USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=14 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 Set 1.1: A 73 MET CE :methyl -161:sc= -0.313 (180deg=-1.06) USER MOD Set 1.2: A 77 ASN : amide:sc= -0.244 X(o=-0.56,f=-0.25) USER MOD Set 2.1: A 70 LYS NZ :NH3+ 162:sc=0.000977 (180deg=0) USER MOD Set 2.2: A 74 GLN : amide:sc= -0.238 X(o=-0.24,f=-0.34) USER MOD Set 3.1: A 33 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 68 GLN : amide:sc= -0.0943 K(o=-0.094,f=-6.5!) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= -0.0082 USER MOD Single : A 19 SER OG : rot 42:sc= 0.0514 USER MOD Single : A 24 SER OG : rot 94:sc= 1.3 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= -0.31 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc=-0.00839 X(o=-0.0084,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 163:sc=-0.00871 (180deg=-0.0966) USER MOD Single : A 71 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0146) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -16.099 -6.346 0.864 1.00 0.00 N ATOM 105 CA GLN A 10 -16.816 -6.929 1.992 1.00 0.00 C ATOM 106 C GLN A 10 -17.918 -7.867 1.511 1.00 0.00 C ATOM 107 O GLN A 10 -18.400 -7.771 0.382 1.00 0.00 O ATOM 108 CB GLN A 10 -17.414 -5.827 2.868 1.00 0.00 C ATOM 109 CG GLN A 10 -18.035 -4.689 2.074 1.00 0.00 C ATOM 110 CD GLN A 10 -18.720 -3.666 2.959 1.00 0.00 C ATOM 111 OE1 GLN A 10 -18.294 -2.514 3.040 1.00 0.00 O ATOM 112 NE2 GLN A 10 -19.788 -4.083 3.628 1.00 0.00 N ATOM 0 HA GLN A 10 -16.105 -7.507 2.582 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.173 -6.263 3.518 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -16.634 -5.425 3.514 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -17.260 -4.195 1.487 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.759 -5.096 1.368 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.106 -5.047 3.531 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.290 -3.439 4.239 1.00 0.00 H new ATOM 121 N PRO A 11 -18.328 -8.797 2.386 1.00 0.00 N ATOM 122 CA PRO A 11 -19.379 -9.771 2.073 1.00 0.00 C ATOM 123 C PRO A 11 -20.755 -9.124 1.966 1.00 0.00 C ATOM 124 O PRO A 11 -21.043 -8.111 2.604 1.00 0.00 O ATOM 125 CB PRO A 11 -19.332 -10.737 3.259 1.00 0.00 C ATOM 126 CG PRO A 11 -18.765 -9.935 4.379 1.00 0.00 C ATOM 127 CD PRO A 11 -17.798 -8.970 3.749 1.00 0.00 C ATOM 0 HA PRO A 11 -19.216 -10.251 1.108 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.326 -11.112 3.504 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.710 -11.604 3.039 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.551 -9.405 4.916 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.261 -10.576 5.102 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.764 -8.024 4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.783 -9.368 3.738 1.00 0.00 H new ATOM 135 N PRO A 12 -21.628 -9.721 1.141 1.00 0.00 N ATOM 136 CA PRO A 12 -22.990 -9.220 0.932 1.00 0.00 C ATOM 137 C PRO A 12 -23.872 -9.409 2.161 1.00 0.00 C ATOM 138 O PRO A 12 -23.418 -9.902 3.193 1.00 0.00 O ATOM 139 CB PRO A 12 -23.506 -10.069 -0.232 1.00 0.00 C ATOM 140 CG PRO A 12 -22.710 -11.326 -0.166 1.00 0.00 C ATOM 141 CD PRO A 12 -21.353 -10.931 0.349 1.00 0.00 C ATOM 0 HA PRO A 12 -23.004 -8.148 0.734 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.573 -10.270 -0.133 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -23.365 -9.561 -1.186 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -23.182 -12.052 0.495 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.634 -11.792 -1.149 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.910 -11.718 0.959 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.657 -10.729 -0.465 1.00 0.00 H new ATOM 149 N ALA A 13 -25.136 -9.014 2.044 1.00 0.00 N ATOM 150 CA ALA A 13 -26.082 -9.143 3.145 1.00 0.00 C ATOM 151 C ALA A 13 -26.928 -10.403 2.997 1.00 0.00 C ATOM 152 O ALA A 13 -27.416 -10.954 3.984 1.00 0.00 O ATOM 153 CB ALA A 13 -26.973 -7.913 3.221 1.00 0.00 C ATOM 0 H ALA A 13 -25.528 -8.602 1.197 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.514 -9.225 4.072 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.675 -8.023 4.048 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -26.358 -7.028 3.382 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -27.526 -7.806 2.288 1.00 0.00 H new ATOM 159 N ASP A 14 -27.098 -10.854 1.759 1.00 0.00 N ATOM 160 CA ASP A 14 -27.885 -12.050 1.482 1.00 0.00 C ATOM 161 C ASP A 14 -27.016 -13.301 1.555 1.00 0.00 C ATOM 162 O ASP A 14 -27.481 -14.371 1.951 1.00 0.00 O ATOM 163 CB ASP A 14 -28.540 -11.948 0.104 1.00 0.00 C ATOM 164 CG ASP A 14 -30.030 -11.681 0.188 1.00 0.00 C ATOM 165 OD1 ASP A 14 -30.781 -12.615 0.542 1.00 0.00 O ATOM 166 OD2 ASP A 14 -30.445 -10.539 -0.099 1.00 0.00 O ATOM 0 H ASP A 14 -26.701 -10.409 0.931 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.664 -12.126 2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -28.062 -11.149 -0.464 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.370 -12.874 -0.445 1.00 0.00 H new ATOM 171 N LEU A 15 -25.753 -13.161 1.169 1.00 0.00 N ATOM 172 CA LEU A 15 -24.818 -14.281 1.190 1.00 0.00 C ATOM 173 C LEU A 15 -25.390 -15.482 0.443 1.00 0.00 C ATOM 174 O LEU A 15 -25.104 -16.630 0.782 1.00 0.00 O ATOM 175 CB LEU A 15 -24.491 -14.671 2.632 1.00 0.00 C ATOM 176 CG LEU A 15 -23.497 -13.768 3.363 1.00 0.00 C ATOM 177 CD1 LEU A 15 -24.230 -12.679 4.131 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.622 -14.587 4.301 1.00 0.00 C ATOM 0 H LEU A 15 -25.352 -12.283 0.838 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.902 -13.967 0.689 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -25.420 -14.690 3.201 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.096 -15.687 2.632 1.00 0.00 H new ATOM 0 HG LEU A 15 -22.855 -13.292 2.622 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.506 -12.046 4.645 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.813 -12.074 3.437 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -24.897 -13.136 4.863 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.921 -13.928 4.813 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -23.249 -15.091 5.037 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -22.069 -15.330 3.727 1.00 0.00 H new ATOM 190 N SER A 16 -26.197 -15.208 -0.577 1.00 0.00 N ATOM 191 CA SER A 16 -26.811 -16.266 -1.371 1.00 0.00 C ATOM 192 C SER A 16 -26.287 -16.243 -2.804 1.00 0.00 C ATOM 193 O SER A 16 -26.995 -16.606 -3.742 1.00 0.00 O ATOM 194 CB SER A 16 -28.333 -16.115 -1.371 1.00 0.00 C ATOM 195 OG SER A 16 -28.802 -15.676 -0.108 1.00 0.00 O ATOM 0 H SER A 16 -26.441 -14.263 -0.873 1.00 0.00 H new ATOM 0 HA SER A 16 -26.548 -17.223 -0.921 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.631 -15.403 -2.141 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.796 -17.069 -1.623 1.00 0.00 H new ATOM 0 HG SER A 16 -29.777 -15.586 -0.135 1.00 0.00 H new ATOM 201 N GLY A 17 -25.039 -15.812 -2.964 1.00 0.00 N ATOM 202 CA GLY A 17 -24.440 -15.749 -4.285 1.00 0.00 C ATOM 203 C GLY A 17 -22.926 -15.810 -4.238 1.00 0.00 C ATOM 204 O GLY A 17 -22.249 -15.329 -5.147 1.00 0.00 O ATOM 0 H GLY A 17 -24.433 -15.506 -2.203 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.815 -16.574 -4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.748 -14.826 -4.777 1.00 0.00 H new ATOM 208 N LEU A 18 -22.392 -16.403 -3.175 1.00 0.00 N ATOM 209 CA LEU A 18 -20.948 -16.524 -3.012 1.00 0.00 C ATOM 210 C LEU A 18 -20.478 -17.935 -3.353 1.00 0.00 C ATOM 211 O LEU A 18 -21.204 -18.908 -3.149 1.00 0.00 O ATOM 212 CB LEU A 18 -20.545 -16.173 -1.579 1.00 0.00 C ATOM 213 CG LEU A 18 -20.922 -14.770 -1.101 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.454 -14.550 0.329 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.333 -13.715 -2.025 1.00 0.00 C ATOM 0 H LEU A 18 -22.938 -16.807 -2.414 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.470 -15.825 -3.699 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.001 -16.899 -0.906 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.465 -16.288 -1.488 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.008 -14.679 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.731 -13.547 0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.924 -15.284 0.983 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.371 -14.661 0.378 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.612 -12.723 -1.669 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.247 -13.805 -2.034 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.718 -13.860 -3.034 1.00 0.00 H new ATOM 227 N SER A 19 -19.259 -18.038 -3.872 1.00 0.00 N ATOM 228 CA SER A 19 -18.693 -19.330 -4.242 1.00 0.00 C ATOM 229 C SER A 19 -17.835 -19.891 -3.112 1.00 0.00 C ATOM 230 O SER A 19 -17.540 -19.197 -2.139 1.00 0.00 O ATOM 231 CB SER A 19 -17.855 -19.197 -5.516 1.00 0.00 C ATOM 232 OG SER A 19 -17.178 -17.953 -5.554 1.00 0.00 O ATOM 0 H SER A 19 -18.644 -17.243 -4.046 1.00 0.00 