USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=12 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 33 SER OG : rot 180:sc= 0.0444 USER MOD Set 1.2: A 68 GLN : amide:sc= 0.0803 K(o=0.12,f=-9.7!) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.066) 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 78:sc= 1.34 USER MOD Single : A 25 LYS NZ :NH3+ -149:sc= 0.145 (180deg=0) USER MOD Single : A 26 SER OG : rot 63:sc= 0.156 USER MOD Single : A 38 SER OG : rot 86:sc= 0.861 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=-0.36) USER MOD Single : A 52 GLN : amide:sc= 0.122 X(o=0.12,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0151 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= -0.0781 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 174:sc= 0 (180deg=-0.0541) USER MOD Single : A 74 GLN : amide:sc= -0.0053 X(o=-0.0053,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -16.499 -6.483 1.122 1.00 0.00 N ATOM 105 CA GLN A 10 -17.188 -7.145 2.223 1.00 0.00 C ATOM 106 C GLN A 10 -18.316 -8.031 1.706 1.00 0.00 C ATOM 107 O GLN A 10 -18.831 -7.842 0.604 1.00 0.00 O ATOM 108 CB GLN A 10 -17.745 -6.108 3.200 1.00 0.00 C ATOM 109 CG GLN A 10 -18.376 -4.906 2.517 1.00 0.00 C ATOM 110 CD GLN A 10 -19.622 -4.417 3.229 1.00 0.00 C ATOM 111 OE1 GLN A 10 -19.664 -4.353 4.458 1.00 0.00 O ATOM 112 NE2 GLN A 10 -20.646 -4.069 2.459 1.00 0.00 N ATOM 0 HA GLN A 10 -16.467 -7.775 2.744 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.489 -6.585 3.838 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -16.940 -5.765 3.850 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -17.648 -4.096 2.470 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.629 -5.168 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.568 -4.138 1.444 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.511 -3.733 2.882 1.00 0.00 H new ATOM 121 N PRO A 11 -18.710 -9.023 2.519 1.00 0.00 N ATOM 122 CA PRO A 11 -19.782 -9.958 2.164 1.00 0.00 C ATOM 123 C PRO A 11 -21.153 -9.291 2.151 1.00 0.00 C ATOM 124 O PRO A 11 -21.409 -8.328 2.874 1.00 0.00 O ATOM 125 CB PRO A 11 -19.711 -11.014 3.270 1.00 0.00 C ATOM 126 CG PRO A 11 -19.100 -10.307 4.430 1.00 0.00 C ATOM 127 CD PRO A 11 -18.141 -9.306 3.847 1.00 0.00 C ATOM 0 HA PRO A 11 -19.654 -10.363 1.160 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.702 -11.396 3.516 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.107 -11.868 2.964 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.863 -9.812 5.031 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.582 -11.007 5.085 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.079 -8.405 4.458 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -17.132 -9.711 3.774 1.00 0.00 H new ATOM 135 N PRO A 12 -22.058 -9.814 1.310 1.00 0.00 N ATOM 136 CA PRO A 12 -23.419 -9.284 1.184 1.00 0.00 C ATOM 137 C PRO A 12 -24.266 -9.560 2.422 1.00 0.00 C ATOM 138 O PRO A 12 -23.769 -10.076 3.422 1.00 0.00 O ATOM 139 CB PRO A 12 -23.981 -10.035 -0.026 1.00 0.00 C ATOM 140 CG PRO A 12 -23.199 -11.302 -0.082 1.00 0.00 C ATOM 141 CD PRO A 12 -21.823 -10.961 0.418 1.00 0.00 C ATOM 0 HA PRO A 12 -23.425 -8.200 1.071 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -25.047 -10.232 0.090 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -23.862 -9.456 -0.942 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -23.659 -12.072 0.537 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -23.159 -11.692 -1.099 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -21.370 -11.798 0.950 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -21.151 -10.702 -0.400 1.00 0.00 H new ATOM 149 N ALA A 13 -25.547 -9.213 2.347 1.00 0.00 N ATOM 150 CA ALA A 13 -26.462 -9.426 3.461 1.00 0.00 C ATOM 151 C ALA A 13 -27.122 -10.799 3.375 1.00 0.00 C ATOM 152 O ALA A 13 -27.359 -11.449 4.393 1.00 0.00 O ATOM 153 CB ALA A 13 -27.519 -8.332 3.492 1.00 0.00 C ATOM 0 H ALA A 13 -25.974 -8.783 1.526 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.885 -9.386 4.385 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -28.196 -8.504 4.329 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -27.036 -7.362 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -28.084 -8.345 2.560 1.00 0.00 H new ATOM 159 N ASP A 14 -27.416 -11.233 2.154 1.00 0.00 N ATOM 160 CA ASP A 14 -28.048 -12.529 1.935 1.00 0.00 C ATOM 161 C ASP A 14 -27.028 -13.657 2.049 1.00 0.00 C ATOM 162 O ASP A 14 -27.296 -14.692 2.660 1.00 0.00 O ATOM 163 CB ASP A 14 -28.719 -12.568 0.561 1.00 0.00 C ATOM 164 CG ASP A 14 -30.228 -12.679 0.656 1.00 0.00 C ATOM 165 OD1 ASP A 14 -30.714 -13.693 1.199 1.00 0.00 O ATOM 166 OD2 ASP A 14 -30.922 -11.753 0.188 1.00 0.00 O ATOM 0 H ASP A 14 -27.227 -10.706 1.301 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.807 -12.670 2.705 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -28.458 -11.666 0.007 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.330 -13.414 -0.006 1.00 0.00 H new ATOM 171 N LEU A 15 -25.857 -13.451 1.456 1.00 0.00 N ATOM 172 CA LEU A 15 -24.796 -14.452 1.490 1.00 0.00 C ATOM 173 C LEU A 15 -25.276 -15.775 0.903 1.00 0.00 C ATOM 174 O LEU A 15 -24.799 -16.844 1.285 1.00 0.00 O ATOM 175 CB LEU A 15 -24.312 -14.663 2.926 1.00 0.00 C ATOM 176 CG LEU A 15 -22.798 -14.621 3.137 1.00 0.00 C ATOM 177 CD1 LEU A 15 -22.470 -14.393 4.604 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.155 -15.907 2.638 1.00 0.00 C ATOM 0 H LEU A 15 -25.618 -12.600 0.946 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.967 -14.087 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -24.768 -13.901 3.558 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.681 -15.628 3.274 1.00 0.00 H new ATOM 0 HG LEU A 15 -22.393 -13.788 2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -21.388 -14.366 4.735 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.899 -13.445 4.930 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.888 -15.204 5.201 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.078 -15.860 2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -22.565 -16.755 3.186 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -22.361 -16.028 1.574 1.00 0.00 H new ATOM 190 N SER A 16 -26.222 -15.695 -0.028 1.00 0.00 N ATOM 191 CA SER A 16 -26.768 -16.887 -0.666 1.00 0.00 C ATOM 192 C SER A 16 -26.394 -16.931 -2.145 1.00 0.00 C ATOM 193 O SER A 16 -27.108 -17.512 -2.960 1.00 0.00 O ATOM 194 CB SER A 16 -28.290 -16.922 -0.512 1.00 0.00 C ATOM 195 OG SER A 16 -28.688 -16.390 0.740 1.00 0.00 O ATOM 0 H SER A 16 -26.626 -14.818 -0.357 1.00 0.00 H new ATOM 0 HA SER A 16 -26.340 -17.761 -0.174 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.753 -16.352 -1.317 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.645 -17.949 -0.604 1.00 0.00 H new ATOM 0 HG SER A 16 -29.665 -16.422 0.813 1.00 0.00 H new ATOM 201 N GLY A 17 -25.267 -16.312 -2.482 1.00 0.00 N ATOM 202 CA GLY A 17 -24.816 -16.291 -3.861 1.00 0.00 C ATOM 203 C GLY A 17 -23.306 -16.226 -3.977 1.00 0.00 C ATOM 204 O GLY A 17 -22.772 -15.770 -4.989 1.00 0.00 O ATOM 0 H GLY A 17 -24.658 -15.825 -1.825 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -25.178 -17.183 -4.372 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -25.254 -15.432 -4.370 1.00 0.00 H new ATOM 208 N LEU A 18 -22.614 -16.683 -2.938 1.00 0.00 N ATOM 209 CA LEU A 18 -21.156 -16.673 -2.926 1.00 0.00 C ATOM 210 C LEU A 18 -20.600 -18.068 -3.192 1.00 0.00 C ATOM 211 O LEU A 18 -21.143 -19.065 -2.716 1.00 0.00 O ATOM 212 CB LEU A 18 -20.640 -16.154 -1.583 1.00 0.00 C ATOM 213 CG LEU A 18 -20.977 -14.700 -1.251 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.458 -14.334 0.131 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.401 -13.765 -2.304 1.00 0.00 C ATOM 0 H LEU A 18 -23.040 -17.065 -2.093 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.816 -16.008 -3.720 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.041 -16.789 -0.793 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.556 -16.268 -1.564 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.061 -14.590 -1.250 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.707 -13.296 0.350 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.919 -14.983 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.376 -14.461 0.159 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.651 -12.735 -2.051 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.317 -13.878 -2.337 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.822 -14.012 -3.279 1.00 0.00 H new ATOM 227 N SER A 19 -19.513 -18.131 -3.955 1.00 0.00 N ATOM 228 CA SER A 19 -18.884 -19.405 -4.286 1.00 0.00 C ATOM 229 C SER A 19 -17.960 -19.862 -3.162 1.00 0.00 C ATOM 230 O SER A 19 -17.689 -19.113 -2.223 1.00 0.00 O ATOM 231 CB SER A 19 -18.097 -19.284 -5.593 1.00 0.00 C ATOM 232 OG SER A 19 -17.054 -18.333 -5.474 1.00 0.00 O ATOM 0 H SER A 19 -19.050 -17.315 -4.355 1.00 0.00 H new ATOM 0 HA SER A 19 -19.670 -20.150 -4.411 