USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 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 122 LYS NZ :NH3+ -175:sc= -0.0517 (180deg=-0.119) USER MOD Set 1.2: A 126 ASN : amide:sc= -1.71! C(o=-1.8!,f=-2.6!) USER MOD Set 2.1: A 56 MET CE :methyl 161:sc= -5.5 (180deg=-8.1!) USER MOD Set 2.2: A 96 THR OG1 : rot -110:sc= -1.14! USER MOD Set 3.1: A 27 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.075) USER MOD Set 3.2: A 29 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.193) USER MOD Set 4.1: A 21 GLN : amide:sc= 0.431 K(o=1.6,f=-9.8!) USER MOD Set 4.2: A 25 TYR OH : rot 70:sc= 1.19 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.178 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 77:sc= -4.69! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -128:sc= 0.287! (180deg=-2.06!) USER MOD Single : A 31 MET CE :methyl 139:sc= -0.0352 (180deg=-0.667) USER MOD Single : A 32 GLN : amide:sc= -6.47! C(o=-6.5!,f=-8.9!) USER MOD Single : A 34 THR OG1 : rot -101:sc= 1.28 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 90:sc= 0.496! USER MOD Single : A 49 SER OG : rot 111:sc= -8.6! USER MOD Single : A 50 SER OG : rot 74:sc= 0.605 USER MOD Single : A 53 LYS NZ :NH3+ -134:sc= -6.18! (180deg=-10.3!) USER MOD Single : A 54 GLN : amide:sc= -6.36! C(o=-6.4!,f=-9.1!) USER MOD Single : A 55 LYS NZ :NH3+ 141:sc= -2.08! (180deg=-3.12!) USER MOD Single : A 62 SER OG : rot 156:sc= -2.61! USER MOD Single : A 63 SER OG : rot -160:sc= -0.115! USER MOD Single : A 67 LYS NZ :NH3+ -164:sc= -5.65! (180deg=-7.5!) USER MOD Single : A 71 THR OG1 : rot -104:sc= -6.62! USER MOD Single : A 79 ASN : amide:sc= -3.99! C(o=-4!,f=-8.2!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -90:sc= -2.11! USER MOD Single : A 93 LYS NZ :NH3+ 165:sc= -15.2! (180deg=-16.3!) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -164:sc= -0.0663 (180deg=-0.456) USER MOD Single : A 99 TYR OH : rot -132:sc= -2.05 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0.0759 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 88:sc= 0.506 USER MOD Single : A 141 SER OG : rot 105:sc= 0.606 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.368 3.241 -13.618 1.00 0.00 N ATOM 106 CA VAL A 7 113.580 4.570 -12.982 1.00 0.00 C ATOM 107 C VAL A 7 115.072 4.897 -12.916 1.00 0.00 C ATOM 108 O VAL A 7 115.465 6.039 -13.046 1.00 0.00 O ATOM 109 CB VAL A 7 113.006 4.553 -11.563 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.570 4.029 -11.597 1.00 0.00 C ATOM 111 CG2 VAL A 7 113.861 3.642 -10.677 1.00 0.00 C ATOM 0 HA VAL A 7 113.075 5.329 -13.579 1.00 0.00 H new ATOM 0 HB VAL A 7 113.013 5.565 -11.158 1.00 0.00 H new ATOM 0 HG11 VAL A 7 111.163 4.018 -10.586 1.00 0.00 H new ATOM 0 HG12 VAL A 7 110.961 4.678 -12.226 1.00 0.00 H new ATOM 0 HG13 VAL A 7 111.561 3.018 -12.003 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.453 3.630 -9.666 1.00 0.00 H new ATOM 0 HG22 VAL A 7 113.856 2.630 -11.083 1.00 0.00 H new ATOM 0 HG23 VAL A 7 114.884 4.017 -10.650 1.00 0.00 H new ATOM 121 N LYS A 8 115.911 3.920 -12.694 1.00 0.00 N ATOM 122 CA LYS A 8 117.365 4.224 -12.603 1.00 0.00 C ATOM 123 C LYS A 8 117.538 5.357 -11.590 1.00 0.00 C ATOM 124 O LYS A 8 118.618 5.870 -11.378 1.00 0.00 O ATOM 125 CB LYS A 8 117.881 4.642 -13.986 1.00 0.00 C ATOM 126 CG LYS A 8 118.895 5.784 -13.863 1.00 0.00 C ATOM 127 CD LYS A 8 119.476 6.100 -15.243 1.00 0.00 C ATOM 128 CE LYS A 8 118.608 7.154 -15.933 1.00 0.00 C ATOM 129 NZ LYS A 8 118.979 7.237 -17.374 1.00 0.00 N ATOM 0 H LYS A 8 115.656 2.940 -12.574 1.00 0.00 H new ATOM 0 HA LYS A 8 117.934 3.352 -12.279 1.00 0.00 H new ATOM 0 HB2 LYS A 8 118.345 3.788 -14.480 1.00 0.00 H new ATOM 0 HB3 LYS A 8 117.046 4.956 -14.612 1.00 0.00 H new ATOM 0 HG2 LYS A 8 118.413 6.669 -13.448 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.693 5.504 -13.176 1.00 0.00 H new ATOM 0 HD2 LYS A 8 120.499 6.464 -15.144 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.517 5.194 -15.848 1.00 0.00 H new ATOM 0 HE2 LYS A 8 117.554 6.895 -15.832 1.00 0.00 H new ATOM 0 HE3 LYS A 8 118.745 8.124 -15.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 118.389 7.953 -17.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 119.981 7.503 -17.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.826 6.313 -17.826 1.00 0.00 H new ATOM 143 N GLY A 9 116.462 5.744 -10.959 1.00 0.00 N ATOM 144 CA GLY A 9 116.529 6.837 -9.955 1.00 0.00 C ATOM 145 C GLY A 9 115.638 7.991 -10.406 1.00 0.00 C ATOM 146 O GLY A 9 116.110 9.003 -10.885 1.00 0.00 O ATOM 0 H GLY A 9 115.534 5.345 -11.099 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.205 6.472 -8.980 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.558 7.179 -9.841 1.00 0.00 H new ATOM 150 N ALA A 10 114.350 7.847 -10.259 1.00 0.00 N ATOM 151 CA ALA A 10 113.432 8.943 -10.684 1.00 0.00 C ATOM 152 C ALA A 10 112.002 8.411 -10.745 1.00 0.00 C ATOM 153 O ALA A 10 111.209 8.820 -11.570 1.00 0.00 O ATOM 154 CB ALA A 10 113.848 9.450 -12.067 1.00 0.00 C ATOM 0 H ALA A 10 113.895 7.023 -9.866 1.00 0.00 H new ATOM 0 HA ALA A 10 113.486 9.762 -9.967 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.177 10.251 -12.378 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.869 9.828 -12.024 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.794 8.632 -12.786 1.00 0.00 H new ATOM 160 N LEU A 11 111.670 7.499 -9.878 1.00 0.00 N ATOM 161 CA LEU A 11 110.296 6.933 -9.877 1.00 0.00 C ATOM 162 C LEU A 11 109.273 8.061 -9.750 1.00 0.00 C ATOM 163 O LEU A 11 109.605 9.227 -9.837 1.00 0.00 O ATOM 164 CB LEU A 11 110.153 5.973 -8.696 1.00 0.00 C ATOM 165 CG LEU A 11 109.964 6.762 -7.395 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.177 5.827 -6.208 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.983 7.901 -7.309 1.00 0.00 C ATOM 0 H LEU A 11 112.295 7.120 -9.167 1.00 0.00 H new ATOM 0 HA LEU A 11 110.120 6.397 -10.810 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.302 5.312 -8.856 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.038 5.341 -8.622 1.00 0.00 H new ATOM 0 HG LEU A 11 108.957 7.178 -7.379 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.044 6.382 -5.279 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.453 5.013 -6.251 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.186 5.417 -6.244 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.836 8.452 -6.380 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.992 7.489 -7.331 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.848 8.575 -8.155 1.00 0.00 H new ATOM 179 N THR A 12 108.032 7.725 -9.542 1.00 0.00 N ATOM 180 CA THR A 12 106.991 8.782 -9.404 1.00 0.00 C ATOM 181 C THR A 12 107.418 9.783 -8.325 1.00 0.00 C ATOM 182 O THR A 12 108.453 9.640 -7.704 1.00 0.00 O ATOM 183 CB THR A 12 105.661 8.139 -9.006 1.00 0.00 C ATOM 184 OG1 THR A 12 105.637 7.936 -7.600 1.00 0.00 O ATOM 185 CG2 THR A 12 105.506 6.796 -9.720 1.00 0.00 C ATOM 0 H THR A 12 107.693 6.766 -9.462 1.00 0.00 H new ATOM 0 HA THR A 12 106.873 9.302 -10.355 1.00 0.00 H new ATOM 0 HB THR A 12 104.840 8.796 -9.293 1.00 0.00 H new ATOM 0 HG1 THR A 12 104.785 7.526 -7.343 1.00 0.00 H new ATOM 0 HG21 THR A 12 104.558 6.340 -9.435 1.00 0.00 H new ATOM 0 HG22 THR A 12 105.523 6.953 -10.798 1.00 0.00 H new ATOM 0 HG23 THR A 12 106.326 6.136 -9.436 1.00 0.00 H new ATOM 193 N SER A 13 106.626 10.796 -8.098 1.00 0.00 N ATOM 194 CA SER A 13 106.973 11.811 -7.061 1.00 0.00 C ATOM 195 C SER A 13 107.038 11.144 -5.684 1.00 0.00 C ATOM 196 O SER A 13 107.118 11.803 -4.667 1.00 0.00 O ATOM 197 CB SER A 13 105.907 12.907 -7.045 1.00 0.00 C ATOM 198 OG SER A 13 106.496 14.130 -6.623 1.00 0.00 O ATOM 0 H SER A 13 105.748 10.965 -8.589 1.00 0.00 H new ATOM 0 HA SER A 13 107.944 12.248 -7.296 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.473 13.023 -8.038 1.00 0.00 H new ATOM 0 HB3 SER A 13 105.095 12.630 -6.373 1.00 0.00 H new ATOM 0 HG SER A 13 105.815 14.835 -6.613 1.00 0.00 H new ATOM 204 N GLY A 14 106.989 9.842 -5.644 1.00 0.00 N ATOM 205 CA GLY A 14 107.030 9.128 -4.335 1.00 0.00 C ATOM 206 C GLY A 14 108.138 9.701 -3.446 1.00 0.00 C ATOM 207 O GLY A 14 108.038 9.693 -2.236 1.00 0.00 O ATOM 0 H GLY A 14 106.922 9.239 -6.464 1.00 0.00 H new ATOM 0 HA2 GLY A 14 106.067 9.222 -3.832 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.201 8.064 -4.499 1.00 0.00 H new ATOM 211 N ARG A 15 109.198 10.183 -4.027 1.00 0.00 N ATOM 212 CA ARG A 15 110.310 10.735 -3.200 1.00 0.00 C ATOM 213 C ARG A 15 109.816 11.910 -2.346 1.00 0.00 C ATOM 214 O ARG A 15 109.887 11.878 -1.133 1.00 0.00 O ATOM 215 CB ARG A 15 111.438 11.215 -4.116 1.00 0.00 C ATOM 216 CG ARG A 15 110.850 11.690 -5.444 1.00 0.00 C ATOM 217 CD ARG A 15 111.665 12.867 -5.985 1.00 0.00 C ATOM 218 NE ARG A 15 111.037 14.148 -5.556 1.00 0.00 N ATOM 219 CZ ARG A 15 111.391 15.270 -6.122 1.00 0.00 C ATOM 220 NH1 ARG A 15 112.297 15.269 -7.061 1.00 0.00 N ATOM 221 NH2 ARG A 15 110.840 16.392 -5.748 1.00 0.00 N ATOM 0 H ARG A 15 109.345 10.220 -5.036 1.00 0.00 H new ATOM 0 HA ARG A 15 110.676 9.949 -2.539 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.988 12.026 -3.639 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.149 10.407 -4.289 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.852 10.873 -6.165 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.811 11.989 -5.305 1.00 0.00 H new ATOM 0 HD2 ARG A 15 112.690 12.812 -5.618 1.00 0.00 H new ATOM 0 HD3 ARG A 15 111.713 12.820 -7.073 1.00 0.00 H new ATOM 0 HE ARG A 15 110.331 14.148 -4.820 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.728 14.392 -7.353 1.00 0.00 H new ATOM 0 HH12 ARG A 15 112.574 16.145 -7.503 1.00 0.00 H new ATOM 0 HH21 ARG A 15 110.133 16.393 -5.013 1.00 0.00 H new ATOM 0 HH22 ARG A 15 111.117 17.268 -6.190 1.00 0.00 H new ATOM 235 N GLU A 16 109.340 12.954 -2.967 1.00 0.00 N ATOM 236 CA GLU A 16 108.873 14.139 -2.186 1.00 0.00 C ATOM 237 C GLU A 16 107.448 13.927 -1.671 1.00 0.00 C ATOM 238 O GLU A 16 107.095 14.381 -0.602 1.00 0.00 O ATOM 239 CB GLU A 16 108.886 15.375 -3.090 1.00 0.00 C ATOM 240 CG GLU A 16 108.791 16.640 -2.232 1.00 0.00 C ATOM 241 CD GLU A 16 107.948 17.690 -2.958 1.00 0.00 C ATOM 242 OE1 GLU A 16 107.803 17.574 -4.163 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.461 18.591 -2.295 1.00 0.00 O ATOM 0 H GLU A 16 109.253 13.040 -3.980 1.00 0.00 H new ATOM 0 HA GLU A 16 109.541 14.275 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 16 109.800 15.394 -3.684 1.00 0.00 H new ATOM 0 HB3 GLU A 16 108.052 15.335 -3.790 1.00 0.00 H new ATOM 0 HG2 GLU A 16 108.344 16.404 -1.266 1.00 0.00 H new ATOM 0 HG3 GLU A 16 109.788 17.033 -2.034 1.00 0.00 H new ATOM 250 N GLU A 17 106.619 13.274 -2.430 1.00 0.00 N ATOM 251 CA GLU A 17 105.208 13.076 -1.992 1.00 0.00 C ATOM 252 C GLU A 17 105.107 12.008 -0.897 1.00 0.00 C ATOM 253 O GLU A 17 104.465 12.211 0.114 1.00 0.00 O ATOM 254 CB GLU A 17 104.366 12.644 -3.193 1.00 0.00 C ATOM 255 CG GLU A 17 102.975 12.221 -2.717 1.00 0.00 C ATOM 256 CD GLU A 17 101.957 12.463 -3.833 1.00 0.00 C ATOM 257 OE1 GLU A 17 101.883 13.584 -4.307 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.270 11.522 -4.194 1.00 0.00 O ATOM 0 H GLU A 17 106.854 12.868 -3.335 1.00 0.00 H new ATOM 0 HA GLU A 17 104.841 14.018 -1.586 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.284 13.464 -3.906 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.851 11.817 -3.712 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.980 11.168 -2.437 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.696 12.786 -1.827 1.00 0.00 H new ATOM 265 N LEU A 18 105.693 10.861 -1.097 1.00 0.00 N ATOM 266 CA LEU A 18 105.570 9.785 -0.071 1.00 0.00 C ATOM 267 C LEU A 18 106.494 10.030 1.131 1.00 0.00 C ATOM 268 O LEU A 18 106.185 9.622 2.233 1.00 0.00 O ATOM 269 CB LEU A 18 105.895 8.431 -0.708 1.00 0.00 C ATOM 270 CG LEU A 18 104.644 7.547 -0.689 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.230 7.276 0.761 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.502 8.259 -1.422 1.00 0.00 C ATOM 0 H LEU A 18 106.248 10.622 -1.919 1.00 0.00 H new ATOM 0 HA LEU A 18 104.544 9.789 0.297 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.239 8.572 -1.733 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.705 7.946 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 18 104.861 6.602 -1.187 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.340 6.647 0.774 1.00 0.00 H new ATOM 0 HD12 LEU A 18 105.041 6.767 1.282 1.00 0.00 H new ATOM 0 HD13 LEU A 18 104.014 8.221 1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.612 7.629 -1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.285 9.205 -0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.795 8.450 -2.454 1.00 0.00 H new ATOM 284 N THR A 19 107.618 10.675 0.960 1.00 0.00 N ATOM 285 CA THR A 19 108.498 10.891 2.145 1.00 0.00 C ATOM 286 C THR A 19 107.925 12.019 2.999 1.00 0.00 C ATOM 287 O THR A 19 107.673 11.846 4.173 1.00 0.00 O ATOM 288 CB THR A 19 109.914 11.249 1.693 1.00 0.00 C ATOM 289 OG1 THR A 19 110.305 10.365 0.654 1.00 0.00 O ATOM 290 CG2 THR A 19 110.883 11.115 2.876 1.00 0.00 C ATOM 0 H THR A 19 107.958 11.053 0.076 1.00 0.00 H new ATOM 0 HA THR A 19 108.541 9.974 2.732 1.00 0.00 H new ATOM 0 HB THR A 19 109.935 12.276 1.329 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.867 10.629 -0.182 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.892 11.371 2.551 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.577 11.790 3.675 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.869 10.089 3.243 1.00 0.00 H new ATOM 298 N ARG A 20 107.698 13.167 2.420 1.00 0.00 N ATOM 299 CA ARG A 20 107.122 14.292 3.205 1.00 0.00 C ATOM 300 C ARG A 20 105.857 13.809 3.913 1.00 0.00 C ATOM 301 O ARG A 20 105.563 14.203 5.024 1.00 0.00 O ATOM 302 CB ARG A 20 106.766 15.439 2.265 1.00 0.00 C ATOM 303 CG ARG A 20 108.024 16.243 1.962 1.00 0.00 C ATOM 304 CD ARG A 20 107.649 17.511 1.193 1.00 0.00 C ATOM 305 NE ARG A 20 106.892 18.430 2.088 1.00 0.00 N ATOM 306 CZ ARG A 20 106.206 19.418 1.581 1.00 0.00 C ATOM 307 NH1 ARG A 20 106.183 19.600 0.289 1.00 0.00 N ATOM 308 NH2 ARG A 20 105.544 20.223 2.365 1.00 0.00 N ATOM 0 H ARG A 20 107.887 13.373 1.439 1.00 0.00 H new ATOM 0 HA ARG A 20 107.850 14.637 