H new ATOM 0 HA SER A 19 -19.516 -20.020 -4.427 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.131 -20.010 -5.565 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.499 -19.291 -6.390 1.00 0.00 H new ATOM 0 HG SER A 19 -16.817 -17.750 -4.666 1.00 0.00 H new ATOM 238 N ILE A 20 -17.438 -21.152 -3.249 1.00 0.00 N ATOM 239 CA ILE A 20 -16.613 -21.807 -2.241 1.00 0.00 C ATOM 240 C ILE A 20 -15.342 -21.010 -1.969 1.00 0.00 C ATOM 241 O ILE A 20 -14.784 -21.068 -0.874 1.00 0.00 O ATOM 242 CB ILE A 20 -16.229 -23.235 -2.670 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.484 -24.057 -2.967 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.394 -23.906 -1.589 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.189 -25.471 -3.416 1.00 0.00 C ATOM 0 H ILE A 20 -17.674 -21.740 -4.048 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.209 -21.858 -1.329 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.632 -23.177 -3.580 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.106 -24.091 -2.073 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.064 -23.553 -3.740 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.130 -24.915 -1.907 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.485 -23.329 -1.421 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -15.968 -23.955 -0.664 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.125 -25.994 -3.609 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.593 -25.446 -4.328 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.636 -25.993 -2.635 1.00 0.00 H new ATOM 257 N GLU A 21 -14.890 -20.265 -2.973 1.00 0.00 N ATOM 258 CA GLU A 21 -13.685 -19.456 -2.841 1.00 0.00 C ATOM 259 C GLU A 21 -13.990 -18.136 -2.138 1.00 0.00 C ATOM 260 O GLU A 21 -13.120 -17.547 -1.497 1.00 0.00 O ATOM 261 CB GLU A 21 -13.073 -19.183 -4.217 1.00 0.00 C ATOM 262 CG GLU A 21 -11.558 -19.301 -4.244 1.00 0.00 C ATOM 263 CD GLU A 21 -11.042 -19.890 -5.542 1.00 0.00 C ATOM 264 OE1 GLU A 21 -11.510 -20.981 -5.927 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.169 -19.258 -6.173 1.00 0.00 O ATOM 0 H GLU A 21 -15.340 -20.205 -3.886 1.00 0.00 H new ATOM 0 HA GLU A 21 -12.969 -20.013 -2.237 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.496 -19.882 -4.939 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.357 -18.181 -4.539 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.118 -18.315 -4.097 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.231 -19.924 -3.411 1.00 0.00 H new ATOM 272 N GLU A 22 -15.232 -17.678 -2.264 1.00 0.00 N ATOM 273 CA GLU A 22 -15.651 -16.428 -1.642 1.00 0.00 C ATOM 274 C GLU A 22 -15.827 -16.602 -0.136 1.00 0.00 C ATOM 275 O GLU A 22 -15.432 -15.741 0.650 1.00 0.00 O ATOM 276 CB GLU A 22 -16.958 -15.935 -2.266 1.00 0.00 C ATOM 277 CG GLU A 22 -16.766 -15.209 -3.587 1.00 0.00 C ATOM 278 CD GLU A 22 -16.477 -13.732 -3.404 1.00 0.00 C ATOM 279 OE1 GLU A 22 -15.427 -13.402 -2.812 1.00 0.00 O ATOM 280 OE2 GLU A 22 -17.300 -12.906 -3.851 1.00 0.00 O ATOM 0 H GLU A 22 -15.965 -18.154 -2.791 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.872 -15.686 -1.816 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.620 -16.787 -2.422 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.457 -15.268 -1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.945 -15.671 -4.135 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.662 -15.327 -4.196 1.00 0.00 H new ATOM 287 N VAL A 23 -16.424 -17.722 0.258 1.00 0.00 N ATOM 288 CA VAL A 23 -16.653 -18.011 1.669 1.00 0.00 C ATOM 289 C VAL A 23 -15.362 -17.892 2.471 1.00 0.00 C ATOM 290 O VAL A 23 -15.362 -17.394 3.596 1.00 0.00 O ATOM 291 CB VAL A 23 -17.239 -19.421 1.866 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.596 -19.653 3.326 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.455 -19.622 0.973 1.00 0.00 C ATOM 0 H VAL A 23 -16.758 -18.444 -0.380 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.371 -17.274 2.030 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.482 -20.152 1.582 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -18.009 -20.655 3.445 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.701 -19.554 3.940 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.335 -18.917 3.641 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.856 -20.624 1.125 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.217 -18.884 1.224 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.164 -19.502 -0.071 1.00 0.00 H new ATOM 303 N SER A 24 -14.263 -18.354 1.883 1.00 0.00 N ATOM 304 CA SER A 24 -12.964 -18.303 2.544 1.00 0.00 C ATOM 305 C SER A 24 -12.645 -16.885 3.007 1.00 0.00 C ATOM 306 O SER A 24 -11.928 -16.685 3.988 1.00 0.00 O ATOM 307 CB SER A 24 -11.868 -18.803 1.601 1.00 0.00 C ATOM 308 OG SER A 24 -12.422 -19.308 0.398 1.00 0.00 O ATOM 0 H SER A 24 -14.246 -18.768 0.951 1.00 0.00 H new ATOM 0 HA SER A 24 -13.004 -18.952 3.419 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.179 -17.989 1.374 1.00 0.00 H new ATOM 0 HB3 SER A 24 -11.288 -19.583 2.094 1.00 0.00 H new ATOM 0 HG SER A 24 -12.440 -18.598 -0.277 1.00 0.00 H new ATOM 314 N LYS A 25 -13.183 -15.902 2.294 1.00 0.00 N ATOM 315 CA LYS A 25 -12.959 -14.501 2.629 1.00 0.00 C ATOM 316 C LYS A 25 -14.087 -13.963 3.504 1.00 0.00 C ATOM 317 O LYS A 25 -13.882 -13.055 4.309 1.00 0.00 O ATOM 318 CB LYS A 25 -12.843 -13.661 1.355 1.00 0.00 C ATOM 319 CG LYS A 25 -11.616 -13.987 0.521 1.00 0.00 C ATOM 320 CD LYS A 25 -11.099 -12.762 -0.213 1.00 0.00 C ATOM 321 CE LYS A 25 -10.242 -13.148 -1.409 1.00 0.00 C ATOM 322 NZ LYS A 25 -8.797 -12.879 -1.167 1.00 0.00 N ATOM 0 H LYS A 25 -13.778 -16.050 1.479 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.025 -14.433 3.187 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.735 -13.812 0.748 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.817 -12.606 1.627 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.832 -14.384 1.166 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.862 -14.767 -0.199 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.940 -12.155 -0.548 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.515 -12.147 0.471 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.382 -14.206 -1.630 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.573 -12.593 -2.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.247 -13.156 -2.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.659 -11.865 -0.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.475 -13.428 -0.345 1.00 0.00 H new ATOM 336 N SER A 26 -15.278 -14.530 3.340 1.00 0.00 N ATOM 337 CA SER A 26 -16.440 -14.106 4.113 1.00 0.00 C ATOM 338 C SER A 26 -16.136 -14.131 5.608 1.00 0.00 C ATOM 339 O SER A 26 -16.645 -13.309 6.371 1.00 0.00 O ATOM 340 CB SER A 26 -17.638 -15.008 3.809 1.00 0.00 C ATOM 341 OG SER A 26 -17.956 -14.985 2.429 1.00 0.00 O ATOM 0 H SER A 26 -15.464 -15.284 2.679 1.00 0.00 H new ATOM 0 HA SER A 26 -16.683 -13.083 3.826 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.415 -16.030 4.117 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.500 -14.681 4.390 1.00 0.00 H new ATOM 0 HG SER A 26 -18.724 -15.570 2.260 1.00 0.00 H new ATOM 347 N LEU A 27 -15.303 -15.081 6.020 1.00 0.00 N ATOM 348 CA LEU A 27 -14.930 -15.215 7.424 1.00 0.00 C ATOM 349 C LEU A 27 -13.807 -14.247 7.784 1.00 0.00 C ATOM 350 O LEU A 27 -13.674 -13.836 8.937 1.00 0.00 O ATOM 351 CB LEU A 27 -14.496 -16.651 7.722 1.00 0.00 C ATOM 352 CG LEU A 27 -15.621 -17.678 7.857 1.00 0.00 C ATOM 353 CD1 LEU A 27 -15.050 -19.068 8.091 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.564 -17.290 8.987 1.00 0.00 C ATOM 0 H LEU A 27 -14.873 -15.769 5.402 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.802 -14.972 8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.825 -16.979 6.928 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.919 -16.650 8.647 1.00 0.00 H new ATOM 0 HG LEU A 27 -16.187 -17.692 6.926 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.865 -19.785 8.185 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.416 -19.347 7.250 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.459 -19.069 9.007 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.358 -18.032 9.069 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.010 -17.247 9.925 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.000 -16.313 8.778 1.00 0.00 H new ATOM 366 N ARG A 28 -13.003 -13.886 6.789 1.00 0.00 N ATOM 367 CA ARG A 28 -11.892 -12.966 7.001 1.00 0.00 C ATOM 368 C ARG A 28 -12.375 -11.670 7.646 1.00 0.00 C ATOM 369 O ARG A 28 -11.643 -11.029 8.401 1.00 0.00 O ATOM 370 CB ARG A 28 -11.196 -12.659 5.673 1.00 0.00 C ATOM 371 CG ARG A 28 -9.689 -12.510 5.796 1.00 0.00 C ATOM 372 CD ARG A 28 -8.988 -13.857 5.718 1.00 0.00 C ATOM 373 NE ARG A 28 -7.676 -13.755 5.083 1.00 0.00 N ATOM 374 CZ ARG A 28 -6.635 -13.147 5.640 1.00 0.00 C ATOM 375 NH1 ARG A 28 -6.752 -12.588 6.837 1.00 0.00 N ATOM 376 NH2 ARG A 28 -5.474 -13.096 4.999 1.00 0.00 N ATOM 0 H ARG A 