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.680 -20.255 -5.861 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.769 -18.992 -6.400 1.00 0.00 H new ATOM 0 HG SER A 19 -16.565 -18.276 -6.322 1.00 0.00 H new ATOM 238 N ILE A 20 -17.478 -21.096 -3.267 1.00 0.00 N ATOM 239 CA ILE A 20 -16.583 -21.654 -2.260 1.00 0.00 C ATOM 240 C ILE A 20 -15.338 -20.790 -2.093 1.00 0.00 C ATOM 241 O ILE A 20 -14.760 -20.721 -1.009 1.00 0.00 O ATOM 242 CB ILE A 20 -16.154 -23.088 -2.621 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.384 -23.977 -2.820 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.251 -23.659 -1.539 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.051 -25.369 -3.310 1.00 0.00 C ATOM 0 H ILE A 20 -17.692 -21.728 -4.038 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.137 -21.675 -1.322 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.594 -23.059 -3.556 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -17.924 -24.052 -1.876 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.055 -23.500 -3.534 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -14.956 -24.673 -1.809 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.362 -23.036 -1.441 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -15.787 -23.677 -0.590 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -17.970 -25.943 -3.428 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.538 -25.304 -4.269 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.405 -25.865 -2.586 1.00 0.00 H new ATOM 257 N GLU A 21 -14.932 -20.131 -3.174 1.00 0.00 N ATOM 258 CA GLU A 21 -13.755 -19.270 -3.145 1.00 0.00 C ATOM 259 C GLU A 21 -14.050 -17.970 -2.402 1.00 0.00 C ATOM 260 O GLU A 21 -13.175 -17.410 -1.741 1.00 0.00 O ATOM 261 CB GLU A 21 -13.287 -18.961 -4.569 1.00 0.00 C ATOM 262 CG GLU A 21 -12.640 -20.145 -5.267 1.00 0.00 C ATOM 263 CD GLU A 21 -12.651 -20.009 -6.778 1.00 0.00 C ATOM 264 OE1 GLU A 21 -12.839 -18.876 -7.269 1.00 0.00 O ATOM 265 OE2 GLU A 21 -12.473 -21.034 -7.468 1.00 0.00 O ATOM 0 H GLU A 21 -15.400 -20.177 -4.079 1.00 0.00 H new ATOM 0 HA GLU A 21 -12.962 -19.799 -2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -14.140 -18.625 -5.158 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.576 -18.135 -4.538 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.611 -20.247 -4.923 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -13.163 -21.059 -4.984 1.00 0.00 H new ATOM 272 N GLU A 22 -15.287 -17.498 -2.515 1.00 0.00 N ATOM 273 CA GLU A 22 -15.696 -16.263 -1.855 1.00 0.00 C ATOM 274 C GLU A 22 -15.883 -16.484 -0.357 1.00 0.00 C ATOM 275 O GLU A 22 -15.732 -15.559 0.442 1.00 0.00 O ATOM 276 CB GLU A 22 -16.994 -15.736 -2.470 1.00 0.00 C ATOM 277 CG GLU A 22 -16.780 -14.904 -3.723 1.00 0.00 C ATOM 278 CD GLU A 22 -16.538 -13.439 -3.416 1.00 0.00 C ATOM 279 OE1 GLU A 22 -15.384 -13.081 -3.103 1.00 0.00 O ATOM 280 OE2 GLU A 22 -17.504 -12.651 -3.490 1.00 0.00 O ATOM 0 H GLU A 22 -16.023 -17.951 -3.057 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.908 -15.524 -2.000 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.641 -16.580 -2.710 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.519 -15.133 -1.729 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.929 -15.301 -4.277 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.653 -14.997 -4.370 1.00 0.00 H new ATOM 287 N VAL A 23 -16.213 -17.716 0.017 1.00 0.00 N ATOM 288 CA VAL A 23 -16.420 -18.060 1.419 1.00 0.00 C ATOM 289 C VAL A 23 -15.136 -17.886 2.223 1.00 0.00 C ATOM 290 O VAL A 23 -15.165 -17.441 3.370 1.00 0.00 O ATOM 291 CB VAL A 23 -16.918 -19.509 1.574 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.151 -19.840 3.040 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.187 -19.725 0.762 1.00 0.00 C ATOM 0 H VAL A 23 -16.343 -18.493 -0.631 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.180 -17.380 1.803 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.150 -20.182 1.192 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.503 -20.868 3.130 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.218 -19.726 3.591 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -17.900 -19.163 3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.525 -20.754 0.883 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -18.963 -19.044 1.112 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -17.983 -19.531 -0.291 1.00 0.00 H new ATOM 303 N SER A 24 -14.010 -18.241 1.613 1.00 0.00 N ATOM 304 CA SER A 24 -12.715 -18.128 2.273 1.00 0.00 C ATOM 305 C SER A 24 -12.467 -16.698 2.742 1.00 0.00 C ATOM 306 O SER A 24 -11.747 -16.466 3.713 1.00 0.00 O ATOM 307 CB SER A 24 -11.596 -18.567 1.326 1.00 0.00 C ATOM 308 OG SER A 24 -12.125 -19.094 0.121 1.00 0.00 O ATOM 0 H SER A 24 -13.968 -18.609 0.663 1.00 0.00 H new ATOM 0 HA SER A 24 -12.721 -18.782 3.145 1.00 0.00 H new ATOM 0 HB2 SER A 24 -10.950 -17.718 1.103 1.00 0.00 H new ATOM 0 HB3 SER A 24 -10.976 -19.319 1.814 1.00 0.00 H new ATOM 0 HG SER A 24 -12.418 -18.359 -0.457 1.00 0.00 H new ATOM 314 N LYS A 25 -13.069 -15.740 2.044 1.00 0.00 N ATOM 315 CA LYS A 25 -12.916 -14.332 2.387 1.00 0.00 C ATOM 316 C LYS A 25 -14.059 -13.863 3.282 1.00 0.00 C ATOM 317 O LYS A 25 -13.904 -12.922 4.061 1.00 0.00 O ATOM 318 CB LYS A 25 -12.866 -13.479 1.117 1.00 0.00 C ATOM 319 CG LYS A 25 -11.940 -14.033 0.049 1.00 0.00 C ATOM 320 CD LYS A 25 -11.490 -12.948 -0.916 1.00 0.00 C ATOM 321 CE LYS A 25 -12.457 -12.803 -2.082 1.00 0.00 C ATOM 322 NZ LYS A 25 -13.037 -11.434 -2.154 1.00 0.00 N ATOM 0 H LYS A 25 -13.668 -15.914 1.237 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.979 -14.216 2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.872 -13.395 0.706 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.543 -12.471 1.379 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.068 -14.486 0.521 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.450 -14.823 -0.502 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.412 -11.998 -0.387 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.496 -13.185 -1.294 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.938 -13.027 -3.014 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.260 -13.533 -1.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.997 -11.484 -2.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.078 -11.024 -1.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.442 -10.836 -2.763 1.00 0.00 H new ATOM 336 N SER A 26 -15.206 -14.525 3.166 1.00 0.00 N ATOM 337 CA SER A 26 -16.375 -14.175 3.964 1.00 0.00 C ATOM 338 C SER A 26 -16.034 -14.159 5.451 1.00 0.00 C ATOM 339 O SER A 26 -16.343 -13.201 6.161 1.00 0.00 O ATOM 340 CB SER A 26 -17.513 -15.163 3.700 1.00 0.00 C ATOM 341 OG SER A 26 -18.100 -14.938 2.430 1.00 0.00 O ATOM 0 H SER A 26 -15.350 -15.307 2.527 1.00 0.00 H new ATOM 0 HA SER A 26 -16.697 -13.175 3.673 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.133 -16.183 3.753 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.271 -15.065 4.477 1.00 0.00 H new ATOM 0 HG SER A 26 -17.432 -15.089 1.729 1.00 0.00 H new ATOM 347 N LEU A 27 -15.395 -15.227 5.916 1.00 0.00 N ATOM 348 CA LEU A 27 -15.011 -15.339 7.319 1.00 0.00 C ATOM 349 C LEU A 27 -13.918 -14.332 7.665 1.00 0.00 C ATOM 350 O LEU A 27 -13.803 -13.896 8.811 1.00 0.00 O ATOM 351 CB LEU A 27 -14.529 -16.758 7.625 1.00 0.00 C ATOM 352 CG LEU A 27 -15.589 -17.857 7.552 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.982 -19.208 7.898 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.752 -17.539 8.481 1.00 0.00 C ATOM 0 H LEU A 27 -15.132 -16.028 5.342 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.887 -15.121 7.929 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.728 -17.006 6.928 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.095 -16.765 8.625 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.968 -17.903 6.531 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.751 -19.978 7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.184 -19.440 7.193 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.575 -19.176 8.909 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.497 -18.332 8.416 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.389 -17.465 9.506 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.204 -16.592 8.187 1.00 0.00 H new ATOM 366 N ARG A 28 -13.120 -13.967 6.668 1.00 0.00 N ATOM 367 CA ARG A 28 -12.037 -13.011 6.867 1.00 0.00 C ATOM 368 C ARG A 28 -12.560 -11.718 7.485 1.00 0.00 C ATOM 369 O ARG A 28 -11.841 -11.026 8.206 1.00 0.00 O ATOM 370 CB ARG A 28 -11.344 -12.709 5.537 1.00 0.00 C ATOM 371 CG ARG A 28 -9.828 -12.804 5.605 1.00 0.00 C ATOM 372 CD ARG A 28 -9.238 -13.247 4.276 1.00 0.00 C ATOM 373 NE ARG A 28 -8.600 -12.143 3.564 1.00 0.00 N ATOM 374 CZ ARG A 28 -7.989 -12.279 2.393 1.00 0.00 C ATOM 375 NH1 ARG A 28 -7.934 -13.465 1.804 1.00 0.00 N ATOM 376 NH2 ARG A 28 -7.433 -11.226 1.807 1.00 0.00 N ATOM 0 H ARG A 28 -13.203 -14.318 5.714 