USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 561 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0.0098) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 91:sc= 1.17 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 50:sc= -0.191 USER MOD Single : A 33 SER OG : rot 180:sc= 0.0761 USER MOD Single : A 38 SER OG : rot 84:sc= 1.19 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0117) USER MOD Single : A 48 ASN : amide:sc=-0.00489 X(o=-0.0049,f=-0.1) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.321 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0615) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -151:sc= -0.117 (180deg=-0.528) USER MOD Single : A 68 GLN : amide:sc= 0.041 K(o=0.041,f=-8.3!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 168:sc= 0.769 (180deg=0.412) USER MOD Single : A 73 MET CE :methyl -146:sc= -0.325 (180deg=-1.02) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.26 F(o=-1.1,f=-0.26) USER MOD Single : A 77 ASN : amide:sc= -0.115 X(o=-0.12,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.200 -6.718 1.546 1.00 0.00 N ATOM 105 CA GLN A 10 -16.089 -7.310 2.538 1.00 0.00 C ATOM 106 C GLN A 10 -17.279 -7.987 1.868 1.00 0.00 C ATOM 107 O GLN A 10 -17.646 -7.675 0.735 1.00 0.00 O ATOM 108 CB GLN A 10 -16.580 -6.241 3.517 1.00 0.00 C ATOM 109 CG GLN A 10 -16.950 -4.928 2.848 1.00 0.00 C ATOM 110 CD GLN A 10 -15.865 -3.878 2.984 1.00 0.00 C ATOM 111 OE1 GLN A 10 -15.043 -3.697 2.085 1.00 0.00 O ATOM 112 NE2 GLN A 10 -15.856 -3.177 4.112 1.00 0.00 N ATOM 0 HA GLN A 10 -15.527 -8.065 3.087 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.448 -6.623 4.054 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -15.803 -6.055 4.259 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -17.147 -5.106 1.791 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -17.874 -4.549 3.285 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -16.556 -3.359 4.831 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -15.149 -2.456 4.259 1.00 0.00 H new ATOM 121 N PRO A 11 -17.899 -8.939 2.582 1.00 0.00 N ATOM 122 CA PRO A 11 -19.058 -9.681 2.075 1.00 0.00 C ATOM 123 C PRO A 11 -20.304 -8.809 1.972 1.00 0.00 C ATOM 124 O PRO A 11 -20.484 -7.849 2.722 1.00 0.00 O ATOM 125 CB PRO A 11 -19.259 -10.780 3.121 1.00 0.00 C ATOM 126 CG PRO A 11 -18.669 -10.227 4.372 1.00 0.00 C ATOM 127 CD PRO A 11 -17.517 -9.363 3.939 1.00 0.00 C ATOM 0 HA PRO A 11 -18.892 -10.059 1.066 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.316 -11.013 3.252 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.763 -11.704 2.824 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.405 -9.646 4.927 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.331 -11.027 5.031 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.383 -8.510 4.604 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.578 -9.917 3.938 1.00 0.00 H new ATOM 135 N PRO A 12 -21.188 -9.148 1.022 1.00 0.00 N ATOM 136 CA PRO A 12 -22.434 -8.408 0.799 1.00 0.00 C ATOM 137 C PRO A 12 -23.433 -8.601 1.934 1.00 0.00 C ATOM 138 O PRO A 12 -23.143 -9.276 2.922 1.00 0.00 O ATOM 139 CB PRO A 12 -22.977 -9.011 -0.499 1.00 0.00 C ATOM 140 CG PRO A 12 -22.393 -10.380 -0.554 1.00 0.00 C ATOM 141 CD PRO A 12 -21.039 -10.279 0.092 1.00 0.00 C ATOM 0 HA PRO A 12 -22.266 -7.332 0.748 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.066 -9.045 -0.494 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -22.681 -8.419 -1.365 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -23.025 -11.095 -0.027 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.309 -10.727 -1.584 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.774 -11.198 0.616 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.256 -10.094 -0.643 1.00 0.00 H new ATOM 149 N ALA A 13 -24.612 -8.005 1.787 1.00 0.00 N ATOM 150 CA ALA A 13 -25.655 -8.114 2.799 1.00 0.00 C ATOM 151 C ALA A 13 -26.207 -9.533 2.868 1.00 0.00 C ATOM 152 O ALA A 13 -26.489 -10.048 3.951 1.00 0.00 O ATOM 153 CB ALA A 13 -26.774 -7.124 2.512 1.00 0.00 C ATOM 0 H ALA A 13 -24.868 -7.442 0.976 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.214 -7.877 3.767 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.546 -7.216 3.276 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -26.374 -6.110 2.521 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -27.205 -7.335 1.533 1.00 0.00 H new ATOM 159 N ASP A 14 -26.359 -10.161 1.708 1.00 0.00 N ATOM 160 CA ASP A 14 -26.877 -11.523 1.637 1.00 0.00 C ATOM 161 C ASP A 14 -25.780 -12.501 1.227 1.00 0.00 C ATOM 162 O ASP A 14 -25.095 -12.297 0.224 1.00 0.00 O ATOM 163 CB ASP A 14 -28.040 -11.597 0.647 1.00 0.00 C ATOM 164 CG ASP A 14 -29.064 -10.501 0.873 1.00 0.00 C ATOM 165 OD1 ASP A 14 -29.695 -10.492 1.950 1.00 0.00 O ATOM 166 OD2 ASP A 14 -29.234 -9.654 -0.029 1.00 0.00 O ATOM 0 H ASP A 14 -26.131 -9.749 0.803 1.00 0.00 H new ATOM 0 HA ASP A 14 -27.235 -11.802 2.628 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.653 -11.525 -0.369 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.527 -12.568 0.735 1.00 0.00 H new ATOM 171 N LEU A 15 -25.619 -13.562 2.009 1.00 0.00 N ATOM 172 CA LEU A 15 -24.605 -14.573 1.728 1.00 0.00 C ATOM 173 C LEU A 15 -25.196 -15.732 0.933 1.00 0.00 C ATOM 174 O LEU A 15 -24.879 -16.895 1.183 1.00 0.00 O ATOM 175 CB LEU A 15 -23.998 -15.091 3.033 1.00 0.00 C ATOM 176 CG LEU A 15 -23.427 -14.031 3.975 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.310 -14.580 5.389 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.073 -13.547 3.476 1.00 0.00 C ATOM 0 H LEU A 15 -26.177 -13.745 2.843 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.821 -14.109 1.129 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -24.764 -15.650 3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -23.203 -15.795 2.786 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.111 -13.182 3.992 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -22.902 -13.811 6.045 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.296 -14.876 5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.648 -15.446 5.389 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.682 -12.793 4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -21.381 -14.388 3.429 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -22.185 -13.113 2.482 1.00 0.00 H new ATOM 190 N SER A 16 -26.057 -15.407 -0.027 1.00 0.00 N ATOM 191 CA SER A 16 -26.694 -16.421 -0.858 1.00 0.00 C ATOM 192 C SER A 16 -26.219 -16.316 -2.304 1.00 0.00 C ATOM 193 O SER A 16 -26.930 -16.697 -3.232 1.00 0.00 O ATOM 194 CB SER A 16 -28.216 -16.278 -0.798 1.00 0.00 C ATOM 195 OG SER A 16 -28.650 -15.140 -1.523 1.00 0.00 O ATOM 0 H SER A 16 -26.329 -14.449 -0.248 1.00 0.00 H new ATOM 0 HA SER A 16 -26.413 -17.401 -0.472 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.685 -17.174 -1.206 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.536 -16.195 0.241 1.00 0.00 H new ATOM 0 HG SER A 16 -29.626 -15.072 -1.471 1.00 0.00 H new ATOM 201 N GLY A 17 -25.008 -15.796 -2.486 1.00 0.00 N ATOM 202 CA GLY A 17 -24.457 -15.650 -3.821 1.00 0.00 C ATOM 203 C GLY A 17 -22.942 -15.668 -3.827 1.00 0.00 C ATOM 204 O GLY A 17 -22.310 -15.104 -4.722 1.00 0.00 O ATOM 0 H GLY A 17 -24.400 -15.474 -1.733 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.829 -16.455 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.808 -14.714 -4.255 1.00 0.00 H new ATOM 208 N LEU A 18 -22.355 -16.315 -2.826 1.00 0.00 N ATOM 209 CA LEU A 18 -20.903 -16.403 -2.719 1.00 0.00 C ATOM 210 C LEU A 18 -20.421 -17.823 -3.002 1.00 0.00 C ATOM 211 O LEU A 18 -20.988 -18.793 -2.499 1.00 0.00 O ATOM 212 CB LEU A 18 -20.447 -15.966 -1.326 1.00 0.00 C ATOM 213 CG LEU A 18 -20.839 -14.549 -0.906 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.462 -14.299 0.547 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.178 -13.522 -1.814 1.00 0.00 C ATOM 0 H LEU A 18 -22.862 -16.786 -2.077 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.468 -15.736 -3.463 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.854 -16.666 -0.596 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.361 -16.051 -1.278 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.920 -14.448 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.749 -13.286 0.828 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.981 -15.013 1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.386 -14.419 0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.468 -12.519 -1.501 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.095 -13.623 -1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.497 -13.687 -2.843 1.00 0.00 H new ATOM 227 N SER A 19 -19.371 -17.936 -3.808 1.00 0.00 N ATOM 228 CA SER A 19 -18.813 -19.237 -4.159 1.00 0.00 C ATOM 229 C SER A 19 -17.972 -19.794 -3.015 1.00 0.00 C ATOM 230 O SER A 19 -17.700 -19.100 -2.035 1.00 0.00 O ATOM 231 CB SER A 19 -17.963 -19.126 -5.426 1.00 0.00 C ATOM 232 OG SER A 19 -16.644 -18.707 -5.120 1.00 