28 -13.100 -14.216 5.829 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.181 -13.444 7.675 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.417 -13.457 4.964 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.611 -11.740 5.259 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.321 -11.860 5.002 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.446 -12.026 6.742 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -8.874 -14.265 6.722 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.608 -14.557 5.158 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.553 -14.174 4.161 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.643 -12.624 7.332 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -5.951 -12.122 7.263 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.381 -13.524 4.078 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.675 -12.629 5.428 1.00 0.00 H new ATOM 390 N PHE A 29 -13.612 -11.289 7.343 1.00 0.00 N ATOM 391 CA PHE A 29 -14.192 -10.069 7.892 1.00 0.00 C ATOM 392 C PHE A 29 -14.086 -10.053 9.414 1.00 0.00 C ATOM 393 O PHE A 29 -13.662 -9.061 10.007 1.00 0.00 O ATOM 394 CB PHE A 29 -15.657 -9.942 7.470 1.00 0.00 C ATOM 395 CG PHE A 29 -16.284 -8.636 7.867 1.00 0.00 C ATOM 396 CD1 PHE A 29 -16.017 -7.479 7.153 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.139 -8.565 8.955 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.592 -6.275 7.515 1.00 0.00 C ATOM 399 CE2 PHE A 29 -17.718 -7.364 9.321 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.443 -6.218 8.601 1.00 0.00 C ATOM 0 H PHE A 29 -14.232 -11.808 6.720 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.632 -9.221 7.498 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.726 -10.055 6.388 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.227 -10.759 7.913 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.352 -7.518 6.303 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.356 -9.457 9.523 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.376 -5.381 6.949 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.385 -7.322 10.169 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.893 -5.279 8.887 1.00 0.00 H new ATOM 410 N ILE A 30 -14.475 -11.159 10.040 1.00 0.00 N ATOM 411 CA ILE A 30 -14.423 -11.273 11.492 1.00 0.00 C ATOM 412 C ILE A 30 -13.057 -11.765 11.956 1.00 0.00 C ATOM 413 O ILE A 30 -12.632 -11.485 13.077 1.00 0.00 O ATOM 414 CB ILE A 30 -15.508 -12.230 12.021 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.367 -13.607 11.367 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.893 -11.655 11.763 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.274 -14.657 11.969 1.00 0.00 C ATOM 0 H ILE A 30 -14.830 -11.989 9.564 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.603 -10.276 11.893 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.378 -12.344 13.097 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.583 -13.519 10.302 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.332 -13.938 11.455 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.649 -12.343 12.142 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -16.989 -10.695 12.270 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.035 -11.515 10.691 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.121 -15.607 11.457 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -16.043 -14.774 13.028 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.313 -14.348 11.857 1.00 0.00 H new ATOM 429 N GLY A 31 -12.371 -12.500 11.086 1.00 0.00 N ATOM 430 CA GLY A 31 -11.058 -13.018 11.424 1.00 0.00 C ATOM 431 C GLY A 31 -11.131 -14.270 12.276 1.00 0.00 C ATOM 432 O GLY A 31 -11.185 -14.192 13.504 1.00 0.00 O ATOM 0 H GLY A 31 -12.701 -12.746 10.153 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.510 -13.237 10.508 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.495 -12.252 11.957 1.00 0.00 H new ATOM 436 N LEU A 32 -11.134 -15.427 11.624 1.00 0.00 N ATOM 437 CA LEU A 32 -11.202 -16.702 12.330 1.00 0.00 C ATOM 438 C LEU A 32 -9.918 -17.502 12.135 1.00 0.00 C ATOM 439 O LEU A 32 -8.981 -17.042 11.482 1.00 0.00 O ATOM 440 CB LEU A 32 -12.402 -17.515 11.839 1.00 0.00 C ATOM 441 CG LEU A 32 -13.780 -16.965 12.205 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.876 -17.896 11.710 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.891 -16.760 13.709 1.00 0.00 C ATOM 0 H LEU A 32 -11.090 -15.509 10.608 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.321 -16.495 13.393 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.341 -17.595 10.754 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.319 -18.526 12.238 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.905 -15.999 11.717 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.850 -17.488 11.980 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.810 -17.991 10.626 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.754 -18.877 12.169 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.879 -16.368 13.951 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.744 -17.713 14.218 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.130 -16.052 14.037 1.00 0.00 H new ATOM 455 N SER A 33 -9.882 -18.703 12.705 1.00 0.00 N ATOM 456 CA SER A 33 -8.712 -19.566 12.595 1.00 0.00 C ATOM 457 C SER A 33 -8.563 -20.101 11.174 1.00 0.00 C ATOM 458 O SER A 33 -9.548 -20.458 10.528 1.00 0.00 O ATOM 459 CB SER A 33 -8.817 -20.730 13.582 1.00 0.00 C ATOM 460 OG SER A 33 -9.336 -20.297 14.828 1.00 0.00 O ATOM 0 H SER A 33 -10.649 -19.100 13.247 1.00 0.00 H new ATOM 0 HA SER A 33 -7.830 -18.973 12.835 1.00 0.00 H new ATOM 0 HB2 SER A 33 -9.460 -21.506 13.167 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.833 -21.176 13.729 1.00 0.00 H new ATOM 0 HG SER A 33 -9.395 -21.060 15.441 1.00 0.00 H new ATOM 466 N GLU A 34 -7.324 -20.154 10.695 1.00 0.00 N ATOM 467 CA GLU A 34 -7.046 -20.644 9.351 1.00 0.00 C ATOM 468 C GLU A 34 -7.654 -22.028 9.140 1.00 0.00 C ATOM 469 O GLU A 34 -8.033 -22.387 8.025 1.00 0.00 O ATOM 470 CB GLU A 34 -5.536 -20.696 9.105 1.00 0.00 C ATOM 471 CG GLU A 34 -4.782 -21.532 10.125 1.00 0.00 C ATOM 472 CD GLU A 34 -3.308 -21.667 9.794 1.00 0.00 C ATOM 473 OE1 GLU A 34 -2.982 -22.373 8.817 1.00 0.00 O ATOM 474 OE2 GLU A 34 -2.482 -21.066 10.512 1.00 0.00 O ATOM 0 H GLU A 34 -6.498 -19.864 11.218 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.500 -19.954 8.639 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.352 -21.100 8.109 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.139 -19.681 9.115 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.889 -21.079 11.111 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.231 -22.524 10.179 1.00 0.00 H new ATOM 481 N ASP A 35 -7.743 -22.799 10.218 1.00 0.00 N ATOM 482 CA ASP A 35 -8.305 -24.143 10.152 1.00 0.00 C ATOM 483 C ASP A 35 -9.807 -24.091 9.888 1.00 0.00 C ATOM 484 O ASP A 35 -10.330 -24.845 9.067 1.00 0.00 O ATOM 485 CB ASP A 35 -8.029 -24.899 11.452 1.00 0.00 C ATOM 486 CG ASP A 35 -6.630 -25.482 11.497 1.00 0.00 C ATOM 487 OD1 ASP A 35 -5.672 -24.751 11.171 1.00 0.00 O ATOM 488 OD2 ASP A 35 -6.494 -26.671 11.856 1.00 0.00 O ATOM 0 H ASP A 35 -7.433 -22.516 11.148 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.827 -24.670 9.326 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -8.166 -24.224 12.297 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.758 -25.702 11.564 1.00 0.00 H new ATOM 493 N VAL A 36 -10.496 -23.198 10.592 1.00 0.00 N ATOM 494 CA VAL A 36 -11.937 -23.048 10.434 1.00 0.00 C ATOM 495 C VAL A 36 -12.302 -22.724 8.989 1.00 0.00 C ATOM 496 O VAL A 36 -13.120 -23.410 8.376 1.00 0.00 O ATOM 497 CB VAL A 36 -12.490 -21.941 11.352 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.989 -21.780 11.151 1.00 0.00 C ATOM 499 CG2 VAL A 36 -12.169 -22.247 12.807 1.00 0.00 C ATOM 0 H VAL A 36 -10.079 -22.568 11.277 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.386 -24.001 10.714 1.00 0.00 H new ATOM 0 HB VAL A 36 -12.009 -20.999 11.087 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.362 -20.994 11.808 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.190 -21.512 10.114 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.491 -22.718 11.387 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.567 -21.455 13.442 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.621 -23.198 13.087 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.088 -22.307 12.936 1.00 0.00 H new ATOM 509 N ILE A 37 -11.689 -21.674 8.452 1.00 0.00 N ATOM 510 CA ILE A 37 -11.947 -21.260 7.078 1.00 0.00 C ATOM 511 C ILE A 37 -11.777 -22.427 6.111 1.00 0.00 C ATOM 512 O ILE A 37 -12.665 -22.716 5.309 1.00 0.00 O ATOM 513 CB ILE A 37 -11.013 -20.113 6.651 1.00 0.00 C ATOM 514 CG1 ILE A 37 -11.181 -18.914 7.585 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.292 -19.712 5.210 1.00 0.00 C ATOM 516 CD1 ILE A 37 -10.112 -17.858 7.412 1.00 0.00 C ATOM 0 H ILE A 37 -11.011 -21.095 8.947 