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.315 -13.455 7.552 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.710 -13.403 4.781 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.623 -11.707 5.211 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.414 -11.835 5.883 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.541 -13.509 6.385 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -8.507 -14.037 4.449 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -10.025 -13.672 3.654 1.00 0.00 H new ATOM 0 HE ARG A 28 -8.625 -11.216 3.990 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.362 -14.276 2.250 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -7.464 -13.566 0.904 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -7.475 -10.311 2.256 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -6.964 -11.332 0.907 1.00 0.00 H new ATOM 390 N PHE A 29 -13.818 -11.397 7.198 1.00 0.00 N ATOM 391 CA PHE A 29 -14.437 -10.186 7.724 1.00 0.00 C ATOM 392 C PHE A 29 -14.286 -10.113 9.241 1.00 0.00 C ATOM 393 O PHE A 29 -13.840 -9.101 9.782 1.00 0.00 O ATOM 394 CB PHE A 29 -15.919 -10.140 7.345 1.00 0.00 C ATOM 395 CG PHE A 29 -16.615 -8.889 7.800 1.00 0.00 C ATOM 396 CD1 PHE A 29 -16.222 -7.649 7.323 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.663 -8.954 8.704 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.861 -6.497 7.740 1.00 0.00 C ATOM 399 CE2 PHE A 29 -18.306 -7.805 9.125 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.905 -6.575 8.641 1.00 0.00 C ATOM 0 H PHE A 29 -14.428 -11.959 6.604 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.929 -9.328 7.284 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -16.012 -10.225 6.262 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.423 -11.004 7.777 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.407 -7.582 6.617 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.981 -9.913 9.084 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.544 -5.536 7.362 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -19.121 -7.869 9.831 1.00 0.00 H new ATOM 0 HZ PHE A 29 -18.407 -5.676 8.967 1.00 0.00 H new ATOM 410 N ILE A 30 -14.662 -11.192 9.919 1.00 0.00 N ATOM 411 CA ILE A 30 -14.568 -11.250 11.373 1.00 0.00 C ATOM 412 C ILE A 30 -13.176 -11.688 11.816 1.00 0.00 C ATOM 413 O ILE A 30 -12.727 -11.350 12.910 1.00 0.00 O ATOM 414 CB ILE A 30 -15.611 -12.215 11.966 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.468 -13.604 11.338 1.00 0.00 C ATOM 416 CG2 ILE A 30 -17.016 -11.673 11.752 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.290 -14.667 12.031 1.00 0.00 C ATOM 0 H ILE A 30 -15.034 -12.037 9.486 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.765 -10.244 11.743 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.436 -12.302 13.038 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.764 -13.553 10.290 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.418 -13.897 11.358 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.742 -12.366 12.177 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -17.111 -10.704 12.242 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.204 -11.560 10.684 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.140 -15.625 11.533 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -15.978 -14.747 13.072 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.345 -14.397 11.988 1.00 0.00 H new ATOM 429 N GLY A 31 -12.497 -12.443 10.957 1.00 0.00 N ATOM 430 CA GLY A 31 -11.162 -12.914 11.278 1.00 0.00 C ATOM 431 C GLY A 31 -11.179 -14.164 12.134 1.00 0.00 C ATOM 432 O GLY A 31 -11.110 -14.087 13.361 1.00 0.00 O ATOM 0 H GLY A 31 -12.847 -12.737 10.045 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.620 -13.117 10.354 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.618 -12.127 11.800 1.00 0.00 H new ATOM 436 N LEU A 32 -11.271 -15.321 11.487 1.00 0.00 N ATOM 437 CA LEU A 32 -11.298 -16.595 12.197 1.00 0.00 C ATOM 438 C LEU A 32 -9.982 -17.345 12.020 1.00 0.00 C ATOM 439 O LEU A 32 -9.057 -16.852 11.375 1.00 0.00 O ATOM 440 CB LEU A 32 -12.460 -17.455 11.696 1.00 0.00 C ATOM 441 CG LEU A 32 -13.861 -16.991 12.097 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.914 -17.946 11.558 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.970 -16.871 13.610 1.00 0.00 C ATOM 0 H LEU A 32 -11.328 -15.403 10.472 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.437 -16.389 13.258 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.411 -17.498 10.608 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.317 -18.472 12.062 1.00 0.00 H new ATOM 0 HG LEU A 32 -14.036 -16.007 11.661 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.904 -17.600 11.853 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.851 -17.981 10.470 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.742 -18.943 11.963 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.973 -16.540 13.877 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.774 -17.841 14.067 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.240 -16.146 13.971 1.00 0.00 H new ATOM 455 N SER A 33 -9.906 -18.541 12.595 1.00 0.00 N ATOM 456 CA SER A 33 -8.703 -19.359 12.503 1.00 0.00 C ATOM 457 C SER A 33 -8.521 -19.899 11.088 1.00 0.00 C ATOM 458 O SER A 33 -9.485 -20.301 10.437 1.00 0.00 O ATOM 459 CB SER A 33 -8.770 -20.518 13.499 1.00 0.00 C ATOM 460 OG SER A 33 -9.691 -20.242 14.541 1.00 0.00 O ATOM 0 H SER A 33 -10.664 -18.965 13.130 1.00 0.00 H new ATOM 0 HA SER A 33 -7.847 -18.730 12.747 1.00 0.00 H new ATOM 0 HB2 SER A 33 -9.065 -21.430 12.981 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.781 -20.697 13.921 1.00 0.00 H new ATOM 0 HG SER A 33 -9.717 -20.998 15.164 1.00 0.00 H new ATOM 466 N GLU A 34 -7.277 -19.906 10.619 1.00 0.00 N ATOM 467 CA GLU A 34 -6.968 -20.396 9.281 1.00 0.00 C ATOM 468 C GLU A 34 -7.534 -21.797 9.071 1.00 0.00 C ATOM 469 O GLU A 34 -7.911 -22.166 7.958 1.00 0.00 O ATOM 470 CB GLU A 34 -5.455 -20.406 9.053 1.00 0.00 C ATOM 471 CG GLU A 34 -4.857 -19.021 8.875 1.00 0.00 C ATOM 472 CD GLU A 34 -4.907 -18.544 7.437 1.00 0.00 C ATOM 473 OE1 GLU A 34 -5.721 -19.086 6.659 1.00 0.00 O ATOM 474 OE2 GLU A 34 -4.133 -17.628 7.088 1.00 0.00 O ATOM 0 H GLU A 34 -6.467 -19.578 11.146 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.432 -19.723 8.560 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.972 -20.895 9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.233 -21.005 8.169 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.394 -18.314 9.507 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.821 -19.030 9.215 1.00 0.00 H new ATOM 481 N ASP A 35 -7.590 -22.574 10.147 1.00 0.00 N ATOM 482 CA ASP A 35 -8.111 -23.935 10.082 1.00 0.00 C ATOM 483 C ASP A 35 -9.613 -23.930 9.819 1.00 0.00 C ATOM 484 O ASP A 35 -10.119 -24.733 9.034 1.00 0.00 O ATOM 485 CB ASP A 35 -7.811 -24.681 11.383 1.00 0.00 C ATOM 486 CG ASP A 35 -7.331 -26.098 11.141 1.00 0.00 C ATOM 487 OD1 ASP A 35 -7.771 -26.711 10.146 1.00 0.00 O ATOM 488 OD2 ASP A 35 -6.515 -26.594 11.945 1.00 0.00 O ATOM 0 H ASP A 35 -7.281 -22.285 11.075 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.618 -24.448 9.256 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.053 -24.135 11.945 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.709 -24.705 12.000 1.00 0.00 H new ATOM 493 N VAL A 36 -10.322 -23.020 10.480 1.00 0.00 N ATOM 494 CA VAL A 36 -11.767 -22.911 10.318 1.00 0.00 C ATOM 495 C VAL A 36 -12.136 -22.619 8.868 1.00 0.00 C ATOM 496 O VAL A 36 -12.976 -23.302 8.281 1.00 0.00 O ATOM 497 CB VAL A 36 -12.351 -21.806 11.217 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.854 -21.693 11.017 1.00 0.00 C ATOM 499 CG2 VAL A 36 -12.018 -22.076 12.677 1.00 0.00 C ATOM 0 H VAL A 36 -9.919 -22.348 11.133 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.192 -23.871 10.613 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.899 -20.855 10.934 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.249 -20.907 11.661 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.065 -21.449 9.976 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.327 -22.642 11.271 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.438 -21.285 13.298 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.441 -23.035 12.975 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.936 -22.101 12.805 1.00 0.00 H new ATOM 509 N ILE A 37 -11.503 -21.600 8.295 1.00 0.00 N ATOM 510 CA ILE A 37 -11.764 -21.219 6.913 1.00 0.00 C ATOM 511 C ILE A 37 -11.590 -22.407 5.973 1.00 0.00 C ATOM 512 O ILE A 37 -12.496 -22.747 5.211 1.00 0.00 O ATOM 513 CB ILE A 37 -10.834 -20.079 6.459 1.00 0.00 C ATOM 514 CG1 ILE A 37 -11.000 -18.862 7.371 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.121 -19.706 5.012 1.00 0.00 C ATOM 516 CD1 ILE A 37 -10.050 -17.730 7.048 1.00 0.00 C ATOM 0 H ILE A 37 -10.806 -21.024 8.767 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.797 -20.873 6.870 