.570 2.978 -1.516 1.00 0.00 H new ATOM 0 HA VAL A 83 -18.335 3.040 -3.287 1.00 0.00 H new ATOM 0 HB VAL A 83 -21.279 3.019 -3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -20.622 1.970 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -19.977 3.620 -5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -18.910 2.218 -5.582 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -20.983 0.547 -4.091 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -19.289 0.712 -3.572 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -20.607 1.087 -2.437 1.00 0.00 H new ATOM 1265 N VAL A 84 -18.294 5.308 -4.307 1.00 0.00 N ATOM 1266 CA VAL A 84 -18.132 6.624 -4.893 1.00 0.00 C ATOM 1267 C VAL A 84 -17.947 6.518 -6.410 1.00 0.00 C ATOM 1268 O VAL A 84 -18.250 7.496 -7.093 1.00 0.00 O ATOM 1269 CB VAL A 84 -17.009 7.417 -4.186 1.00 0.00 C ATOM 1270 CG1 VAL A 84 -17.303 7.611 -2.687 1.00 0.00 C ATOM 1271 CG2 VAL A 84 -15.625 6.774 -4.349 1.00 0.00 C ATOM 0 H VAL A 84 -17.513 4.684 -4.510 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.044 7.199 -4.733 1.00 0.00 H new ATOM 0 HB VAL A 84 -16.990 8.388 -4.680 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -16.490 8.173 -2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -18.237 8.160 -2.567 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.390 6.638 -2.204 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -14.880 7.378 -3.831 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -15.638 5.770 -3.925 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.373 6.717 -5.408 1.00 0.00 H new ATOM 1281 N GLU A 85 -17.543 5.358 -6.959 1.00 0.00 N ATOM 1282 CA GLU A 85 -17.519 5.168 -8.416 1.00 0.00 C ATOM 1283 C GLU A 85 -17.643 3.690 -8.801 1.00 0.00 C ATOM 1284 O GLU A 85 -17.386 2.799 -7.991 1.00 0.00 O ATOM 1285 CB GLU A 85 -16.230 5.766 -9.036 1.00 0.00 C ATOM 1286 CG GLU A 85 -16.436 7.059 -9.842 1.00 0.00 C ATOM 1287 CD GLU A 85 -17.258 6.896 -11.137 1.00 0.00 C ATOM 1288 OE1 GLU A 85 -18.223 6.099 -11.178 1.00 0.00 O ATOM 1289 OE2 GLU A 85 -16.966 7.609 -12.124 1.00 0.00 O ATOM 0 H GLU A 85 -17.233 4.549 -6.421 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.384 5.697 -8.817 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.518 5.965 -8.235 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.777 5.018 -9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -16.932 7.791 -9.205 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -15.459 7.469 -10.099 1.00 0.00 H new ATOM 1296 N THR A 86 -18.013 3.431 -10.055 1.00 0.00 N ATOM 1297 CA THR A 86 -17.982 2.129 -10.712 1.00 0.00 C ATOM 1298 C THR A 86 -17.685 2.385 -12.198 1.00 0.00 C ATOM 1299 O THR A 86 -18.310 3.260 -12.807 1.00 0.00 O ATOM 1300 CB THR A 86 -19.328 1.413 -10.504 1.00 0.00 C ATOM 1301 OG1 THR A 86 -19.527 1.166 -9.128 1.00 0.00 O ATOM 1302 CG2 THR A 86 -19.459 0.096 -11.281 1.00 0.00 C ATOM 0 H THR A 86 -18.361 4.165 -10.671 1.00 0.00 H new ATOM 0 HA THR A 86 -17.213 1.479 -10.295 1.00 0.00 H new ATOM 0 HB THR A 86 -20.093 2.083 -10.897 1.00 0.00 H new ATOM 0 HG1 THR A 86 -20.385 0.712 -8.998 1.00 0.00 H new ATOM 0 HG21 THR A 86 -20.434 -0.348 -11.082 1.00 0.00 H new ATOM 0 HG22 THR A 86 -19.360 0.292 -12.349 1.00 0.00 H new ATOM 0 HG23 THR A 86 -18.676 -0.593 -10.964 1.00 0.00 H new ATOM 1310 N SER A 87 -16.756 1.624 -12.782 1.00 0.00 N ATOM 1311 CA SER A 87 -16.241 1.852 -14.137 1.00 0.00 C ATOM 1312 C SER A 87 -15.917 0.506 -14.791 1.00 0.00 C ATOM 1313 O SER A 87 -15.586 -0.437 -14.082 1.00 0.00 O ATOM 1314 CB SER A 87 -14.970 2.716 -14.062 1.00 0.00 C ATOM 1315 OG SER A 87 -15.176 3.907 -13.317 1.00 0.00 O ATOM 0 H SER A 87 -16.333 0.819 -12.320 1.00 0.00 H new ATOM 0 HA SER A 87 -16.992 2.370 -14.733 1.00 0.00 H new ATOM 0 HB2 SER A 87 -14.166 2.138 -13.606 1.00 0.00 H new ATOM 0 HB3 SER A 87 -14.646 2.972 -15.071 1.00 0.00 H new ATOM 0 HG SER A 87 -14.345 4.425 -13.293 1.00 0.00 H new ATOM 1321 N VAL A 88 -15.973 0.392 -16.120 1.00 0.00 N ATOM 1322 CA VAL A 88 -15.879 -0.895 -16.818 1.00 0.00 C ATOM 1323 C VAL A 88 -14.814 -0.789 -17.914 1.00 0.00 C ATOM 1324 O VAL A 88 -14.616 0.284 -18.495 1.00 0.00 O ATOM 1325 CB VAL A 88 -17.272 -1.287 -17.375 1.00 0.00 C ATOM 1326 CG1 VAL A 88 -17.274 -2.678 -18.031 1.00 0.00 C ATOM 1327 CG2 VAL A 88 -18.361 -1.292 -16.285 1.00 0.00 C ATOM 0 H VAL A 88 -16.085 1.190 -16.745 1.00 0.00 H new ATOM 0 HA VAL A 88 -15.574 -1.687 -16.134 1.00 0.00 H new ATOM 0 HB VAL A 88 -17.494 -0.524 -18.121 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -18.273 -2.903 -18.404 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -16.566 -2.690 -18.860 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.984 -3.428 -17.295 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -19.317 -1.573 -16.727 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -18.095 -2.010 -15.509 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -18.442 -0.297 -15.847 1.00 0.00 H new ATOM 1337 N GLY A 89 -14.140 -1.900 -18.210 1.00 0.00 N ATOM 1338 CA GLY A 89 -13.180 -2.018 -19.299 1.00 0.00 C ATOM 1339 C GLY A 89 -11.805 -1.467 -18.924 1.00 0.00 C ATOM 1340 O GLY A 89 -11.608 -0.914 -17.837 1.00 0.00 O ATOM 0 H GLY A 89 -14.252 -2.765 -17.682 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -13.084 -3.066 -19.583 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -13.557 -1.485 -20.172 1.00 0.00 H new ATOM 1344 N PHE A 90 -10.847 -1.629 -19.841 1.00 0.00 N ATOM 1345 CA PHE A 90 -9.490 -1.106 -19.703 1.00 0.00 C ATOM 1346 C PHE A 90 -9.515 0.418 -19.514 1.00 0.00 C ATOM 1347 O PHE A 90 -10.439 1.100 -19.973 1.00 0.00 O ATOM 1348 CB PHE A 90 -8.663 -1.510 -20.937 1.00 0.00 C ATOM 1349 CG PHE A 90 -7.218 -1.042 -20.903 1.00 0.00 C ATOM 1350 CD1 PHE A 90 -6.246 -1.796 -20.217 1.00 0.00 C ATOM 1351 CD2 PHE A 90 -6.851 0.169 -21.524 1.00 0.00 C ATOM 1352 CE1 PHE A 90 -4.921 -1.332 -20.140 1.00 0.00 C ATOM 1353 CE2 PHE A 90 -5.527 0.633 -21.441 1.00 0.00 C ATOM 1354 CZ PHE A 90 -4.561 -0.116 -20.746 1.00 0.00 C ATOM 0 H PHE A 90 -10.998 -2.136 -20.713 1.00 0.00 H new ATOM 0 HA PHE A 90 -9.022 -1.533 -18.816 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -8.679 -2.596 -21.030 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -9.142 -1.106 -21.829 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.519 -2.731 -19.750 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.589 0.742 -22.065 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.177 -1.912 -19.613 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.251 1.565 -21.911 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.544 0.242 -20.678 1.00 0.00 H new ATOM 1364 N LYS A 91 -8.481 0.964 -18.871 1.00 0.00 N ATOM 1365 CA LYS A 91 -8.224 2.398 -18.783 1.00 0.00 C ATOM 1366 C LYS A 91 -6.714 2.587 -18.621 1.00 0.00 C ATOM 1367 O LYS A 91 -6.089 1.755 -17.960 1.00 0.00 O ATOM 1368 CB LYS A 91 -8.998 3.003 -17.593 1.00 0.00 C ATOM 1369 CG LYS A 91 -10.112 3.950 -18.076 1.00 0.00 C ATOM 1370 CD LYS A 91 -11.356 3.929 -17.178 1.00 0.00 C ATOM 1371 CE LYS A 91 -12.151 2.610 -17.240 1.00 0.00 C ATOM 1372 NZ LYS A 91 -12.638 2.287 -18.605 1.00 0.00 N ATOM 0 H LYS A 91 -7.782 0.403 -18.385 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.564 2.912 -19.682 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.432 2.203 -16.994 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -8.309 3.547 -16.947 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.721 4.967 -18.121 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.400 3.674 -19.091 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.051 4.109 -16.147 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.012 4.751 -17.464 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.520 1.796 -16.884 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -13.003 2.674 -16.