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.978 -20.910 7.042 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.982 -20.460 6.718 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -12.158 -18.462 7.411 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -11.171 -19.264 8.617 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.624 -18.900 4.922 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -11.126 -20.568 4.556 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.326 -19.381 5.118 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.295 -17.038 8.106 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.134 -18.294 7.615 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.136 -17.480 6.390 1.00 0.00 H new ATOM 528 N SER A 38 -10.631 -23.095 6.194 1.00 0.00 N ATOM 529 CA SER A 38 -10.344 -24.230 5.325 1.00 0.00 C ATOM 530 C SER A 38 -11.306 -25.382 5.599 1.00 0.00 C ATOM 531 O SER A 38 -11.577 -26.202 4.721 1.00 0.00 O ATOM 532 CB SER A 38 -8.901 -24.698 5.523 1.00 0.00 C ATOM 533 OG SER A 38 -8.329 -25.120 4.297 1.00 0.00 O ATOM 0 H SER A 38 -9.886 -22.870 6.854 1.00 0.00 H new ATOM 0 HA SER A 38 -10.476 -23.908 4.292 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.307 -23.887 5.945 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.877 -25.518 6.241 1.00 0.00 H new ATOM 0 HG SER A 38 -7.406 -25.413 4.450 1.00 0.00 H new ATOM 539 N PHE A 39 -11.820 -25.437 6.823 1.00 0.00 N ATOM 540 CA PHE A 39 -12.751 -26.489 7.215 1.00 0.00 C ATOM 541 C PHE A 39 -14.049 -26.389 6.419 1.00 0.00 C ATOM 542 O PHE A 39 -14.744 -27.385 6.216 1.00 0.00 O ATOM 543 CB PHE A 39 -13.051 -26.402 8.713 1.00 0.00 C ATOM 544 CG PHE A 39 -12.638 -27.626 9.478 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.254 -28.846 9.245 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.635 -27.558 10.432 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.876 -29.975 9.948 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.253 -28.684 11.137 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.875 -29.893 10.896 1.00 0.00 C ATOM 0 H PHE A 39 -11.608 -24.765 7.561 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.285 -27.451 7.000 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.539 -25.534 9.128 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.120 -26.239 8.853 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.038 -28.915 8.506 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.146 -26.615 10.627 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.363 -30.920 9.756 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.468 -28.618 11.876 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.579 -30.773 11.448 1.00 0.00 H new ATOM 559 N PHE A 40 -14.370 -25.180 5.970 1.00 0.00 N ATOM 560 CA PHE A 40 -15.585 -24.949 5.197 1.00 0.00 C ATOM 561 C PHE A 40 -15.370 -25.302 3.728 1.00 0.00 C ATOM 562 O PHE A 40 -16.099 -26.116 3.161 1.00 0.00 O ATOM 563 CB PHE A 40 -16.025 -23.489 5.324 1.00 0.00 C ATOM 564 CG PHE A 40 -16.911 -23.231 6.509 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.592 -23.746 7.755 1.00 0.00 C ATOM 566 CD2 PHE A 40 -18.063 -22.472 6.377 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.405 -23.510 8.847 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.879 -22.232 7.466 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.550 -22.753 8.703 1.00 0.00 C ATOM 0 H PHE A 40 -13.806 -24.345 6.128 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.368 -25.593 5.596 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -15.140 -22.856 5.397 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.552 -23.196 4.416 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.697 -24.339 7.874 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.326 -22.064 5.412 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.145 -23.918 9.813 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.773 -21.638 7.351 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.187 -22.568 9.555 1.00 0.00 H new ATOM 579 N VAL A 41 -14.365 -24.682 3.118 1.00 0.00 N ATOM 580 CA VAL A 41 -14.053 -24.930 1.715 1.00 0.00 C ATOM 581 C VAL A 41 -13.853 -26.418 1.451 1.00 0.00 C ATOM 582 O VAL A 41 -14.358 -26.960 0.468 1.00 0.00 O ATOM 583 CB VAL A 41 -12.788 -24.168 1.278 1.00 0.00 C ATOM 584 CG1 VAL A 41 -12.491 -24.424 -0.191 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.945 -22.679 1.547 1.00 0.00 C ATOM 0 H VAL A 41 -13.753 -24.005 3.573 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.903 -24.572 1.134 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.944 -24.533 1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.594 -23.877 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -12.333 -25.491 -0.350 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -13.333 -24.088 -0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -12.042 -22.155 1.232 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.800 -22.297 0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.106 -22.517 2.613 1.00 0.00 H new ATOM 595 N THR A 42 -13.112 -27.076 2.337 1.00 0.00 N ATOM 596 CA THR A 42 -12.843 -28.502 2.201 1.00 0.00 C ATOM 597 C THR A 42 -14.132 -29.313 2.269 1.00 0.00 C ATOM 598 O THR A 42 -14.208 -30.420 1.737 1.00 0.00 O ATOM 599 CB THR A 42 -11.879 -29.000 3.294 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.471 -30.343 3.013 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.538 -28.941 4.664 1.00 0.00 C ATOM 0 H THR A 42 -12.687 -26.643 3.157 1.00 0.00 H new ATOM 0 HA THR A 42 -12.378 -28.644 1.225 1.00 0.00 H new ATOM 0 HB THR A 42 -11.005 -28.349 3.300 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.857 -30.651 3.712 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.838 -29.298 5.420 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.821 -27.912 4.888 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.428 -29.571 4.667 1.00 0.00 H new ATOM 609 N GLU A 43 -15.144 -28.754 2.924 1.00 0.00 N ATOM 610 CA GLU A 43 -16.431 -29.427 3.061 1.00 0.00 C ATOM 611 C GLU A 43 -17.407 -28.958 1.985 1.00 0.00 C ATOM 612 O GLU A 43 -18.623 -29.045 2.154 1.00 0.00 O ATOM 613 CB GLU A 43 -17.022 -29.169 4.448 1.00 0.00 C ATOM 614 CG GLU A 43 -16.564 -30.166 5.500 1.00 0.00 C ATOM 615 CD GLU A 43 -17.512 -31.340 5.643 1.00 0.00 C ATOM 616 OE1 GLU A 43 -18.638 -31.135 6.143 1.00 0.00 O ATOM 617 OE2 GLU A 43 -17.129 -32.464 5.255 1.00 0.00 O ATOM 0 H GLU A 43 -15.098 -27.837 3.368 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.267 -30.498 2.938 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.749 -28.164 4.769 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -18.110 -29.198 4.381 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.572 -30.535 5.238 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.472 -29.659 6.460 1.00 0.00 H new ATOM 624 N LYS A 44 -16.864 -28.461 0.879 1.00 0.00 N ATOM 625 CA LYS A 44 -17.684 -27.979 -0.226 1.00 0.00 C ATOM 626 C LYS A 44 -18.663 -26.910 0.249 1.00 0.00 C ATOM 627 O LYS A 44 -19.717 -26.707 -0.355 1.00 0.00 O ATOM 628 CB LYS A 44 -18.452 -29.140 -0.864 1.00 0.00 C ATOM 629 CG LYS A 44 -18.582 -29.027 -2.373 1.00 0.00 C ATOM 630 CD LYS A 44 -18.474 -30.386 -3.045 1.00 0.00 C ATOM 631 CE LYS A 44 -17.026 -30.751 -3.334 1.00 0.00 C ATOM 632 NZ LYS A 44 -16.654 -32.062 -2.733 1.00 0.00 N ATOM 0 H LYS A 44 -15.859 -28.381 0.724 1.00 0.00 H new ATOM 0 HA LYS A 44 -17.022 -27.537 -0.970 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.948 -30.075 -0.620 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.448 -29.191 -0.425 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -19.540 -28.571 -2.624 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.805 -28.367 -2.758 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -18.921 -31.146 -2.405 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -19.041 -30.379 -3.976 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.869 -30.788 -4.412 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.370 -29.973 -2.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.660 -32.275 -2.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.779 -32.019 -1.