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.802 -20.423 6.528 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -12.025 -18.498 7.295 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.847 -19.170 8.405 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.456 -18.899 4.706 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.957 -20.574 4.373 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.156 -19.378 4.919 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.225 -16.901 7.734 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.022 -18.077 7.152 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.218 -17.395 6.024 1.00 0.00 H new ATOM 528 N SER A 38 -10.421 -23.036 6.033 1.00 0.00 N ATOM 529 CA SER A 38 -10.127 -24.185 5.185 1.00 0.00 C ATOM 530 C SER A 38 -11.088 -25.334 5.475 1.00 0.00 C ATOM 531 O SER A 38 -11.354 -26.169 4.611 1.00 0.00 O ATOM 532 CB SER A 38 -8.684 -24.647 5.398 1.00 0.00 C ATOM 533 OG SER A 38 -7.801 -23.541 5.476 1.00 0.00 O ATOM 0 H SER A 38 -9.662 -22.769 6.660 1.00 0.00 H new ATOM 0 HA SER A 38 -10.254 -23.881 4.146 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.618 -25.234 6.314 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.383 -25.300 4.579 1.00 0.00 H new ATOM 0 HG SER A 38 -7.771 -23.211 6.398 1.00 0.00 H new ATOM 539 N PHE A 39 -11.605 -25.370 6.699 1.00 0.00 N ATOM 540 CA PHE A 39 -12.536 -26.416 7.106 1.00 0.00 C ATOM 541 C PHE A 39 -13.829 -26.336 6.301 1.00 0.00 C ATOM 542 O PHE A 39 -14.522 -27.337 6.116 1.00 0.00 O ATOM 543 CB PHE A 39 -12.843 -26.302 8.600 1.00 0.00 C ATOM 544 CG PHE A 39 -12.461 -27.524 9.386 1.00 0.00 C ATOM 545 CD1 PHE A 39 -12.962 -28.769 9.043 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.600 -27.426 10.467 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.611 -29.895 9.764 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.246 -28.549 11.192 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.753 -29.784 10.840 1.00 0.00 C ATOM 0 H PHE A 39 -11.395 -24.687 7.426 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.067 -27.381 6.912 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.315 -25.439 9.006 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -13.909 -26.114 8.730 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.634 -28.861 8.203 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.201 -26.462 10.746 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.007 -30.860 9.486 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.574 -28.460 12.033 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.479 -30.662 11.406 1.00 0.00 H new ATOM 559 N PHE A 40 -14.150 -25.137 5.825 1.00 0.00 N ATOM 560 CA PHE A 40 -15.361 -24.924 5.041 1.00 0.00 C ATOM 561 C PHE A 40 -15.093 -25.144 3.555 1.00 0.00 C ATOM 562 O PHE A 40 -15.883 -25.780 2.857 1.00 0.00 O ATOM 563 CB PHE A 40 -15.900 -23.511 5.270 1.00 0.00 C ATOM 564 CG PHE A 40 -16.814 -23.402 6.457 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.471 -23.984 7.666 1.00 0.00 C ATOM 566 CD2 PHE A 40 -18.015 -22.718 6.363 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.311 -23.887 8.760 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.858 -22.617 7.453 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.505 -23.201 8.654 1.00 0.00 C ATOM 0 H PHE A 40 -13.588 -24.298 5.969 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.108 -25.648 5.368 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -15.061 -22.828 5.404 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.436 -23.186 4.378 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.537 -24.519 7.755 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.296 -22.258 5.427 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.034 -24.347 9.697 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.792 -22.082 7.366 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.161 -23.121 9.508 1.00 0.00 H new ATOM 579 N VAL A 41 -13.971 -24.614 3.077 1.00 0.00 N ATOM 580 CA VAL A 41 -13.597 -24.752 1.675 1.00 0.00 C ATOM 581 C VAL A 41 -13.298 -26.206 1.326 1.00 0.00 C ATOM 582 O VAL A 41 -13.429 -26.620 0.174 1.00 0.00 O ATOM 583 CB VAL A 41 -12.367 -23.890 1.334 1.00 0.00 C ATOM 584 CG1 VAL A 41 -12.003 -24.035 -0.135 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.625 -22.432 1.686 1.00 0.00 C ATOM 0 H VAL A 41 -13.306 -24.085 3.641 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.447 -24.408 1.086 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.523 -24.241 1.929 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.132 -23.419 -0.357 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.774 -25.078 -0.352 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.842 -23.712 -0.751 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.746 -21.837 1.439 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.481 -22.067 1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.833 -22.346 2.753 1.00 0.00 H new ATOM 595 N THR A 42 -12.894 -26.978 2.330 1.00 0.00 N ATOM 596 CA THR A 42 -12.575 -28.386 2.131 1.00 0.00 C ATOM 597 C THR A 42 -13.835 -29.244 2.150 1.00 0.00 C ATOM 598 O THR A 42 -13.868 -30.327 1.568 1.00 0.00 O ATOM 599 CB THR A 42 -11.602 -28.899 3.209 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.145 -30.214 2.870 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.271 -28.926 4.574 1.00 0.00 C ATOM 0 H THR A 42 -12.780 -26.651 3.290 1.00 0.00 H new ATOM 0 HA THR A 42 -12.099 -28.467 1.154 1.00 0.00 H new ATOM 0 HB THR A 42 -10.752 -28.219 3.253 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.526 -30.533 3.559 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.564 -29.292 5.319 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.592 -27.919 4.842 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.138 -29.586 4.541 1.00 0.00 H new ATOM 609 N GLU A 43 -14.871 -28.751 2.822 1.00 0.00 N ATOM 610 CA GLU A 43 -16.134 -29.474 2.916 1.00 0.00 C ATOM 611 C GLU A 43 -17.116 -28.994 1.852 1.00 0.00 C ATOM 612 O GLU A 43 -18.330 -29.130 2.004 1.00 0.00 O ATOM 613 CB GLU A 43 -16.746 -29.297 4.307 1.00 0.00 C ATOM 614 CG GLU A 43 -16.259 -30.319 5.321 1.00 0.00 C ATOM 615 CD GLU A 43 -17.150 -31.544 5.387 1.00 0.00 C ATOM 616 OE1 GLU A 43 -16.894 -32.505 4.631 1.00 0.00 O ATOM 617 OE2 GLU A 43 -18.102 -31.543 6.195 1.00 0.00 O ATOM 0 H GLU A 43 -14.860 -27.855 3.309 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.931 -30.532 2.748 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.514 -28.296 4.672 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.831 -29.364 4.229 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.245 -30.625 5.065 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.212 -29.855 6.306 1.00 0.00 H new ATOM 624 N LYS A 44 -16.582 -28.431 0.773 1.00 0.00 N ATOM 625 CA LYS A 44 -17.409 -27.930 -0.319 1.00 0.00 C ATOM 626 C LYS A 44 -18.430 -26.919 0.192 1.00 0.00 C ATOM 627 O LYS A 44 -19.486 -26.729 -0.413 1.00 0.00 O ATOM 628 CB LYS A 44 -18.127 -29.089 -1.014 1.00 0.00 C ATOM 629 CG LYS A 44 -18.431 -28.825 -2.479 1.00 0.00 C ATOM 630 CD LYS A 44 -19.766 -29.424 -2.889 1.00 0.00 C ATOM 631 CE LYS A 44 -19.833 -29.662 -4.389 1.00 0.00 C ATOM 632 NZ LYS A 44 -20.988 -28.958 -5.011 1.00 0.00 N ATOM 0 H LYS A 44 -15.579 -28.310 0.631 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.758 -27.431 -1.036 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.513 -29.986 -0.935 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.060 -29.295 -0.489 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -18.442 -27.750 -2.661 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.638 -29.245 -3.097 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -19.920 -30.366 -2.363 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -20.573 -28.756 -2.589 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -18.907 -29.321 -4.853 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -19.912 -30.732 -4.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -20.999 -29.145 -6.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -21.873 -29.302 -4.