3.939 1.00 0.00 H new ATOM 0 HB2 ARG A 20 106.337 15.049 1.342 1.00 0.00 H new ATOM 0 HB3 ARG A 20 106.011 16.079 2.722 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.533 16.505 2.890 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.719 15.642 1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.548 18.005 0.824 1.00 0.00 H new ATOM 0 HD3 ARG A 20 107.045 17.256 0.322 1.00 0.00 H new ATOM 0 HE ARG A 20 106.910 18.287 3.098 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.701 18.970 -0.324 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.647 20.372 -0.108 1.00 0.00 H new ATOM 0 HH21 ARG A 20 105.562 20.081 3.375 1.00 0.00 H new ATOM 0 HH22 ARG A 20 105.008 20.995 1.968 1.00 0.00 H new ATOM 322 N GLN A 21 105.111 12.950 3.277 1.00 0.00 N ATOM 323 CA GLN A 21 103.871 12.427 3.907 1.00 0.00 C ATOM 324 C GLN A 21 104.249 11.382 4.956 1.00 0.00 C ATOM 325 O GLN A 21 103.474 11.058 5.833 1.00 0.00 O ATOM 326 CB GLN A 21 102.980 11.790 2.841 1.00 0.00 C ATOM 327 CG GLN A 21 102.612 12.839 1.791 1.00 0.00 C ATOM 328 CD GLN A 21 101.405 13.645 2.275 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.641 13.182 3.097 1.00 0.00 O ATOM 330 NE2 GLN A 21 101.201 14.842 1.796 1.00 0.00 N ATOM 0 H GLN A 21 105.309 12.587 2.344 1.00 0.00 H new ATOM 0 HA GLN A 21 103.327 13.244 4.381 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.498 10.955 2.370 1.00 0.00 H new ATOM 0 HB3 GLN A 21 102.077 11.387 3.300 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.458 13.503 1.613 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.382 12.354 0.842 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.843 15.231 1.105 1.00 0.00 H new ATOM 0 HE22 GLN A 21 100.400 15.388 2.112 1.00 0.00 H new ATOM 339 N VAL A 22 105.438 10.847 4.868 1.00 0.00 N ATOM 340 CA VAL A 22 105.868 9.820 5.857 1.00 0.00 C ATOM 341 C VAL A 22 105.531 10.308 7.268 1.00 0.00 C ATOM 342 O VAL A 22 105.234 9.528 8.149 1.00 0.00 O ATOM 343 CB VAL A 22 107.378 9.584 5.726 1.00 0.00 C ATOM 344 CG1 VAL A 22 108.147 10.644 6.519 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.730 8.195 6.263 1.00 0.00 C ATOM 0 H VAL A 22 106.129 11.078 4.154 1.00 0.00 H new ATOM 0 HA VAL A 22 105.346 8.882 5.668 1.00 0.00 H new ATOM 0 HB VAL A 22 107.656 9.652 4.674 1.00 0.00 H new ATOM 0 HG11 VAL A 22 109.218 10.467 6.419 1.00 0.00 H new ATOM 0 HG12 VAL A 22 107.905 11.634 6.133 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.866 10.586 7.571 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.803 8.030 6.169 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.443 8.127 7.312 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.195 7.437 5.691 1.00 0.00 H new ATOM 355 N GLY A 23 105.561 11.593 7.490 1.00 0.00 N ATOM 356 CA GLY A 23 105.225 12.118 8.842 1.00 0.00 C ATOM 357 C GLY A 23 103.762 11.793 9.144 1.00 0.00 C ATOM 358 O GLY A 23 103.331 11.799 10.280 1.00 0.00 O ATOM 0 H GLY A 23 105.803 12.300 6.796 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.875 11.670 9.594 1.00 0.00 H new ATOM 0 HA3 GLY A 23 105.389 13.195 8.881 1.00 0.00 H new ATOM 362 N ARG A 24 102.997 11.502 8.126 1.00 0.00 N ATOM 363 CA ARG A 24 101.561 11.168 8.332 1.00 0.00 C ATOM 364 C ARG A 24 101.381 9.650 8.275 1.00 0.00 C ATOM 365 O ARG A 24 100.663 9.069 9.065 1.00 0.00 O ATOM 366 CB ARG A 24 100.722 11.822 7.232 1.00 0.00 C ATOM 367 CG ARG A 24 100.546 13.310 7.540 1.00 0.00 C ATOM 368 CD ARG A 24 100.132 14.050 6.266 1.00 0.00 C ATOM 369 NE ARG A 24 98.983 13.344 5.633 1.00 0.00 N ATOM 370 CZ ARG A 24 98.319 13.914 4.665 1.00 0.00 C ATOM 371 NH1 ARG A 24 98.662 15.104 4.252 1.00 0.00 N ATOM 372 NH2 ARG A 24 97.312 13.296 4.111 1.00 0.00 N ATOM 0 H ARG A 24 103.309 11.482 7.155 1.00 0.00 H new ATOM 0 HA ARG A 24 101.236 11.538 9.304 1.00 0.00 H new ATOM 0 HB2 ARG A 24 101.209 11.695 6.265 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.749 11.336 7.165 1.00 0.00 H new ATOM 0 HG2 ARG A 24 99.790 13.445 8.314 1.00 0.00 H new ATOM 0 HG3 ARG A 24 101.477 13.724 7.928 1.00 0.00 H new ATOM 0 HD2 ARG A 24 99.856 15.077 6.503 1.00 0.00 H new ATOM 0 HD3 ARG A 24 100.971 14.098 5.571 1.00 0.00 H new ATOM 0 HE ARG A 24 98.715 12.414 5.956 1.00 0.00 H new ATOM 0 HH11 ARG A 24 99.448 15.587 4.686 1.00 0.00 H new ATOM 0 HH12 ARG A 24 98.144 15.550 3.495 1.00 0.00 H new ATOM 0 HH21 ARG A 24 97.043 12.367 4.435 1.00 0.00 H new ATOM 0 HH22 ARG A 24 96.793 13.742 3.354 1.00 0.00 H new ATOM 386 N TYR A 25 102.030 9.001 7.346 1.00 0.00 N ATOM 387 CA TYR A 25 101.897 7.521 7.239 1.00 0.00 C ATOM 388 C TYR A 25 103.023 6.850 8.025 1.00 0.00 C ATOM 389 O TYR A 25 102.901 5.723 8.463 1.00 0.00 O ATOM 390 CB TYR A 25 101.984 7.100 5.769 1.00 0.00 C ATOM 391 CG TYR A 25 101.295 8.127 4.900 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.245 8.898 5.417 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.705 8.305 3.573 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.609 9.846 4.609 1.00 0.00 C ATOM 395 CE2 TYR A 25 101.067 9.253 2.765 1.00 0.00 C ATOM 396 CZ TYR A 25 100.019 10.024 3.283 1.00 0.00 C ATOM 397 OH TYR A 25 99.390 10.958 2.486 1.00 0.00 O ATOM 0 H TYR A 25 102.646 9.432 6.657 1.00 0.00 H new ATOM 0 HA TYR A 25 100.933 7.216 7.647 1.00 0.00 H new ATOM 0 HB2 TYR A 25 103.028 7.000 5.471 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.518 6.124 5.633 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.927 8.760 6.440 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.513 7.711 3.173 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.801 10.441 5.009 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.383 9.390 1.741 1.00 0.00 H new ATOM 0 HH TYR A 25 99.623 11.859 2.792 1.00 0.00 H new ATOM 407 N LYS A 26 104.121 7.531 8.209 1.00 0.00 N ATOM 408 CA LYS A 26 105.251 6.926 8.967 1.00 0.00 C ATOM 409 C LYS A 26 105.667 5.616 8.297 1.00 0.00 C ATOM 410 O LYS A 26 106.536 4.913 8.772 1.00 0.00 O ATOM 411 CB LYS A 26 104.810 6.647 10.406 1.00 0.00 C ATOM 412 CG LYS A 26 104.254 7.929 11.029 1.00 0.00 C ATOM 413 CD LYS A 26 105.407 8.775 11.572 1.00 0.00 C ATOM 414 CE LYS A 26 104.844 9.963 12.354 1.00 0.00 C ATOM 415 NZ LYS A 26 104.556 9.544 13.755 1.00 0.00 N ATOM 0 H LYS A 26 104.284 8.478 7.868 1.00 0.00 H new ATOM 0 HA LYS A 26 106.095 7.615 8.975 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.051 5.865 10.419 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.654 6.282 10.992 1.00 0.00 H new ATOM 0 HG2 LYS A 26 103.694 8.494 10.284 1.00 0.00 H new ATOM 0 HG3 LYS A 26 103.559 7.684 11.832 1.00 0.00 H new ATOM 0 HD2 LYS A 26 106.043 8.170 12.218 1.00 0.00 H new ATOM 0 HD3 LYS A 26 106.030 9.129 10.751 1.00 0.00 H new ATOM 0 HE2 LYS A 26 105.558 10.787 12.349 1.00 0.00 H new ATOM 0 HE3 LYS A 26 103.934 10.327 11.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 104.173 10.351 14.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 103.860 8.771 13.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 105.434 9.217 14.207 1.00 0.00 H new ATOM 429 N ASN A 27 105.051 5.279 7.195 1.00 0.00 N ATOM 430 CA ASN A 27 105.412 4.015 6.499 1.00 0.00 C ATOM 431 C ASN A 27 106.519 4.291 5.480 1.00 0.00 C ATOM 432 O ASN A 27 106.617 5.369 4.929 1.00 0.00 O ATOM 433 CB ASN A 27 104.181 3.460 5.779 1.00 0.00 C ATOM 434 CG ASN A 27 103.405 2.545 6.726 1.00 0.00 C ATOM 435 OD1 ASN A 27 102.581 1.763 6.295 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.634 2.609 8.009 1.00 0.00 N ATOM 0 H ASN A 27 104.314 5.826 6.749 1.00 0.00 H new ATOM 0 HA ASN A 27 105.765 3.286 7.229 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.544 4.278 5.443 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.485 2.907 4.890 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.121 2.003 8.649 1.00 0.00 H new ATOM 0 HD22 ASN A 27 104.326 3.265 8.371 1.00 0.00 H new ATOM 443 N LYS A 28 107.353 3.322 5.228 1.00 0.00 N ATOM 444 CA LYS A 28 108.456 3.513 4.245 1.00 0.00 C ATOM 445 C LYS A 28 108.480 2.311 3.297 1.00 0.00 C ATOM 446 O LYS A 28 108.625 2.443 2.093 1.00 0.00 O ATOM 447 CB LYS A 28 109.788 3.595 4.991 1.00 0.00 C ATOM 448 CG LYS A 28 109.917 4.959 5.677 1.00 0.00 C ATOM 449 CD LYS A 28 109.381 4.873 7.110 1.00 0.00 C ATOM 450 CE LYS A 28 109.818 6.111 7.899 1.00 0.00 C ATOM 451 NZ LYS A 28 110.740 5.701 8.995 1.00 0.00 N ATOM 0 H LYS A 28 107.318 2.400 5.663 1.00 0.00 H new ATOM 0 HA LYS A 28 108.299 4.432 3.680 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.850 2.798 5.732 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.614 3.448 4.295 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.961 5.273 5.688 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.363 5.712 5.116 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.293 4.802 7.098 1.00 0.00 H new ATOM 0 HD3 LYS A 28 109.754 3.971 7.595 1.00 0.00 H new ATOM 0 HE2 LYS A 28 110.315 6.820 7.237 1.00 0.00 H new ATOM 0 HE3 LYS A 28 108.946 6.618 8.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 110.402 6.092 9.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 110.767 4.663 9.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 111.696 6.061 8.798 1.00 0.00 H new ATOM 465 N LYS A 29 108.333 1.138 3.847 1.00 0.00 N ATOM 466 CA LYS A 29 108.337 -0.100 3.020 1.00 0.00 C ATOM 467 C LYS A 29 107.063 -0.155 2.175 1.00 0.00 C ATOM 468 O LYS A 29 106.873 -1.039 1.367 1.00 0.00 O ATOM 469 CB LYS A 29 108.368 -1.317 3.951 1.00 0.00 C ATOM 470 CG LYS A 29 107.635 -0.989 5.255 1.00 0.00 C ATOM 471 CD LYS A 29 106.220 -0.496 4.942 1.00 0.00 C ATOM 472 CE LYS A 29 105.335 -0.668 6.178 1.00 0.00 C ATOM 473 NZ LYS A 29 105.895 0.130 7.305 1.00 0.00 N ATOM 0 H LYS A 29 108.209 0.983 4.847 1.00 0.00 H new ATOM 0 HA LYS A 29 109.209 -0.102 2.367 1.00 0.00 H new ATOM 0 HB2 LYS A 29 107.898 -2.172 3.464 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.399 -1.598 4.163 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.590 -1.873 5.890 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.182 -0.226 5.809 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.246 0.552 4.643 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.805 -1.056 4.104 1.00 0.00 H new ATOM 0 HE2 LYS A 29 104.318 -0.343 5.958 1.00 0.00 H new ATOM 0 HE3 LYS A 29 105.280 -1.721 6.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 105.191 0.194 8.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 106.754 -0.333 7.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.131 1.086 6.970 1.00 0.00 H new ATOM 487 N PHE A 30 106.177 0.768 2.383 1.00 0.00 N ATOM 488 CA PHE A 30 104.891 0.758 1.626 1.00 0.00 C ATOM 489 C PHE A 30 105.107 1.042 0.130 1.00 0.00 C ATOM 490 O PHE A 30 105.072 0.151 -0.698 1.00 0.00 O ATOM 491 CB PHE A 30 104.055 1.899 2.204 1.00 0.00 C ATOM 492 CG PHE A 30 104.906 3.166 2.285 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.233 3.193 1.794 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.365 4.327 2.850 1.00 0.00 C ATOM 495 CE1 PHE A 30 106.988 4.365 1.869 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.130 5.498 2.925 1.00 0.00 C ATOM 497 CZ PHE A 30 106.440 5.515 2.433 1.00 0.00 C ATOM 0 H PHE A 30 106.283 1.535 3.047 1.00 0.00 H new ATOM 0 HA PHE A 30 104.417 -0.219 1.717 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.180 2.076 1.579 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.689 1.630 3.195 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.664 2.303 1.359 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.354 4.320 3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 30 107.999 4.380 1.489 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.708 6.390 3.364 1.00 0.00 H new ATOM 0 HZ PHE A 30 107.026 6.420 2.491 1.00 0.00 H new ATOM 507 N MET A 31 105.365 2.275 -0.207 1.00 0.00 N ATOM 508 CA MET A 31 105.624 2.651 -1.617 1.00 0.00 C ATOM 509 C MET A 31 107.069 2.326 -1.966 1.00 0.00 C ATOM 510 O MET A 31 107.366 1.745 -2.992 1.00 0.00 O ATOM 511 CB MET A 31 105.386 4.151 -1.788 1.00 0.00 C ATOM 512 CG MET A 31 106.037 4.630 -3.086 1.00 0.00 C ATOM 513 SD MET A 31 105.627 3.484 -4.426 1.00 0.00 S ATOM 514 CE MET A 31 103.848 3.811 -4.467 1.00 0.00 C ATOM 0 H MET A 31 105.407 3.051 0.453 1.00 0.00 H new ATOM 0 HA MET A 31 104.956 2.096 -2.275 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.316 4.360 -1.807 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.801 4.694 -0.939 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.688 5.633 -3.332 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.118 4.690 -2.962 1.00 0.00 H new ATOM 0 HE1 MET A 31 103.510 3.855 -5.502 1.00 0.00 H new ATOM 0 HE2 MET A 31 103.319 3.013 -3.946 1.00 0.00 H new ATOM 0 HE3 MET A 31 103.642 4.762 -3.977 1.00 0.00 H new ATOM 524 N GLN A 32 107.975 2.729 -1.116 1.00 0.00 N ATOM 525 CA GLN A 32 109.410 2.487 -1.384 1.00 0.00 C ATOM 526 C GLN A 32 109.733 1.003 -1.184 1.00 0.00 C ATOM 527 O GLN A 32 110.615 0.464 -1.823 1.00 0.00 O ATOM 528 CB GLN A 32 110.245 3.364 -0.450 1.00 0.00 C ATOM 529 CG GLN A 32 109.831 4.827 -0.629 1.00 0.00 C ATOM 530 CD GLN A 32 110.488 5.679 0.459 1.00 0.00 C ATOM 531 OE1 GLN A 32 109.828 6.457 1.118 1.00 0.00 O ATOM 532 NE2 GLN A 32 111.769 5.564 0.675 1.00 0.00 N ATOM 0 H GLN A 32 107.775 3.218 -0.244 1.00 0.00 H new ATOM 0 HA GLN A 32 109.648 2.746 -2.416 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.098 3.056 0.585 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.306 3.244 -0.671 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.130 5.183 -1.615 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.746 4.919 -0.573 1.00 0.00 H new ATOM 0 HE21 GLN A 32 112.323 4.910 0.121 1.00 0.00 H new ATOM 0 HE22 GLN A 32 112.217 6.128 1.398 1.00 0.00 H new ATOM 541 N GLY A 33 109.028 0.327 -0.311 1.00 0.00 N ATOM 542 CA GLY A 33 109.312 -1.121 -0.107 1.00 0.00 C ATOM 543 C GLY A 33 108.882 -1.879 -1.358 1.00 0.00 C ATOM 544 O GLY A 33 109.643 -2.633 -1.931 1.00 0.00 O ATOM 0 H GLY A 33 108.277 0.712 0.262 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.374 -1.276 0.083 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.774 -1.493 0.765 1.00 0.00 H new ATOM 548 N THR A 34 107.674 -1.665 -1.807 1.00 0.00 N ATOM 549 CA THR A 34 107.219 -2.358 -3.041 1.00 0.00 C ATOM 550 C THR A 34 108.179 -1.980 -4.167 1.00 0.00 C ATOM 551 O THR