0.00 O ATOM 0 H SER A 19 -18.889 -17.143 -4.231 1.00 0.00 H new ATOM 0 HA SER A 19 -19.641 -19.922 -4.345 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.933 -20.090 -5.933 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.422 -18.417 -6.115 1.00 0.00 H new ATOM 0 HG SER A 19 -16.120 -18.645 -5.946 1.00 0.00 H new ATOM 238 N ILE A 20 -17.562 -21.051 -3.148 1.00 0.00 N ATOM 239 CA ILE A 20 -16.750 -21.701 -2.127 1.00 0.00 C ATOM 240 C ILE A 20 -15.493 -20.892 -1.826 1.00 0.00 C ATOM 241 O ILE A 20 -15.041 -20.832 -0.683 1.00 0.00 O ATOM 242 CB ILE A 20 -16.342 -23.124 -2.554 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.584 -23.971 -2.838 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.485 -23.774 -1.478 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.265 -25.360 -3.344 1.00 0.00 C ATOM 0 H ILE A 20 -17.779 -21.639 -3.953 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.363 -21.762 -1.228 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.754 -23.058 -3.469 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.175 -24.052 -1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.203 -23.458 -3.574 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.205 -24.779 -1.794 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.586 -23.179 -1.320 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -16.050 -23.831 -0.548 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.192 -25.904 -3.524 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.700 -25.288 -4.274 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.672 -25.891 -2.600 1.00 0.00 H new ATOM 257 N GLU A 21 -14.935 -20.270 -2.860 1.00 0.00 N ATOM 258 CA GLU A 21 -13.730 -19.463 -2.705 1.00 0.00 C ATOM 259 C GLU A 21 -14.048 -18.135 -2.025 1.00 0.00 C ATOM 260 O GLU A 21 -13.245 -17.616 -1.250 1.00 0.00 O ATOM 261 CB GLU A 21 -13.082 -19.209 -4.068 1.00 0.00 C ATOM 262 CG GLU A 21 -11.592 -19.505 -4.098 1.00 0.00 C ATOM 263 CD GLU A 21 -10.870 -18.757 -5.202 1.00 0.00 C ATOM 264 OE1 GLU A 21 -11.125 -19.056 -6.387 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.051 -17.871 -4.880 1.00 0.00 O ATOM 0 H GLU A 21 -15.297 -20.309 -3.813 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.032 -20.015 -2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.581 -19.823 -4.818 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.243 -18.168 -4.349 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.153 -19.238 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.441 -20.576 -4.231 1.00 0.00 H new ATOM 272 N GLU A 22 -15.225 -17.592 -2.320 1.00 0.00 N ATOM 273 CA GLU A 22 -15.648 -16.324 -1.738 1.00 0.00 C ATOM 274 C GLU A 22 -15.905 -16.472 -0.241 1.00 0.00 C ATOM 275 O GLU A 22 -15.725 -15.527 0.527 1.00 0.00 O ATOM 276 CB GLU A 22 -16.911 -15.814 -2.435 1.00 0.00 C ATOM 277 CG GLU A 22 -16.644 -15.174 -3.787 1.00 0.00 C ATOM 278 CD GLU A 22 -16.409 -13.679 -3.689 1.00 0.00 C ATOM 279 OE1 GLU A 22 -15.764 -13.244 -2.712 1.00 0.00 O ATOM 280 OE2 GLU A 22 -16.870 -12.945 -4.587 1.00 0.00 O ATOM 0 H GLU A 22 -15.902 -18.010 -2.958 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.845 -15.601 -1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.604 -16.645 -2.566 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.404 -15.087 -1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.773 -15.646 -4.242 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.490 -15.362 -4.447 1.00 0.00 H new ATOM 287 N VAL A 23 -16.327 -17.664 0.166 1.00 0.00 N ATOM 288 CA VAL A 23 -16.608 -17.937 1.571 1.00 0.00 C ATOM 289 C VAL A 23 -15.346 -17.814 2.418 1.00 0.00 C ATOM 290 O VAL A 23 -15.394 -17.350 3.557 1.00 0.00 O ATOM 291 CB VAL A 23 -17.206 -19.344 1.761 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.518 -19.598 3.228 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.451 -19.513 0.904 1.00 0.00 C ATOM 0 H VAL A 23 -16.482 -18.457 -0.457 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.335 -17.194 1.898 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.469 -20.080 1.439 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.940 -20.597 3.343 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.602 -19.521 3.813 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.237 -18.858 3.581 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.861 -20.512 1.050 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.195 -18.770 1.192 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.191 -19.378 -0.146 1.00 0.00 H new ATOM 303 N SER A 24 -14.218 -18.233 1.853 1.00 0.00 N ATOM 304 CA SER A 24 -12.943 -18.173 2.557 1.00 0.00 C ATOM 305 C SER A 24 -12.665 -16.759 3.059 1.00 0.00 C ATOM 306 O SER A 24 -12.118 -16.568 4.145 1.00 0.00 O ATOM 307 CB SER A 24 -11.808 -18.633 1.641 1.00 0.00 C ATOM 308 OG SER A 24 -12.297 -19.460 0.599 1.00 0.00 O ATOM 0 H SER A 24 -14.162 -18.618 0.910 1.00 0.00 H new ATOM 0 HA SER A 24 -13.000 -18.841 3.417 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.306 -17.765 1.215 1.00 0.00 H new ATOM 0 HB3 SER A 24 -11.065 -19.177 2.223 1.00 0.00 H new ATOM 0 HG SER A 24 -12.530 -18.907 -0.176 1.00 0.00 H new ATOM 314 N LYS A 25 -13.046 -15.769 2.258 1.00 0.00 N ATOM 315 CA LYS A 25 -12.840 -14.371 2.619 1.00 0.00 C ATOM 316 C LYS A 25 -13.986 -13.858 3.485 1.00 0.00 C ATOM 317 O LYS A 25 -13.812 -12.930 4.275 1.00 0.00 O ATOM 318 CB LYS A 25 -12.715 -13.511 1.359 1.00 0.00 C ATOM 319 CG LYS A 25 -11.622 -13.976 0.412 1.00 0.00 C ATOM 320 CD LYS A 25 -10.968 -12.805 -0.302 1.00 0.00 C ATOM 321 CE LYS A 25 -11.408 -12.722 -1.756 1.00 0.00 C ATOM 322 NZ LYS A 25 -11.480 -11.313 -2.234 1.00 0.00 N ATOM 0 H LYS A 25 -13.499 -15.909 1.355 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.916 -14.302 3.192 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.668 -13.515 0.830 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.517 -12.480 1.651 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.867 -14.531 0.970 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.043 -14.662 -0.323 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.223 -11.877 0.210 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.884 -12.908 -0.254 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.710 -13.282 -2.379 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.384 -13.194 -1.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.783 -11.299 -3.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.164 -10.785 -1.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.543 -10.870 -2.152 1.00 0.00 H new ATOM 336 N SER A 26 -15.157 -14.469 3.332 1.00 0.00 N ATOM 337 CA SER A 26 -16.332 -14.072 4.099 1.00 0.00 C ATOM 338 C SER A 26 -16.029 -14.068 5.594 1.00 0.00 C ATOM 339 O SER A 26 -16.498 -13.201 6.332 1.00 0.00 O ATOM 340 CB SER A 26 -17.500 -15.015 3.806 1.00 0.00 C ATOM 341 OG SER A 26 -17.852 -14.980 2.433 1.00 0.00 O ATOM 0 H SER A 26 -15.317 -15.240 2.684 1.00 0.00 H new ATOM 0 HA SER A 26 -16.607 -13.061 3.799 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.230 -16.032 4.090 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.360 -14.733 4.413 1.00 0.00 H new ATOM 0 HG SER A 26 -17.047 -15.097 1.886 1.00 0.00 H new ATOM 347 N LEU A 27 -15.242 -15.044 6.034 1.00 0.00 N ATOM 348 CA LEU A 27 -14.875 -15.155 7.441 1.00 0.00 C ATOM 349 C LEU A 27 -13.761 -14.173 7.793 1.00 0.00 C ATOM 350 O LEU A 27 -13.635 -13.748 8.941 1.00 0.00 O ATOM 351 CB LEU A 27 -14.431 -16.583 7.762 1.00 0.00 C ATOM 352 CG LEU A 27 -15.508 -17.663 7.646 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.955 -19.015 8.067 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.723 -17.296 8.485 1.00 0.00 C ATOM 0 H LEU A 27 -14.846 -15.770 5.436 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.752 -14.911 8.040 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.609 -16.845 7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.036 -16.600 8.778 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.819 -17.730 6.603 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.735 -19.771 7.978 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.116 -19.281 7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.616 -18.963 9.102 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.479 -18.075 8.391 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.428 -17.201 9.530 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.133 -16.348 8.136 1.00 0.00 H new ATOM 366 N ARG A 28 -12.958 -13.816 6.796 1.00 0.00 N ATOM 367 CA ARG A 28 -11.856 -12.884 7.000 1.00 0.00 C ATOM 368 C ARG A 28 -12.344 -11.603 7.672 1.00 0.00 C ATOM 369 O ARG A 28 -11.618 -10.982 8.449 1.00 0.00 O ATOM 370 CB ARG A 28 -11.189 -12.549 5.665 1.00 0.00 C ATOM 371 CG ARG A 28 -9.891 -11.772 5.810 1.00 0.00 C ATOM 372 CD ARG A 28 -8.852 -12.563 6.589 1.00 0.00 C ATOM 373 NE ARG A 28 -7.571 -12.621 5.890 1.00 0.00 N ATOM 374 CZ ARG A 28 -6.705 -11.615 5.858 1.00 0.00 C ATOM 375 NH1 ARG A 28 -6.981 -10.478 6.481 1.00 0.00 N ATOM 