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -20.900 -27.935 -4.847 1.00 0.00 H new ATOM 646 N ILE A 45 -18.109 -26.272 1.307 1.00 0.00 N ATOM 647 CA ILE A 45 -18.998 -25.279 1.897 1.00 0.00 C ATOM 648 C ILE A 45 -18.956 -23.970 1.114 1.00 0.00 C ATOM 649 O ILE A 45 -17.903 -23.345 0.987 1.00 0.00 O ATOM 650 CB ILE A 45 -18.632 -24.997 3.366 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.470 -26.310 4.135 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.692 -24.122 4.018 1.00 0.00 C ATOM 653 CD1 ILE A 45 -19.746 -27.117 4.227 1.00 0.00 C ATOM 0 H ILE A 45 -17.240 -26.418 1.820 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.005 -25.693 1.856 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.682 -24.463 3.392 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.702 -26.913 3.651 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.115 -26.091 5.142 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.419 -23.932 5.056 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.763 -23.176 3.482 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.655 -24.631 3.984 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.557 -28.034 4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.510 -26.532 4.738 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.091 -27.367 3.224 1.00 0.00 H new ATOM 665 N ASP A 46 -20.107 -23.562 0.594 1.00 0.00 N ATOM 666 CA ASP A 46 -20.203 -22.326 -0.174 1.00 0.00 C ATOM 667 C ASP A 46 -21.119 -21.323 0.522 1.00 0.00 C ATOM 668 O ASP A 46 -21.609 -21.575 1.622 1.00 0.00 O ATOM 669 CB ASP A 46 -20.722 -22.615 -1.584 1.00 0.00 C ATOM 670 CG ASP A 46 -21.978 -23.464 -1.576 1.00 0.00 C ATOM 671 OD1 ASP A 46 -21.870 -24.681 -1.316 1.00 0.00 O ATOM 672 OD2 ASP A 46 -23.068 -22.911 -1.830 1.00 0.00 O ATOM 0 H ASP A 46 -20.987 -24.069 0.690 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.205 -21.893 -0.244 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.927 -21.673 -2.093 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -19.946 -23.124 -2.156 1.00 0.00 H new ATOM 677 N GLY A 47 -21.344 -20.185 -0.127 1.00 0.00 N ATOM 678 CA GLY A 47 -22.198 -19.161 0.445 1.00 0.00 C ATOM 679 C GLY A 47 -23.598 -19.668 0.733 1.00 0.00 C ATOM 680 O GLY A 47 -24.145 -19.423 1.808 1.00 0.00 O ATOM 0 H GLY A 47 -20.950 -19.954 -1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.751 -18.793 1.369 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.255 -18.315 -0.240 1.00 0.00 H new ATOM 684 N ASN A 48 -24.179 -20.376 -0.230 1.00 0.00 N ATOM 685 CA ASN A 48 -25.524 -20.917 -0.076 1.00 0.00 C ATOM 686 C ASN A 48 -25.557 -21.991 1.008 1.00 0.00 C ATOM 687 O ASN A 48 -26.579 -22.192 1.666 1.00 0.00 O ATOM 688 CB ASN A 48 -26.018 -21.499 -1.402 1.00 0.00 C ATOM 689 CG ASN A 48 -27.530 -21.580 -1.470 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.226 -20.584 -1.271 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.047 -22.770 -1.752 1.00 0.00 N ATOM 0 H ASN A 48 -23.739 -20.588 -1.125 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.184 -20.103 0.223 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.653 -20.884 -2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -25.597 -22.495 -1.538 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.059 -22.886 -1.811 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -27.432 -23.569 -1.910 1.00 0.00 H new ATOM 698 N LEU A 49 -24.434 -22.677 1.188 1.00 0.00 N ATOM 699 CA LEU A 49 -24.333 -23.730 2.192 1.00 0.00 C ATOM 700 C LEU A 49 -24.235 -23.138 3.594 1.00 0.00 C ATOM 701 O LEU A 49 -24.848 -23.641 4.537 1.00 0.00 O ATOM 702 CB LEU A 49 -23.116 -24.613 1.912 1.00 0.00 C ATOM 703 CG LEU A 49 -23.215 -26.063 2.390 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.371 -26.117 3.902 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.376 -26.771 1.707 1.00 0.00 C ATOM 0 H LEU A 49 -23.580 -22.523 0.652 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.236 -24.338 2.137 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -22.935 -24.617 0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.245 -24.156 2.380 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.292 -26.578 2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.440 -27.156 4.224 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.508 -25.647 4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.277 -25.586 4.193 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.432 -27.801 2.059 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.307 -26.256 1.944 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.222 -26.764 0.628 1.00 0.00 H new ATOM 717 N LEU A 50 -23.462 -22.066 3.725 1.00 0.00 N ATOM 718 CA LEU A 50 -23.285 -21.402 5.012 1.00 0.00 C ATOM 719 C LEU A 50 -24.617 -20.889 5.548 1.00 0.00 C ATOM 720 O LEU A 50 -25.008 -21.201 6.673 1.00 0.00 O ATOM 721 CB LEU A 50 -22.295 -20.244 4.879 1.00 0.00 C ATOM 722 CG LEU A 50 -22.256 -19.257 6.047 1.00 0.00 C ATOM 723 CD1 LEU A 50 -22.022 -19.990 7.358 1.00 0.00 C ATOM 724 CD2 LEU A 50 -21.179 -18.206 5.821 1.00 0.00 C ATOM 0 H LEU A 50 -22.947 -21.638 2.956 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.888 -22.132 5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.296 -20.660 4.747 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.533 -19.691 3.970 1.00 0.00 H new ATOM 0 HG LEU A 50 -23.221 -18.753 6.104 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.997 -19.271 8.177 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.829 -20.703 7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -21.072 -20.522 7.313 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -21.165 -17.512 6.662 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -20.207 -18.693 5.737 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.392 -17.659 4.903 1.00 0.00 H new ATOM 736 N VAL A 51 -25.313 -20.101 4.734 1.00 0.00 N ATOM 737 CA VAL A 51 -26.603 -19.546 5.125 1.00 0.00 C ATOM 738 C VAL A 51 -27.564 -20.646 5.561 1.00 0.00 C ATOM 739 O VAL A 51 -28.466 -20.412 6.365 1.00 0.00 O ATOM 740 CB VAL A 51 -27.243 -18.748 3.973 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.421 -17.506 3.664 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.390 -19.621 2.737 1.00 0.00 C ATOM 0 H VAL A 51 -25.005 -19.833 3.799 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.418 -18.875 5.964 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.238 -18.429 4.284 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.888 -16.955 2.848 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.373 -16.872 4.549 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.413 -17.800 3.373 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.844 -19.041 1.934 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.408 -19.972 2.421 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.024 -20.477 2.969 1.00 0.00 H new ATOM 752 N GLN A 52 -27.365 -21.846 5.024 1.00 0.00 N ATOM 753 CA GLN A 52 -28.215 -22.983 5.359 1.00 0.00 C ATOM 754 C GLN A 52 -27.804 -23.596 6.693 1.00 0.00 C ATOM 755 O GLN A 52 -28.643 -24.101 7.441 1.00 0.00 O ATOM 756 CB GLN A 52 -28.145 -24.040 4.256 1.00 0.00 C ATOM 757 CG GLN A 52 -29.175 -23.839 3.155 1.00 0.00 C ATOM 758 CD GLN A 52 -29.118 -24.924 2.098 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.044 -25.725 1.963 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.028 -24.957 1.341 1.00 0.00 N ATOM 0 H GLN A 52 -26.623 -22.056 4.356 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.241 -22.625 5.446 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.148 -24.029 3.816 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.287 -25.026 4.699 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.172 -23.818 3.595 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -29.013 -22.869 2.684 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.285 -24.274 1.487 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -27.934 -25.665 0.613 1.00 0.00 H new ATOM 769 N LEU A 53 -26.509 -23.548 6.987 1.00 0.00 N ATOM 770 CA LEU A 53 -25.986 -24.100 8.232 1.00 0.00 C ATOM 771 C LEU A 53 -26.616 -23.412 9.439 1.00 0.00 C ATOM 772 O LEU A 53 -26.913 -22.217 9.402 1.00 0.00 O ATOM 773 CB LEU A 53 -24.465 -23.948 8.281 1.00 0.00 C ATOM 774 CG LEU A 53 -23.668 -24.883 7.371 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.251 -24.364 7.182 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.649 -26.294 7.941 1.00 0.00 C ATOM 0 H LEU A 53 -25.802 -23.133 6.380 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.240 -25.159 8.266 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.214 -22.920 8.021 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.137 -24.106 9.308 1.00 0.00 H new ATOM 0 HG LEU A 53 -24.155 -24.913 6.397 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.699 -25.042 6.532 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.284 -23.373 6.729 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.753 -24.304 8.150 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -23.077 -26.946 7.280 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.186 -26.282 8.928 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.670 -26.667 8.024 1.00 0.00 H new ATOM 788 N THR A 54 -26.816 -24.173 10.510 1.00 0.00 N ATOM 789 CA THR A 54 -27.410 -23.638 11.729 1.00 0.00 C ATOM 790 C THR A 54 -26.543 -23.947 12.944 1.00 0.00 C ATOM 791 O THR A 54 -25.633 -24.773 12.875 1.00 0.00 O ATOM 792 CB THR A 54 -28.823 -24.205 11.962 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.873 -25.577 11.557 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.861 -23.405 11.190 1.00 0.00 C ATOM 0 H THR A 54 -26.575 -25.163 10.558 1.00 0.00 H new ATOM 0 HA THR A 54 -27.478 -22.558 11.600 1.00 0.00 H new ATOM 0 HB THR A 54 -29.049 -24.132 13.026 