A 34 108.303 -2.669 -5.160 1.00 0.00 O ATOM 552 CB THR A 34 105.801 -1.904 -3.396 1.00 0.00 C ATOM 553 OG1 THR A 34 105.698 -0.498 -3.224 1.00 0.00 O ATOM 554 CG2 THR A 34 104.794 -2.607 -2.484 1.00 0.00 C ATOM 0 H THR A 34 106.989 -1.045 -1.375 1.00 0.00 H new ATOM 0 HA THR A 34 107.210 -3.438 -2.892 1.00 0.00 H new ATOM 0 HB THR A 34 105.587 -2.160 -4.434 1.00 0.00 H new ATOM 0 HG1 THR A 34 105.242 -0.304 -2.378 1.00 0.00 H new ATOM 0 HG21 THR A 34 103.785 -2.283 -2.738 1.00 0.00 H new ATOM 0 HG22 THR A 34 104.873 -3.686 -2.618 1.00 0.00 H new ATOM 0 HG23 THR A 34 105.006 -2.354 -1.445 1.00 0.00 H new ATOM 562 N VAL A 35 108.864 -0.881 -4.002 1.00 0.00 N ATOM 563 CA VAL A 35 109.832 -0.427 -5.036 1.00 0.00 C ATOM 564 C VAL A 35 111.098 -1.286 -4.953 1.00 0.00 C ATOM 565 O VAL A 35 111.486 -1.926 -5.910 1.00 0.00 O ATOM 566 CB VAL A 35 110.171 1.044 -4.775 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.655 1.305 -5.034 1.00 0.00 C ATOM 568 CG2 VAL A 35 109.331 1.931 -5.696 1.00 0.00 C ATOM 0 H VAL A 35 108.792 -0.274 -3.186 1.00 0.00 H new ATOM 0 HA VAL A 35 109.402 -0.529 -6.032 1.00 0.00 H new ATOM 0 HB VAL A 35 109.949 1.276 -3.733 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.878 2.355 -4.844 1.00 0.00 H new ATOM 0 HG12 VAL A 35 112.255 0.681 -4.372 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.891 1.066 -6.071 1.00 0.00 H new ATOM 0 HG21 VAL A 35 109.571 2.978 -5.511 1.00 0.00 H new ATOM 0 HG22 VAL A 35 109.550 1.686 -6.735 1.00 0.00 H new ATOM 0 HG23 VAL A 35 108.273 1.761 -5.498 1.00 0.00 H new ATOM 578 N ALA A 36 111.742 -1.317 -3.814 1.00 0.00 N ATOM 579 CA ALA A 36 112.970 -2.148 -3.686 1.00 0.00 C ATOM 580 C ALA A 36 112.680 -3.505 -4.311 1.00 0.00 C ATOM 581 O ALA A 36 113.404 -3.984 -5.160 1.00 0.00 O ATOM 582 CB ALA A 36 113.323 -2.325 -2.208 1.00 0.00 C ATOM 0 H ALA A 36 111.471 -0.806 -2.974 1.00 0.00 H new ATOM 0 HA ALA A 36 113.810 -1.668 -4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.223 -2.934 -2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.500 -1.349 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.498 -2.819 -1.694 1.00 0.00 H new ATOM 588 N VAL A 37 111.606 -4.116 -3.906 1.00 0.00 N ATOM 589 CA VAL A 37 111.236 -5.431 -4.484 1.00 0.00 C ATOM 590 C VAL A 37 111.157 -5.286 -6.000 1.00 0.00 C ATOM 591 O VAL A 37 111.585 -6.152 -6.741 1.00 0.00 O ATOM 592 CB VAL A 37 109.873 -5.868 -3.941 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.704 -7.378 -4.128 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.774 -5.518 -2.450 1.00 0.00 C ATOM 0 H VAL A 37 110.966 -3.759 -3.196 1.00 0.00 H new ATOM 0 HA VAL A 37 111.981 -6.180 -4.215 1.00 0.00 H new ATOM 0 HB VAL A 37 109.085 -5.347 -4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.733 -7.686 -3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.766 -7.622 -5.188 1.00 0.00 H new ATOM 0 HG13 VAL A 37 110.493 -7.902 -3.588 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.803 -5.830 -2.067 1.00 0.00 H new ATOM 0 HG22 VAL A 37 110.563 -6.033 -1.902 1.00 0.00 H new ATOM 0 HG23 VAL A 37 109.886 -4.441 -2.321 1.00 0.00 H new ATOM 604 N CYS A 38 110.635 -4.184 -6.474 1.00 0.00 N ATOM 605 CA CYS A 38 110.564 -3.989 -7.940 1.00 0.00 C ATOM 606 C CYS A 38 111.971 -4.178 -8.487 1.00 0.00 C ATOM 607 O CYS A 38 112.173 -4.675 -9.573 1.00 0.00 O ATOM 608 CB CYS A 38 110.067 -2.576 -8.253 1.00 0.00 C ATOM 609 SG CYS A 38 109.110 -2.600 -9.789 1.00 0.00 S ATOM 0 H CYS A 38 110.260 -3.421 -5.910 1.00 0.00 H new ATOM 0 HA CYS A 38 109.874 -4.700 -8.394 1.00 0.00 H new ATOM 0 HB2 CYS A 38 109.451 -2.206 -7.434 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.912 -1.895 -8.349 1.00 0.00 H new ATOM 0 HG CYS A 38 108.685 -1.400 -10.055 1.00 0.00 H new ATOM 615 N ALA A 39 112.949 -3.778 -7.725 1.00 0.00 N ATOM 616 CA ALA A 39 114.353 -3.937 -8.172 1.00 0.00 C ATOM 617 C ALA A 39 114.825 -5.382 -7.953 1.00 0.00 C ATOM 618 O ALA A 39 115.410 -5.995 -8.823 1.00 0.00 O ATOM 619 CB ALA A 39 115.247 -2.990 -7.378 1.00 0.00 C ATOM 0 H ALA A 39 112.832 -3.346 -6.808 1.00 0.00 H new ATOM 0 HA ALA A 39 114.412 -3.703 -9.235 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.280 -3.105 -7.705 1.00 0.00 H new ATOM 0 HB2 ALA A 39 114.926 -1.962 -7.544 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.174 -3.225 -6.316 1.00 0.00 H new ATOM 625 N ARG A 40 114.604 -5.916 -6.779 1.00 0.00 N ATOM 626 CA ARG A 40 115.079 -7.300 -6.476 1.00 0.00 C ATOM 627 C ARG A 40 114.871 -8.225 -7.681 1.00 0.00 C ATOM 628 O ARG A 40 115.738 -9.004 -8.019 1.00 0.00 O ATOM 629 CB ARG A 40 114.321 -7.847 -5.258 1.00 0.00 C ATOM 630 CG ARG A 40 114.510 -9.365 -5.165 1.00 0.00 C ATOM 631 CD ARG A 40 113.251 -10.074 -5.668 1.00 0.00 C ATOM 632 NE ARG A 40 112.300 -10.261 -4.536 1.00 0.00 N ATOM 633 CZ ARG A 40 111.152 -10.847 -4.739 1.00 0.00 C ATOM 634 NH1 ARG A 40 110.835 -11.266 -5.934 1.00 0.00 N ATOM 635 NH2 ARG A 40 110.319 -11.012 -3.748 1.00 0.00 N ATOM 0 H ARG A 40 114.113 -5.452 -6.015 1.00 0.00 H new ATOM 0 HA ARG A 40 116.146 -7.262 -6.256 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.685 -7.370 -4.348 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.261 -7.608 -5.341 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.372 -9.671 -5.758 1.00 0.00 H new ATOM 0 HG3 ARG A 40 114.714 -9.653 -4.134 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.782 -9.488 -6.458 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.513 -11.040 -6.100 1.00 0.00 H new ATOM 0 HE ARG A 40 112.546 -9.931 -3.603 1.00 0.00 H new ATOM 0 HH11 ARG A 40 111.485 -11.135 -6.709 1.00 0.00 H new ATOM 0 HH12 ARG A 40 109.938 -11.724 -6.092 1.00 0.00 H new ATOM 0 HH21 ARG A 40 110.565 -10.683 -2.815 1.00 0.00 H new ATOM 0 HH22 ARG A 40 109.422 -11.470 -3.907 1.00 0.00 H new ATOM 649 N ILE A 41 113.742 -8.169 -8.329 1.00 0.00 N ATOM 650 CA ILE A 41 113.528 -9.072 -9.502 1.00 0.00 C ATOM 651 C ILE A 41 113.961 -8.393 -10.807 1.00 0.00 C ATOM 652 O ILE A 41 114.201 -9.049 -11.801 1.00 0.00 O ATOM 653 CB ILE A 41 112.052 -9.453 -9.601 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.197 -8.338 -9.000 1.00 0.00 C ATOM 655 CG2 ILE A 41 111.813 -10.755 -8.840 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.554 -7.013 -9.673 1.00 0.00 C ATOM 0 H ILE A 41 112.965 -7.547 -8.104 1.00 0.00 H new ATOM 0 HA ILE A 41 114.134 -9.966 -9.354 1.00 0.00 H new ATOM 0 HB ILE A 41 111.778 -9.591 -10.647 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.139 -8.558 -9.142 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.368 -8.271 -7.925 1.00 0.00 H new ATOM 0 HG21 ILE A 41 110.760 -11.029 -8.909 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.423 -11.547 -9.274 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.085 -10.620 -7.793 1.00 0.00 H new ATOM 0 HD11 ILE A 41 110.947 -6.214 -9.248 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.609 -6.794 -9.508 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.361 -7.085 -10.743 1.00 0.00 H new ATOM 668 N ALA A 42 114.046 -7.091 -10.830 1.00 0.00 N ATOM 669 CA ALA A 42 114.443 -6.401 -12.089 1.00 0.00 C ATOM 670 C ALA A 42 115.967 -6.288 -12.162 1.00 0.00 C ATOM 671 O ALA A 42 116.512 -5.754 -13.107 1.00 0.00 O ATOM 672 CB ALA A 42 113.807 -5.010 -12.132 1.00 0.00 C ATOM 0 H ALA A 42 113.859 -6.478 -10.036 1.00 0.00 H new ATOM 0 HA ALA A 42 114.094 -6.979 -12.945 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.098 -4.505 -13.053 1.00 0.00 H new ATOM 0 HB2 ALA A 42 112.722 -5.105 -12.097 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.148 -4.427 -11.276 1.00 0.00 H new ATOM 678 N VAL A 43 116.657 -6.773 -11.162 1.00 0.00 N ATOM 679 CA VAL A 43 118.150 -6.683 -11.162 1.00 0.00 C ATOM 680 C VAL A 43 118.690 -6.720 -12.596 1.00 0.00 C ATOM 681 O VAL A 43 119.700 -6.122 -12.901 1.00 0.00 O ATOM 682 CB VAL A 43 118.731 -7.839 -10.344 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.694 -8.329 -9.336 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.127 -8.992 -11.264 1.00 0.00 C ATOM 0 H VAL A 43 116.252 -7.228 -10.344 1.00 0.00 H new ATOM 0 HA VAL A 43 118.450 -5.737 -10.710 1.00 0.00 H new ATOM 0 HB VAL A 43 119.616 -7.484 -9.816 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.111 -9.152 -8.756 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.424 -7.513 -8.666 1.00 0.00 H new ATOM 0 HG13 VAL A 43 116.806 -8.673 -9.866 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.539 -9.807 -10.669 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.248 -9.345 -11.804 1.00 0.00 H new ATOM 0 HG23 VAL A 43 119.877 -8.648 -11.976 1.00 0.00 H new ATOM 694 N ALA A 44 118.027 -7.407 -13.480 1.00 0.00 N ATOM 695 CA ALA A 44 118.509 -7.471 -14.889 1.00 0.00 C ATOM 696 C ALA A 44 119.906 -8.094 -14.921 1.00 0.00 C ATOM 697 O ALA A 44 120.336 -8.625 -15.926 1.00 0.00 O ATOM 698 CB ALA A 44 118.566 -6.058 -15.473 1.00 0.00 C ATOM 0 H ALA A 44 117.171 -7.928 -13.290 1.00 0.00 H new ATOM 0 HA ALA A 44 117.826 -8.080 -15.480 1.00 0.00 H new ATOM 0 HB1 ALA A 44 118.918 -6.104 -16.503 1.00 0.00 H new ATOM 0 HB2 ALA A 44 117.571 -5.614 -15.449 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.250 -5.448 -14.883 1.00 0.00 H new ATOM 704 N SER A 45 120.617 -8.034 -13.829 1.00 0.00 N ATOM 705 CA SER A 45 121.982 -8.623 -13.795 1.00 0.00 C ATOM 706 C SER A 45 121.897 -10.121 -14.052 1.00 0.00 C ATOM 707 O SER A 45 121.134 -10.586 -14.875 1.00 0.00 O ATOM 708 CB SER A 45 122.606 -8.395 -12.420 1.00 0.00 C ATOM 709 OG SER A 45 124.021 -8.375 -12.544 1.00 0.00 O ATOM 0 H SER A 45 120.310 -7.601 -12.958 1.00 0.00 H new ATOM 0 HA SER A 45 122.594 -8.148 -14.562 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.253 -7.453 -11.999 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.301 -9.185 -11.734 1.00 0.00 H new ATOM 0 HG SER A 45 124.322 -7.458 -12.713 1.00 0.00 H new ATOM 715 N ASP A 46 122.678 -10.875 -13.342 1.00 0.00 N ATOM 716 CA ASP A 46 122.659 -12.352 -13.520 1.00 0.00 C ATOM 717 C ASP A 46 122.755 -13.025 -12.150 1.00 0.00 C ATOM 718 O ASP A 46 123.641 -13.817 -11.899 1.00 0.00 O ATOM 719 CB ASP A 46 123.848 -12.779 -14.384 1.00 0.00 C ATOM 720 CG ASP A 46 124.082 -11.738 -15.480 1.00 0.00 C ATOM 721 OD1 ASP A 46 123.179 -11.528 -16.273 1.00 0.00 O ATOM 722 OD2 ASP A 46 125.161 -11.169 -15.508 1.00 0.00 O ATOM 0 H ASP A 46 123.334 -10.533 -12.640 1.00 0.00 H new ATOM 0 HA ASP A 46 121.732 -12.650 -14.010 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.741 -12.881 -13.768 1.00 0.00 H new ATOM 0 HB3 ASP A 46 123.655 -13.755 -14.830 1.00 0.00 H new ATOM 727 N GLY A 47 121.854 -12.712 -11.258 1.00 0.00 N ATOM 728 CA GLY A 47 121.906 -13.333 -9.906 1.00 0.00 C ATOM 729 C GLY A 47 120.552 -13.192 -9.209 1.00 0.00 C ATOM 730 O GLY A 47 119.940 -14.166 -8.819 1.00 0.00 O ATOM 0 H GLY A 47 121.088 -12.056 -11.407 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.171 -14.387 -9.992 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.683 -12.856 -9.308 1.00 0.00 H new ATOM 734 N VAL A 48 120.085 -11.987 -9.042 1.00 0.00 N ATOM 735 CA VAL A 48 118.777 -11.781 -8.363 1.00 0.00 C ATOM 736 C VAL A 48 118.926 -12.071 -6.870 1.00 0.00 C ATOM 737 O VAL A 48 119.850 -12.736 -6.445 1.00 0.00 O ATOM 738 CB VAL A 48 117.727 -12.717 -8.967 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.337 -12.100 -8.795 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.016 -12.917 -10.458 1.00 0.00 C ATOM 0 H VAL A 48 120.554 -11.134 -9.347 1.00 0.00 H new ATOM 0 HA VAL A 48 118.458 -10.748 -8.502 1.00 0.00 H new ATOM 0 HB VAL A 48 117.764 -13.681 -8.459 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.588 -12.765 -9.225 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.131 -11.958 -7.734 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.301 -11.137 -9.304 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.268 -13.584 -10.887 1.00 0.00 H new ATOM 0 HG22 VAL A 48 117.980 -11.954 -10.968 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.006 -13.356 -10.581 1.00 0.00 H new ATOM 750 N SER A 49 118.027 -11.570 -6.069 1.00 0.00 N ATOM 751 CA SER A 49 118.122 -11.809 -4.603 1.00 0.00 C ATOM 752 C SER A 49 116.751 -12.197 -4.049 1.00 0.00 C ATOM 753 O SER A 49 116.041 -13.000 -4.621 1.00 0.00 O ATOM 754 CB SER A 49 118.602 -10.533 -3.912 1.00 0.00 C ATOM 755 OG SER A 49 119.587 -9.904 -4.721 1.00 0.00 O ATOM 0 H SER A 49 117.231 -11.006 -6.367 1.00 0.00 H new ATOM 0 HA SER A 49 118.828 -12.619 -4.417 1.00 0.00 H new ATOM 0 HB2 SER A 49 117.763 -9.857 -3.748 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.017 -10.770 -2.932 1.00 0.00 H new ATOM 0 HG SER A 49 119.226 -9.069 -5.086 1.00 0.00 H new ATOM 761 N SER A 50 116.385 -11.632 -2.932 1.00 0.00 N ATOM 762 CA SER A 50 115.072 -11.955 -2.311 1.00 0.00 C ATOM 763 C SER A 50 115.184 -11.706 -0.810 1.00 0.00 C ATOM 764 O SER A 50 114.552 -10.823 -0.265 1.00 0.00 O ATOM 765 CB SER A 50 114.726 -13.423 -2.562 1.00 0.00 C ATOM 766 OG SER A 50 113.996 -13.533 -3.776 1.00 0.00 O ATOM 0 H SER A 50 116.947 -10.953 -2.418 1.00 0.00 H new ATOM 0 HA SER A 50 114.289 -11.332 -2.743 1.00 0.00 H new ATOM 0 HB2 SER A 50 115.637 -14.019 -2.617 1.00 0.00 H new ATOM 0 HB3 SER A 50 114.137 -13.816 -1.733 1.00 0.00 H new ATOM 0 HG SER A 50 114.604 -13.412 -4.535 1.00 0.00 H new ATOM 772 N GLU A 51 115.999 -12.473 -0.142 1.00 0.00 N ATOM 773 CA GLU A 51 116.174 -12.280 1.321 1.00 0.00 C ATOM 774 C GLU A 51 116.967 -10.995 1.574 1.00 0.00 C ATOM 775 O GLU A 51 116.759 -10.315 2.556 1.00 0.00 O ATOM 776 CB GLU A 51 116.936 -13.472 1.905 1.00 0.00 C ATOM 777 CG GLU A 51 115.981 -14.654 2.080 1.00 0.00 C ATOM 778 CD GLU A 51 115.335 -14.992 0.735 1.00 0.00 C ATOM 779 OE1 GLU A 51 116.068 -15.160 -0.226 1.00 0.00 O ATOM 780 OE2 GLU A 51 114.119 -15.078 0.689 1.00 0.00 O ATOM 0 H GLU A 51 116.552 -13.227 -0.549 1.00 0.00 H new ATOM 0 HA GLU A 51 115.197 -12.204 1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 51 117.758 -13.750 1.245 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.375 -13.201 2.865 1.00 0.00 H new ATOM 0 HG2 GLU A 51 116.522 -15.519 2.463 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.213 -14.409 2.813 1.00 0.00 H new ATOM 787 N GLU A 52 117.882 -10.660 0.701 1.00 0.00 N ATOM 788 CA GLU A 52 118.690 -9.421 0.907 1.00 0.00 C ATOM 789 C GLU A 52 117.820 -8.184 0.673 1.00 0.00 C ATOM 790 O GLU A 52 117.750 -7.302 1.507 1.00 0.00 O ATOM 791 CB GLU A 52 119.862 -9.408 -0.076 1.00 0.00 C ATOM 792 CG GLU A 52 121.160 -9.754 0.659 1.00 0.00 C ATOM 793 CD GLU A 52 121.139 -11.228 1.068 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.650 -12.032 0.290 1.00 0.00 O ATOM 795 OE2 GLU A 52 121.613 -11.529 2.151 1.00 0.00 O ATOM 0 H GLU A 52 118.104 -11.189 -0.143 1.00 0.00 H new ATOM 0 HA GLU A 52 119.066 -9.407 1.930 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.685 -10.126 -0.877 1.00 0.00 H new ATOM 0 HB3 GLU A 52 119.947 -8.426 -0.541 1.00 0.00 H new ATOM 0 HG2 GLU A 52 122.018 -9.556 0.016 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.270 -9.123 1.541 1.00 0.00 H new ATOM 802 N LYS A 53 117.146 -8.107 -0.444 1.00 0.00 N ATOM 803 CA LYS A 53 116.281 -6.918 -0.691 1.00 0.00 C ATOM 804 C LYS A 53 115.279 -6.831 0.456 1.00 0.00 C ATOM 805 O LYS A 53 114.921 -5.761 0.909 1.00 0.00 O ATOM 806 CB LYS A 53 115.569 -7.063 -2.051 1.00 0.00 C ATOM 807 CG LYS A 53 114.069 -6.737 -1.940 1.00 0.00 C ATOM 808 CD LYS A 53 113.263 -8.041 -1.924 1.00 0.00 C ATOM 809 CE LYS A 53 111.975 -7.848 -1.122 1.00 0.00 C ATOM 810 NZ LYS A 53 110.863 -8.589 -1.783 1.00 0.00 N ATOM 0 H LYS A 53 117.156 -8.806 -1.187 1.00 0.00 H new ATOM 0 HA LYS A 53 116.872 -6.003 -0.730 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.034 -6.398 -2.779 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.695 -8.080 -2.422 1.00 0.00 H new ATOM 0 HG2 LYS A 53 113.876 -6.166 -1.032 1.00 0.00 H new ATOM 0 HG3 LYS A 53 113.758 -6.115 -2.779 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.025 -8.344 -2.944 1.00 0.00 H new ATOM 0 HD3 LYS A 53 113.859 -8.841 -1.485 1.00 0.00 H new ATOM 0 HE2 LYS A 53 112.111 -8.209 -0.102 1.00 0.00 H new ATOM 0 HE3 LYS A 53 111.731 -6.788 -1.