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.328 1.511 -18.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -13.092 3.126 -19.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -11.836 1.998 -19.200 1.00 0.00 H new ATOM 1386 N PRO A 92 -6.121 3.644 -19.204 1.00 0.00 N ATOM 1387 CA PRO A 92 -4.709 3.947 -19.026 1.00 0.00 C ATOM 1388 C PRO A 92 -4.450 4.464 -17.607 1.00 0.00 C ATOM 1389 O PRO A 92 -5.372 4.914 -16.917 1.00 0.00 O ATOM 1390 CB PRO A 92 -4.390 5.003 -20.092 1.00 0.00 C ATOM 1391 CG PRO A 92 -5.715 5.743 -20.264 1.00 0.00 C ATOM 1392 CD PRO A 92 -6.757 4.645 -20.050 1.00 0.00 C ATOM 0 HA PRO A 92 -4.072 3.070 -19.143 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -3.594 5.674 -19.768 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -4.061 4.546 -21.025 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.824 6.549 -19.538 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -5.800 6.192 -21.254 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.653 5.045 -19.575 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -7.067 4.212 -21.001 1.00 0.00 H new ATOM 1400 N LYS A 93 -3.175 4.456 -17.191 1.00 0.00 N ATOM 1401 CA LYS A 93 -2.769 4.907 -15.859 1.00 0.00 C ATOM 1402 C LYS A 93 -3.264 6.319 -15.598 1.00 0.00 C ATOM 1403 O LYS A 93 -3.801 6.568 -14.527 1.00 0.00 O ATOM 1404 CB LYS A 93 -1.234 4.839 -15.701 1.00 0.00 C ATOM 1405 CG LYS A 93 -0.780 5.222 -14.283 1.00 0.00 C ATOM 1406 CD LYS A 93 0.738 5.411 -14.206 1.00 0.00 C ATOM 1407 CE LYS A 93 1.082 5.951 -12.814 1.00 0.00 C ATOM 1408 NZ LYS A 93 2.541 6.099 -12.609 1.00 0.00 N ATOM 0 H LYS A 93 -2.399 4.136 -17.771 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.220 4.240 -15.124 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.891 3.830 -15.931 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.766 5.507 -16.424 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.277 6.143 -13.978 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.086 4.447 -13.581 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.249 4.465 -14.384 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.075 6.104 -14.977 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.598 6.918 -12.673 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.678 5.279 -12.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.716 6.707 -11.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.965 5.164 -12.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.968 6.531 -13.453 1.00 0.00 H new ATOM 1422 N GLU A 94 -3.093 7.239 -16.550 1.00 0.00 N ATOM 1423 CA GLU A 94 -3.333 8.656 -16.294 1.00 0.00 C ATOM 1424 C GLU A 94 -4.803 8.916 -15.974 1.00 0.00 C ATOM 1425 O GLU A 94 -5.098 9.669 -15.044 1.00 0.00 O ATOM 1426 CB GLU A 94 -2.868 9.507 -17.487 1.00 0.00 C ATOM 1427 CG GLU A 94 -1.351 9.455 -17.728 1.00 0.00 C ATOM 1428 CD GLU A 94 -0.549 10.092 -16.579 1.00 0.00 C ATOM 1429 OE1 GLU A 94 -0.296 11.318 -16.617 1.00 0.00 O ATOM 1430 OE2 GLU A 94 -0.150 9.371 -15.637 1.00 0.00 O ATOM 0 H GLU A 94 -2.790 7.027 -17.501 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.749 8.947 -15.421 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -3.382 