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.774 -25.931 11.710 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.851 -23.824 11.370 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.841 -22.367 11.521 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.636 -23.450 10.124 1.00 0.00 H new ATOM 802 N GLU A 55 -26.833 -23.280 14.057 1.00 0.00 N ATOM 803 CA GLU A 55 -26.079 -23.485 15.288 1.00 0.00 C ATOM 804 C GLU A 55 -26.134 -24.947 15.723 1.00 0.00 C ATOM 805 O GLU A 55 -25.209 -25.450 16.359 1.00 0.00 O ATOM 806 CB GLU A 55 -26.624 -22.590 16.402 1.00 0.00 C ATOM 807 CG GLU A 55 -25.552 -22.065 17.342 1.00 0.00 C ATOM 808 CD GLU A 55 -26.041 -20.915 18.201 1.00 0.00 C ATOM 809 OE1 GLU A 55 -26.948 -20.183 17.751 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.516 -20.745 19.321 1.00 0.00 O ATOM 0 H GLU A 55 -27.584 -22.594 14.131 1.00 0.00 H new ATOM 0 HA GLU A 55 -25.040 -23.220 15.095 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -27.148 -21.745 15.954 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.359 -23.151 16.980 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -25.211 -22.875 17.986 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.691 -21.737 16.759 1.00 0.00 H new ATOM 817 N GLU A 56 -27.225 -25.621 15.374 1.00 0.00 N ATOM 818 CA GLU A 56 -27.401 -27.024 15.729 1.00 0.00 C ATOM 819 C GLU A 56 -26.479 -27.915 14.902 1.00 0.00 C ATOM 820 O GLU A 56 -25.822 -28.810 15.434 1.00 0.00 O ATOM 821 CB GLU A 56 -28.857 -27.447 15.522 1.00 0.00 C ATOM 822 CG GLU A 56 -29.749 -27.164 16.719 1.00 0.00 C ATOM 823 CD GLU A 56 -29.412 -28.033 17.916 1.00 0.00 C ATOM 824 OE1 GLU A 56 -29.544 -29.270 17.808 1.00 0.00 O ATOM 825 OE2 GLU A 56 -29.017 -27.474 18.961 1.00 0.00 O ATOM 0 H GLU A 56 -28.000 -25.219 14.846 1.00 0.00 H new ATOM 0 HA GLU A 56 -27.142 -27.141 16.781 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -29.257 -26.928 14.651 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.889 -28.514 15.300 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -29.654 -26.115 16.998 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -30.790 -27.326 16.438 1.00 0.00 H new ATOM 832 N ILE A 57 -26.436 -27.663 13.598 1.00 0.00 N ATOM 833 CA ILE A 57 -25.595 -28.441 12.697 1.00 0.00 C ATOM 834 C ILE A 57 -24.123 -28.087 12.877 1.00 0.00 C ATOM 835 O ILE A 57 -23.242 -28.923 12.670 1.00 0.00 O ATOM 836 CB ILE A 57 -25.989 -28.217 11.225 1.00 0.00 C ATOM 837 CG1 ILE A 57 -27.462 -28.570 11.009 1.00 0.00 C ATOM 838 CG2 ILE A 57 -25.101 -29.045 10.308 1.00 0.00 C ATOM 839 CD1 ILE A 57 -28.020 -28.060 9.699 1.00 0.00 C ATOM 0 H ILE A 57 -26.974 -26.926 13.142 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.748 -29.490 12.950 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.848 -27.164 10.983 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.577 -29.653 11.046 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -28.050 -28.159 11.830 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -25.391 -28.876 9.271 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -24.061 -28.751 10.446 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -25.214 -30.102 10.549 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -29.068 -28.347 9.614 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.937 -26.974 9.667 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.457 -28.491 8.871 1.00 0.00 H new ATOM 851 N LEU A 58 -23.862 -26.844 13.265 1.00 0.00 N ATOM 852 CA LEU A 58 -22.495 -26.378 13.476 1.00 0.00 C ATOM 853 C LEU A 58 -21.889 -27.016 14.721 1.00 0.00 C ATOM 854 O LEU A 58 -20.671 -27.164 14.825 1.00 0.00 O ATOM 855 CB LEU A 58 -22.469 -24.854 13.605 1.00 0.00 C ATOM 856 CG LEU A 58 -22.712 -24.067 12.316 1.00 0.00 C ATOM 857 CD1 LEU A 58 -23.254 -22.682 12.631 1.00 0.00 C ATOM 858 CD2 LEU A 58 -21.429 -23.968 11.503 1.00 0.00 C ATOM 0 H LEU A 58 -24.579 -26.140 13.440 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.899 -26.673 12.612 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.222 -24.558 14.335 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.500 -24.560 14.009 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.455 -24.599 11.722 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.421 -22.137 11.702 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -24.196 -22.774 13.172 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.534 -22.141 13.245 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.620 -23.405 10.589 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.665 -23.459 12.090 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -21.083 -24.969 11.247 1.00 0.00 H new ATOM 870 N SER A 59 -22.746 -27.395 15.663 1.00 0.00 N ATOM 871 CA SER A 59 -22.295 -28.016 16.903 1.00 0.00 C ATOM 872 C SER A 59 -22.446 -29.533 16.837 1.00 0.00 C ATOM 873 O SER A 59 -21.704 -30.269 17.486 1.00 0.00 O ATOM 874 CB SER A 59 -23.085 -27.465 18.092 1.00 0.00 C ATOM 875 OG SER A 59 -22.601 -27.992 19.315 1.00 0.00 O ATOM 0 H SER A 59 -23.757 -27.283 15.591 1.00 0.00 H new ATOM 0 HA SER A 59 -21.240 -27.778 17.036 1.00 0.00 H new ATOM 0 HB2 SER A 59 -23.013 -26.377 18.107 1.00 0.00 H new ATOM 0 HB3 SER A 59 -24.140 -27.713 17.978 1.00 0.00 H new ATOM 0 HG SER A 59 -23.121 -27.623 20.059 1.00 0.00 H new ATOM 881 N GLU A 60 -23.413 -29.991 16.048 1.00 0.00 N ATOM 882 CA GLU A 60 -23.662 -31.420 15.898 1.00 0.00 C ATOM 883 C GLU A 60 -22.646 -32.053 14.952 1.00 0.00 C ATOM 884 O GLU A 60 -21.941 -32.993 15.319 1.00 0.00 O ATOM 885 CB GLU A 60 -25.080 -31.661 15.377 1.00 0.00 C ATOM 886 CG GLU A 60 -26.147 -31.578 16.455 1.00 0.00 C ATOM 887 CD GLU A 60 -26.706 -32.937 16.829 1.00 0.00 C ATOM 888 OE1 GLU A 60 -25.905 -33.835 17.164 1.00 0.00 O ATOM 889 OE2 GLU A 60 -27.943 -33.103 16.787 1.00 0.00 O ATOM 0 H GLU A 60 -24.036 -29.394 15.504 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.559 -31.886 16.878 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.302 -30.929 14.601 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -25.124 -32.645 14.909 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.725 -31.106 17.342 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.959 -30.938 16.109 1.00 0.00 H new ATOM 896 N ASP A 61 -22.578 -31.531 13.732 1.00 0.00 N ATOM 897 CA ASP A 61 -21.649 -32.044 12.732 1.00 0.00 C ATOM 898 C ASP A 61 -20.262 -31.433 12.915 1.00 0.00 C ATOM 899 O ASP A 61 -19.337 -32.097 13.383 1.00 0.00 O ATOM 900 CB ASP A 61 -22.168 -31.749 11.324 1.00 0.00 C ATOM 901 CG ASP A 61 -22.637 -32.999 10.606 1.00 0.00 C ATOM 902 OD1 ASP A 61 -23.757 -33.467 10.901 1.00 0.00 O ATOM 903 OD2 ASP A 61 -21.885 -33.510 9.750 1.00 0.00 O ATOM 0 H ASP A 61 -23.155 -30.753 13.412 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.571 -33.123 12.863 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.992 -31.038 11.385 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -21.379 -31.273 10.741 1.00 0.00 H new ATOM 908 N PHE A 62 -20.126 -30.166 12.541 1.00 0.00 N ATOM 909 CA PHE A 62 -18.852 -29.466 12.662 1.00 0.00 C ATOM 910 C PHE A 62 -18.297 -29.587 14.078 1.00 0.00 C ATOM 911 O PHE A 62 -17.096 -29.776 14.273 1.00 0.00 O ATOM 912 CB PHE A 62 -19.019 -27.991 12.291 1.00 0.00 C ATOM 913 CG PHE A 62 -18.926 -27.729 10.815 1.00 0.00 C ATOM 914 CD1 PHE A 62 -20.049 -27.823 10.009 1.00 0.00 C ATOM 915 CD2 PHE A 62 -17.715 -27.390 10.234 1.00 0.00 C ATOM 916 CE1 PHE A 62 -19.966 -27.583 8.651 1.00 0.00 C ATOM 917 CE2 PHE A 62 -17.626 -27.148 8.876 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.753 -27.246 8.083 1.00 0.00 C ATOM 0 H PHE A 62 -20.882 -29.602 12.152 1.00 0.00 H new ATOM 0 HA PHE A 62 -18.145 -29.929 11.973 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.985 -27.641 12.654 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -18.255 -27.407 12.804 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -21.000 -28.087 10.447 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -16.830 -27.314 10.849 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -20.849 -27.659 8.034 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -16.676 -26.883 8.435 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.686 -27.060 7.021 1.00 0.00 H new ATOM 928 N LYS A 63 -19.180 -29.475 15.064 1.00 0.00 N ATOM 929 CA LYS A 63 -18.782 -29.572 16.464 1.00 0.00 C ATOM 930 C LYS A 63 -17.642 -28.608 16.773 1.00 0.00 C ATOM 931 O LYS A 63 -16.766 -28.905 17.587 1.00 0.00 O ATOM 932 CB LYS A 63 -18.357 -31.004 16.796 1.00 0.00 C ATOM 933 CG LYS A 63 -19.386 -32.051 16.404 1.00 0.00 C ATOM 934 CD LYS A 63 -19.757 -32.936 17.582 1.00 0.00 C ATOM 935 CE LYS A 63 -18.757 -34.067 17.766 1.00 0.00 C ATOM 936 NZ LYS A 63 -19.036 -34.859 18.996 1.00 0.00 N ATOM 0 H LYS A 63 -20.177 -29.317 14.920 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.640 -29.302 17.080 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -17.418 -31.222 16.288 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -18.165 -31.078 17.866 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.280 -31.559 16.022 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.991 -32.666 15.596 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.800 -32.335 18.491 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.753 -33.351 17.427 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -18.787 -34.724 16.897 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -17.749 -33.656 17.