376 NH2 ARG A 28 -5.560 -11.744 5.200 1.00 0.00 N ATOM 0 H ARG A 28 -13.050 -14.158 5.839 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.126 -13.362 7.653 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -10.990 -13.475 5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.884 -11.969 5.057 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.499 -11.529 4.822 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -10.086 -10.827 6.317 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -8.710 -12.108 7.569 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.219 -13.575 6.758 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.328 -13.482 5.399 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.861 -10.374 6.987 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.314 -9.707 6.455 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.344 -12.617 4.718 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.896 -10.970 5.176 1.00 0.00 H new ATOM 390 N PHE A 29 -13.578 -11.215 7.367 1.00 0.00 N ATOM 391 CA PHE A 29 -14.162 -10.008 7.940 1.00 0.00 C ATOM 392 C PHE A 29 -14.065 -10.026 9.462 1.00 0.00 C ATOM 393 O PHE A 29 -13.552 -9.088 10.073 1.00 0.00 O ATOM 394 CB PHE A 29 -15.625 -9.872 7.512 1.00 0.00 C ATOM 395 CG PHE A 29 -16.224 -8.534 7.840 1.00 0.00 C ATOM 396 CD1 PHE A 29 -15.761 -7.384 7.223 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.249 -8.428 8.766 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.310 -6.151 7.522 1.00 0.00 C ATOM 399 CE2 PHE A 29 -17.802 -7.198 9.069 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.331 -6.058 8.447 1.00 0.00 C ATOM 0 H PHE A 29 -14.192 -11.718 6.727 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.600 -9.151 7.569 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.698 -10.040 6.438 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.211 -10.652 7.997 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -14.962 -7.451 6.500 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.620 -9.316 9.256 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -15.941 -5.262 7.033 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.602 -7.128 9.791 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.761 -5.096 8.684 1.00 0.00 H new ATOM 410 N ILE A 30 -14.562 -11.100 10.068 1.00 0.00 N ATOM 411 CA ILE A 30 -14.530 -11.241 11.518 1.00 0.00 C ATOM 412 C ILE A 30 -13.148 -11.667 12.000 1.00 0.00 C ATOM 413 O ILE A 30 -12.768 -11.406 13.140 1.00 0.00 O ATOM 414 CB ILE A 30 -15.570 -12.267 12.007 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.349 -13.616 11.321 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.980 -11.758 11.743 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.204 -14.729 11.886 1.00 0.00 C ATOM 0 H ILE A 30 -14.991 -11.884 9.577 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.771 -10.263 11.935 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.448 -12.402 13.082 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.559 -13.512 10.257 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.299 -13.893 11.413 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.704 -12.493 12.094 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -17.132 -10.818 12.273 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.115 -11.598 10.673 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -15.994 -15.656 11.352 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -15.977 -14.861 12.944 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.257 -14.473 11.770 1.00 0.00 H new ATOM 429 N GLY A 31 -12.397 -12.324 11.120 1.00 0.00 N ATOM 430 CA GLY A 31 -11.064 -12.775 11.473 1.00 0.00 C ATOM 431 C GLY A 31 -11.080 -14.056 12.283 1.00 0.00 C ATOM 432 O GLY A 31 -11.087 -14.021 13.514 1.00 0.00 O ATOM 0 H GLY A 31 -12.689 -12.551 10.169 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.484 -12.931 10.563 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.559 -11.995 12.043 1.00 0.00 H new ATOM 436 N LEU A 32 -11.088 -15.191 11.592 1.00 0.00 N ATOM 437 CA LEU A 32 -11.106 -16.490 12.255 1.00 0.00 C ATOM 438 C LEU A 32 -9.797 -17.239 12.021 1.00 0.00 C ATOM 439 O LEU A 32 -8.910 -16.754 11.319 1.00 0.00 O ATOM 440 CB LEU A 32 -12.282 -17.327 11.749 1.00 0.00 C ATOM 441 CG LEU A 32 -13.674 -16.845 12.161 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.743 -17.789 11.632 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.770 -16.721 13.674 1.00 0.00 C ATOM 0 H LEU A 32 -11.082 -15.238 10.573 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.221 -16.322 13.326 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.238 -17.359 10.660 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.154 -18.350 12.103 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.840 -15.860 11.726 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.727 -17.431 11.935 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.689 -17.826 10.544 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.580 -18.787 12.038 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.767 -16.377 13.948 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.583 -17.693 14.131 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.029 -16.004 14.028 1.00 0.00 H new ATOM 455 N SER A 33 -9.686 -18.424 12.613 1.00 0.00 N ATOM 456 CA SER A 33 -8.485 -19.239 12.470 1.00 0.00 C ATOM 457 C SER A 33 -8.380 -19.810 11.059 1.00 0.00 C ATOM 458 O SER A 33 -9.387 -20.152 10.441 1.00 0.00 O ATOM 459 CB SER A 33 -8.491 -20.376 13.494 1.00 0.00 C ATOM 460 OG SER A 33 -9.491 -20.173 14.477 1.00 0.00 O ATOM 0 H SER A 33 -10.412 -18.841 13.196 1.00 0.00 H new ATOM 0 HA SER A 33 -7.619 -18.602 12.650 1.00 0.00 H new ATOM 0 HB2 SER A 33 -8.663 -21.325 12.987 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.514 -20.443 13.973 1.00 0.00 H new ATOM 0 HG SER A 33 -9.475 -20.914 15.118 1.00 0.00 H new ATOM 466 N GLU A 34 -7.153 -19.909 10.558 1.00 0.00 N ATOM 467 CA GLU A 34 -6.916 -20.437 9.219 1.00 0.00 C ATOM 468 C GLU A 34 -7.525 -21.828 9.068 1.00 0.00 C ATOM 469 O GLU A 34 -7.980 -22.204 7.988 1.00 0.00 O ATOM 470 CB GLU A 34 -5.415 -20.490 8.926 1.00 0.00 C ATOM 471 CG GLU A 34 -4.790 -19.124 8.700 1.00 0.00 C ATOM 472 CD GLU A 34 -4.787 -18.719 7.239 1.00 0.00 C ATOM 473 OE1 GLU A 34 -5.821 -18.208 6.762 1.00 0.00 O ATOM 474 OE2 GLU A 34 -3.748 -18.913 6.573 1.00 0.00 O ATOM 0 H GLU A 34 -6.309 -19.631 11.058 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.395 -19.770 8.502 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.908 -20.979 9.758 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.247 -21.107 8.043 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.336 -18.379 9.279 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.766 -19.131 9.074 1.00 0.00 H new ATOM 481 N ASP A 35 -7.528 -22.588 10.158 1.00 0.00 N ATOM 482 CA ASP A 35 -8.081 -23.937 10.148 1.00 0.00 C ATOM 483 C ASP A 35 -9.588 -23.905 9.917 1.00 0.00 C ATOM 484 O ASP A 35 -10.127 -24.707 9.154 1.00 0.00 O ATOM 485 CB ASP A 35 -7.769 -24.649 11.465 1.00 0.00 C ATOM 486 CG ASP A 35 -6.695 -25.707 11.311 1.00 0.00 C ATOM 487 OD1 ASP A 35 -6.959 -26.728 10.642 1.00 0.00 O ATOM 488 OD2 ASP A 35 -5.589 -25.515 11.859 1.00 0.00 O ATOM 0 H ASP A 35 -7.154 -22.292 11.060 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.618 -24.487 9.329 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.448 -23.915 12.204 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.678 -25.112 11.849 1.00 0.00 H new ATOM 493 N VAL A 36 -10.264 -22.974 10.582 1.00 0.00 N ATOM 494 CA VAL A 36 -11.710 -22.837 10.450 1.00 0.00 C ATOM 495 C VAL A 36 -12.105 -22.561 9.004 1.00 0.00 C ATOM 496 O VAL A 36 -12.953 -23.253 8.439 1.00 0.00 O ATOM 497 CB VAL A 36 -12.251 -21.705 11.343 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.761 -21.592 11.206 1.00 0.00 C ATOM 499 CG2 VAL A 36 -11.855 -21.937 12.794 1.00 0.00 C ATOM 0 H VAL A 36 -9.833 -22.303 11.218 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.148 -23.782 10.770 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.809 -20.764 11.015 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.125 -20.787 11.844 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.017 -21.377 10.169 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.225 -22.531 11.507 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.245 -21.128 13.411 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.267 -22.886 13.136 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.768 -21.963 12.875 1.00 0.00 H new ATOM 509 N ILE A 37 -11.486 -21.547 8.410 1.00 0.00 N ATOM 510 CA ILE A 37 -11.772 -21.180 7.028 1.00 0.00 C ATOM 511 C ILE A 37 -11.613 -22.378 6.098 1.00 0.00 C ATOM 512 O ILE A 37 -12.534 -22.731 5.361 1.00 0.00 O ATOM 513 CB ILE A 37 -10.852 -20.044 6.545 1.00 0.00 C ATOM 514 CG1 ILE A 37 -11.002 -18.818 7.449 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.168 -19.685 5.101 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.980 -17.737 7.175 1.00 0.00 C ATOM 0 H ILE A 37 -10.783 -20.964 8.864 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.806 -20.835 7.000 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.818 -20.386 6.596 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -12.002 -18.403 7.321 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.918 -19.131 8.490 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.510 -18.880 4.774 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -11.016 -20.559 4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.205 -19.358 5.026 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.146 -16.899 7.852 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.978 -18.136 7.331 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.079 -17.396 6.144 1.00 0.00 H new ATOM 528 N SER A 38 -10.440 -23.001 6.139 1.00 0.00 N ATOM 529 CA SER A 38 -10.159 -24.158 5.298 1.00 0.00 C ATOM 530 C SER A 38 -11.134 -25.294 5.593 1.00 0.00 C ATOM 531 O SER A 38 -11.409 -26.131 4.734 1.00 0.00 O ATOM 532 CB SER A 38 -8.722 -24.636 5.513 1.00 0.00 C ATOM 533 OG SER A 38 -7.828 -23.540 5.599 1.00 0.00 O ATOM 0 H SER A 38 -9.669 -22.724 6.746 1.00 0.00 H new ATOM 0 HA SER A 38 -10.282 -23.857 4.258 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.665 -25.228 6.426 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.425 -25.288 4.691 1.00 0.00 H new ATOM 0 HG SER A 38 -7.824 -23.192 6.515 1.00 0.00 H new ATOM 539 N PHE A 39 -11.654 -25.316 6.816 1.00 0.00 N ATOM 540 CA PHE A 39 -12.598 -26.348 7.228 1.00 0.00 C ATOM 541 C PHE A 39 -13.887 -26.261 6.417 1.00 0.00 C ATOM 542 O PHE A 39 -14.594 -27.254 6.245 1.00 0.00 O ATOM 543 CB PHE A 39 -12.910 -26.218 8.720 1.00 0.00 C ATOM 544 CG PHE A 39 -12.560 -27.444 9.515 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.031 -28.690 9.134 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.759 -27.350 10.641 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.711 -29.819 9.864 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.436 -28.476 11.375 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.911 -29.712 10.985 1.00 0.00 C ATOM 0 H PHE A 39 -11.437 -24.630 7.539 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.139 -27.319 7.044 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.365 -25.365 9.124 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -13.972 -26.005 8.844 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.655 -28.780 8.257 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.382 -26.386 10.949 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.086 -30.784 9.558 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.813 -28.389 12.253 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.658 -30.594 11.555 1.00 0.00 H new ATOM 559 N PHE A 40 -14.188 -25.064 5.922 1.00 0.00 N ATOM 560 CA PHE A 40 -15.393 -24.845 5.131 1.00 0.00 C ATOM 561 C PHE A 40 -15.122 -25.087 3.649 1.00 0.00 C ATOM 562 O PHE A 40 -15.926 -25.707 2.952 1.00 0.00 O ATOM 563 CB PHE A 40 -15.914 -23.422 5.340 1.00 0.00 C ATOM 564 CG PHE A 40 -16.828 -23.286 6.524 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.495 -23.856 7.742 1.00 0.00 C ATOM 566 CD2 PHE A 40 -18.020 -22.587 6.419 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.334 -23.733 8.833 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.863 -22.460 7.507 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.519 -23.033 8.715 1.00 0.00 C ATOM 0 H PHE A 40 -13.614 -24.232 6.055 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.150 -25.554 5.464 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -15.066 -22.748 5.466 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.444 -23.102 4.443 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.569 -24.403 7.840 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.293 -22.136 5.476 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.064 -24.183 9.777 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.790 -21.913 7.412 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.176 -22.934 9.567 1.00 0.00 H new ATOM 579 N VAL A 41 -13.983 -24.593 3.173 1.00 0.00 N ATOM 580 CA VAL A 41 -13.605 -24.755 1.774 1.00 0.00 C ATOM 581 C VAL A 41 -13.333 -26.219 1.445 1.00 0.00 C ATOM 582 O VAL A 41 -13.466 -26.644 0.296 1.00 0.00 O ATOM 583 CB VAL A 41 -12.356 -23.923 1.431 1.00 0.00 C ATOM 584 CG1 VAL A 41 -11.985 -24.096 -0.034 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.586 -22.456 1.761 1.00 0.00 C ATOM 0 H VAL A 41 -13.306 -24.077 3.736 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.444 -24.401 1.176 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.524 -24.282 2.037 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.100 -23.501 -0.258 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.776 -25.147 -0.235 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.813 -23.765 -0.661 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.693 -21.883 1.512 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.431 -22.081 1.183 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.800 -22.351 2.825 1.00 0.00 H new ATOM 595 N THR A 42 -12.953 -26.988 2.460 1.00 0.00 N ATOM 596 CA THR A 42 -12.662 -28.404 2.279 1.00 0.00 C ATOM 597 C THR A 42 -13.939 -29.236 2.307 1.00 0.00 C ATOM 598 O THR A 42 -13.993 -30.326 1.737 1.00 0.00 O ATOM 599 CB THR A 42 -11.701 -28.924 3.366 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.307 -30.268 3.069 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.357 -28.873 4.737 1.00 0.00 C ATOM 0 H THR A 42 -12.840 -26.653 3.417 1.00 0.00 H new ATOM 0 HA THR A 42 -12.186 -28.506 1.304 1.00 0.00 H new ATOM 0 HB THR A 42 -10.820 -28.282 3.379 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.695 -30.591 3.763 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.660 -29.245 5.488 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.629 -27.844 4.972 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.253 -29.494 4.735 1.00 0.00 H new ATOM 609 N GLU A 43 -14.965 -28.715 2.971 1.00 0.00 N ATOM 610 CA GLU A 43 -16.242 -29.411 3.072 1.00 0.00 C ATOM 611 C GLU A 43 -17.213 -28.925 1.999 1.00 0.00 C ATOM 612 O GLU A 43 -18.430 -29.038 2.150 1.00 0.00 O ATOM 613 CB GLU A 43 -16.853 -29.204 4.460 1.00 0.00 C ATOM 614 CG GLU A 43 -16.391 -30.224 5.487 1.00 0.00 C ATOM 615 CD GLU A 43 -17.264 -31.464 5.511 1.00 0.00 C ATOM 616 OE1 GLU A 43 -17.227 -32.236 4.530 1.00 0.00 O ATOM 617 OE2 GLU A 43 -17.984 -31.662 6.512 1.00 0.00 O ATOM 0 H GLU A 43 -14.937 -27.813 3.447 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.060 -30.475 2.918 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.600 -28.205 4.814 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.939 -29.248 4.380 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.363 -30.512 5.270 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.391 -29.765 6.475 1.00 0.00 H new ATOM 624 N LYS A 44 -16.666 -28.384 0.916 1.00 0.00 N ATOM 625 CA LYS A 44 -17.480 -27.881 -0.183 1.00 0.00 C ATOM 626 C LYS A 44 -18.493 -26.854 0.315 1.00 0.00 C ATOM 627 O LYS A 44 -19.547 -26.663 -0.292 1.00 0.00 O ATOM 628 CB LYS A 44 -18.208 -29.036 -0.876 1.00 0.00 C ATOM 629 CG LYS A 44 -18.231 -28.919 -2.390 1.00 0.00 C ATOM 630 CD LYS A 44 -18.685 -30.214 -3.042 1.00 0.00 C ATOM 631 CE LYS A 44 -20.124 -30.120 -3.526 1.00 0.00 C ATOM 632 NZ LYS A 44 -21.096 -30.264 -2.407 1.00 0.00 N ATOM 0 H LYS A 44 -15.661 -28.283 0.776 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.818 -27.394 -0.899 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.728 -29.975 -0.600 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.233 -29.082 -0.508 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -18.899 -28.109 -2.683 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.236 -28.658 -2.751 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -18.032 -30.448 -3.883 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -18.593 -31.033 -2.329 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -20.279 -29.161 -4.020 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -20.309 -30.895 -4.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -22.065 -30.245 -2.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -20.932 -31.167 -1.