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.263 -32.809 -3.125 1.00 0.00 H new ATOM 646 N ILE A 45 -18.306 -26.227 1.332 1.00 0.00 N ATOM 647 CA ILE A 45 -19.152 -25.177 1.885 1.00 0.00 C ATOM 648 C ILE A 45 -19.085 -23.913 1.035 1.00 0.00 C ATOM 649 O ILE A 45 -18.014 -23.337 0.843 1.00 0.00 O ATOM 650 CB ILE A 45 -18.748 -24.832 3.331 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.833 -26.076 4.218 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.634 -23.723 3.878 1.00 0.00 C ATOM 653 CD1 ILE A 45 -20.236 -26.624 4.357 1.00 0.00 C ATOM 0 H ILE A 45 -17.437 -26.382 1.843 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.173 -25.560 1.883 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.717 -24.479 3.330 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -18.188 -26.852 3.805 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.447 -25.834 5.208 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.336 -23.490 4.900 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.528 -22.833 3.258 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.674 -24.050 3.868 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -20.221 -27.505 4.999 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.881 -25.864 4.798 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.619 -26.898 3.374 1.00 0.00 H new ATOM 665 N ASP A 46 -20.237 -23.485 0.530 1.00 0.00 N ATOM 666 CA ASP A 46 -20.311 -22.286 -0.298 1.00 0.00 C ATOM 667 C ASP A 46 -21.188 -21.225 0.359 1.00 0.00 C ATOM 668 O ASP A 46 -21.589 -21.365 1.514 1.00 0.00 O ATOM 669 CB ASP A 46 -20.857 -22.631 -1.684 1.00 0.00 C ATOM 670 CG ASP A 46 -22.288 -23.129 -1.635 1.00 0.00 C ATOM 671 OD1 ASP A 46 -22.487 -24.335 -1.382 1.00 0.00 O ATOM 672 OD2 ASP A 46 -23.208 -22.313 -1.851 1.00 0.00 O ATOM 0 H ASP A 46 -21.132 -23.950 0.679 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.303 -21.884 -0.403 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.804 -21.749 -2.322 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.226 -23.393 -2.141 1.00 0.00 H new ATOM 677 N GLY A 47 -21.482 -20.163 -0.385 1.00 0.00 N ATOM 678 CA GLY A 47 -22.309 -19.094 0.142 1.00 0.00 C ATOM 679 C GLY A 47 -23.701 -19.566 0.512 1.00 0.00 C ATOM 680 O GLY A 47 -24.173 -19.318 1.621 1.00 0.00 O ATOM 0 H GLY A 47 -21.162 -20.024 -1.343 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.828 -18.667 1.022 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.384 -18.298 -0.599 1.00 0.00 H new ATOM 684 N ASN A 48 -24.360 -20.247 -0.420 1.00 0.00 N ATOM 685 CA ASN A 48 -25.708 -20.752 -0.187 1.00 0.00 C ATOM 686 C ASN A 48 -25.718 -21.773 0.947 1.00 0.00 C ATOM 687 O ASN A 48 -26.725 -21.944 1.635 1.00 0.00 O ATOM 688 CB ASN A 48 -26.265 -21.386 -1.463 1.00 0.00 C ATOM 689 CG ASN A 48 -27.781 -21.435 -1.471 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.444 -20.441 -1.769 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.337 -22.595 -1.141 1.00 0.00 N ATOM 0 H ASN A 48 -23.983 -20.462 -1.343 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.340 -19.911 0.099 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.918 -20.820 -2.328 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -25.871 -22.397 -1.565 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.353 -22.688 -1.127 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -27.748 -23.393 -0.901 1.00 0.00 H new ATOM 698 N LEU A 49 -24.590 -22.449 1.137 1.00 0.00 N ATOM 699 CA LEU A 49 -24.467 -23.453 2.188 1.00 0.00 C ATOM 700 C LEU A 49 -24.255 -22.795 3.547 1.00 0.00 C ATOM 701 O LEU A 49 -24.855 -23.198 4.545 1.00 0.00 O ATOM 702 CB LEU A 49 -23.306 -24.401 1.881 1.00 0.00 C ATOM 703 CG LEU A 49 -23.444 -25.826 2.419 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.554 -25.816 3.936 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.650 -26.516 1.800 1.00 0.00 C ATOM 0 H LEU A 49 -23.747 -22.320 0.577 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.395 -24.024 2.222 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.181 -24.453 0.799 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.392 -23.968 2.287 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.550 -26.385 2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.651 -26.839 4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.659 -25.362 4.363 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.430 -25.240 4.233 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.732 -27.529 2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.554 -25.957 2.044 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.530 -26.557 0.717 1.00 0.00 H new ATOM 717 N LEU A 50 -23.400 -21.779 3.580 1.00 0.00 N ATOM 718 CA LEU A 50 -23.110 -21.062 4.817 1.00 0.00 C ATOM 719 C LEU A 50 -24.386 -20.490 5.427 1.00 0.00 C ATOM 720 O LEU A 50 -24.643 -20.651 6.620 1.00 0.00 O ATOM 721 CB LEU A 50 -22.107 -19.937 4.555 1.00 0.00 C ATOM 722 CG LEU A 50 -21.926 -18.923 5.685 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.623 -19.633 6.996 1.00 0.00 C ATOM 724 CD2 LEU A 50 -20.820 -17.936 5.343 1.00 0.00 C ATOM 0 H LEU A 50 -22.895 -21.433 2.764 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.676 -21.769 5.524 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.138 -20.385 4.337 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.419 -19.401 3.659 1.00 0.00 H new ATOM 0 HG LEU A 50 -22.857 -18.369 5.803 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.497 -18.895 7.789 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.448 -20.299 7.248 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.706 -20.214 6.892 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.705 -17.222 6.158 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -19.884 -18.475 5.198 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.078 -17.403 4.428 1.00 0.00 H new ATOM 736 N VAL A 51 -25.184 -19.823 4.599 1.00 0.00 N ATOM 737 CA VAL A 51 -26.435 -19.229 5.055 1.00 0.00 C ATOM 738 C VAL A 51 -27.417 -20.302 5.512 1.00 0.00 C ATOM 739 O VAL A 51 -28.291 -20.044 6.339 1.00 0.00 O ATOM 740 CB VAL A 51 -27.092 -18.385 3.947 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.204 -17.208 3.574 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.391 -19.245 2.729 1.00 0.00 C ATOM 0 H VAL A 51 -24.986 -19.681 3.609 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.190 -18.582 5.897 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.035 -17.991 4.326 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.685 -16.623 2.790 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.046 -16.579 4.450 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.243 -17.577 3.214 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.855 -18.632 1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.463 -19.670 2.347 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.070 -20.050 3.010 1.00 0.00 H new ATOM 752 N GLN A 52 -27.266 -21.505 4.968 1.00 0.00 N ATOM 753 CA GLN A 52 -28.141 -22.617 5.320 1.00 0.00 C ATOM 754 C GLN A 52 -27.682 -23.282 6.614 1.00 0.00 C ATOM 755 O GLN A 52 -28.493 -23.821 7.369 1.00 0.00 O ATOM 756 CB GLN A 52 -28.175 -23.646 4.188 1.00 0.00 C ATOM 757 CG GLN A 52 -29.352 -23.471 3.243 1.00 0.00 C ATOM 758 CD GLN A 52 -29.611 -24.704 2.400 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.740 -25.188 2.317 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.563 -25.220 1.767 1.00 0.00 N ATOM 0 H GLN A 52 -26.547 -21.735 4.282 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.145 -22.222 5.472 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.249 -23.577 3.618 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.211 -24.647 4.619 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.246 -23.236 3.821 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -29.164 -22.620 2.588 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.645 -24.787 1.864 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.677 -26.049 1.184 1.00 0.00 H new ATOM 769 N LEU A 53 -26.378 -23.241 6.864 1.00 0.00 N ATOM 770 CA LEU A 53 -25.811 -23.840 8.067 1.00 0.00 C ATOM 771 C LEU A 53 -26.465 -23.269 9.320 1.00 0.00 C ATOM 772 O LEU A 53 -26.785 -22.081 9.381 1.00 0.00 O ATOM 773 CB LEU A 53 -24.300 -23.604 8.114 1.00 0.00 C ATOM 774 CG LEU A 53 -23.428 -24.714 7.525 1.00 0.00 C ATOM 775 CD1 LEU A 53 -21.984 -24.253 7.406 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.520 -25.972 8.377 1.00 0.00 C ATOM 0 H LEU A 53 -25.694 -22.799 6.250 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.005 -24.912 8.035 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.081 -22.677 7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.008 -23.453 9.153 1.00 0.00 H new ATOM 0 HG LEU A 53 -23.796 -24.947 6.526 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.379 -25.056 6.985 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -21.933 -23.381 6.754 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.603 -23.991 8.393 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -22.894 -26.752 7.944 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.178 -25.752 9.388 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.554 -26.314 8.410 1.00 0.00 H new ATOM 788 N THR A 54 -26.660 -24.122 10.321 1.00 0.00 N ATOM 789 CA THR A 54 -27.275 -23.703 11.574 1.00 0.00 C ATOM 790 C THR A 54 -26.360 -23.988 12.759 1.00 0.00 C ATOM 791 O THR A 54 -25.342 -24.666 12.619 1.00 0.00 O ATOM 792 CB THR A 54 -28.625 -24.410 11.801 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.460 -25.828 11.690 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.661 -23.934 10.794 1.00 0.00 C ATOM 0 H THR A 54 -26.401 -25.108 10.288 1.00 0.00 H new ATOM 0 HA THR A 54 -27.443 -22.629 11.499 1.00 0.00 H new ATOM 0 HB THR A 54 -28.976 -24.163 12.803 