9.168 -18.386 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.166 10.542 -17.321 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.041 8.417 -17.851 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.117 9.970 -18.660 1.00 0.00 H new ATOM 1437 N ALA A 95 -5.716 8.251 -16.684 1.00 0.00 N ATOM 1438 CA ALA A 95 -7.142 8.364 -16.435 1.00 0.00 C ATOM 1439 C ALA A 95 -7.504 7.751 -15.084 1.00 0.00 C ATOM 1440 O ALA A 95 -8.255 8.345 -14.313 1.00 0.00 O ATOM 1441 CB ALA A 95 -7.905 7.643 -17.548 1.00 0.00 C ATOM 0 H ALA A 95 -5.480 7.619 -17.449 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.415 9.419 -16.419 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.977 7.724 -17.366 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.664 8.099 -18.508 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -7.619 6.591 -17.563 1.00 0.00 H new ATOM 1447 N LEU A 96 -6.968 6.566 -14.791 1.00 0.00 N ATOM 1448 CA LEU A 96 -7.289 5.833 -13.579 1.00 0.00 C ATOM 1449 C LEU A 96 -6.751 6.570 -12.352 1.00 0.00 C ATOM 1450 O LEU A 96 -7.459 6.673 -11.352 1.00 0.00 O ATOM 1451 CB LEU A 96 -6.739 4.402 -13.693 1.00 0.00 C ATOM 1452 CG LEU A 96 -7.077 3.503 -12.487 1.00 0.00 C ATOM 1453 CD1 LEU A 96 -8.586 3.356 -12.247 1.00 0.00 C ATOM 1454 CD2 LEU A 96 -6.471 2.114 -12.718 1.00 0.00 C ATOM 0 H LEU A 96 -6.297 6.091 -15.394 1.00 0.00 H new ATOM 0 HA LEU A 96 -8.370 5.768 -13.456 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -7.135 3.942 -14.598 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -5.656 4.448 -13.807 1.00 0.00 H new ATOM 0 HG LEU A 96 -6.657 3.980 -11.602 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -8.756 2.712 -11.385 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -9.022 4.337 -12.058 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -9.053 2.915 -13.127 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.704 1.470 -11.870 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -6.888 1.682 -13.628 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.389 2.201 -12.820 1.00 0.00 H new ATOM 1466 N GLN A 97 -5.537 7.128 -12.421 1.00 0.00 N ATOM 1467 CA GLN A 97 -4.983 7.881 -11.304 1.00 0.00 C ATOM 1468 C GLN A 97 -5.710 9.212 -11.157 1.00 0.00 C ATOM 1469 O GLN A 97 -5.863 9.687 -10.035 1.00 0.00 O ATOM 1470 CB GLN A 97 -3.452 8.030 -11.385 1.00 0.00 C ATOM 1471 CG GLN A 97 -2.925 8.964 -12.483 1.00 0.00 C ATOM 1472 CD GLN A 97 -2.980 10.458 -12.159 1.00 0.00 C ATOM 1473 OE1 GLN A 97 -2.435 10.923 -11.162 1.00 0.00 O ATOM 1474 NE2 GLN A 97 -3.630 11.238 -13.009 1.00 0.00 N ATOM 0 H GLN A 97 -4.927 7.070 -13.236 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.155 7.309 -10.392 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -3.091 8.392 -10.423 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -3.018 7.042 -11.537 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.891 8.695 -12.699 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.498 8.786 -13.393 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -4.077 10.834 -13.832 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.684 12.243 -12.841 1.00 0.00 H new ATOM 1483 N GLU A 98 -6.197 9.804 -12.256 1.00 0.00 N ATOM 1484 CA GLU A 98 -6.962 11.037 -12.179 1.00 0.00 C ATOM 1485 C GLU A 98 -8.258 10.729 -11.435 1.00 0.00 C ATOM 1486 O GLU A 98 -8.577 11.403 -10.459 1.00 0.00 O ATOM 1487 CB GLU A 98 -7.212 11.611 -13.583 1.00 0.00 C ATOM 1488 CG GLU A 98 -7.949 12.958 -13.555 1.00 0.00 C ATOM 1489 CD GLU A 98 -7.128 14.097 -12.918 1.00 0.00 C ATOM 1490 OE1 GLU A 98 -5.974 14.337 -13.339 1.00 0.00 O ATOM 1491 OE2 GLU A 98 -7.650 14.772 -12.003 1.00 0.00 O ATOM 0 H GLU