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -20.971 -29.480 -1.735 1.00 0.00 H new ATOM 646 N ILE A 45 -18.165 -26.196 1.422 1.00 0.00 N ATOM 647 CA ILE A 45 -19.045 -25.187 1.999 1.00 0.00 C ATOM 648 C ILE A 45 -18.994 -23.891 1.198 1.00 0.00 C ATOM 649 O ILE A 45 -17.935 -23.279 1.053 1.00 0.00 O ATOM 650 CB ILE A 45 -18.674 -24.888 3.463 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.520 -26.191 4.250 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.726 -23.997 4.105 1.00 0.00 C ATOM 653 CD1 ILE A 45 -19.798 -26.994 4.344 1.00 0.00 C ATOM 0 H ILE A 45 -17.297 -26.343 1.937 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.056 -25.593 1.965 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.720 -24.361 3.479 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.750 -26.802 3.779 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.171 -25.959 5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.449 -23.795 5.140 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.791 -23.057 3.556 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.693 -24.499 4.080 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.615 -27.904 4.915 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.565 -26.401 4.843 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.137 -27.257 3.342 1.00 0.00 H new ATOM 665 N ASP A 46 -20.145 -23.475 0.682 1.00 0.00 N ATOM 666 CA ASP A 46 -20.234 -22.249 -0.103 1.00 0.00 C ATOM 667 C ASP A 46 -21.186 -21.253 0.552 1.00 0.00 C ATOM 668 O ASP A 46 -21.722 -21.508 1.629 1.00 0.00 O ATOM 669 CB ASP A 46 -20.700 -22.561 -1.526 1.00 0.00 C ATOM 670 CG ASP A 46 -21.947 -23.423 -1.551 1.00 0.00 C ATOM 671 OD1 ASP A 46 -23.041 -22.890 -1.273 1.00 0.00 O ATOM 672 OD2 ASP A 46 -21.827 -24.630 -1.847 1.00 0.00 O ATOM 0 H ASP A 46 -21.030 -23.969 0.793 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.241 -21.801 -0.146 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.896 -21.628 -2.054 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -19.900 -23.069 -2.064 1.00 0.00 H new ATOM 677 N GLY A 47 -21.392 -20.117 -0.108 1.00 0.00 N ATOM 678 CA GLY A 47 -22.279 -19.100 0.425 1.00 0.00 C ATOM 679 C GLY A 47 -23.676 -19.628 0.686 1.00 0.00 C ATOM 680 O GLY A 47 -24.241 -19.404 1.756 1.00 0.00 O ATOM 0 H GLY A 47 -20.960 -19.883 -1.002 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.862 -18.709 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.334 -18.267 -0.276 1.00 0.00 H new ATOM 684 N ASN A 48 -24.235 -20.329 -0.295 1.00 0.00 N ATOM 685 CA ASN A 48 -25.576 -20.888 -0.166 1.00 0.00 C ATOM 686 C ASN A 48 -25.623 -21.940 0.937 1.00 0.00 C ATOM 687 O ASN A 48 -26.672 -22.180 1.538 1.00 0.00 O ATOM 688 CB ASN A 48 -26.023 -21.504 -1.494 1.00 0.00 C ATOM 689 CG ASN A 48 -27.521 -21.401 -1.703 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.097 -20.315 -1.623 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.160 -22.533 -1.974 1.00 0.00 N ATOM 0 H ASN A 48 -23.781 -20.523 -1.187 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.257 -20.079 0.100 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.509 -21.004 -2.315 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -25.726 -22.552 -1.524 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.169 -22.526 -2.126 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -27.642 -23.410 -2.031 1.00 0.00 H new ATOM 698 N LEU A 49 -24.481 -22.565 1.200 1.00 0.00 N ATOM 699 CA LEU A 49 -24.391 -23.592 2.233 1.00 0.00 C ATOM 700 C LEU A 49 -24.277 -22.963 3.618 1.00 0.00 C ATOM 701 O LEU A 49 -24.892 -23.432 4.577 1.00 0.00 O ATOM 702 CB LEU A 49 -23.188 -24.501 1.973 1.00 0.00 C ATOM 703 CG LEU A 49 -23.293 -25.926 2.516 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.412 -25.911 4.033 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.479 -26.648 1.894 1.00 0.00 C ATOM 0 H LEU A 49 -23.604 -22.379 0.713 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.303 -24.188 2.199 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.025 -24.555 0.897 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.304 -24.033 2.406 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.384 -26.465 2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.486 -26.934 4.402 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.532 -25.433 4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.304 -25.356 4.323 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.538 -27.661 2.292 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.397 -26.111 2.131 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.353 -26.690 0.812 1.00 0.00 H new ATOM 717 N LEU A 50 -23.488 -21.898 3.715 1.00 0.00 N ATOM 718 CA LEU A 50 -23.295 -21.203 4.983 1.00 0.00 C ATOM 719 C LEU A 50 -24.626 -20.708 5.541 1.00 0.00 C ATOM 720 O LEU A 50 -24.949 -20.944 6.705 1.00 0.00 O ATOM 721 CB LEU A 50 -22.337 -20.024 4.800 1.00 0.00 C ATOM 722 CG LEU A 50 -22.124 -19.136 6.026 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.735 -19.975 7.232 1.00 0.00 C ATOM 724 CD2 LEU A 50 -21.063 -18.082 5.742 1.00 0.00 C ATOM 0 H LEU A 50 -22.972 -21.497 2.931 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.863 -21.908 5.693 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.369 -20.414 4.486 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.709 -19.402 3.986 1.00 0.00 H new ATOM 0 HG LEU A 50 -23.062 -18.628 6.251 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.588 -19.325 8.095 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.528 -20.691 7.448 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.810 -20.511 7.019 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.924 -17.459 6.625 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -20.122 -18.571 5.491 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.382 -17.460 4.906 1.00 0.00 H new ATOM 736 N VAL A 51 -25.396 -20.023 4.701 1.00 0.00 N ATOM 737 CA VAL A 51 -26.694 -19.498 5.109 1.00 0.00 C ATOM 738 C VAL A 51 -27.615 -20.617 5.581 1.00 0.00 C ATOM 739 O VAL A 51 -28.519 -20.392 6.385 1.00 0.00 O ATOM 740 CB VAL A 51 -27.377 -18.735 3.959 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.627 -17.449 3.651 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.475 -19.614 2.721 1.00 0.00 C ATOM 0 H VAL A 51 -25.143 -19.819 3.734 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.512 -18.809 5.934 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.388 -18.472 4.271 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -27.125 -16.924 2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.614 -16.814 4.537 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.604 -17.686 3.359 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.960 -19.059 1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.475 -19.910 2.405 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.060 -20.504 2.952 1.00 0.00 H new ATOM 752 N GLN A 52 -27.379 -21.824 5.075 1.00 0.00 N ATOM 753 CA GLN A 52 -28.189 -22.978 5.445 1.00 0.00 C ATOM 754 C GLN A 52 -27.710 -23.580 6.763 1.00 0.00 C ATOM 755 O GLN A 52 -28.495 -24.159 7.515 1.00 0.00 O ATOM 756 CB GLN A 52 -28.141 -24.036 4.341 1.00 0.00 C ATOM 757 CG GLN A 52 -29.092 -23.755 3.189 1.00 0.00 C ATOM 758 CD GLN A 52 -29.352 -24.980 2.335 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.301 -25.728 2.574 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.508 -25.193 1.332 1.00 0.00 N ATOM 0 H GLN A 52 -26.634 -22.027 4.408 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.218 -22.642 5.573 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.124 -24.100 3.954 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.381 -25.009 4.770 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.038 -23.386 3.585 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -28.677 -22.963 2.565 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.735 -24.547 1.170 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.633 -26.002 0.724 1.00 0.00 H new ATOM 769 N LEU A 53 -26.417 -23.439 7.036 1.00 0.00 N ATOM 770 CA LEU A 53 -25.833 -23.969 8.263 1.00 0.00 C ATOM 771 C LEU A 53 -26.467 -23.324 9.491 1.00 0.00 C ATOM 772 O LEU A 53 -26.656 -22.108 9.540 1.00 0.00 O ATOM 773 CB LEU A 53 -24.321 -23.736 8.273 1.00 0.00 C ATOM 774 CG LEU A 53 -23.488 -24.697 7.425 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.030 -24.264 7.403 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.615 -26.119 7.951 1.00 0.00 C ATOM 0 H LEU A 53 -25.754 -22.963 6.425 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.030 -25.041 8.297 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.128 -22.720 7.930 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -23.971 -23.796 9.304 1.00 0.00 H new ATOM 0 HG LEU A 53 -23.868 -24.672 6.404 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.453 -24.960 6.794 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -21.954 -23.263 6.979 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.637 -24.258 8.420 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -23.016 -26.790 7.335 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.261 -26.159 8.981 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.659 -26.429 7.914 1.00 0.00 H new ATOM 788 N THR A 54 -26.792 -24.146 10.484 1.00 0.00 N ATOM 789 CA THR A 54 -27.404 -23.656 11.713 1.00 0.00 C ATOM 790 C THR A 54 -26.515 -23.937 12.919 1.00 0.00 C ATOM 791 O THR A 54 -25.544 -24.686 12.824 1.00 0.00 O ATOM 792 CB THR A 54 -28.785 -24.295 11.946 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.723 -25.703 11.691 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.836 -23.658 11.049 1.00 0.00 C ATOM 0 H THR A 54 -26.641 -25.155 10.461 1.00 0.00 H new ATOM 