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.322 -26.270 11.837 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.606 -24.447 10.974 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.806 -22.859 10.901 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.315 -24.155 9.784 1.00 0.00 H new ATOM 802 N GLU A 55 -26.728 -23.467 13.925 1.00 0.00 N ATOM 803 CA GLU A 55 -25.938 -23.667 15.134 1.00 0.00 C ATOM 804 C GLU A 55 -25.926 -25.139 15.539 1.00 0.00 C ATOM 805 O GLU A 55 -24.982 -25.610 16.172 1.00 0.00 O ATOM 806 CB GLU A 55 -26.493 -22.817 16.279 1.00 0.00 C ATOM 807 CG GLU A 55 -25.439 -22.391 17.287 1.00 0.00 C ATOM 808 CD GLU A 55 -26.040 -21.774 18.535 1.00 0.00 C ATOM 809 OE1 GLU A 55 -27.200 -21.316 18.469 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.351 -21.749 19.576 1.00 0.00 O ATOM 0 H GLU A 55 -27.568 -22.904 14.058 1.00 0.00 H new ATOM 0 HA GLU A 55 -24.914 -23.357 14.924 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -26.967 -21.928 15.863 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.270 -23.381 16.795 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -24.839 -23.257 17.567 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.764 -21.673 16.820 1.00 0.00 H new ATOM 817 N GLU A 56 -26.982 -25.857 15.170 1.00 0.00 N ATOM 818 CA GLU A 56 -27.093 -27.274 15.496 1.00 0.00 C ATOM 819 C GLU A 56 -26.100 -28.099 14.682 1.00 0.00 C ATOM 820 O GLU A 56 -25.426 -28.981 15.215 1.00 0.00 O ATOM 821 CB GLU A 56 -28.517 -27.770 15.236 1.00 0.00 C ATOM 822 CG GLU A 56 -29.497 -27.412 16.341 1.00 0.00 C ATOM 823 CD GLU A 56 -29.508 -28.431 17.464 1.00 0.00 C ATOM 824 OE1 GLU A 56 -28.452 -28.623 18.103 1.00 0.00 O ATOM 825 OE2 GLU A 56 -30.573 -29.038 17.703 1.00 0.00 O ATOM 0 H GLU A 56 -27.772 -25.481 14.646 1.00 0.00 H new ATOM 0 HA GLU A 56 -26.860 -27.396 16.554 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -28.873 -27.350 14.296 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.499 -28.853 15.114 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -29.240 -26.433 16.746 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -30.499 -27.330 15.920 1.00 0.00 H new ATOM 832 N ILE A 57 -26.015 -27.805 13.389 1.00 0.00 N ATOM 833 CA ILE A 57 -25.104 -28.519 12.502 1.00 0.00 C ATOM 834 C ILE A 57 -23.655 -28.132 12.776 1.00 0.00 C ATOM 835 O ILE A 57 -22.743 -28.943 12.613 1.00 0.00 O ATOM 836 CB ILE A 57 -25.427 -28.241 11.022 1.00 0.00 C ATOM 837 CG1 ILE A 57 -26.870 -28.641 10.709 1.00 0.00 C ATOM 838 CG2 ILE A 57 -24.457 -28.989 10.119 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.342 -28.183 9.346 1.00 0.00 C ATOM 0 H ILE A 57 -26.565 -27.078 12.932 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.237 -29.582 12.701 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.317 -27.173 10.836 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -26.959 -29.726 10.770 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -27.528 -28.224 11.471 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -24.698 -28.783 9.076 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -23.439 -28.661 10.328 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -24.539 -30.060 10.305 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -28.373 -28.501 9.192 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.285 -27.096 9.288 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -26.708 -28.621 8.575 1.00 0.00 H new ATOM 851 N LEU A 58 -23.449 -26.888 13.195 1.00 0.00 N ATOM 852 CA LEU A 58 -22.110 -26.393 13.494 1.00 0.00 C ATOM 853 C LEU A 58 -21.527 -27.102 14.712 1.00 0.00 C ATOM 854 O LEU A 58 -20.309 -27.218 14.851 1.00 0.00 O ATOM 855 CB LEU A 58 -22.145 -24.883 13.737 1.00 0.00 C ATOM 856 CG LEU A 58 -22.213 -24.004 12.488 1.00 0.00 C ATOM 857 CD1 LEU A 58 -22.855 -22.664 12.812 1.00 0.00 C ATOM 858 CD2 LEU A 58 -20.823 -23.803 11.901 1.00 0.00 C ATOM 0 H LEU A 58 -24.192 -26.204 13.335 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.472 -26.602 12.635 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.007 -24.656 14.364 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.256 -24.606 14.304 1.00 0.00 H new ATOM 0 HG LEU A 58 -22.830 -24.509 11.745 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -22.895 -22.052 11.911 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.866 -22.826 13.185 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.265 -22.152 13.572 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -20.891 -23.175 11.013 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.183 -23.320 12.639 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.399 -24.770 11.630 1.00 0.00 H new ATOM 870 N SER A 59 -22.404 -27.576 15.591 1.00 0.00 N ATOM 871 CA SER A 59 -21.976 -28.272 16.798 1.00 0.00 C ATOM 872 C SER A 59 -22.098 -29.783 16.626 1.00 0.00 C ATOM 873 O SER A 59 -21.380 -30.551 17.266 1.00 0.00 O ATOM 874 CB SER A 59 -22.809 -27.816 17.998 1.00 0.00 C ATOM 875 OG SER A 59 -22.276 -28.322 19.210 1.00 0.00 O ATOM 0 H SER A 59 -23.415 -27.491 15.490 1.00 0.00 H new ATOM 0 HA SER A 59 -20.929 -28.027 16.977 1.00 0.00 H new ATOM 0 HB2 SER A 59 -22.834 -26.727 18.035 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.838 -28.155 17.880 1.00 0.00 H new ATOM 0 HG SER A 59 -22.825 -28.015 19.962 1.00 0.00 H new ATOM 881 N GLU A 60 -23.012 -30.202 15.756 1.00 0.00 N ATOM 882 CA GLU A 60 -23.229 -31.621 15.500 1.00 0.00 C ATOM 883 C GLU A 60 -22.189 -32.162 14.523 1.00 0.00 C ATOM 884 O GLU A 60 -21.439 -33.083 14.846 1.00 0.00 O ATOM 885 CB GLU A 60 -24.636 -31.852 14.945 1.00 0.00 C ATOM 886 CG GLU A 60 -25.702 -31.973 16.021 1.00 0.00 C ATOM 887 CD GLU A 60 -26.125 -33.409 16.264 1.00 0.00 C ATOM 888 OE1 GLU A 60 -25.262 -34.306 16.167 1.00 0.00 O ATOM 889 OE2 GLU A 60 -27.319 -33.635 16.552 1.00 0.00 O ATOM 0 H GLU A 60 -23.614 -29.579 15.217 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.127 -32.155 16.445 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -24.895 -31.028 14.280 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -24.635 -32.760 14.342 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.325 -31.547 16.951 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.573 -31.385 15.732 1.00 0.00 H new ATOM 896 N ASP A 61 -22.153 -31.584 13.327 1.00 0.00 N ATOM 897 CA ASP A 61 -21.206 -32.007 12.302 1.00 0.00 C ATOM 898 C ASP A 61 -19.830 -31.394 12.546 1.00 0.00 C ATOM 899 O ASP A 61 -18.890 -32.087 12.935 1.00 0.00 O ATOM 900 CB ASP A 61 -21.714 -31.614 10.914 1.00 0.00 C ATOM 901 CG ASP A 61 -20.769 -32.043 9.809 1.00 0.00 C ATOM 902 OD1 ASP A 61 -20.880 -33.198 9.348 1.00 0.00 O ATOM 903 OD2 ASP A 61 -19.920 -31.223 9.404 1.00 0.00 O ATOM 0 H ASP A 61 -22.769 -30.822 13.044 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.115 -33.092 12.353 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.692 -32.065 10.747 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -21.850 -30.533 10.873 1.00 0.00 H new ATOM 908 N PHE A 62 -19.720 -30.090 12.315 1.00 0.00 N ATOM 909 CA PHE A 62 -18.459 -29.383 12.508 1.00 0.00 C ATOM 910 C PHE A 62 -17.922 -29.604 13.919 1.00 0.00 C ATOM 911 O PHE A 62 -16.729 -29.842 14.111 1.00 0.00 O ATOM 912 CB PHE A 62 -18.645 -27.886 12.250 1.00 0.00 C ATOM 913 CG PHE A 62 -18.690 -27.531 10.791 1.00 0.00 C ATOM 914 CD1 PHE A 62 -19.864 -27.668 10.067 1.00 0.00 C ATOM 915 CD2 PHE A 62 -17.559 -27.060 10.144 1.00 0.00 C ATOM 916 CE1 PHE A 62 -19.908 -27.342 8.725 1.00 0.00 C ATOM 917 CE2 PHE A 62 -17.598 -26.732 8.801 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.774 -26.872 8.091 1.00 0.00 C ATOM 0 H PHE A 62 -20.489 -29.501 11.994 1.00 0.00 H new ATOM 0 HA PHE A 62 -17.736 -29.781 11.796 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.569 -27.555 12.725 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -17.830 -27.340 12.724 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -20.754 -28.034 10.557 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -16.637 -26.948 10.695 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -20.829 -27.455 8.172 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -16.709 -26.367 8.308 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.807 -26.615 7.043 1.00 0.00 H new ATOM 928 N LYS A 63 -18.811 -29.524 14.903 1.00 0.00 N ATOM 929 CA LYS A 63 -18.428 -29.716 16.297 1.00 0.00 C ATOM 930 C LYS A 63 -17.370 -28.700 16.716 1.00 0.00 C ATOM 931 O LYS A 63 -16.485 -29.005 17.516 1.00 0.00 O ATOM 932 CB LYS A 63 -17.901 -31.136 16.512 1.00 0.00 C ATOM 933 CG LYS A 63 -18.785 -32.211 15.906 1.00 0.00 C ATOM 934 CD LYS A 63 -19.162 -33.267 16.931 1.00 0.00 C ATOM 935 CE LYS A 63 -19.399 -34.620 16.277 1.00 0.00 C ATOM 936 NZ LYS A 63 -18.458 -35.656 16.788 1.00 0.00 N ATOM 0 H LYS A 63 -19.802 -29.328 14.761 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.314 -29.567 16.915 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -16.903 -31.213 16.081 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -17.802 -31.320 17.582 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -19.689 -31.755 15.503 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.266 -32.682 15.071 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -18.369 -33.355 17.673 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.062 -32.956 17.462 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -20.425 -34.938 16.462 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -19.284 -34.526 15.