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 110.022 -7.979 -1.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 111.152 -8.864 -2.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 110.638 -9.442 -1.232 1.00 0.00 H new ATOM 824 N GLN A 54 114.840 -7.957 0.942 1.00 0.00 N ATOM 825 CA GLN A 54 113.877 -7.957 2.075 1.00 0.00 C ATOM 826 C GLN A 54 114.447 -7.101 3.215 1.00 0.00 C ATOM 827 O GLN A 54 113.747 -6.309 3.821 1.00 0.00 O ATOM 828 CB GLN A 54 113.645 -9.407 2.530 1.00 0.00 C ATOM 829 CG GLN A 54 114.294 -9.663 3.894 1.00 0.00 C ATOM 830 CD GLN A 54 113.512 -8.926 4.984 1.00 0.00 C ATOM 831 OE1 GLN A 54 112.563 -8.224 4.698 1.00 0.00 O ATOM 832 NE2 GLN A 54 113.875 -9.057 6.231 1.00 0.00 N ATOM 0 H GLN A 54 115.108 -8.880 0.602 1.00 0.00 H new ATOM 0 HA GLN A 54 112.921 -7.532 1.770 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.575 -9.607 2.589 1.00 0.00 H new ATOM 0 HB3 GLN A 54 114.058 -10.094 1.792 1.00 0.00 H new ATOM 0 HG2 GLN A 54 114.310 -10.732 4.105 1.00 0.00 H new ATOM 0 HG3 GLN A 54 115.330 -9.324 3.884 1.00 0.00 H new ATOM 0 HE21 GLN A 54 114.672 -9.647 6.471 1.00 0.00 H new ATOM 0 HE22 GLN A 54 113.362 -8.570 6.965 1.00 0.00 H new ATOM 841 N LYS A 55 115.717 -7.235 3.499 1.00 0.00 N ATOM 842 CA LYS A 55 116.323 -6.412 4.583 1.00 0.00 C ATOM 843 C LYS A 55 116.236 -4.945 4.174 1.00 0.00 C ATOM 844 O LYS A 55 115.933 -4.080 4.971 1.00 0.00 O ATOM 845 CB LYS A 55 117.792 -6.799 4.781 1.00 0.00 C ATOM 846 CG LYS A 55 117.946 -8.318 4.688 1.00 0.00 C ATOM 847 CD LYS A 55 117.223 -8.983 5.862 1.00 0.00 C ATOM 848 CE LYS A 55 117.850 -8.519 7.178 1.00 0.00 C ATOM 849 NZ LYS A 55 117.108 -7.332 7.690 1.00 0.00 N ATOM 0 H LYS A 55 116.356 -7.876 3.029 1.00 0.00 H new ATOM 0 HA LYS A 55 115.789 -6.581 5.518 1.00 0.00 H new ATOM 0 HB2 LYS A 55 118.410 -6.315 4.025 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.142 -6.448 5.752 1.00 0.00 H new ATOM 0 HG2 LYS A 55 117.535 -8.678 3.745 1.00 0.00 H new ATOM 0 HG3 LYS A 55 119.002 -8.587 4.699 1.00 0.00 H new ATOM 0 HD2 LYS A 55 116.164 -8.727 5.842 1.00 0.00 H new ATOM 0 HD3 LYS A 55 117.291 -10.068 5.777 1.00 0.00 H new ATOM 0 HE2 LYS A 55 117.820 -9.325 7.912 1.00 0.00 H new ATOM 0 HE3 LYS A 55 118.899 -8.267 7.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 117.020 -7.397 8.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 117.625 -6.465 7.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 116.160 -7.305 7.263 1.00 0.00 H new ATOM 863 N MET A 56 116.496 -4.664 2.927 1.00 0.00 N ATOM 864 CA MET A 56 116.425 -3.259 2.450 1.00 0.00 C ATOM 865 C MET A 56 115.068 -2.658 2.831 1.00 0.00 C ATOM 866 O MET A 56 114.994 -1.566 3.355 1.00 0.00 O ATOM 867 CB MET A 56 116.584 -3.236 0.929 1.00 0.00 C ATOM 868 CG MET A 56 116.714 -1.791 0.446 1.00 0.00 C ATOM 869 SD MET A 56 118.315 -1.568 -0.372 1.00 0.00 S ATOM 870 CE MET A 56 118.504 0.205 -0.049 1.00 0.00 C ATOM 0 H MET A 56 116.755 -5.350 2.218 1.00 0.00 H new ATOM 0 HA MET A 56 117.221 -2.675 2.911 1.00 0.00 H new ATOM 0 HB2 MET A 56 117.465 -3.808 0.637 1.00 0.00 H new ATOM 0 HB3 MET A 56 115.724 -3.712 0.457 1.00 0.00 H new ATOM 0 HG2 MET A 56 115.905 -1.553 -0.244 1.00 0.00 H new ATOM 0 HG3 MET A 56 116.626 -1.105 1.289 1.00 0.00 H new ATOM 0 HE1 MET A 56 119.551 0.486 -0.162 1.00 0.00 H new ATOM 0 HE2 MET A 56 117.898 0.770 -0.757 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.177 0.427 0.967 1.00 0.00 H new ATOM 880 N ILE A 57 113.991 -3.355 2.583 1.00 0.00 N ATOM 881 CA ILE A 57 112.662 -2.789 2.953 1.00 0.00 C ATOM 882 C ILE A 57 112.677 -2.437 4.441 1.00 0.00 C ATOM 883 O ILE A 57 112.267 -1.364 4.837 1.00 0.00 O ATOM 884 CB ILE A 57 111.549 -3.803 2.669 1.00 0.00 C ATOM 885 CG1 ILE A 57 111.974 -4.725 1.523 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.262 -3.062 2.275 1.00 0.00 C ATOM 887 CD1 ILE A 57 110.786 -5.597 1.099 1.00 0.00 C ATOM 0 H ILE A 57 113.973 -4.277 2.147 1.00 0.00 H new ATOM 0 HA ILE A 57 112.470 -1.896 2.359 1.00 0.00 H new ATOM 0 HB ILE A 57 111.367 -4.396 3.565 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.324 -4.133 0.677 1.00 0.00 H new ATOM 0 HG13 ILE A 57 112.806 -5.354 1.838 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.472 -3.786 2.074 1.00 0.00 H new ATOM 0 HG22 ILE A 57 109.955 -2.407 3.091 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.444 -2.466 1.381 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.089 -6.253 0.283 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.456 -6.199 1.946 1.00 0.00 H new ATOM 0 HD13 ILE A 57 109.967 -4.959 0.766 1.00 0.00 H new ATOM 899 N GLY A 58 113.165 -3.317 5.274 1.00 0.00 N ATOM 900 CA GLY A 58 113.219 -2.991 6.729 1.00 0.00 C ATOM 901 C GLY A 58 113.946 -1.654 6.886 1.00 0.00 C ATOM 902 O GLY A 58 113.518 -0.763 7.606 1.00 0.00 O ATOM 0 H GLY A 58 113.524 -4.236 5.015 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.213 -2.929 7.143 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.741 -3.776 7.276 1.00 0.00 H new ATOM 906 N PHE A 59 115.035 -1.499 6.186 1.00 0.00 N ATOM 907 CA PHE A 59 115.786 -0.224 6.257 1.00 0.00 C ATOM 908 C PHE A 59 114.822 0.907 5.914 1.00 0.00 C ATOM 909 O PHE A 59 114.819 1.949 6.536 1.00 0.00 O ATOM 910 CB PHE A 59 116.938 -0.268 5.249 1.00 0.00 C ATOM 911 CG PHE A 59 117.015 1.033 4.490 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.608 2.146 5.083 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.506 1.121 3.190 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.694 3.352 4.380 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.589 2.325 2.486 1.00 0.00 C ATOM 916 CZ PHE A 59 117.183 3.440 3.079 1.00 0.00 C ATOM 0 H PHE A 59 115.435 -2.205 5.567 1.00 0.00 H new ATOM 0 HA PHE A 59 116.200 -0.066 7.253 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.879 -0.451 5.768 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.792 -1.095 4.554 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.002 2.077 6.086 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.048 0.258 2.730 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.154 4.214 4.840 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.194 2.393 1.483 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.249 4.371 2.535 1.00 0.00 H new ATOM 926 N LEU A 60 113.983 0.693 4.939 1.00 0.00 N ATOM 927 CA LEU A 60 112.994 1.736 4.567 1.00 0.00 C ATOM 928 C LEU A 60 112.217 2.120 5.823 1.00 0.00 C ATOM 929 O LEU A 60 111.982 3.281 6.092 1.00 0.00 O ATOM 930 CB LEU A 60 112.033 1.164 3.517 1.00 0.00 C ATOM 931 CG LEU A 60 112.079 1.974 2.210 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.515 2.407 1.881 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.562 1.087 1.079 1.00 0.00 C ATOM 0 H LEU A 60 113.942 -0.162 4.384 1.00 0.00 H new ATOM 0 HA LEU A 60 113.493 2.612 4.153 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.293 0.125 3.312 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.017 1.166 3.912 1.00 0.00 H new ATOM 0 HG LEU A 60 111.465 2.868 2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.519 2.978 0.952 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.902 3.027 2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.144 1.524 1.767 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.586 1.642 0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.193 0.202 0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.538 0.783 1.294 1.00 0.00 H new ATOM 945 N ARG A 61 111.829 1.148 6.606 1.00 0.00 N ATOM 946 CA ARG A 61 111.080 1.454 7.853 1.00 0.00 C ATOM 947 C ARG A 61 111.827 2.542 8.620 1.00 0.00 C ATOM 948 O ARG A 61 111.230 3.435 9.188 1.00 0.00 O ATOM 949 CB ARG A 61 110.981 0.195 8.715 1.00 0.00 C ATOM 950 CG ARG A 61 110.396 -0.948 7.884 1.00 0.00 C ATOM 951 CD ARG A 61 110.407 -2.237 8.707 1.00 0.00 C ATOM 952 NE ARG A 61 109.391 -2.142 9.792 1.00 0.00 N ATOM 953 CZ ARG A 61 109.007 -3.219 10.422 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.512 -4.378 10.099 1.00 0.00 N ATOM 955 NH2 ARG A 61 108.119 -3.136 11.375 1.00 0.00 N ATOM 0 H ARG A 61 112.000 0.157 6.433 1.00 0.00 H new ATOM 0 HA ARG A 61 110.075 1.797 7.607 1.00 0.00 H new ATOM 0 HB2 ARG A 61 111.967 -0.081 9.089 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.352 0.385 9.585 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.377 -0.707 7.581 1.00 0.00 H new ATOM 0 HG3 ARG A 61 110.977 -1.082 6.971 1.00 0.00 H new ATOM 0 HD2 ARG A 61 110.192 -3.092 8.066 1.00 0.00 H new ATOM 0 HD3 ARG A 61 111.397 -2.400 9.134 1.00 0.00 H new ATOM 0 HE ARG A 61 108.995 -1.236 10.043 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.206 -4.442 9.355 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.212 -5.220 10.591 1.00 0.00 H new ATOM 0 HH21 ARG A 61 107.725 -2.230 11.627 1.00 0.00 H new ATOM 0 HH22 ARG A 61 107.819 -3.977 11.867 1.00 0.00 H new ATOM 969 N SER A 62 113.131 2.480 8.639 1.00 0.00 N ATOM 970 CA SER A 62 113.908 3.524 9.370 1.00 0.00 C ATOM 971 C SER A 62 114.704 4.380 8.374 1.00 0.00 C ATOM 972 O SER A 62 115.468 5.239 8.761 1.00 0.00 O ATOM 973 CB SER A 62 114.869 2.845 10.346 1.00 0.00 C ATOM 974 OG SER A 62 115.825 2.089 9.615 1.00 0.00 O ATOM 0 H SER A 62 113.689 1.758 8.184 1.00 0.00 H new ATOM 0 HA SER A 62 113.220 4.167 9.919 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.372 3.593 10.959 1.00 0.00 H new ATOM 0 HB3 SER A 62 114.317 2.195 11.025 1.00 0.00 H new ATOM 0 HG SER A 62 116.635 1.976 10.155 1.00 0.00 H new ATOM 980 N SER A 63 114.539 4.140 7.099 1.00 0.00 N ATOM 981 CA SER A 63 115.298 4.921 6.070 1.00 0.00 C ATOM 982 C SER A 63 115.410 6.394 6.461 1.00 0.00 C ATOM 983 O SER A 63 114.909 6.824 7.476 1.00 0.00 O ATOM 984 CB SER A 63 114.592 4.824 4.723 1.00 0.00 C ATOM 985 OG SER A 63 114.702 6.069 4.046 1.00 0.00 O ATOM 0 H SER A 63 113.908 3.433 6.722 1.00 0.00 H new ATOM 0 HA SER A 63 116.300 4.497 6.004 1.00 0.00 H new ATOM 0 HB2 SER A 63 115.036 4.030 4.123 1.00 0.00 H new ATOM 0 HB3 SER A 63 113.543 4.566 4.867 1.00 0.00 H new ATOM 0 HG SER A 63 114.005 6.131 3.360 1.00 0.00 H new ATOM 991 N GLU A 64 116.070 7.172 5.642 1.00 0.00 N ATOM 992 CA GLU A 64 116.231 8.620 5.942 1.00 0.00 C ATOM 993 C GLU A 64 114.861 9.297 5.963 1.00 0.00 C ATOM 994 O GLU A 64 114.707 10.383 6.486 1.00 0.00 O ATOM 995 CB GLU A 64 117.115 9.264 4.872 1.00 0.00 C ATOM 996 CG GLU A 64 117.393 10.725 5.242 1.00 0.00 C ATOM 997 CD GLU A 64 118.902 10.945 5.374 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.548 10.120 5.999 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.385 11.934 4.849 1.00 0.00 O ATOM 0 H GLU A 64 116.506 6.861 4.774 1.00 0.00 H new ATOM 0 HA GLU A 64 116.701 8.741 6.918 1.00 0.00 H new ATOM 0 HB2 GLU A 64 118.053 8.716 4.784 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.623 9.212 3.901 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.984 11.388 4.479 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.896 10.974 6.180 1.00 0.00 H new ATOM 1006 N GLU A 65 113.860 8.665 5.410 1.00 0.00 N ATOM 1007 CA GLU A 65 112.503 9.281 5.419 1.00 0.00 C ATOM 1008 C GLU A 65 112.246 9.871 6.806 1.00 0.00 C ATOM 1009 O GLU A 65 111.347 10.663 7.002 1.00 0.00 O ATOM 1010 CB GLU A 65 111.449 8.211 5.118 1.00 0.00 C ATOM 1011 CG GLU A 65 111.308 8.016 3.602 1.00 0.00 C ATOM 1012 CD GLU A 65 111.667 6.575 3.233 1.00 0.00 C ATOM 1013 OE1 GLU A 65 110.804 5.721 3.352 1.00 0.00 O ATOM 1014 OE2 GLU A 65 112.799 6.350 2.838 1.00 0.00 O ATOM 0 H GLU A 65 113.923 7.754 4.955 1.00 0.00 H new ATOM 0 HA GLU A 65 112.444 10.062 4.661 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.732 7.269 5.588 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.490 8.505 5.545 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.287 8.238 3.290 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.961 8.711 3.074 1.00 0.00 H new ATOM 1021 N LEU A 66 113.043 9.490 7.767 1.00 0.00 N ATOM 1022 CA LEU A 66 112.864 10.027 9.146 1.00 0.00 C ATOM 1023 C LEU A 66 112.743 11.548 9.067 1.00 0.00 C ATOM 1024 O LEU A 66 112.136 12.183 9.906 1.00 0.00 O ATOM 1025 CB LEU A 66 114.081 9.659 10.007 1.00 0.00 C ATOM 1026 CG LEU A 66 114.354 8.154 9.913 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.864 7.908 9.829 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.803 7.452 11.155 1.00 0.00 C ATOM 0 H LEU A 66 113.812 8.829 7.656 1.00 0.00 H new ATOM 0 HA LEU A 66 111.966 9.601 9.594 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.956 10.217 9.673 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.901 9.940 11.045 1.00 0.00 H new ATOM 0 HG LEU A 66 113.867 7.759 9.021 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.055 6.837 9.762 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.265 8.404 8.945 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.348 8.308 10.720 1.00 0.00 H new ATOM 0 HD21 LEU A 66 113.999 6.382 11.085 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.289 7.852 12.045 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.728 7.621 11.222 1.00 0.00 H new ATOM 1040 N LYS A 67 113.323 12.132 8.056 1.00 0.00 N ATOM 1041 CA LYS A 67 113.256 13.611 7.898 1.00 0.00 C ATOM 1042 C LYS A 67 111.881 14.010 7.359 1.00 0.00 C ATOM 1043 O LYS A 67 111.241 14.894 7.889 1.00 0.00 O ATOM 1044 CB LYS A 67 114.337 14.063 6.917 1.00 0.00 C ATOM 1045 CG LYS A 67 114.444 13.048 5.774 1.00 0.00 C ATOM 1046 CD LYS A 67 114.244 13.753 4.435 1.00 0.00 C ATOM 1047 CE LYS A 67 113.978 12.706 3.353 1.00 0.00 C ATOM 1048 NZ LYS A 67 115.184 11.847 3.181 1.00 0.00 N ATOM 0 H LYS A 67 113.844 11.644 7.327 1.00 0.00 H new ATOM 0 HA LYS A 67 113.416 14.087 8.866 1.00 0.00 H new ATOM 0 HB2 LYS A 67 114.095 15.049 6.521 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.295 14.152 7.430 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.419 12.562 5.797 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.695 12.266 5.899 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.408 14.449 4.498 1.00 0.00 H new ATOM 0 HD3 LYS A 67 115.128 14.338 4.183 1.00 0.00 H new ATOM 0 HE2 LYS A 67 113.119 12.094 3.629 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.731 13.196 2.