0 HA THR A 54 -27.526 -22.579 11.599 1.00 0.00 H new ATOM 0 HB THR A 54 -29.067 -24.126 12.985 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.605 -26.102 11.843 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.803 -24.126 11.232 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.902 -22.592 11.266 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.557 -23.799 10.005 1.00 0.00 H new ATOM 802 N GLU A 55 -26.856 -23.331 14.053 1.00 0.00 N ATOM 803 CA GLU A 55 -26.087 -23.518 15.278 1.00 0.00 C ATOM 804 C GLU A 55 -26.125 -24.976 15.727 1.00 0.00 C ATOM 805 O GLU A 55 -25.196 -25.460 16.372 1.00 0.00 O ATOM 806 CB GLU A 55 -26.630 -22.616 16.389 1.00 0.00 C ATOM 807 CG GLU A 55 -25.544 -21.951 17.218 1.00 0.00 C ATOM 808 CD GLU A 55 -26.012 -20.664 17.868 1.00 0.00 C ATOM 809 OE1 GLU A 55 -26.024 -19.621 17.181 1.00 0.00 O ATOM 810 OE2 GLU A 55 -26.368 -20.700 19.065 1.00 0.00 O ATOM 0 H GLU A 55 -27.658 -22.708 14.148 1.00 0.00 H new ATOM 0 HA GLU A 55 -25.052 -23.246 15.072 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -27.259 -21.845 15.945 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.267 -23.207 17.047 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -25.207 -22.642 17.991 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.684 -21.741 16.582 1.00 0.00 H new ATOM 817 N GLU A 56 -27.206 -25.668 15.381 1.00 0.00 N ATOM 818 CA GLU A 56 -27.365 -27.070 15.750 1.00 0.00 C ATOM 819 C GLU A 56 -26.486 -27.964 14.880 1.00 0.00 C ATOM 820 O GLU A 56 -25.857 -28.901 15.372 1.00 0.00 O ATOM 821 CB GLU A 56 -28.830 -27.491 15.618 1.00 0.00 C ATOM 822 CG GLU A 56 -29.660 -27.204 16.858 1.00 0.00 C ATOM 823 CD GLU A 56 -29.558 -28.305 17.896 1.00 0.00 C ATOM 824 OE1 GLU A 56 -28.838 -29.293 17.644 1.00 0.00 O ATOM 825 OE2 GLU A 56 -30.200 -28.178 18.960 1.00 0.00 O ATOM 0 H GLU A 56 -27.984 -25.281 14.846 1.00 0.00 H new ATOM 0 HA GLU A 56 -27.054 -27.185 16.788 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -29.273 -26.973 14.767 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.874 -28.558 15.400 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -29.333 -26.262 17.299 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -30.704 -27.076 16.571 1.00 0.00 H new ATOM 832 N ILE A 57 -26.450 -27.669 13.585 1.00 0.00 N ATOM 833 CA ILE A 57 -25.649 -28.445 12.647 1.00 0.00 C ATOM 834 C ILE A 57 -24.165 -28.128 12.798 1.00 0.00 C ATOM 835 O ILE A 57 -23.307 -28.954 12.482 1.00 0.00 O ATOM 836 CB ILE A 57 -26.074 -28.180 11.190 1.00 0.00 C ATOM 837 CG1 ILE A 57 -27.557 -28.504 11.002 1.00 0.00 C ATOM 838 CG2 ILE A 57 -25.221 -28.999 10.233 1.00 0.00 C ATOM 839 CD1 ILE A 57 -28.136 -27.961 9.714 1.00 0.00 C ATOM 0 H ILE A 57 -26.966 -26.898 13.162 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.819 -29.496 12.881 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.922 -27.124 10.968 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.690 -29.586 11.023 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -28.119 -28.098 11.843 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -25.533 -28.801 9.207 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -24.173 -28.724 10.353 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -25.345 -30.060 10.452 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -29.191 -28.229 9.648 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -28.035 -26.876 9.699 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.600 -28.387 8.866 1.00 0.00 H new ATOM 851 N LEU A 58 -23.869 -26.928 13.282 1.00 0.00 N ATOM 852 CA LEU A 58 -22.487 -26.501 13.477 1.00 0.00 C ATOM 853 C LEU A 58 -21.892 -27.137 14.730 1.00 0.00 C ATOM 854 O LEU A 58 -20.678 -27.313 14.832 1.00 0.00 O ATOM 855 CB LEU A 58 -22.413 -24.977 13.581 1.00 0.00 C ATOM 856 CG LEU A 58 -22.618 -24.204 12.278 1.00 0.00 C ATOM 857 CD1 LEU A 58 -23.093 -22.789 12.565 1.00 0.00 C ATOM 858 CD2 LEU A 58 -21.333 -24.183 11.463 1.00 0.00 C ATOM 0 H LEU A 58 -24.567 -26.233 13.547 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.907 -26.829 12.615 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.163 -24.645 14.299 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.439 -24.708 13.990 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.387 -24.711 11.695 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.233 -22.255 11.625 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -24.038 -22.825 13.106 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.348 -22.271 13.169 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.497 -23.629 10.539 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.544 -23.701 12.040 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -21.036 -25.205 11.225 1.00 0.00 H new ATOM 870 N SER A 59 -22.756 -27.481 15.680 1.00 0.00 N ATOM 871 CA SER A 59 -22.316 -28.097 16.926 1.00 0.00 C ATOM 872 C SER A 59 -22.453 -29.615 16.861 1.00 0.00 C ATOM 873 O SER A 59 -21.734 -30.343 17.544 1.00 0.00 O ATOM 874 CB SER A 59 -23.127 -27.551 18.103 1.00 0.00 C ATOM 875 OG SER A 59 -22.565 -27.953 19.340 1.00 0.00 O ATOM 0 H SER A 59 -23.764 -27.344 15.610 1.00 0.00 H new ATOM 0 HA SER A 59 -21.264 -27.851 17.072 1.00 0.00 H new ATOM 0 HB2 SER A 59 -23.160 -26.463 18.052 1.00 0.00 H new ATOM 0 HB3 SER A 59 -24.156 -27.905 18.035 1.00 0.00 H new ATOM 0 HG SER A 59 -23.101 -27.590 20.076 1.00 0.00 H new ATOM 881 N GLU A 60 -23.382 -30.084 16.034 1.00 0.00 N ATOM 882 CA GLU A 60 -23.614 -31.515 15.879 1.00 0.00 C ATOM 883 C GLU A 60 -22.645 -32.117 14.866 1.00 0.00 C ATOM 884 O GLU A 60 -21.857 -33.004 15.195 1.00 0.00 O ATOM 885 CB GLU A 60 -25.056 -31.776 15.440 1.00 0.00 C ATOM 886 CG GLU A 60 -26.061 -31.707 16.577 1.00 0.00 C ATOM 887 CD GLU A 60 -26.660 -33.060 16.909 1.00 0.00 C ATOM 888 OE1 GLU A 60 -26.984 -33.812 15.966 1.00 0.00 O ATOM 889 OE2 GLU A 60 -26.804 -33.367 18.111 1.00 0.00 O ATOM 0 H GLU A 60 -23.986 -29.494 15.461 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.444 -31.991 16.845 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.332 -31.047 14.678 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -25.113 -32.760 14.976 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.573 -31.302 17.464 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.860 -31.016 16.309 1.00 0.00 H new ATOM 896 N ASP A 61 -22.711 -31.630 13.632 1.00 0.00 N ATOM 897 CA ASP A 61 -21.839 -32.118 12.569 1.00 0.00 C ATOM 898 C ASP A 61 -20.426 -31.567 12.729 1.00 0.00 C ATOM 899 O ASP A 61 -19.509 -32.287 13.126 1.00 0.00 O ATOM 900 CB ASP A 61 -22.400 -31.729 11.201 1.00 0.00 C ATOM 901 CG ASP A 61 -21.532 -32.217 10.058 1.00 0.00 C ATOM 902 OD1 ASP A 61 -21.411 -33.449 9.889 1.00 0.00 O ATOM 903 OD2 ASP A 61 -20.973 -31.368 9.333 1.00 0.00 O ATOM 0 H ASP A 61 -23.359 -30.898 13.343 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.795 -33.205 12.639 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -23.403 -32.141 11.093 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -22.493 -30.644 11.145 1.00 0.00 H new ATOM 908 N PHE A 62 -20.257 -30.287 12.416 1.00 0.00 N ATOM 909 CA PHE A 62 -18.954 -29.640 12.523 1.00 0.00 C ATOM 910 C PHE A 62 -18.354 -29.851 13.910 1.00 0.00 C ATOM 911 O PHE A 62 -17.166 -30.143 14.047 1.00 0.00 O ATOM 912 CB PHE A 62 -19.080 -28.143 12.232 1.00 0.00 C ATOM 913 CG PHE A 62 -19.090 -27.816 10.766 1.00 0.00 C ATOM 914 CD1 PHE A 62 -20.218 -28.052 9.998 1.00 0.00 C ATOM 915 CD2 PHE A 62 -17.970 -27.272 10.157 1.00 0.00 C ATOM 916 CE1 PHE A 62 -20.231 -27.752 8.649 1.00 0.00 C ATOM 917 CE2 PHE A 62 -17.977 -26.970 8.808 1.00 0.00 C ATOM 918 CZ PHE A 62 -19.108 -27.211 8.053 1.00 0.00 C ATOM 0 H PHE A 62 -21.005 -29.677 12.086 1.00 0.00 H new ATOM 0 HA PHE A 62 -18.290 -30.092 11.787 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.998 -27.769 12.686 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -18.252 -27.618 12.708 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -21.098 -28.476 10.459 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -17.083 -27.082 10.743 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -21.118 -27.940 8.062 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -17.098 -26.546 8.345 1.00 0.00 H new ATOM 0 HZ PHE A 62 -19.115 -26.977 6.999 1.00 0.00 H new ATOM 928 N LYS A 63 -19.184 -29.701 14.937 1.00 0.00 N ATOM 929 CA LYS A 63 -18.738 -29.876 16.314 1.00 0.00 C ATOM 930 C LYS A 63 -17.649 -28.867 16.665 1.00 0.00 C ATOM 931 O LYS A 63 -16.807 -29.122 17.527 1.00 0.00 O ATOM 932 CB LYS A 63 -18.217 -31.299 16.526 1.00 0.00 C ATOM 933 CG LYS A 63 -18.871 -32.018 17.693 1.00 0.00 C ATOM 934 CD LYS A 63 -19.182 -33.466 17.352 1.00 0.00 C ATOM 935 CE LYS A 63 -19.272 -34.326 18.604 1.00 0.00 C ATOM 936 NZ LYS A 63 -17.928 -34.613 19.177 1.00 0.00 N ATOM 0 H LYS A 63 -20.170 -29.458 14.841 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.591 -29.707 16.971 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -18.381 -31.876 15.616 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -17.140 -31.262 16.690 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -18.212 -31.981 18.560 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.791 -31.503 17.970 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.123 -33.518 16.805 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -18.408 -33.860 16.693 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -19.884 -33.819 19.350 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -19.773 -35.264 18.