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.652 -36.563 16.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.480 -35.365 16.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.585 -35.764 17.815 1.00 0.00 H new ATOM 950 N LEU A 64 -17.468 -27.492 16.171 1.00 0.00 N ATOM 951 CA LEU A 64 -16.519 -26.431 16.490 1.00 0.00 C ATOM 952 C LEU A 64 -16.671 -25.981 17.939 1.00 0.00 C ATOM 953 O LEU A 64 -17.481 -26.528 18.687 1.00 0.00 O ATOM 954 CB LEU A 64 -16.722 -25.240 15.551 1.00 0.00 C ATOM 955 CG LEU A 64 -16.321 -25.460 14.091 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.277 -24.732 13.160 1.00 0.00 C ATOM 957 CD2 LEU A 64 -14.890 -25.001 13.856 1.00 0.00 C ATOM 0 H LEU A 64 -18.194 -27.223 15.507 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.512 -26.826 16.356 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.774 -24.956 15.579 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.153 -24.395 15.940 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.378 -26.527 13.875 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -16.976 -24.900 12.126 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.289 -25.109 13.310 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.253 -23.664 13.376 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -14.622 -25.165 12.812 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.805 -23.940 14.090 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.216 -25.569 14.497 1.00 0.00 H new ATOM 969 N SER A 65 -15.889 -24.980 18.328 1.00 0.00 N ATOM 970 CA SER A 65 -15.935 -24.457 19.689 1.00 0.00 C ATOM 971 C SER A 65 -17.113 -23.503 19.864 1.00 0.00 C ATOM 972 O SER A 65 -17.645 -22.969 18.891 1.00 0.00 O ATOM 973 CB SER A 65 -14.628 -23.739 20.027 1.00 0.00 C ATOM 974 OG SER A 65 -13.987 -24.341 21.138 1.00 0.00 O ATOM 0 H SER A 65 -15.215 -24.514 17.720 1.00 0.00 H new ATOM 0 HA SER A 65 -16.065 -25.297 20.371 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.963 -23.762 19.163 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.831 -22.691 20.245 1.00 0.00 H new ATOM 0 HG SER A 65 -13.153 -23.864 21.332 1.00 0.00 H new ATOM 980 N LYS A 66 -17.516 -23.295 21.113 1.00 0.00 N ATOM 981 CA LYS A 66 -18.630 -22.405 21.420 1.00 0.00 C ATOM 982 C LYS A 66 -18.409 -21.026 20.807 1.00 0.00 C ATOM 983 O LYS A 66 -19.299 -20.472 20.161 1.00 0.00 O ATOM 984 CB LYS A 66 -18.807 -22.280 22.935 1.00 0.00 C ATOM 985 CG LYS A 66 -20.178 -21.772 23.346 1.00 0.00 C ATOM 986 CD LYS A 66 -20.584 -22.305 24.710 1.00 0.00 C ATOM 987 CE LYS A 66 -22.063 -22.658 24.753 1.00 0.00 C ATOM 988 NZ LYS A 66 -22.365 -23.881 23.960 1.00 0.00 N ATOM 0 H LYS A 66 -17.088 -23.731 21.930 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.535 -22.834 20.989 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -18.637 -23.254 23.394 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.046 -21.605 23.327 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -20.172 -20.682 23.367 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -20.916 -22.072 22.602 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -19.991 -23.188 24.948 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -20.365 -21.559 25.473 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -22.370 -22.811 25.788 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -22.647 -21.822 24.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -23.296 -24.253 24.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -22.373 -23.645 22.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -21.637 -24.601 24.141 1.00 0.00 H new ATOM 1002 N LEU A 67 -17.217 -20.476 21.013 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.878 -19.161 20.479 1.00 0.00 C ATOM 1004 C LEU A 67 -16.987 -19.147 18.958 1.00 0.00 C ATOM 1005 O LEU A 67 -17.547 -18.219 18.376 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.463 -18.766 20.904 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.336 -17.448 21.669 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.871 -16.293 20.836 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -16.067 -17.531 23.001 1.00 0.00 C ATOM 0 H LEU A 67 -16.469 -20.920 21.546 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.587 -18.438 20.882 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -15.055 -19.564 21.525 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.840 -18.707 20.011 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.280 -17.267 21.868 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.772 -15.364 21.397 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.303 -16.219 19.909 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -16.922 -16.467 20.605 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.966 -16.584 23.531 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -17.123 -17.737 22.824 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.637 -18.332 23.603 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.449 -20.182 18.321 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.487 -20.288 16.867 1.00 0.00 C ATOM 1023 C GLN A 68 -17.926 -20.350 16.364 1.00 0.00 C ATOM 1024 O GLN A 68 -18.341 -19.534 15.540 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.719 -21.528 16.405 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.259 -21.254 16.084 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.391 -22.490 16.213 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.861 -23.552 16.624 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.117 -22.359 15.863 1.00 0.00 N ATOM 0 H GLN A 68 -15.982 -20.959 18.789 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.013 -19.399 16.450 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.775 -22.290 17.182 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.206 -21.938 15.520 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.181 -20.864 15.069 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.883 -20.479 16.752 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.770 -21.460 15.528 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.485 -23.157 15.929 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.682 -21.322 16.864 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.074 -21.489 16.465 1.00 0.00 C ATOM 1040 C VAL A 69 -20.852 -20.188 16.627 1.00 0.00 C ATOM 1041 O VAL A 69 -21.816 -19.935 15.904 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.765 -22.593 17.288 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.204 -22.779 16.832 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -19.991 -23.899 17.183 1.00 0.00 C ATOM 0 H VAL A 69 -18.354 -22.006 17.546 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.070 -21.778 15.414 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.778 -22.287 18.334 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.675 -23.563 17.425 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.751 -21.846 16.964 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.218 -23.062 15.780 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.493 -24.668 17.770 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.945 -24.212 16.140 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.980 -23.754 17.564 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.427 -19.366 17.579 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.082 -18.088 17.836 1.00 0.00 C ATOM 1056 C LYS A 70 -20.550 -17.007 16.902 1.00 0.00 C ATOM 1057 O LYS A 70 -21.278 -16.092 16.516 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.872 -17.668 19.292 1.00 0.00 C ATOM 1059 CG LYS A 70 -21.998 -16.813 19.847 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.513 -15.421 20.215 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.669 -14.438 20.323 1.00 0.00 C ATOM 1062 NZ LYS A 70 -22.285 -13.076 19.859 1.00 0.00 N ATOM 0 H LYS A 70 -19.631 -19.561 18.186 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.149 -18.211 17.650 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.768 -18.561 19.908 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -19.935 -17.116 19.371 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.796 -16.738 19.109 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.422 -17.296 20.727 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.978 -15.460 21.164 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -20.805 -15.071 19.464 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -23.510 -14.800 19.731 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.007 -14.387 21.