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 115.114 11.325 2.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 116.036 12.443 3.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 115.245 11.172 3.970 1.00 0.00 H new ATOM 1062 N VAL A 68 111.427 13.371 6.306 1.00 0.00 N ATOM 1063 CA VAL A 68 110.093 13.716 5.731 1.00 0.00 C ATOM 1064 C VAL A 68 110.252 14.889 4.761 1.00 0.00 C ATOM 1065 O VAL A 68 109.503 15.840 4.817 1.00 0.00 O ATOM 1066 CB VAL A 68 109.135 14.114 6.869 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.687 14.086 6.378 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.292 13.135 8.041 1.00 0.00 C ATOM 0 H VAL A 68 111.926 12.625 5.821 1.00 0.00 H new ATOM 0 HA VAL A 68 109.686 12.856 5.200 1.00 0.00 H new ATOM 0 HB VAL A 68 109.381 15.124 7.197 1.00 0.00 H new ATOM 0 HG11 VAL A 68 107.021 14.369 7.193 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.569 14.788 5.552 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.437 13.081 6.038 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.613 13.418 8.845 1.00 0.00 H new ATOM 0 HG22 VAL A 68 109.056 12.125 7.706 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.319 13.165 8.405 1.00 0.00 H new ATOM 1078 N PHE A 69 111.218 14.834 3.868 1.00 0.00 N ATOM 1079 CA PHE A 69 111.401 15.976 2.915 1.00 0.00 C ATOM 1080 C PHE A 69 112.467 15.679 1.847 1.00 0.00 C ATOM 1081 O PHE A 69 112.181 15.677 0.666 1.00 0.00 O ATOM 1082 CB PHE A 69 111.841 17.221 3.691 1.00 0.00 C ATOM 1083 CG PHE A 69 110.687 17.769 4.493 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.624 18.411 3.847 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.682 17.637 5.887 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.555 18.919 4.595 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.615 18.146 6.635 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.551 18.787 5.990 1.00 0.00 C ATOM 0 H PHE A 69 111.875 14.062 3.760 1.00 0.00 H new ATOM 0 HA PHE A 69 110.445 16.134 2.416 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.669 16.971 4.355 1.00 0.00 H new ATOM 0 HB3 PHE A 69 112.205 17.980 2.999 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.628 18.514 2.772 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.502 17.142 6.385 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.734 19.413 4.097 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.612 18.044 7.710 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.727 19.180 6.567 1.00 0.00 H new ATOM 1098 N ASP A 70 113.699 15.479 2.238 1.00 0.00 N ATOM 1099 CA ASP A 70 114.773 15.245 1.222 1.00 0.00 C ATOM 1100 C ASP A 70 114.324 14.209 0.191 1.00 0.00 C ATOM 1101 O ASP A 70 114.600 13.026 0.303 1.00 0.00 O ATOM 1102 CB ASP A 70 116.055 14.769 1.906 1.00 0.00 C ATOM 1103 CG ASP A 70 117.213 14.823 0.908 1.00 0.00 C ATOM 1104 OD1 ASP A 70 117.022 14.382 -0.214 1.00 0.00 O ATOM 1105 OD2 ASP A 70 118.270 15.303 1.282 1.00 0.00 O ATOM 0 H ASP A 70 114.008 15.467 3.210 1.00 0.00 H new ATOM 0 HA ASP A 70 114.969 16.187 0.711 1.00 0.00 H new ATOM 0 HB2 ASP A 70 116.275 15.397 2.769 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.927 13.752 2.276 1.00 0.00 H new ATOM 1110 N THR A 71 113.650 14.659 -0.829 1.00 0.00 N ATOM 1111 CA THR A 71 113.188 13.733 -1.896 1.00 0.00 C ATOM 1112 C THR A 71 114.407 13.162 -2.618 1.00 0.00 C ATOM 1113 O THR A 71 114.413 12.026 -3.048 1.00 0.00 O ATOM 1114 CB THR A 71 112.322 14.504 -2.895 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.919 14.442 -4.182 1.00 0.00 O ATOM 1116 CG2 THR A 71 112.208 15.966 -2.459 1.00 0.00 C ATOM 0 H THR A 71 113.398 15.637 -0.969 1.00 0.00 H new ATOM 0 HA THR A 71 112.604 12.924 -1.458 1.00 0.00 H new ATOM 0 HB THR A 71 111.328 14.059 -2.929 1.00 0.00 H new ATOM 0 HG1 THR A 71 113.349 15.299 -4.385 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.591 16.511 -3.173 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.751 16.016 -1.471 1.00 0.00 H new ATOM 0 HG23 THR A 71 113.201 16.413 -2.422 1.00 0.00 H new ATOM 1124 N ALA A 72 115.443 13.944 -2.750 1.00 0.00 N ATOM 1125 CA ALA A 72 116.665 13.450 -3.439 1.00 0.00 C ATOM 1126 C ALA A 72 117.222 12.254 -2.670 1.00 0.00 C ATOM 1127 O ALA A 72 117.861 11.387 -3.230 1.00 0.00 O ATOM 1128 CB ALA A 72 117.714 14.564 -3.484 1.00 0.00 C ATOM 0 H ALA A 72 115.495 14.904 -2.410 1.00 0.00 H new ATOM 0 HA ALA A 72 116.417 13.150 -4.457 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.609 14.201 -3.989 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.313 15.420 -4.027 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.968 14.866 -2.468 1.00 0.00 H new ATOM 1134 N GLU A 73 116.978 12.201 -1.389 1.00 0.00 N ATOM 1135 CA GLU A 73 117.487 11.060 -0.578 1.00 0.00 C ATOM 1136 C GLU A 73 116.623 9.825 -0.843 1.00 0.00 C ATOM 1137 O GLU A 73 117.105 8.707 -0.862 1.00 0.00 O ATOM 1138 CB GLU A 73 117.417 11.420 0.907 1.00 0.00 C ATOM 1139 CG GLU A 73 118.595 12.325 1.270 1.00 0.00 C ATOM 1140 CD GLU A 73 119.812 11.465 1.616 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.708 10.669 2.534 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.827 11.618 0.957 1.00 0.00 O ATOM 0 H GLU A 73 116.447 12.900 -0.869 1.00 0.00 H new ATOM 0 HA GLU A 73 118.520 10.849 -0.853 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.476 11.925 1.125 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.441 10.514 1.513 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.829 12.987 0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.332 12.960 2.116 1.00 0.00 H new ATOM 1149 N VAL A 74 115.348 10.016 -1.053 1.00 0.00 N ATOM 1150 CA VAL A 74 114.463 8.849 -1.319 1.00 0.00 C ATOM 1151 C VAL A 74 114.863 8.222 -2.657 1.00 0.00 C ATOM 1152 O VAL A 74 115.295 7.081 -2.725 1.00 0.00 O ATOM 1153 CB VAL A 74 113.010 9.321 -1.377 1.00 0.00 C ATOM 1154 CG1 VAL A 74 112.072 8.124 -1.208 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.749 10.327 -0.251 1.00 0.00 C ATOM 0 H VAL A 74 114.885 10.925 -1.052 1.00 0.00 H new ATOM 0 HA VAL A 74 114.565 8.109 -0.525 1.00 0.00 H new ATOM 0 HB VAL A 74 112.828 9.795 -2.341 1.00 0.00 H new ATOM 0 HG11 VAL A 74 111.037 8.464 -1.250 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.251 7.406 -2.008 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.259 7.648 -0.245 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.713 10.662 -0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.936 9.852 0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.412 11.184 -0.368 1.00 0.00 H new ATOM 1165 N ILE A 75 114.749 8.964 -3.723 1.00 0.00 N ATOM 1166 CA ILE A 75 115.152 8.413 -5.042 1.00 0.00 C ATOM 1167 C ILE A 75 116.570 7.876 -4.908 1.00 0.00 C ATOM 1168 O ILE A 75 116.994 7.021 -5.649 1.00 0.00 O ATOM 1169 CB ILE A 75 115.124 9.513 -6.105 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.875 10.746 -5.583 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.672 9.885 -6.422 1.00 0.00 C ATOM 1172 CD1 ILE A 75 117.054 11.058 -6.507 1.00 0.00 C ATOM 0 H ILE A 75 114.397 9.921 -3.736 1.00 0.00 H new ATOM 0 HA ILE A 75 114.464 7.623 -5.343 1.00 0.00 H new ATOM 0 HB ILE A 75 115.607 9.154 -7.014 1.00 0.00 H new ATOM 0 HG12 ILE A 75 115.201 11.601 -5.535 1.00 0.00 H new ATOM 0 HG13 ILE A 75 116.232 10.565 -4.569 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.654 10.669 -7.179 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.145 9.007 -6.796 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.182 10.244 -5.517 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.586 11.934 -6.135 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.732 10.205 -6.532 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.685 11.258 -7.513 1.00 0.00 H new ATOM 1184 N GLU A 76 117.309 8.378 -3.960 1.00 0.00 N ATOM 1185 CA GLU A 76 118.702 7.894 -3.774 1.00 0.00 C ATOM 1186 C GLU A 76 118.675 6.399 -3.472 1.00 0.00 C ATOM 1187 O GLU A 76 119.469 5.642 -3.994 1.00 0.00 O ATOM 1188 CB GLU A 76 119.361 8.636 -2.611 1.00 0.00 C ATOM 1189 CG GLU A 76 120.880 8.626 -2.795 1.00 0.00 C ATOM 1190 CD GLU A 76 121.266 9.595 -3.914 1.00 0.00 C ATOM 1191 OE1 GLU A 76 121.226 9.187 -5.064 1.00 0.00 O ATOM 1192 OE2 GLU A 76 121.593 10.728 -3.604 1.00 0.00 O ATOM 0 H GLU A 76 117.008 9.102 -3.307 1.00 0.00 H new ATOM 0 HA GLU A 76 119.274 8.079 -4.684 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.996 9.662 -2.567 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.095 8.162 -1.666 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.371 8.913 -1.865 1.00 0.00 H new ATOM 0 HG3 GLU A 76 121.221 7.619 -3.038 1.00 0.00 H new ATOM 1199 N PHE A 77 117.772 5.954 -2.635 1.00 0.00 N ATOM 1200 CA PHE A 77 117.732 4.501 -2.329 1.00 0.00 C ATOM 1201 C PHE A 77 117.225 3.739 -3.556 1.00 0.00 C ATOM 1202 O PHE A 77 117.921 2.901 -4.090 1.00 0.00 O ATOM 1203 CB PHE A 77 116.819 4.245 -1.126 1.00 0.00 C ATOM 1204 CG PHE A 77 115.492 3.689 -1.586 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.380 2.338 -1.937 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.375 4.526 -1.660 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.147 1.825 -2.358 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.144 4.015 -2.083 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.029 2.665 -2.431 1.00 0.00 C ATOM 0 H PHE A 77 117.074 6.526 -2.160 1.00 0.00 H new ATOM 0 HA PHE A 77 118.735 4.152 -2.082 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.297 3.545 -0.440 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.662 5.173 -0.576 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.244 1.692 -1.883 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.463 5.568 -1.390 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.058 0.783 -2.626 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.282 4.663 -2.141 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.078 2.270 -2.756 1.00 0.00 H new ATOM 1219 N PHE A 78 116.032 4.014 -4.028 1.00 0.00 N ATOM 1220 CA PHE A 78 115.554 3.263 -5.228 1.00 0.00 C ATOM 1221 C PHE A 78 116.543 3.469 -6.377 1.00 0.00 C ATOM 1222 O PHE A 78 116.889 2.549 -7.080 1.00 0.00 O ATOM 1223 CB PHE A 78 114.170 3.755 -5.664 1.00 0.00 C ATOM 1224 CG PHE A 78 113.539 2.775 -6.651 1.00 0.00 C ATOM 1225 CD1 PHE A 78 114.158 1.548 -6.960 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.315 3.097 -7.253 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.552 0.661 -7.860 1.00 0.00 C ATOM 1228 CE2 PHE A 78 111.714 2.207 -8.153 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.332 0.991 -8.456 1.00 0.00 C ATOM 0 H PHE A 78 115.386 4.705 -3.647 1.00 0.00 H new ATOM 0 HA PHE A 78 115.484 2.206 -4.972 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.526 3.867 -4.792 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.256 4.739 -6.125 1.00 0.00 H new ATOM 0 HD1 PHE A 78 115.102 1.290 -6.502 1.00 0.00 H new ATOM 0 HD2 PHE A 78 111.833 4.035 -7.022 1.00 0.00 H new ATOM 0 HE1 PHE A 78 114.029 -0.279 -8.093 1.00 0.00 H new ATOM 0 HE2 PHE A 78 110.771 2.461 -8.614 1.00 0.00 H new ATOM 0 HZ PHE A 78 111.867 0.307 -9.150 1.00 0.00 H new ATOM 1239 N ASN A 79 117.000 4.674 -6.569 1.00 0.00 N ATOM 1240 CA ASN A 79 117.967 4.942 -7.676 1.00 0.00 C ATOM 1241 C ASN A 79 119.127 3.957 -7.592 1.00 0.00 C ATOM 1242 O ASN A 79 119.447 3.275 -8.545 1.00 0.00 O ATOM 1243 CB ASN A 79 118.519 6.364 -7.546 1.00 0.00 C ATOM 1244 CG ASN A 79 119.598 6.591 -8.607 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.983 5.674 -9.304 1.00 0.00 O ATOM 1246 ND2 ASN A 79 120.104 7.784 -8.761 1.00 0.00 N ATOM 0 H ASN A 79 116.747 5.488 -6.008 1.00 0.00 H new ATOM 0 HA ASN A 79 117.453 4.830 -8.631 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.715 7.090 -7.668 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.936 6.514 -6.550 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.823 7.946 -9.467 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.781 8.554 -8.176 1.00 0.00 H new ATOM 1253 N LYS A 80 119.767 3.884 -6.464 1.00 0.00 N ATOM 1254 CA LYS A 80 120.912 2.950 -6.326 1.00 0.00 C ATOM 1255 C LYS A 80 120.420 1.511 -6.482 1.00 0.00 C ATOM 1256 O LYS A 80 121.098 0.674 -7.040 1.00 0.00 O ATOM 1257 CB LYS A 80 121.552 3.135 -4.951 1.00 0.00 C ATOM 1258 CG LYS A 80 122.474 4.358 -4.981 1.00 0.00 C ATOM 1259 CD LYS A 80 123.837 3.967 -5.560 1.00 0.00 C ATOM 1260 CE LYS A 80 124.475 2.896 -4.677 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.944 3.132 -4.591 1.00 0.00 N ATOM 0 H LYS A 80 119.547 4.431 -5.631 1.00 0.00 H new ATOM 0 HA LYS A 80 121.652 3.159 -7.099 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.780 3.266 -4.193 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.119 2.245 -4.678 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.026 5.148 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.597 4.757 -3.974 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.719 3.593 -6.577 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.485 4.842 -5.616 1.00 0.00 H new ATOM 0 HE2 LYS A 80 124.033 2.920 -3.681 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.279 1.906 -5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.378 2.403 -3.