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.010 -35.358 19.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.289 -34.932 18.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.545 -33.750 19.613 1.00 0.00 H new ATOM 950 N LEU A 64 -17.673 -27.720 15.994 1.00 0.00 N ATOM 951 CA LEU A 64 -16.688 -26.671 16.237 1.00 0.00 C ATOM 952 C LEU A 64 -16.752 -26.189 17.683 1.00 0.00 C ATOM 953 O LEU A 64 -17.561 -26.673 18.474 1.00 0.00 O ATOM 954 CB LEU A 64 -16.919 -25.497 15.284 1.00 0.00 C ATOM 955 CG LEU A 64 -16.613 -25.759 13.809 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.642 -25.076 12.921 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.209 -25.285 13.464 1.00 0.00 C ATOM 0 H LEU A 64 -18.363 -27.493 15.278 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.697 -27.087 16.056 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.960 -25.186 15.369 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.308 -24.659 15.618 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.666 -26.833 13.631 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.408 -25.273 11.875 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.635 -25.463 13.150 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.621 -24.001 13.101 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -15.008 -25.479 12.410 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -15.128 -24.215 13.658 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.483 -25.820 14.076 1.00 0.00 H new ATOM 969 N SER A 65 -15.895 -25.230 18.019 1.00 0.00 N ATOM 970 CA SER A 65 -15.852 -24.683 19.370 1.00 0.00 C ATOM 971 C SER A 65 -17.003 -23.706 19.597 1.00 0.00 C ATOM 972 O SER A 65 -17.541 -23.132 18.650 1.00 0.00 O ATOM 973 CB SER A 65 -14.516 -23.980 19.617 1.00 0.00 C ATOM 974 OG SER A 65 -14.428 -23.503 20.948 1.00 0.00 O ATOM 0 H SER A 65 -15.221 -24.816 17.375 1.00 0.00 H new ATOM 0 HA SER A 65 -15.955 -25.509 20.073 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.696 -24.671 19.420 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.405 -23.148 18.921 1.00 0.00 H new ATOM 0 HG SER A 65 -13.564 -23.059 21.080 1.00 0.00 H new ATOM 980 N LYS A 66 -17.374 -23.523 20.859 1.00 0.00 N ATOM 981 CA LYS A 66 -18.460 -22.616 21.214 1.00 0.00 C ATOM 982 C LYS A 66 -18.210 -21.221 20.648 1.00 0.00 C ATOM 983 O LYS A 66 -19.130 -20.564 20.160 1.00 0.00 O ATOM 984 CB LYS A 66 -18.613 -22.542 22.734 1.00 0.00 C ATOM 985 CG LYS A 66 -19.878 -21.831 23.184 1.00 0.00 C ATOM 986 CD LYS A 66 -20.763 -22.741 24.019 1.00 0.00 C ATOM 987 CE LYS A 66 -21.876 -23.356 23.184 1.00 0.00 C ATOM 988 NZ LYS A 66 -22.818 -22.323 22.669 1.00 0.00 N ATOM 0 H LYS A 66 -16.939 -23.991 21.654 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.382 -23.005 20.781 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -18.610 -23.553 23.141 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -17.748 -22.028 23.153 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -19.613 -20.947 23.765 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -20.432 -21.485 22.311 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -20.158 -23.533 24.461 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -21.196 -22.173 24.843 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -21.442 -23.902 22.346 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -22.425 -24.080 23.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -23.762 -22.742 22.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -22.871 -21.534 23.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -22.479 -21.971 21.751 1.00 0.00 H new ATOM 1002 N LEU A 67 -16.960 -20.776 20.716 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.588 -19.459 20.210 1.00 0.00 C ATOM 1004 C LEU A 67 -16.762 -19.389 18.696 1.00 0.00 C ATOM 1005 O LEU A 67 -17.182 -18.366 18.157 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.141 -19.137 20.584 1.00 0.00 C ATOM 1007 CG LEU A 67 -14.946 -18.035 21.626 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.351 -16.685 21.057 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -15.742 -18.346 22.885 1.00 0.00 C ATOM 0 H LEU A 67 -16.187 -21.308 21.116 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.247 -18.721 20.668 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.672 -20.048 20.956 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.608 -18.851 19.678 1.00 0.00 H new ATOM 0 HG LEU A 67 -13.889 -17.992 21.889 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.205 -15.913 21.813 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -14.738 -16.459 20.185 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -16.401 -16.713 20.765 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.592 -17.552 23.616 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.801 -18.416 22.638 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.404 -19.294 23.304 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.438 -20.485 18.017 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.560 -20.548 16.565 1.00 0.00 C ATOM 1023 C GLN A 68 -18.025 -20.569 16.143 1.00 0.00 C ATOM 1024 O GLN A 68 -18.450 -19.779 15.300 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.843 -21.786 16.025 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.357 -21.572 15.784 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.544 -22.835 15.990 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -14.076 -23.871 16.391 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.247 -22.757 15.715 1.00 0.00 N ATOM 0 H GLN A 68 -16.089 -21.341 18.449 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.093 -19.656 16.147 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.974 -22.607 16.729 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.314 -22.090 15.090 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.206 -21.209 14.767 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.992 -20.796 16.457 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.848 -21.878 15.385 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.650 -23.576 15.834 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.793 -21.480 16.733 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.211 -21.604 16.418 1.00 0.00 C ATOM 1040 C VAL A 69 -20.933 -20.274 16.602 1.00 0.00 C ATOM 1041 O VAL A 69 -21.945 -20.009 15.952 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.890 -22.671 17.297 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.355 -22.823 16.918 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -20.160 -24.000 17.181 1.00 0.00 C ATOM 0 H VAL A 69 -18.457 -22.143 17.432 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.278 -21.909 15.374 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.841 -22.345 18.336 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.818 -23.581 17.550 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.868 -21.871 17.058 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.431 -23.125 15.874 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.653 -24.742 17.809 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.175 -24.334 16.144 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -19.127 -23.878 17.508 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.407 -19.440 17.493 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.000 -18.136 17.763 1.00 0.00 C ATOM 1056 C LYS A 70 -20.466 -17.085 16.795 1.00 0.00 C ATOM 1057 O LYS A 70 -21.136 -16.092 16.508 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.712 -17.710 19.205 1.00 0.00 C ATOM 1059 CG LYS A 70 -21.747 -16.757 19.776 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.110 -15.730 20.698 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.160 -14.860 21.372 1.00 0.00 C ATOM 1062 NZ LYS A 70 -22.784 -15.546 22.537 1.00 0.00 N ATOM 0 H LYS A 70 -19.571 -19.644 18.040 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.078 -18.219 17.624 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.662 -18.599 19.834 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -19.732 -17.235 19.246 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.262 -16.247 18.962 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.500 -17.322 20.325 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.516 -16.239 21.457 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -20.427 -15.101 20.127 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -21.702 -13.928 21.702 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -22.932 -14.597 20.