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -23.143 -12.523 19.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -21.732 -12.600 20.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -21.712 -13.153 18.995 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.276 -17.118 16.540 1.00 0.00 N ATOM 1077 CA LYS A 71 -18.646 -16.151 15.648 1.00 0.00 C ATOM 1078 C LYS A 71 -19.095 -16.368 14.207 1.00 0.00 C ATOM 1079 O LYS A 71 -19.098 -15.437 13.401 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.122 -16.258 15.741 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.423 -14.914 15.841 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.325 -14.933 16.891 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.764 -14.237 18.170 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.793 -12.757 18.014 1.00 0.00 N ATOM 0 H LYS A 71 -18.659 -17.869 16.851 1.00 0.00 H new ATOM 0 HA LYS A 71 -18.953 -15.153 15.959 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.861 -16.860 16.612 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -16.749 -16.788 14.864 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -15.997 -14.652 14.873 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.151 -14.142 16.089 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.050 -15.964 17.113 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.435 -14.444 16.497 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.755 -14.592 18.455 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -15.085 -14.504 18.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.981 -12.314 18.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.875 -12.428 17.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.543 -12.493 17.344 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.474 -17.602 13.889 1.00 0.00 N ATOM 1099 CA ILE A 72 -19.927 -17.939 12.545 1.00 0.00 C ATOM 1100 C ILE A 72 -21.409 -17.626 12.370 1.00 0.00 C ATOM 1101 O ILE A 72 -21.803 -16.954 11.417 1.00 0.00 O ATOM 1102 CB ILE A 72 -19.686 -19.426 12.227 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.204 -19.770 12.382 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.167 -19.751 10.820 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -17.931 -21.257 12.441 1.00 0.00 C ATOM 0 H ILE A 72 -19.476 -18.384 14.544 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.346 -17.329 11.853 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.255 -20.030 12.933 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -17.650 -19.340 11.547 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -17.824 -19.303 13.291 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -19.990 -20.806 10.610 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.233 -19.539 10.742 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -19.622 -19.141 10.099 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -16.860 -21.426 12.551 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.456 -21.690 13.292 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.280 -21.728 11.522 1.00 0.00 H new ATOM 1117 N MET A 73 -22.225 -18.116 13.297 1.00 0.00 N ATOM 1118 CA MET A 73 -23.664 -17.886 13.246 1.00 0.00 C ATOM 1119 C MET A 73 -23.974 -16.394 13.190 1.00 0.00 C ATOM 1120 O MET A 73 -24.781 -15.949 12.374 1.00 0.00 O ATOM 1121 CB MET A 73 -24.346 -18.515 14.463 1.00 0.00 C ATOM 1122 CG MET A 73 -24.577 -20.011 14.324 1.00 0.00 C ATOM 1123 SD MET A 73 -25.809 -20.410 13.069 1.00 0.00 S ATOM 1124 CE MET A 73 -27.246 -19.565 13.725 1.00 0.00 C ATOM 0 H MET A 73 -21.915 -18.675 14.092 1.00 0.00 H new ATOM 0 HA MET A 73 -24.050 -18.354 12.340 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.736 -18.330 15.347 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.304 -18.021 14.628 1.00 0.00 H new ATOM 0 HG2 MET A 73 -23.635 -20.498 14.071 1.00 0.00 H new ATOM 0 HG3 MET A 73 -24.897 -20.416 15.284 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.148 -19.976 13.272 1.00 0.00 H new ATOM 0 HE2 MET A 73 -27.288 -19.703 14.805 1.00 0.00 H new ATOM 0 HE3 MET A 73 -27.178 -18.501 13.498 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.329 -15.626 14.063 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.538 -14.184 14.112 1.00 0.00 C ATOM 1136 C GLN A 74 -23.277 -13.550 12.749 1.00 0.00 C ATOM 1137 O GLN A 74 -23.829 -12.497 12.428 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.627 -13.551 15.165 1.00 0.00 C ATOM 1139 CG GLN A 74 -21.161 -13.523 14.764 1.00 0.00 C ATOM 1140 CD GLN A 74 -20.293 -12.799 15.774 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -20.432 -12.994 16.982 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -19.390 -11.957 15.284 1.00 0.00 N ATOM 0 H GLN A 74 -22.658 -15.978 14.745 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.578 -14.002 14.384 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -22.962 -12.532 15.358 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.729 -14.102 16.100 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -20.801 -14.545 14.648 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -21.063 -13.038 13.793 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -19.309 -11.826 14.276 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -18.777 -11.442 15.916 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.433 -14.197 11.953 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.098 -13.695 10.625 1.00 0.00 C ATOM 1153 C PHE A 75 -23.185 -14.057 9.616 1.00 0.00 C ATOM 1154 O PHE A 75 -23.423 -13.326 8.655 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.752 -14.260 10.167 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.313 -13.750 8.825 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.793 -12.473 8.691 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.421 -14.547 7.697 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.387 -12.000 7.457 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -20.017 -14.080 6.460 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.500 -12.805 6.340 1.00 0.00 C ATOM 0 H PHE A 75 -21.968 -15.070 12.204 1.00 0.00 H new ATOM 0 HA PHE A 75 -22.027 -12.609 10.682 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -19.992 -14.011 10.908 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.817 -15.347 10.130 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.704 -11.839 9.561 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.825 -15.545 7.785 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.982 -11.003 7.366 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.106 -14.712 5.588 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.185 -12.438 5.375 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.839 -15.191 9.843 1.00 0.00 N ATOM 1172 CA ILE A 76 -24.900 -15.651 8.956 1.00 0.00 C ATOM 1173 C ILE A 76 -26.135 -14.762 9.068 1.00 0.00 C ATOM 1174 O ILE A 76 -26.544 -14.126 8.098 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.300 -17.106 9.262 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.087 -18.030 9.127 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.420 -17.554 8.336 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.363 -19.455 9.551 1.00 0.00 C ATOM 0 H ILE A 76 -23.653 -15.808 10.634 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.507 -15.597 7.941 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.662 -17.160 10.289 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -23.751 -18.027 8.090 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.269 -17.633 9.728 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.691 -18.585 8.565 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.288 -16.910 8.477 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.084 -17.489 7.301 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.460 -20.052 9.429 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.669 -19.471 10.597 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.159 -19.871 8.933 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.722 -14.723 10.260 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.909 -13.911 10.500 1.00 0.00 C ATOM 1192 C ASN A 77 -27.662 -12.457 10.111 1.00 0.00 C ATOM 1193 O ASN A 77 -28.353 -11.906 9.255 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.320 -13.994 11.971 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.057 -15.279 12.294 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.277 -15.283 12.464 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -28.318 -16.379 12.381 1.00 0.00 N ATOM 0 H ASN A 77 -26.395 -15.244 11.074 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.717 -14.302 9.881 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.432 -13.920 12.598 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -28.955 -13.143 12.217 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -28.758 -17.274 12.596 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -27.310 -16.329 12.233 1.00 0.00 H new