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.359 3.088 -5.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.121 4.071 -4.179 1.00 0.00 H new ATOM 1275 N LEU A 81 119.249 1.210 -5.993 1.00 0.00 N ATOM 1276 CA LEU A 81 118.736 -0.184 -6.119 1.00 0.00 C ATOM 1277 C LEU A 81 118.427 -0.504 -7.588 1.00 0.00 C ATOM 1278 O LEU A 81 118.917 -1.467 -8.135 1.00 0.00 O ATOM 1279 CB LEU A 81 117.450 -0.335 -5.292 1.00 0.00 C ATOM 1280 CG LEU A 81 117.708 -0.070 -3.802 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.764 -0.945 -2.975 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.162 -0.392 -3.432 1.00 0.00 C ATOM 0 H LEU A 81 118.629 1.863 -5.515 1.00 0.00 H new ATOM 0 HA LEU A 81 119.497 -0.873 -5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.695 0.359 -5.661 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.049 -1.340 -5.420 1.00 0.00 H new ATOM 0 HG LEU A 81 117.528 0.985 -3.593 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.938 -0.766 -1.914 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.731 -0.699 -3.220 1.00 0.00 H new ATOM 0 HD13 LEU A 81 116.950 -1.995 -3.201 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.319 -0.196 -2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.367 -1.442 -3.641 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.834 0.233 -4.020 1.00 0.00 H new ATOM 1294 N VAL A 82 117.612 0.279 -8.232 1.00 0.00 N ATOM 1295 CA VAL A 82 117.273 -0.017 -9.652 1.00 0.00 C ATOM 1296 C VAL A 82 118.519 0.083 -10.544 1.00 0.00 C ATOM 1297 O VAL A 82 118.738 -0.747 -11.397 1.00 0.00 O ATOM 1298 CB VAL A 82 116.197 0.961 -10.135 1.00 0.00 C ATOM 1299 CG1 VAL A 82 116.555 2.390 -9.707 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.085 0.885 -11.661 1.00 0.00 C ATOM 0 H VAL A 82 117.166 1.109 -7.840 1.00 0.00 H new ATOM 0 HA VAL A 82 116.893 -1.036 -9.717 1.00 0.00 H new ATOM 0 HB VAL A 82 115.240 0.691 -9.689 1.00 0.00 H new ATOM 0 HG11 VAL A 82 115.784 3.078 -10.055 1.00 0.00 H new ATOM 0 HG12 VAL A 82 116.621 2.439 -8.620 1.00 0.00 H new ATOM 0 HG13 VAL A 82 117.515 2.670 -10.142 1.00 0.00 H new ATOM 0 HG21 VAL A 82 115.320 1.581 -12.005 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.043 1.149 -12.110 1.00 0.00 H new ATOM 0 HG23 VAL A 82 115.813 -0.128 -11.956 1.00 0.00 H new ATOM 1310 N THR A 83 119.329 1.089 -10.381 1.00 0.00 N ATOM 1311 CA THR A 83 120.536 1.208 -11.253 1.00 0.00 C ATOM 1312 C THR A 83 121.672 0.291 -10.764 1.00 0.00 C ATOM 1313 O THR A 83 122.329 -0.360 -11.552 1.00 0.00 O ATOM 1314 CB THR A 83 121.013 2.661 -11.262 1.00 0.00 C ATOM 1315 OG1 THR A 83 121.701 2.923 -12.477 1.00 0.00 O ATOM 1316 CG2 THR A 83 121.950 2.899 -10.083 1.00 0.00 C ATOM 0 H THR A 83 119.213 1.830 -9.689 1.00 0.00 H new ATOM 0 HA THR A 83 120.264 0.898 -12.262 1.00 0.00 H new ATOM 0 HB THR A 83 120.154 3.327 -11.179 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.006 3.854 -12.486 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.289 3.935 -10.091 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.421 2.697 -9.151 1.00 0.00 H new ATOM 0 HG23 THR A 83 122.811 2.235 -10.163 1.00 0.00 H new ATOM 1324 N SER A 84 121.933 0.257 -9.484 1.00 0.00 N ATOM 1325 CA SER A 84 123.055 -0.594 -8.971 1.00 0.00 C ATOM 1326 C SER A 84 122.664 -2.075 -8.928 1.00 0.00 C ATOM 1327 O SER A 84 123.472 -2.944 -9.190 1.00 0.00 O ATOM 1328 CB SER A 84 123.429 -0.148 -7.556 1.00 0.00 C ATOM 1329 OG SER A 84 123.236 1.256 -7.438 1.00 0.00 O ATOM 0 H SER A 84 121.422 0.778 -8.771 1.00 0.00 H new ATOM 0 HA SER A 84 123.899 -0.475 -9.650 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.817 -0.673 -6.823 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.468 -0.403 -7.345 1.00 0.00 H new ATOM 0 HG SER A 84 124.062 1.722 -7.684 1.00 0.00 H new ATOM 1335 N PHE A 85 121.453 -2.375 -8.561 1.00 0.00 N ATOM 1336 CA PHE A 85 121.037 -3.804 -8.457 1.00 0.00 C ATOM 1337 C PHE A 85 121.365 -4.587 -9.733 1.00 0.00 C ATOM 1338 O PHE A 85 120.997 -5.734 -9.865 1.00 0.00 O ATOM 1339 CB PHE A 85 119.539 -3.895 -8.153 1.00 0.00 C ATOM 1340 CG PHE A 85 118.716 -3.727 -9.412 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.254 -3.131 -10.564 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.406 -4.207 -9.430 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.476 -3.021 -11.723 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.633 -4.100 -10.589 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.167 -3.509 -11.736 1.00 0.00 C ATOM 0 H PHE A 85 120.730 -1.694 -8.328 1.00 0.00 H new ATOM 0 HA PHE A 85 121.601 -4.254 -7.640 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.316 -4.858 -7.695 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.264 -3.127 -7.430 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.267 -2.758 -10.556 1.00 0.00 H new ATOM 0 HD2 PHE A 85 116.988 -4.663 -8.545 1.00 0.00 H new ATOM 0 HE1 PHE A 85 118.888 -2.559 -12.608 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.620 -4.475 -10.598 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.569 -3.429 -12.632 1.00 0.00 H new ATOM 1355 N ASP A 86 122.042 -4.003 -10.681 1.00 0.00 N ATOM 1356 CA ASP A 86 122.357 -4.781 -11.911 1.00 0.00 C ATOM 1357 C ASP A 86 123.687 -5.513 -11.719 1.00 0.00 C ATOM 1358 O ASP A 86 124.209 -6.128 -12.628 1.00 0.00 O ATOM 1359 CB ASP A 86 122.432 -3.863 -13.125 1.00 0.00 C ATOM 1360 CG ASP A 86 123.253 -2.618 -12.783 1.00 0.00 C ATOM 1361 OD1 ASP A 86 123.619 -2.473 -11.629 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.502 -1.832 -13.682 1.00 0.00 O ATOM 0 H ASP A 86 122.385 -3.042 -10.661 1.00 0.00 H new ATOM 0 HA ASP A 86 121.563 -5.507 -12.085 1.00 0.00 H new ATOM 0 HB2 ASP A 86 122.886 -4.390 -13.964 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.428 -3.574 -13.436 1.00 0.00 H new ATOM 1367 N PHE A 87 124.219 -5.473 -10.530 1.00 0.00 N ATOM 1368 CA PHE A 87 125.496 -6.187 -10.246 1.00 0.00 C ATOM 1369 C PHE A 87 125.295 -7.009 -8.972 1.00 0.00 C ATOM 1370 O PHE A 87 125.078 -8.204 -9.019 1.00 0.00 O ATOM 1371 CB PHE A 87 126.643 -5.173 -10.062 1.00 0.00 C ATOM 1372 CG PHE A 87 127.460 -5.504 -8.826 1.00 0.00 C ATOM 1373 CD1 PHE A 87 127.823 -6.830 -8.548 1.00 0.00 C ATOM 1374 CD2 PHE A 87 127.841 -4.482 -7.944 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.554 -7.125 -7.398 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.581 -4.784 -6.797 1.00 0.00 C ATOM 1377 CZ PHE A 87 128.935 -6.108 -6.525 1.00 0.00 C ATOM 0 H PHE A 87 123.821 -4.972 -9.736 1.00 0.00 H new ATOM 0 HA PHE A 87 125.763 -6.840 -11.077 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.286 -5.181 -10.942 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.234 -4.166 -9.975 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.536 -7.622 -9.224 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.562 -3.459 -8.151 1.00 0.00 H new ATOM 0 HE1 PHE A 87 128.827 -8.148 -7.183 1.00 0.00 H new ATOM 0 HE2 PHE A 87 128.879 -3.995 -6.122 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.504 -6.343 -5.638 1.00 0.00 H new ATOM 1387 N ASP A 88 125.357 -6.377 -7.834 1.00 0.00 N ATOM 1388 CA ASP A 88 125.160 -7.119 -6.560 1.00 0.00 C ATOM 1389 C ASP A 88 123.686 -7.055 -6.174 1.00 0.00 C ATOM 1390 O ASP A 88 123.257 -6.170 -5.462 1.00 0.00 O ATOM 1391 CB ASP A 88 125.991 -6.479 -5.456 1.00 0.00 C ATOM 1392 CG ASP A 88 126.061 -4.968 -5.684 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.310 -4.478 -6.511 1.00 0.00 O ATOM 1394 OD2 ASP A 88 126.862 -4.327 -5.028 1.00 0.00 O ATOM 0 H ASP A 88 125.536 -5.378 -7.732 1.00 0.00 H new ATOM 0 HA ASP A 88 125.471 -8.155 -6.691 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.548 -6.691 -4.483 1.00 0.00 H new ATOM 0 HB3 ASP A 88 126.995 -6.904 -5.449 1.00 0.00 H new ATOM 1399 N LEU A 89 122.908 -7.983 -6.642 1.00 0.00 N ATOM 1400 CA LEU A 89 121.463 -7.974 -6.310 1.00 0.00 C ATOM 1401 C LEU A 89 121.294 -8.086 -4.795 1.00 0.00 C ATOM 1402 O LEU A 89 120.609 -7.298 -4.177 1.00 0.00 O ATOM 1403 CB LEU A 89 120.780 -9.157 -7.001 1.00 0.00 C ATOM 1404 CG LEU A 89 121.195 -9.238 -8.487 1.00 0.00 C ATOM 1405 CD1 LEU A 89 121.822 -7.926 -8.963 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.214 -10.356 -8.693 1.00 0.00 C ATOM 0 H LEU A 89 123.211 -8.750 -7.242 1.00 0.00 H new ATOM 0 HA LEU A 89 121.008 -7.045 -6.654 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.047 -10.084 -6.493 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.698 -9.052 -6.926 1.00 0.00 H new ATOM 0 HG LEU A 89 120.291 -9.436 -9.063 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.103 -8.017 -10.012 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.102 -7.116 -8.849 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.709 -7.710 -8.368 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.497 -10.401 -9.745 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.098 -10.158 -8.087 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.775 -11.308 -8.394 1.00 0.00 H new ATOM 1418 N GLU A 90 121.908 -9.063 -4.192 1.00 0.00 N ATOM 1419 CA GLU A 90 121.773 -9.229 -2.718 1.00 0.00 C ATOM 1420 C GLU A 90 122.683 -8.236 -1.971 1.00 0.00 C ATOM 1421 O GLU A 90 122.267 -7.583 -1.031 1.00 0.00 O ATOM 1422 CB GLU A 90 122.167 -10.662 -2.341 1.00 0.00 C ATOM 1423 CG GLU A 90 121.943 -11.587 -3.538 1.00 0.00 C ATOM 1424 CD GLU A 90 122.236 -13.032 -3.129 1.00 0.00 C ATOM 1425 OE1 GLU A 90 123.254 -13.252 -2.494 1.00 0.00 O ATOM 1426 OE2 GLU A 90 121.436 -13.893 -3.456 1.00 0.00 O ATOM 0 H GLU A 90 122.498 -9.754 -4.655 1.00 0.00 H new ATOM 0 HA GLU A 90 120.739 -9.032 -2.433 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.213 -10.694 -2.035 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.575 -11.001 -1.491 1.00 0.00 H new ATOM 0 HG2 GLU A 90 120.916 -11.499 -3.892 1.00 0.00 H new ATOM 0 HG3 GLU A 90 122.591 -11.293 -4.364 1.00 0.00 H new ATOM 1433 N ILE A 91 123.926 -8.141 -2.359 1.00 0.00 N ATOM 1434 CA ILE A 91 124.872 -7.225 -1.648 1.00 0.00 C ATOM 1435 C ILE A 91 124.636 -5.759 -2.036 1.00 0.00 C ATOM 1436 O ILE A 91 124.868 -4.862 -1.252 1.00 0.00 O ATOM 1437 CB ILE A 91 126.307 -7.616 -2.016 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.322 -9.073 -2.487 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.218 -7.463 -0.797 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.746 -9.622 -2.417 1.00 0.00 C ATOM 0 H ILE A 91 124.331 -8.658 -3.139 1.00 0.00 H new ATOM 0 HA ILE A 91 124.705 -7.322 -0.575 1.00 0.00 H new ATOM 0 HB ILE A 91 126.668 -6.965 -2.812 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.659 -9.674 -1.864 1.00 0.00 H new ATOM 0 HG13 ILE A 91 125.946 -9.139 -3.508 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.236 -7.743 -1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.204 -6.427 -0.460 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.864 -8.110 0.005 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.753 -10.659 -2.753 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.397 -9.028 -3.059 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.105 -9.571 -1.389 1.00 0.00 H new ATOM 1452 N GLY A 92 124.206 -5.501 -3.237 1.00 0.00 N ATOM 1453 CA GLY A 92 123.993 -4.085 -3.661 1.00 0.00 C ATOM 1454 C GLY A 92 123.024 -3.377 -2.709 1.00 0.00 C ATOM 1455 O GLY A 92 123.315 -2.318 -2.187 1.00 0.00 O ATOM 0 H GLY A 92 123.992 -6.204 -3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 92 124.947 -3.557 -3.677 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.598 -4.059 -4.676 1.00 0.00 H new ATOM 1459 N LYS A 93 121.871 -3.941 -2.494 1.00 0.00 N ATOM 1460 CA LYS A 93 120.875 -3.290 -1.592 1.00 0.00 C ATOM 1461 C LYS A 93 121.255 -3.496 -0.121 1.00 0.00 C ATOM 1462 O LYS A 93 120.753 -2.817 0.755 1.00 0.00 O ATOM 1463 CB LYS A 93 119.477 -3.879 -1.835 1.00 0.00 C ATOM 1464 CG LYS A 93 119.567 -5.215 -2.587 1.00 0.00 C ATOM 1465 CD LYS A 93 119.275 -4.993 -4.076 1.00 0.00 C ATOM 1466 CE LYS A 93 120.542 -4.510 -4.784 1.00 0.00 C ATOM 1467 NZ LYS A 93 120.817 -3.096 -4.403 1.00 0.00 N ATOM 0 H LYS A 93 121.572 -4.826 -2.903 1.00 0.00 H new ATOM 0 HA LYS A 93 120.869 -2.223 -1.813 1.00 0.00 H new ATOM 0 HB2 LYS A 93 118.970 -4.027 -0.882 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.876 -3.174 -2.409 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.560 -5.647 -2.462 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.855 -5.927 -2.169 1.00 0.00 H new ATOM 0 HD2 LYS A 93 118.924 -5.920 -4.530 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.478 -4.259 -4.195 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.387 -5.142 -4.511 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.420 -4.589 -5.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 121.791 -2.848 -4.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.152 -2.468 -4.