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -23.494 -14.920 22.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -23.243 -16.423 22.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -22.051 -15.774 23.239 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.256 -17.309 16.294 1.00 0.00 N ATOM 1077 CA LYS A 71 -18.632 -16.383 15.356 1.00 0.00 C ATOM 1078 C LYS A 71 -19.132 -16.628 13.936 1.00 0.00 C ATOM 1079 O LYS A 71 -19.140 -15.718 13.106 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.109 -16.526 15.404 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.383 -15.215 15.655 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.442 -15.318 16.844 1.00 0.00 C ATOM 1083 CE LYS A 71 -16.090 -14.790 18.114 1.00 0.00 C ATOM 1084 NZ LYS A 71 -17.404 -15.438 18.378 1.00 0.00 N ATOM 0 H LYS A 71 -18.687 -18.125 16.522 1.00 0.00 H new ATOM 0 HA LYS A 71 -18.905 -15.369 15.648 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.843 -17.235 16.188 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -16.762 -16.949 14.461 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -15.818 -14.935 14.766 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.111 -14.423 15.833 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.149 -16.358 16.989 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.531 -14.756 16.638 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -15.424 -14.962 18.960 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -16.227 -13.712 18.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -17.717 -15.208 19.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -18.106 -15.091 17.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -17.308 -16.469 18.282 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.549 -17.860 13.665 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.053 -18.222 12.346 1.00 0.00 C ATOM 1100 C ILE A 72 -21.522 -17.842 12.196 1.00 0.00 C ATOM 1101 O ILE A 72 -21.900 -17.147 11.253 1.00 0.00 O ATOM 1102 CB ILE A 72 -19.895 -19.730 12.078 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.425 -20.139 12.193 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.443 -20.084 10.703 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.225 -21.629 12.366 1.00 0.00 C ATOM 0 H ILE A 72 -19.548 -18.624 14.341 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.460 -17.668 11.618 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.465 -20.279 12.827 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -17.894 -19.810 11.300 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -17.977 -19.619 13.040 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.324 -21.153 10.528 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.500 -19.824 10.655 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -19.897 -19.529 9.940 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.160 -21.847 12.441 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.728 -21.961 13.275 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.643 -22.154 11.507 1.00 0.00 H new ATOM 1117 N MET A 73 -22.346 -18.300 13.133 1.00 0.00 N ATOM 1118 CA MET A 73 -23.774 -18.005 13.105 1.00 0.00 C ATOM 1119 C MET A 73 -24.017 -16.500 13.086 1.00 0.00 C ATOM 1120 O MET A 73 -24.820 -16.003 12.296 1.00 0.00 O ATOM 1121 CB MET A 73 -24.468 -18.630 14.317 1.00 0.00 C ATOM 1122 CG MET A 73 -24.854 -20.086 14.112 1.00 0.00 C ATOM 1123 SD MET A 73 -26.165 -20.292 12.891 1.00 0.00 S ATOM 1124 CE MET A 73 -27.472 -19.314 13.630 1.00 0.00 C ATOM 0 H MET A 73 -22.050 -18.876 13.921 1.00 0.00 H new ATOM 0 HA MET A 73 -24.192 -18.434 12.194 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.808 -18.556 15.181 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.364 -18.054 14.549 1.00 0.00 H new ATOM 0 HG2 MET A 73 -23.976 -20.649 13.795 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.179 -20.509 15.063 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.437 -19.768 13.406 1.00 0.00 H new ATOM 0 HE2 MET A 73 -27.331 -19.275 14.710 1.00 0.00 H new ATOM 0 HE3 MET A 73 -27.444 -18.303 13.224 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.320 -15.780 13.959 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.463 -14.331 14.041 1.00 0.00 C ATOM 1136 C GLN A 74 -23.200 -13.681 12.687 1.00 0.00 C ATOM 1137 O GLN A 74 -23.725 -12.608 12.390 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.505 -13.762 15.089 1.00 0.00 C ATOM 1139 CG GLN A 74 -21.049 -13.776 14.653 1.00 0.00 C ATOM 1140 CD GLN A 74 -20.567 -12.417 14.184 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -20.024 -12.366 12.973 1.00 0.00 O flip ATOM 1142 NE2 GLN A 74 -20.680 -11.424 14.903 1.00 0.00 N flip ATOM 0 H GLN A 74 -22.651 -16.176 14.619 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.488 -14.108 14.337 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -22.797 -12.737 15.318 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.605 -14.336 16.010 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -20.428 -14.111 15.484 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -20.922 -14.500 13.848 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -21.104 -11.509 15.827 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -20.350 -10.516 14.575 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.383 -14.337 11.870 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.048 -13.821 10.547 1.00 0.00 C ATOM 1153 C PHE A 75 -23.161 -14.126 9.548 1.00 0.00 C ATOM 1154 O PHE A 75 -23.354 -13.394 8.577 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.730 -14.426 10.059 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.344 -13.985 8.676 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.862 -12.706 8.452 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.464 -14.850 7.601 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.506 -12.297 7.180 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -20.109 -14.447 6.327 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.630 -13.169 6.116 1.00 0.00 C ATOM 0 H PHE A 75 -21.941 -15.227 12.100 1.00 0.00 H new ATOM 0 HA PHE A 75 -21.937 -12.739 10.623 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -19.935 -14.154 10.754 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.810 -15.513 10.076 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.763 -12.020 9.280 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.839 -15.850 7.760 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -19.131 -11.297 7.019 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.206 -15.131 5.497 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.353 -12.852 5.121 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.888 -15.210 9.794 1.00 0.00 N ATOM 1172 CA ILE A 76 -24.981 -15.611 8.916 1.00 0.00 C ATOM 1173 C ILE A 76 -26.174 -14.671 9.059 1.00 0.00 C ATOM 1174 O ILE A 76 -26.762 -14.244 8.067 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.440 -17.051 9.210 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.269 -18.024 9.053 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.587 -17.441 8.290 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.563 -19.413 9.576 1.00 0.00 C ATOM 0 H ILE A 76 -23.741 -15.826 10.593 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.601 -15.560 7.896 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.794 -17.100 10.240 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -24.002 -18.091 7.998 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.401 -17.623 9.577 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.900 -18.462 8.511 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.426 -16.763 8.447 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.259 -17.379 7.253 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.689 -20.049 9.432 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.801 -19.359 10.638 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.411 -19.834 9.035 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.523 -14.351 10.301 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.645 -13.460 10.574 1.00 0.00 C ATOM 1192 C ASN A 77 -27.210 -12.000 10.501 1.00 0.00 C ATOM 1193 O ASN A 77 -27.896 -11.165 9.914 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.237 -13.760 11.952 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.603 -14.413 11.865 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.432 -14.036 11.037 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -29.843 -15.399 12.722 1.00 0.00 N ATOM 0 H ASN A 77 -26.045 -14.695 11.134 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.407 -13.632 9.814 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.559 -14.414 12.501 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -28.316 -12.833 12.520 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -30.744 -15.877 12.711 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -29.126 -15.679 13.392 1.00 0.00 H new