A 98 -6.071 9.444 -13.202 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.411 11.805 -11.636 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.258 11.735 -14.095 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.794 10.896 -14.164 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.215 13.239 -14.574 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -8.882 12.841 -13.003 1.00 0.00 H new ATOM 1498 N LEU A 99 -8.946 9.655 -11.829 1.00 0.00 N ATOM 1499 CA LEU A 99 -10.186 9.220 -11.192 1.00 0.00 C ATOM 1500 C LEU A 99 -9.960 8.974 -9.699 1.00 0.00 C ATOM 1501 O LEU A 99 -10.743 9.446 -8.878 1.00 0.00 O ATOM 1502 CB LEU A 99 -10.736 7.990 -11.935 1.00 0.00 C ATOM 1503 CG LEU A 99 -12.141 7.552 -11.463 1.00 0.00 C ATOM 1504 CD1 LEU A 99 -12.882 6.870 -12.620 1.00 0.00 C ATOM 1505 CD2 LEU A 99 -12.101 6.560 -10.294 1.00 0.00 C ATOM 0 H LEU A 99 -8.654 9.060 -12.605 1.00 0.00 H new ATOM 0 HA LEU A 99 -10.942 10.003 -11.259 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.773 8.209 -13.002 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -10.043 7.159 -11.804 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.648 8.458 -11.130 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -13.873 6.562 -12.286 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.980 7.568 -13.451 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -12.320 5.995 -12.946 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.118 6.292 -10.010 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -11.560 5.663 -10.596 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.596 7.019 -9.444 1.00 0.00 H new ATOM 1517 N VAL A 100 -8.869 8.296 -9.332 1.00 0.00 N ATOM 1518 CA VAL A 100 -8.511 8.059 -7.938 1.00 0.00 C ATOM 1519 C VAL A 100 -8.298 9.389 -7.208 1.00 0.00 C ATOM 1520 O VAL A 100 -8.863 9.587 -6.133 1.00 0.00 O ATOM 1521 CB VAL A 100 -7.285 7.118 -7.882 1.00 0.00 C ATOM 1522 CG1 VAL A 100 -6.491 7.203 -6.571 1.00 0.00 C ATOM 1523 CG2 VAL A 100 -7.738 5.666 -8.106 1.00 0.00 C ATOM 0 H VAL A 100 -8.209 7.896 -9.999 1.00 0.00 H new ATOM 0 HA VAL A 100 -9.325 7.559 -7.413 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.613 7.449 -8.674 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -5.648 6.513 -6.611 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -6.122 8.220 -6.434 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -7.138 6.937 -5.736 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -6.873 5.005 -8.066 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.448 5.382 -7.329 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -8.215 5.580 -9.082 1.00 0.00 H new ATOM 1533 N ASN A 101 -7.521 10.318 -7.774 1.00 0.00 N ATOM 1534 CA ASN A 101 -7.189 11.570 -7.089 1.00 0.00 C ATOM 1535 C ASN A 101 -8.405 12.474 -6.882 1.00 0.00 C ATOM 1536 O ASN A 101 -8.385 13.304 -5.976 1.00 0.00 O ATOM 1537 CB ASN A 101 -6.004 12.294 -7.746 1.00 0.00 C ATOM 1538 CG ASN A 101 -6.351 13.584 -8.484 1.00 0.00 C ATOM 1539 OD1 ASN A 101 -6.063 14.686 -8.029 1.00 0.00 O ATOM 1540 ND2 ASN A 101 -6.940 13.453 -9.654 1.00 0.00 N ATOM 0 H ASN A 101 -7.111 10.226 -8.703 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.859 11.296 -6.087 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.268 12.523 -6.975 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -5.527 11.611 -8.449 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -7.168 14.280 -10.206 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.168 12.524 -10.009 1.00 0.00 H new ATOM 1547 N LYS A 102 -9.477 12.288 -7.663 1.00 0.00 N ATOM 1548 CA LYS A 102 -10.757 12.947 -7.373 1.00 0.00 C ATOM 1549 C LYS A 102 -11.295 12.528 -5.999 1.00 0.00 C ATOM 1550 O LYS A 102 -11.919 13.350 -5.325 1.00 0.00 O ATOM 1551 CB LYS A 102 -11.849 12.645 -8.420 1.00 0.00 C ATOM 1552 CG LYS A 102 -11.557 12.989 -9.887 1.00 0.00 C ATOM 1553 CD LYS A 102 -10.909 14.364 -10.100 1.00 0.00 C ATOM 1554 CE LYS A 102 -10.980 14.737 -11.587 1.00 0.00 C ATOM 1555 NZ LYS A 102 -10.149 15.922 -11.907 1.00 0.00 N ATOM 0 H LYS A 102 -9.485 11.693 -8.492 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.539 14.015 -7.396 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -12.078 11.581 -8.366 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -12.751 13.180 -8.125 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.902 12.224 -10.303 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -12.490 12.950 -10.449 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.421 15.116 -9.500 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -9.871 14.344 -9.768 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -10.649 13.890 -12.188 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -12.016 14.937 -11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.462 16.331 -12.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.250 16.631 -11.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -9.152 15.636 -11.983 1.00 0.00 H new ATOM 1569 N HIS A 103 -11.088 11.271 -5.590 1.00 0.00 N ATOM 1570 CA HIS A 103 -11.687 10.703 -4.385 1.00 0.00 C ATOM 1571 C HIS A 103 -10.739 10.734 -3.183 1.00 0.00 C ATOM 1572 O HIS A 103 -11.218 10.698 -2.047 1.00 0.00 O ATOM 1573 CB HIS A 103 -12.150 9.268 -4.668 1.00 0.00 C ATOM 1574 CG HIS A 103 -13.197 9.181 -5.753 1.00 0.00 C ATOM 1575 ND1 HIS A 103 -14.459 9.737 -5.723 1.00 0.00 N ATOM 1576 CD2 HIS A 103 -13.069 8.544 -6.957 1.00 0.00 C ATOM 1577 CE1 HIS A 103 -15.074 9.431 -6.879 1.00 0.00 C ATOM 1578 NE2 HIS A 103 -14.264 8.703 -7.668 1.00 0.00 N ATOM 0 H HIS A 103 -10.492 10.615 -6.095 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.544 11.323 -4.121 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -11.288 8.666 -4.955 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -12.550 8.835 -3.751 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -14.856 10.284 -4.959 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -12.195 8.010 -7.300 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -16.079 9.729 -7.138 1.00 0.00 H new ATOM 1586 N LEU A 104 -9.420 10.808 -3.402 1.00 0.00 N ATOM 1587 CA LEU A 104 -8.445 11.005 -2.329 1.00 0.00 C ATOM 1588 C LEU A 104 -8.816 12.249 -1.526 1.00 0.00 C ATOM 1589 O LEU A 104 -8.923 12.142 -0.288 1.00 0.00 O ATOM 1590 CB LEU A 104 -7.007 11.126 -2.867 1.00 0.00 C ATOM 1591 CG LEU A 104 -6.405 9.838 -3.456 1.00 0.00 C ATOM 1592 CD1 LEU A 104 -4.984 10.122 -3.951 1.00 0.00 C ATOM 1593 CD2 LEU A 104 -6.360 8.688 -2.444 1.00 0.00 C ATOM 1594 OXT LEU A 104 -8.984 13.330 -2.129 1.00 0.00 O ATOM 0 H LEU A 104 -9.002 10.733 -4.329 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.473 10.126 -1.685 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.990 11.898 -3.636 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.363 11.469 -2.057 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.051 9.528 -4.277 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.555 9.211 -4.369 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.014 10.894 -4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.370 10.463 -3.118 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.926 7.806 -2.915 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.751 8.980 -1.589 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.371 8.459 -2.108 1.00 0.00 H new TER 1606 LEU A 104