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.700 -2.984 -3.376 1.00 0.00 H new ATOM 1481 N GLY A 94 122.115 -4.432 0.167 1.00 0.00 N ATOM 1482 CA GLY A 94 122.490 -4.681 1.591 1.00 0.00 C ATOM 1483 C GLY A 94 123.268 -3.491 2.181 1.00 0.00 C ATOM 1484 O GLY A 94 122.948 -3.009 3.248 1.00 0.00 O ATOM 0 H GLY A 94 122.574 -5.034 -0.517 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.590 -4.858 2.180 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.097 -5.584 1.657 1.00 0.00 H new ATOM 1488 N GLU A 95 124.296 -3.024 1.517 1.00 0.00 N ATOM 1489 CA GLU A 95 125.087 -1.880 2.078 1.00 0.00 C ATOM 1490 C GLU A 95 124.442 -0.547 1.694 1.00 0.00 C ATOM 1491 O GLU A 95 124.349 0.364 2.495 1.00 0.00 O ATOM 1492 CB GLU A 95 126.520 -1.924 1.527 1.00 0.00 C ATOM 1493 CG GLU A 95 127.120 -0.508 1.512 1.00 0.00 C ATOM 1494 CD GLU A 95 126.666 0.223 0.247 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.496 -0.435 -0.766 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.496 1.430 0.313 1.00 0.00 O ATOM 0 H GLU A 95 124.621 -3.380 0.618 1.00 0.00 H new ATOM 0 HA GLU A 95 125.105 -1.968 3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.135 -2.582 2.141 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.518 -2.338 0.519 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.802 0.043 2.397 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.208 -0.562 1.543 1.00 0.00 H new ATOM 1503 N THR A 96 124.015 -0.414 0.472 1.00 0.00 N ATOM 1504 CA THR A 96 123.402 0.871 0.042 1.00 0.00 C ATOM 1505 C THR A 96 122.338 1.307 1.052 1.00 0.00 C ATOM 1506 O THR A 96 122.319 2.439 1.503 1.00 0.00 O ATOM 1507 CB THR A 96 122.771 0.696 -1.336 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.083 -0.543 -1.385 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.873 0.715 -2.395 1.00 0.00 C ATOM 0 H THR A 96 124.063 -1.137 -0.246 1.00 0.00 H new ATOM 0 HA THR A 96 124.173 1.639 -0.009 1.00 0.00 H new ATOM 0 HB THR A 96 122.067 1.506 -1.527 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.564 -1.161 -1.973 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.430 0.590 -3.383 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.403 1.667 -2.352 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.573 -0.099 -2.206 1.00 0.00 H new ATOM 1517 N MET A 97 121.461 0.417 1.421 1.00 0.00 N ATOM 1518 CA MET A 97 120.408 0.781 2.408 1.00 0.00 C ATOM 1519 C MET A 97 121.076 1.381 3.646 1.00 0.00 C ATOM 1520 O MET A 97 120.461 2.087 4.425 1.00 0.00 O ATOM 1521 CB MET A 97 119.641 -0.481 2.808 1.00 0.00 C ATOM 1522 CG MET A 97 120.516 -1.339 3.724 1.00 0.00 C ATOM 1523 SD MET A 97 120.393 -0.728 5.424 1.00 0.00 S ATOM 1524 CE MET A 97 121.274 -2.093 6.221 1.00 0.00 C ATOM 0 H MET A 97 121.428 -0.545 1.083 1.00 0.00 H new ATOM 0 HA MET A 97 119.720 1.505 1.972 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.716 -0.211 3.318 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.361 -1.047 1.919 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.198 -2.381 3.677 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.553 -1.307 3.389 1.00 0.00 H new ATOM 0 HE1 MET A 97 121.317 -1.920 7.296 1.00 0.00 H new ATOM 0 HE2 MET A 97 120.750 -3.028 6.025 1.00 0.00 H new ATOM 0 HE3 MET A 97 122.287 -2.155 5.822 1.00 0.00 H new ATOM 1534 N LYS A 98 122.332 1.092 3.834 1.00 0.00 N ATOM 1535 CA LYS A 98 123.057 1.617 5.022 1.00 0.00 C ATOM 1536 C LYS A 98 123.439 3.087 4.829 1.00 0.00 C ATOM 1537 O LYS A 98 123.279 3.887 5.723 1.00 0.00 O ATOM 1538 CB LYS A 98 124.331 0.795 5.231 1.00 0.00 C ATOM 1539 CG LYS A 98 124.524 0.513 6.723 1.00 0.00 C ATOM 1540 CD LYS A 98 125.957 0.039 6.972 1.00 0.00 C ATOM 1541 CE LYS A 98 126.210 -1.253 6.193 1.00 0.00 C ATOM 1542 NZ LYS A 98 127.378 -1.967 6.782 1.00 0.00 N ATOM 0 H LYS A 98 122.891 0.510 3.211 1.00 0.00 H new ATOM 0 HA LYS A 98 122.402 1.540 5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.265 -0.143 4.679 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.192 1.335 4.839 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.322 1.413 7.303 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.816 -0.246 7.055 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.665 0.808 6.662 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.116 -0.129 8.037 1.00 0.00 H new ATOM 0 HE2 LYS A 98 125.326 -1.890 6.227 1.00 0.00 H new ATOM 0 HE3 LYS A 98 126.400 -1.027 5.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 127.720 -2.685 6.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 128.139 -1.286 6.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 127.091 -2.430 7.668 1.00 0.00 H new ATOM 1556 N TYR A 99 123.968 3.459 3.694 1.00 0.00 N ATOM 1557 CA TYR A 99 124.368 4.886 3.529 1.00 0.00 C ATOM 1558 C TYR A 99 123.143 5.797 3.635 1.00 0.00 C ATOM 1559 O TYR A 99 123.253 6.926 4.071 1.00 0.00 O ATOM 1560 CB TYR A 99 125.114 5.100 2.204 1.00 0.00 C ATOM 1561 CG TYR A 99 124.157 5.226 1.049 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.390 6.383 0.888 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.056 4.185 0.127 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.516 6.494 -0.201 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.185 4.291 -0.962 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.414 5.448 -1.126 1.00 0.00 C ATOM 1567 OH TYR A 99 121.552 5.558 -2.198 1.00 0.00 O ATOM 0 H TYR A 99 124.138 2.853 2.891 1.00 0.00 H new ATOM 0 HA TYR A 99 125.055 5.148 4.334 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.727 5.999 2.271 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.792 4.265 2.027 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.471 7.190 1.602 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.652 3.294 0.254 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.921 7.386 -0.327 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.107 3.483 -1.674 1.00 0.00 H new ATOM 0 HH TYR A 99 121.017 4.740 -2.273 1.00 0.00 H new ATOM 1577 N ILE A 100 121.971 5.331 3.286 1.00 0.00 N ATOM 1578 CA ILE A 100 120.781 6.221 3.436 1.00 0.00 C ATOM 1579 C ILE A 100 120.468 6.350 4.932 1.00 0.00 C ATOM 1580 O ILE A 100 120.414 7.435 5.476 1.00 0.00 O ATOM 1581 CB ILE A 100 119.570 5.628 2.714 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.845 5.552 1.213 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.354 6.526 2.954 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.710 4.329 0.911 1.00 0.00 C ATOM 0 H ILE A 100 121.788 4.399 2.914 1.00 0.00 H new ATOM 0 HA ILE A 100 120.997 7.196 2.999 1.00 0.00 H new ATOM 0 HB ILE A 100 119.378 4.626 3.097 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.906 5.490 0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.350 6.458 0.879 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.487 6.109 2.442 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.150 6.585 4.023 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.558 7.525 2.568 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.905 4.277 -0.160 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.655 4.410 1.448 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.188 3.427 1.229 1.00 0.00 H new ATOM 1596 N LEU A 101 120.284 5.242 5.603 1.00 0.00 N ATOM 1597 CA LEU A 101 119.999 5.280 7.071 1.00 0.00 C ATOM 1598 C LEU A 101 121.174 5.929 7.788 1.00 0.00 C ATOM 1599 O LEU A 101 121.030 6.917 8.479 1.00 0.00 O ATOM 1600 CB LEU A 101 119.854 3.841 7.574 1.00 0.00 C ATOM 1601 CG LEU A 101 119.055 3.789 8.879 1.00 0.00 C ATOM 1602 CD1 LEU A 101 119.449 4.953 9.791 1.00 0.00 C ATOM 1603 CD2 LEU A 101 117.564 3.864 8.563 1.00 0.00 C ATOM 0 H LEU A 101 120.319 4.307 5.196 1.00 0.00 H new ATOM 0 HA LEU A 101 119.087 5.846 7.262 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.357 3.236 6.816 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.841 3.407 7.731 1.00 0.00 H new ATOM 0 HG LEU A 101 119.274 2.853 9.393 1.00 0.00 H new ATOM 0 HD11 LEU A 101 118.873 4.903 10.715 1.00 0.00 H new ATOM 0 HD12 LEU A 101 120.512 4.890 10.023 1.00 0.00 H new ATOM 0 HD13 LEU A 101 119.243 5.897 9.286 1.00 0.00 H new ATOM 0 HD21 LEU A 101 116.993 3.827 9.491 1.00 0.00 H new ATOM 0 HD22 LEU A 101 117.349 4.797 8.042 1.00 0.00 H new ATOM 0 HD23 LEU A 101 117.283 3.022 7.931 1.00 0.00 H new ATOM 1615 N ALA A 102 122.340 5.380 7.622 1.00 0.00 N ATOM 1616 CA ALA A 102 123.529 5.962 8.285 1.00 0.00 C ATOM 1617 C ALA A 102 123.676 7.408 7.832 1.00 0.00 C ATOM 1618 O ALA A 102 123.238 8.324 8.498 1.00 0.00 O ATOM 1619 CB ALA A 102 124.779 5.175 7.888 1.00 0.00 C ATOM 0 H ALA A 102 122.519 4.552 7.054 1.00 0.00 H new ATOM 0 HA ALA A 102 123.410 5.917 9.368 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.652 5.607 8.378 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.667 4.135 8.196 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.910 5.221 6.807 1.00 0.00 H new ATOM 1625 N LEU A 103 124.288 7.618 6.700 1.00 0.00 N ATOM 1626 CA LEU A 103 124.471 9.005 6.201 1.00 0.00 C ATOM 1627 C LEU A 103 125.213 9.818 7.258 1.00 0.00 C ATOM 1628 O LEU A 103 125.820 10.826 6.959 1.00 0.00 O ATOM 1629 CB LEU A 103 123.107 9.641 5.921 1.00 0.00 C ATOM 1630 CG LEU A 103 123.298 11.109 5.536 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.278 11.206 4.366 1.00 0.00 C ATOM 1632 CD2 LEU A 103 121.951 11.705 5.122 1.00 0.00 C ATOM 0 H LEU A 103 124.669 6.887 6.100 1.00 0.00 H new ATOM 0 HA LEU A 103 125.048 8.989 5.277 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.603 9.106 5.117 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.471 9.565 6.803 1.00 0.00 H new ATOM 0 HG LEU A 103 123.694 11.660 6.389 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.414 12.252 4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.237 10.780 4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 103 123.882 10.656 3.513 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.085 12.751 4.847 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.556 11.154 4.269 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.251 11.635 5.955 1.00 0.00 H new ATOM 1644 N LYS A 104 125.178 9.379 8.494 1.00 0.00 N ATOM 1645 CA LYS A 104 125.897 10.121 9.571 1.00 0.00 C ATOM 1646 C LYS A 104 127.076 10.859 8.940 1.00 0.00 C ATOM 1647 O LYS A 104 127.343 12.007 9.235 1.00 0.00 O ATOM 1648 CB LYS A 104 126.419 9.123 10.613 1.00 0.00 C ATOM 1649 CG LYS A 104 126.352 9.727 12.019 1.00 0.00 C ATOM 1650 CD LYS A 104 125.461 8.859 12.912 1.00 0.00 C ATOM 1651 CE LYS A 104 124.056 8.776 12.311 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.045 8.832 13.405 1.00 0.00 N ATOM 0 H LYS A 104 124.683 8.541 8.800 1.00 0.00 H new ATOM 0 HA LYS A 104 125.225 10.829 10.057 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.828 8.208 10.576 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.447 8.848 10.378 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.353 9.795 12.444 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.957 10.742 11.971 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.887 7.860 13.006 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.414 9.281 13.916 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.898 9.598 11.613 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.945 7.851 11.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.090 8.776 12.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 123.192 8.033 14.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.147 9.726 13.926 1.00 0.00 H new ATOM 1666 N ASP A 105 127.767 10.202 8.049 1.00 0.00 N ATOM 1667 CA ASP A 105 128.915 10.846 7.359 1.00 0.00 C ATOM 1668 C ASP A 105 128.713 10.691 5.850 1.00 0.00 C ATOM 1669 O ASP A 105 128.244 11.594 5.186 1.00 0.00 O ATOM 1670 CB ASP A 105 130.221 10.170 7.784 1.00 0.00 C ATOM 1671 CG ASP A 105 131.388 11.137 7.576 1.00 0.00 C ATOM 1672 OD1 ASP A 105 131.487 11.691 6.494 1.00 0.00 O ATOM 1673 OD2 ASP A 105 132.162 11.308 8.504 1.00 0.00 O ATOM 0 H ASP A 105 127.582 9.239 7.769 1.00 0.00 H new ATOM 0 HA ASP A 105 128.970 11.902 7.623 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.164 9.872 8.831 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.379 9.262 7.202 1.00 0.00 H new ATOM 1678 N GLN A 106 129.041 9.544 5.311 1.00 0.00 N ATOM 1679 CA GLN A 106 128.848 9.314 3.850 1.00 0.00 C ATOM 1680 C GLN A 106 129.857 8.272 3.346 1.00 0.00 C ATOM 1681 O GLN A 106 129.479 7.270 2.769 1.00 0.00 O ATOM 1682 CB GLN A 106 129.023 10.630 3.079 1.00 0.00 C ATOM 1683 CG GLN A 106 129.551 10.341 1.671 1.00 0.00 C ATOM 1684 CD GLN A 106 129.429 11.600 0.811 1.00 0.00 C ATOM 1685 OE1 GLN A 106 130.410 12.263 0.542 1.00 0.00 O ATOM 1686 NE2 GLN A 106 128.256 11.959 0.366 1.00 0.00 N ATOM 0 H GLN A 106 129.435 8.755 5.823 1.00 0.00 H new ATOM 0 HA GLN A 106 127.838 8.941 3.683 1.00 0.00 H new ATOM 0 HB2 GLN A 106 128.070 11.156 3.019 1.00 0.00 H new ATOM 0 HB3 GLN A 106 129.715 11.284 3.610 1.00 0.00 H new ATOM 0 HG2 GLN A 106 130.592 10.021 1.720 1.00 0.00 H new ATOM 0 HG3 GLN A 106 128.987 9.524 1.220 1.00 0.00 H new ATOM 0 HE21 GLN A 106 127.432 11.402 0.592 1.00 0.00 H new ATOM 0 HE22 GLN A 106 128.163 12.797 -0.208 1.00 0.00 H new ATOM 1695 N PRO A 107 131.129 8.504 3.550 1.00 0.00 N ATOM 1696 CA PRO A 107 132.196 7.565 3.092 1.00 0.00 C ATOM 1697 C PRO A 107 132.223 6.251 3.881 1.00 0.00 C ATOM 1698 O PRO A 107 132.763 5.266 3.425 1.00 0.00 O ATOM 1699 CB PRO A 107 133.493 8.343 3.324 1.00 0.00 C ATOM 1700 CG PRO A 107 133.174 9.326 4.398 1.00 0.00 C ATOM 1701 CD PRO A 107 131.698 9.680 4.234 1.00 0.00 C ATOM 0 HA PRO A 107 132.036 7.267 2.056 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.302 7.678 3.627 1.00 0.00 H new ATOM 0 HB3 PRO A 107 133.818 8.847 2.414 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.364 8.900 5.383 1.00 0.00 H new ATOM 0 HG3 PRO A 107 133.799 10.215 4.309 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.219 9.853 5.197 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.567 10.588 3.645 1.00 0.00 H new ATOM 1709 N GLU A 108 131.657 6.220 5.058 1.00 0.00 N ATOM 1710 CA GLU A 108 131.685 4.952 5.847 1.00 0.00 C ATOM 1711 C GLU A 108 130.749 3.930 5.202 1.00 0.00 C ATOM 1712 O GLU A 108 131.146 2.827 4.867 1.00 0.00 O ATOM 1713 CB GLU A 108 131.231 5.229 7.286 1.00 0.00 C ATOM 1714 CG GLU A 108 131.083 6.736 7.498 1.00 0.00 C ATOM 1715 CD GLU A 108 132.408 7.430 7.179 1.00 0.00 C ATOM 1716 OE1 GLU A 108 133.282 6.775 6.637 1.00 0.00 O ATOM 1717 OE2 GLU A 108 132.527 8.606 7.484 1.00 0.00 O ATOM 0 H GLU A 108 131.182 7.005 5.503 1.00 0.00 H new ATOM 0 HA GLU A 108 132.701 4.557 5.860 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.282 4.730 7.481 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.956 4.822 7.991 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.292 7.128 6.858 1.00 0.00 H new ATOM 0 HG3 GLU A 108 130.791 6.942 8.528 1.00 0.00 H new ATOM 1724 N ALA A 109 129.514 4.291 5.008 1.00 0.00 N ATOM 1725 CA ALA A 109 128.558 3.347 4.374 1.00 0.00 C ATOM 1726 C ALA A 109 129.058 3.014 2.970 1.00 0.00 C ATOM 1727 O ALA A 109 128.946 1.898 2.502 1.00 0.00 O ATOM 1728 CB ALA A 