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.333 -35.620 19.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -18.982 -34.238 19.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -19.988 -35.273 18.934 1.00 0.00 H new ATOM 950 N LEU A 64 -17.658 -27.451 16.119 1.00 0.00 N ATOM 951 CA LEU A 64 -16.625 -26.441 16.326 1.00 0.00 C ATOM 952 C LEU A 64 -16.617 -25.959 17.773 1.00 0.00 C ATOM 953 O LEU A 64 -17.406 -26.422 18.596 1.00 0.00 O ATOM 954 CB LEU A 64 -16.846 -25.258 15.382 1.00 0.00 C ATOM 955 CG LEU A 64 -16.519 -25.503 13.909 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.453 -24.704 13.014 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.067 -25.150 13.619 1.00 0.00 C ATOM 0 H LEU A 64 -18.374 -27.189 15.442 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.658 -26.895 16.109 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.889 -24.951 15.455 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.242 -24.421 15.733 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.664 -26.562 13.696 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.205 -24.891 11.969 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.483 -25.006 13.202 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.341 -23.641 13.228 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -14.852 -25.331 12.566 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.895 -24.099 13.849 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.413 -25.768 14.234 1.00 0.00 H new ATOM 969 N SER A 65 -15.722 -25.023 18.074 1.00 0.00 N ATOM 970 CA SER A 65 -15.610 -24.478 19.422 1.00 0.00 C ATOM 971 C SER A 65 -16.846 -23.659 19.781 1.00 0.00 C ATOM 972 O SER A 65 -17.559 -23.171 18.903 1.00 0.00 O ATOM 973 CB SER A 65 -14.356 -23.610 19.541 1.00 0.00 C ATOM 974 OG SER A 65 -14.397 -22.813 20.712 1.00 0.00 O ATOM 0 H SER A 65 -15.064 -24.627 17.403 1.00 0.00 H new ATOM 0 HA SER A 65 -15.533 -25.312 20.120 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.471 -24.245 19.561 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.269 -22.969 18.664 1.00 0.00 H new ATOM 0 HG SER A 65 -13.584 -22.269 20.766 1.00 0.00 H new ATOM 980 N LYS A 66 -17.093 -23.511 21.078 1.00 0.00 N ATOM 981 CA LYS A 66 -18.242 -22.750 21.556 1.00 0.00 C ATOM 982 C LYS A 66 -18.203 -21.318 21.030 1.00 0.00 C ATOM 983 O LYS A 66 -19.244 -20.702 20.801 1.00 0.00 O ATOM 984 CB LYS A 66 -18.273 -22.741 23.086 1.00 0.00 C ATOM 985 CG LYS A 66 -17.156 -21.925 23.713 1.00 0.00 C ATOM 986 CD LYS A 66 -16.616 -22.590 24.968 1.00 0.00 C ATOM 987 CE LYS A 66 -15.511 -23.582 24.643 1.00 0.00 C ATOM 988 NZ LYS A 66 -14.874 -24.127 25.874 1.00 0.00 N ATOM 0 H LYS A 66 -16.513 -23.908 21.817 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.146 -23.232 21.183 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.232 -22.344 23.419 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.209 -23.767 23.448 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.349 -21.797 22.992 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -17.525 -20.929 23.958 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -16.234 -21.829 25.648 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -17.426 -23.103 25.486 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.921 -24.402 24.053 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -14.754 -23.094 24.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -14.126 -24.799 25.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -14.460 -23.348 26.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -15.590 -24.615 26.449 1.00 0.00 H new ATOM 1002 N LEU A 67 -16.996 -20.796 20.839 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.822 -19.437 20.338 1.00 0.00 C ATOM 1004 C LEU A 67 -17.012 -19.385 18.826 1.00 0.00 C ATOM 1005 O LEU A 67 -17.586 -18.434 18.295 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.434 -18.910 20.708 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.402 -17.696 21.636 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -16.228 -16.559 21.057 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -15.905 -18.071 23.023 1.00 0.00 C ATOM 0 H LEU A 67 -16.124 -21.293 21.023 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.579 -18.805 20.802 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.875 -19.718 21.180 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.908 -18.653 19.789 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.369 -17.358 21.725 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -16.193 -15.704 21.732 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.823 -16.272 20.087 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.261 -16.884 20.937 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.875 -17.194 23.670 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.930 -18.435 22.952 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.271 -18.852 23.441 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.528 -20.415 18.138 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.647 -20.487 16.687 1.00 0.00 C ATOM 1023 C GLN A 68 -18.108 -20.589 16.264 1.00 0.00 C ATOM 1024 O GLN A 68 -18.596 -19.779 15.475 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.863 -21.685 16.149 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.395 -21.386 15.892 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.517 -22.615 16.024 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.990 -23.695 16.380 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.230 -22.457 15.737 1.00 0.00 N ATOM 0 H GLN A 68 -16.050 -21.210 18.562 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.230 -19.571 16.268 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.938 -22.507 16.861 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.324 -22.023 15.221 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.283 -20.970 14.891 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -14.055 -20.624 16.594 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.881 -21.544 15.446 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.591 -23.249 15.808 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.804 -21.590 16.795 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.211 -21.798 16.473 1.00 0.00 C ATOM 1040 C VAL A 69 -21.027 -20.537 16.735 1.00 0.00 C ATOM 1041 O VAL A 69 -22.042 -20.294 16.083 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.807 -22.961 17.289 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.280 -23.145 16.959 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -20.030 -24.243 17.033 1.00 0.00 C ATOM 0 H VAL A 69 -18.416 -22.269 17.450 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.260 -22.045 15.412 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.725 -22.719 18.349 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.684 -23.971 17.545 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.823 -22.231 17.198 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.390 -23.365 15.897 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.464 -25.054 17.617 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.079 -24.492 15.973 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.989 -24.102 17.325 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.576 -19.736 17.695 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.262 -18.498 18.044 1.00 0.00 C ATOM 1056 C LYS A 70 -20.883 -17.376 17.082 1.00 0.00 C ATOM 1057 O LYS A 70 -21.738 -16.608 16.640 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.923 -18.089 19.479 1.00 0.00 C ATOM 1059 CG LYS A 70 -22.050 -17.355 20.185 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.624 -15.961 20.613 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.628 -15.342 21.574 1.00 0.00 C ATOM 1062 NZ LYS A 70 -23.856 -14.877 20.870 1.00 0.00 N ATOM 0 H LYS A 70 -19.738 -19.923 18.245 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.335 -18.673 17.967 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.667 -18.981 20.051 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -20.038 -17.453 19.467 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.912 -17.286 19.522 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.365 -17.925 21.059 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.645 -16.009 21.089 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -21.520 -15.325 19.734 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.901 -16.073 22.335 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -22.165 -14.501 22.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -24.515 -14.462 21.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -23.599 -14.161 20.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -24.312 -15.684 20.398 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.597 -17.288 16.760 1.00 0.00 N ATOM 1077 CA LYS A 71 -19.104 -16.263 15.849 1.00 0.00 C ATOM 1078 C LYS A 71 -19.688 -16.451 14.452 1.00 0.00 C ATOM 1079 O LYS A 71 -20.159 -15.496 13.832 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.576 -16.301 15.783 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.930 -14.927 15.835 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.581 -14.971 16.533 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.701 -14.600 18.003 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.788 -13.126 18.198 1.00 0.00 N ATOM 0 H LYS A 71 -18.877 -17.915 17.117 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.421 -15.292 16.229 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.200 -16.902 16.611 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.273 -16.801 14.863 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.804 -14.545 14.822 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.589 -14.234 16.358 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.156 -15.971 16.443 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.892 -14.286 16.039 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.586 -15.075 18.426 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.840 -14.988 18.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.869 -12.914 19.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.932 -12.674 17.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.624 -12.759 17.700 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.656 -17.686 13.963 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.184 -17.998 12.641 1.00 0.00 C ATOM 1100 C ILE A 72 -21.666 -17.650 12.545 1.00 0.00 C ATOM 1101 O ILE A 72 -22.095 -16.969 11.615 1.00 0.00 O ATOM 1102 CB ILE A 72 -19.994 -19.487 12.296 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.512 -19.861 12.356 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.567 -19.788 10.919 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.269 -21.352 12.442 1.00 0.00 C ATOM 0 H ILE A 72 -19.270 -18.487 14.463 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.624 -17.394 11.927 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.531 -20.087 13.031 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -18.011 -19.470 11.471 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -18.058 -19.376 13.220 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.425 -20.844 10.689 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.632 -19.554 10.909 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.055 -19.182 10.171 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.197 -21.544 12.481 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.742 -21.746 13.342 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.693 -21.841 11.565 1.00 0.00 H new ATOM 1117 N MET A 73 -22.443 -18.122 13.515 1.00 0.00 N ATOM 1118 CA MET A 73 -23.877 -17.858 13.542 1.00 0.00 C ATOM 1119 C MET A 73 -24.156 -16.362 13.435 1.00 0.00 C ATOM 1120 O MET A 73 -25.057 -15.941 12.709 1.00 0.00 O ATOM 1121 CB MET A 73 -24.495 -18.413 14.826 1.00 0.00 C ATOM 1122 CG MET A 73 -25.380 -19.628 14.598 1.00 0.00 C ATOM 1123 SD MET A 73 -27.119 -19.193 14.397 1.00 0.00 S ATOM 1124 CE MET A 73 -27.231 -19.062 12.614 1.00 0.00 C ATOM 0 H MET A 73 -22.104 -18.689 14.292 1.00 0.00 H new ATOM 0 HA MET A 73 -24.329 -18.356 12.685 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.696 -18.680 15.518 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.083 -17.630 15.305 1.00 0.00 H new ATOM 0 HG2 MET A 73 -25.038 -20.161 13.711 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.276 -20.312 15.440 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.270 -18.903 12.325 1.00 0.00 H new ATOM 0 HE2 MET A 73 -26.627 -18.222 12.272 1.00 0.00 H new ATOM 0 HE3 MET A 73 -26.864 -19.982 12.158 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.379 -15.566 14.161 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.545 -14.117 14.147 1.00 0.00 C ATOM 1136 C GLN A 74 -23.215 -13.544 12.773 1.00 0.00 C ATOM 1137 O GLN A 74 -23.742 -12.504 12.380 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.655 -13.470 15.210 1.00 0.00 C ATOM 1139 CG GLN A 74 -23.396 -13.112 16.488 1.00 0.00 C ATOM 1140 CD GLN A 74 -24.002 -11.723 16.441 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -25.221 -11.567 16.373 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -23.151 -10.704 16.479 1.00 0.00 N ATOM 0 H GLN A 74 -22.629 -15.899 14.766 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.588 -13.894 14.372 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -21.839 -14.151 15.452 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.206 -12.568 14.795 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -24.185 -13.843 16.663 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -22.709 -13.176 17.332 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -22.148 -10.879 16.535 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -23.501 -9.746 16.452 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.339 -14.231 12.047 1.00 0.00 N ATOM 1152 CA PHE A 75 -21.937 -13.789 10.716 1.00 0.00 C ATOM 1153 C PHE A 75 -23.045 -14.047 9.700 1.00 0.00 C ATOM 1154 O PHE A 75 -23.339 -13.198 8.857 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.656 -14.506 10.283 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.170 -14.096 8.923 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.719 -12.806 8.693 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.165 -15.000 7.873 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.271 -12.425 7.442 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -19.718 -14.625 6.620 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.271 -13.336 6.404 1.00 0.00 C ATOM 0 H PHE A 75 -21.894 -15.095 12.357 1.00 0.00 H new ATOM 0 HA PHE A 75 -21.749 -12.716 10.758 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -19.873 -14.308 11.015 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.832 -15.582 10.288 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.718 -12.089 9.501 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.514 -16.009 8.035 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.922 -11.417 7.277 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -19.718 -15.340 5.810 1.00 0.00 H new ATOM 0 HZ PHE A 75 -18.922 -13.041 5.425 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.656 -15.224 9.785 1.00 0.00 N ATOM 1172 CA ILE A 76 -24.732 -15.593 8.874 1.00 0.00 C ATOM 1173 C ILE A 76 -25.890 -14.605 8.961 1.00 0.00 C ATOM 1174 O ILE A 76 -26.356 -14.088 7.947 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.258 -17.010 9.169 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.119 -18.028 9.086 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.373 -17.374 8.200 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.523 -19.424 9.506 1.00 0.00 C ATOM 0 H ILE A 76 -23.424 -15.938 10.475 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.314 -15.571 7.868 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.663 -17.028 10.181 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -23.745 -18.059 8.063 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.296 -17.692 9.716 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.734 -18.378 8.422 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.192 -16.663 8.304 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -25.993 -17.342 7.179 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.666 -20.092 9.422 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.869 -19.407 10.539 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.325 -19.780 8.860 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.349 -14.346 10.182 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.453 -13.418 10.402 1.00 0.00 C ATOM 1192 C ASN A 77 -27.033 -11.987 10.081 1.00 0.00 C ATOM 1193 O ASN A 77 -27.753 -11.255 9.405 1.00 0.00 O ATOM 1194 CB ASN A 77 -27.939 -13.506 11.850 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.410 -13.861 11.946 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.266 -13.155 11.413 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -29.710 -14.961 12.627 1.00 0.00 N ATOM 0 H ASN A 77 -25.974 -14.765 11.033 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.268 -13.697 9.734 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.352 -14.254 12.382 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -27.765 -12.552 12.347 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -30.683 -15.251 12.725 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -28.967 -15.516 13.052 1.00 0.00 H new