109 127.182 4.006 4.296 1.00 0.00 C ATOM 0 H ALA A 109 129.125 5.199 5.261 1.00 0.00 H new ATOM 0 HA ALA A 109 128.482 2.431 4.961 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.475 3.318 3.832 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.840 4.254 5.301 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.248 4.916 3.700 1.00 0.00 H new ATOM 1734 N ALA A 110 129.624 3.980 2.302 1.00 0.00 N ATOM 1735 CA ALA A 110 130.153 3.738 0.934 1.00 0.00 C ATOM 1736 C ALA A 110 131.378 2.831 1.026 1.00 0.00 C ATOM 1737 O ALA A 110 131.609 1.998 0.172 1.00 0.00 O ATOM 1738 CB ALA A 110 130.548 5.071 0.294 1.00 0.00 C ATOM 0 H ALA A 110 129.743 4.932 2.648 1.00 0.00 H new ATOM 0 HA ALA A 110 129.387 3.260 0.323 1.00 0.00 H new ATOM 0 HB1 ALA A 110 130.936 4.892 -0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.674 5.719 0.235 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.316 5.552 0.900 1.00 0.00 H new ATOM 1744 N GLN A 111 132.163 2.972 2.062 1.00 0.00 N ATOM 1745 CA GLN A 111 133.358 2.097 2.197 1.00 0.00 C ATOM 1746 C GLN A 111 132.904 0.653 2.038 1.00 0.00 C ATOM 1747 O GLN A 111 133.437 -0.098 1.240 1.00 0.00 O ATOM 1748 CB GLN A 111 133.997 2.294 3.572 1.00 0.00 C ATOM 1749 CG GLN A 111 134.738 3.634 3.600 1.00 0.00 C ATOM 1750 CD GLN A 111 136.243 3.389 3.738 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.932 3.202 2.755 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.784 3.382 4.925 1.00 0.00 N ATOM 0 H GLN A 111 132.028 3.649 2.813 1.00 0.00 H new ATOM 0 HA GLN A 111 134.097 2.347 1.436 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.231 2.273 4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.689 1.479 3.784 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.533 4.193 2.687 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.381 4.241 4.432 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.205 3.539 5.750 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.786 3.220 5.028 1.00 0.00 H new ATOM 1761 N LEU A 112 131.895 0.262 2.766 1.00 0.00 N ATOM 1762 CA LEU A 112 131.392 -1.123 2.617 1.00 0.00 C ATOM 1763 C LEU A 112 131.041 -1.324 1.146 1.00 0.00 C ATOM 1764 O LEU A 112 131.389 -2.316 0.541 1.00 0.00 O ATOM 1765 CB LEU A 112 130.149 -1.315 3.487 1.00 0.00 C ATOM 1766 CG LEU A 112 130.573 -1.740 4.895 1.00 0.00 C ATOM 1767 CD1 LEU A 112 131.171 -3.147 4.851 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.621 -0.762 5.430 1.00 0.00 C ATOM 0 H LEU A 112 131.404 0.838 3.450 1.00 0.00 H new ATOM 0 HA LEU A 112 132.143 -1.847 2.932 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.577 -0.388 3.532 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.498 -2.071 3.048 1.00 0.00 H new ATOM 0 HG LEU A 112 129.701 -1.737 5.549 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.472 -3.446 5.855 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.427 -3.847 4.471 1.00 0.00 H new ATOM 0 HD13 LEU A 112 132.041 -3.152 4.195 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.923 -1.065 6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.491 -0.765 4.773 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.197 0.242 5.466 1.00 0.00 H new ATOM 1780 N ALA A 113 130.380 -0.367 0.555 1.00 0.00 N ATOM 1781 CA ALA A 113 130.036 -0.487 -0.885 1.00 0.00 C ATOM 1782 C ALA A 113 131.300 -0.875 -1.654 1.00 0.00 C ATOM 1783 O ALA A 113 131.244 -1.504 -2.693 1.00 0.00 O ATOM 1784 CB ALA A 113 129.511 0.854 -1.403 1.00 0.00 C ATOM 0 H ALA A 113 130.065 0.491 1.008 1.00 0.00 H new ATOM 0 HA ALA A 113 129.265 -1.245 -1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.260 0.763 -2.460 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.621 1.138 -0.841 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.278 1.618 -1.277 1.00 0.00 H new ATOM 1790 N LEU A 114 132.445 -0.505 -1.141 1.00 0.00 N ATOM 1791 CA LEU A 114 133.724 -0.851 -1.826 1.00 0.00 C ATOM 1792 C LEU A 114 133.932 -2.361 -1.744 1.00 0.00 C ATOM 1793 O LEU A 114 134.076 -3.044 -2.750 1.00 0.00 O ATOM 1794 CB LEU A 114 134.886 -0.134 -1.135 1.00 0.00 C ATOM 1795 CG LEU A 114 135.985 0.160 -2.157 1.00 0.00 C ATOM 1796 CD1 LEU A 114 137.172 0.822 -1.455 1.00 0.00 C ATOM 1797 CD2 LEU A 114 136.443 -1.149 -2.804 1.00 0.00 C ATOM 0 H LEU A 114 132.548 0.023 -0.275 1.00 0.00 H new ATOM 0 HA LEU A 114 133.683 -0.539 -2.869 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.537 0.795 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.281 -0.752 -0.329 1.00 0.00 H new ATOM 0 HG LEU A 114 135.597 0.830 -2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.955 1.031 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.848 1.754 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 114 137.560 0.153 -0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 114 137.226 -0.940 -3.533 1.00 0.00 H new ATOM 0 HD22 LEU A 114 136.831 -1.818 -2.036 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.598 -1.622 -3.305 1.00 0.00 H new ATOM 1809 N ARG A 115 133.921 -2.909 -0.561 1.00 0.00 N ATOM 1810 CA ARG A 115 134.087 -4.376 -0.469 1.00 0.00 C ATOM 1811 C ARG A 115 133.029 -4.979 -1.385 1.00 0.00 C ATOM 1812 O ARG A 115 133.305 -5.828 -2.203 1.00 0.00 O ATOM 1813 CB ARG A 115 133.905 -4.848 0.978 1.00 0.00 C ATOM 1814 CG ARG A 115 135.245 -4.736 1.707 1.00 0.00 C ATOM 1815 CD ARG A 115 135.646 -3.264 1.828 1.00 0.00 C ATOM 1816 NE ARG A 115 136.721 -2.960 0.843 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.887 -3.536 0.950 1.00 0.00 C ATOM 1818 NH1 ARG A 115 138.110 -4.380 1.920 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.829 -3.269 0.088 1.00 0.00 N ATOM 0 H ARG A 115 133.807 -2.414 0.324 1.00 0.00 H new ATOM 0 HA ARG A 115 135.087 -4.687 -0.772 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.151 -4.242 1.480 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.550 -5.879 0.997 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.170 -5.185 2.697 1.00 0.00 H new ATOM 0 HG3 ARG A 115 136.012 -5.288 1.164 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.782 -2.625 1.648 1.00 0.00 H new ATOM 0 HD3 ARG A 115 135.994 -3.053 2.839 1.00 0.00 H new ATOM 0 HE ARG A 115 136.546 -2.301 0.084 1.00 0.00 H new ATOM 0 HH11 ARG A 115 137.373 -4.589 2.594 1.00 0.00 H new ATOM 0 HH12 ARG A 115 139.021 -4.831 2.004 1.00 0.00 H new ATOM 0 HH21 ARG A 115 138.654 -2.610 -0.670 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.740 -3.720 0.172 1.00 0.00 H new ATOM 1833 N VAL A 116 131.826 -4.492 -1.321 1.00 0.00 N ATOM 1834 CA VAL A 116 130.803 -5.010 -2.251 1.00 0.00 C ATOM 1835 C VAL A 116 131.452 -5.000 -3.632 1.00 0.00 C ATOM 1836 O VAL A 116 131.200 -5.844 -4.464 1.00 0.00 O ATOM 1837 CB VAL A 116 129.573 -4.095 -2.219 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.034 -3.883 -3.633 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.480 -4.726 -1.349 1.00 0.00 C ATOM 0 H VAL A 116 131.513 -3.768 -0.674 1.00 0.00 H new ATOM 0 HA VAL A 116 130.471 -6.013 -1.984 1.00 0.00 H new ATOM 0 HB VAL A 116 129.865 -3.132 -1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.161 -3.232 -3.596 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.805 -3.422 -4.251 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.751 -4.844 -4.063 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.608 -4.072 -1.329 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.199 -5.694 -1.764 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.855 -4.861 -0.335 1.00 0.00 H new ATOM 1849 N GLY A 117 132.329 -4.060 -3.864 1.00 0.00 N ATOM 1850 CA GLY A 117 133.031 -4.018 -5.168 1.00 0.00 C ATOM 1851 C GLY A 117 133.606 -5.407 -5.429 1.00 0.00 C ATOM 1852 O GLY A 117 133.436 -5.984 -6.499 1.00 0.00 O ATOM 0 H GLY A 117 132.585 -3.324 -3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.343 -3.733 -5.964 1.00 0.00 H new ATOM 0 HA3 GLY A 117 133.825 -3.272 -5.151 1.00 0.00 H new ATOM 1856 N ILE A 118 134.276 -5.974 -4.454 1.00 0.00 N ATOM 1857 CA ILE A 118 134.826 -7.335 -4.685 1.00 0.00 C ATOM 1858 C ILE A 118 133.686 -8.216 -5.174 1.00 0.00 C ATOM 1859 O ILE A 118 133.882 -9.120 -5.962 1.00 0.00 O ATOM 1860 CB ILE A 118 135.491 -7.928 -3.422 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.619 -7.803 -2.162 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.791 -7.174 -3.165 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.197 -8.321 -2.403 1.00 0.00 C ATOM 0 H ILE A 118 134.459 -5.565 -3.538 1.00 0.00 H new ATOM 0 HA ILE A 118 135.617 -7.281 -5.433 1.00 0.00 H new ATOM 0 HB ILE A 118 135.651 -8.989 -3.611 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.077 -8.362 -1.346 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.578 -6.759 -1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.276 -7.578 -2.277 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.453 -7.287 -4.023 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.574 -6.117 -3.011 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.612 -8.216 -1.489 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.730 -7.744 -3.201 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.236 -9.372 -2.690 1.00 0.00 H new ATOM 1875 N ALA A 119 132.484 -7.945 -4.738 1.00 0.00 N ATOM 1876 CA ALA A 119 131.341 -8.756 -5.212 1.00 0.00 C ATOM 1877 C ALA A 119 131.094 -8.432 -6.682 1.00 0.00 C ATOM 1878 O ALA A 119 130.650 -9.267 -7.437 1.00 0.00 O ATOM 1879 CB ALA A 119 130.091 -8.458 -4.384 1.00 0.00 C ATOM 0 H ALA A 119 132.252 -7.202 -4.079 1.00 0.00 H new ATOM 0 HA ALA A 119 131.571 -9.816 -5.099 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.261 -9.064 -4.747 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.283 -8.695 -3.338 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.837 -7.402 -4.476 1.00 0.00 H new ATOM 1885 N VAL A 120 131.410 -7.243 -7.123 1.00 0.00 N ATOM 1886 CA VAL A 120 131.199 -6.956 -8.564 1.00 0.00 C ATOM 1887 C VAL A 120 131.863 -8.093 -9.306 1.00 0.00 C ATOM 1888 O VAL A 120 131.334 -8.633 -10.256 1.00 0.00 O ATOM 1889 CB VAL A 120 131.839 -5.624 -8.941 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.652 -5.378 -10.437 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.168 -4.504 -8.149 1.00 0.00 C ATOM 0 H VAL A 120 131.794 -6.481 -6.564 1.00 0.00 H new ATOM 0 HA VAL A 120 130.140 -6.880 -8.810 1.00 0.00 H new ATOM 0 HB VAL A 120 132.904 -5.647 -8.709 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.109 -4.426 -10.709 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.126 -6.182 -11.000 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.588 -5.350 -10.671 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.621 -3.549 -8.414 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.104 -4.479 -8.385 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.299 -4.684 -7.082 1.00 0.00 H new ATOM 1901 N ALA A 121 132.991 -8.513 -8.820 1.00 0.00 N ATOM 1902 CA ALA A 121 133.659 -9.683 -9.437 1.00 0.00 C ATOM 1903 C ALA A 121 133.063 -10.933 -8.777 1.00 0.00 C ATOM 1904 O ALA A 121 133.175 -12.037 -9.271 1.00 0.00 O ATOM 1905 CB ALA A 121 135.165 -9.623 -9.173 1.00 0.00 C ATOM 0 H ALA A 121 133.478 -8.099 -8.025 1.00 0.00 H new ATOM 0 HA ALA A 121 133.506 -9.698 -10.516 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.649 -10.486 -9.630 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.574 -8.708 -9.603 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.347 -9.631 -8.098 1.00 0.00 H new ATOM 1911 N LYS A 122 132.431 -10.740 -7.642 1.00 0.00 N ATOM 1912 CA LYS A 122 131.813 -11.875 -6.891 1.00 0.00 C ATOM 1913 C LYS A 122 130.388 -11.493 -6.450 1.00 0.00 C ATOM 1914 O LYS A 122 130.048 -11.591 -5.288 1.00 0.00 O ATOM 1915 CB LYS A 122 132.668 -12.197 -5.661 1.00 0.00 C ATOM 1916 CG LYS A 122 133.645 -13.330 -5.996 1.00 0.00 C ATOM 1917 CD LYS A 122 134.972 -13.095 -5.273 1.00 0.00 C ATOM 1918 CE LYS A 122 135.804 -12.074 -6.051 1.00 0.00 C ATOM 1919 NZ LYS A 122 136.676 -11.320 -5.106 1.00 0.00 N ATOM 0 H LYS A 122 132.317 -9.828 -7.200 1.00 0.00 H new ATOM 0 HA LYS A 122 131.762 -12.752 -7.536 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.218 -11.310 -5.346 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.029 -12.489 -4.828 1.00 0.00 H new ATOM 0 HG2 LYS A 122 133.222 -14.289 -5.697 1.00 0.00 H new ATOM 0 HG3 LYS A 122 133.809 -13.376 -7.073 1.00 0.00 H new ATOM 0 HD2 LYS A 122 134.788 -12.734 -4.261 1.00 0.00 H new ATOM 0 HD3 LYS A 122 135.520 -14.033 -5.182 1.00 0.00 H new ATOM 0 HE2 LYS A 122 136.413 -12.580 -6.800 1.00 0.00 H new ATOM 0 HE3 LYS A 122 135.149 -11.386 -6.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 137.179 -10.569 -5.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.091 -10.895 -4.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 137.367 -11.969 -4.678 1.00 0.00 H new ATOM 1933 N SER A 123 129.569 -11.023 -7.355 1.00 0.00 N ATOM 1934 CA SER A 123 128.183 -10.598 -6.975 1.00 0.00 C ATOM 1935 C SER A 123 127.598 -11.560 -5.947 1.00 0.00 C ATOM 1936 O SER A 123 126.609 -11.271 -5.303 1.00 0.00 O ATOM 1937 CB SER A 123 127.294 -10.586 -8.217 1.00 0.00 C ATOM 1938 OG SER A 123 128.079 -10.251 -9.353 1.00 0.00 O ATOM 0 H SER A 123 129.798 -10.914 -8.343 1.00 0.00 H new ATOM 0 HA SER A 123 128.228 -9.599 -6.542 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.831 -11.563 -8.356 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.486 -9.865 -8.093 1.00 0.00 H new ATOM 0 HG SER A 123 127.512 -10.244 -10.152 1.00 0.00 H new ATOM 1944 N ASP A 124 128.204 -12.689 -5.777 1.00 0.00 N ATOM 1945 CA ASP A 124 127.689 -13.661 -4.776 1.00 0.00 C ATOM 1946 C ASP A 124 128.826 -14.592 -4.356 1.00 0.00 C ATOM 1947 O ASP A 124 128.750 -15.795 -4.503 1.00 0.00 O ATOM 1948 CB ASP A 124 126.538 -14.465 -5.388 1.00 0.00 C ATOM 1949 CG ASP A 124 126.287 -15.723 -4.553 1.00 0.00 C ATOM 1950 OD1 ASP A 124 125.755 -15.591 -3.464 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.631 -16.797 -5.019 1.00 0.00 O ATOM 0 H ASP A 124 129.036 -12.987 -6.286 1.00 0.00 H new ATOM 0 HA ASP A 124 127.316 -13.132 -3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 124 125.635 -13.855 -5.425 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.779 -14.740 -6.415 1.00 0.00 H new ATOM 1956 N GLY A 125 129.888 -14.037 -3.834 1.00 0.00 N ATOM 1957 CA GLY A 125 131.036 -14.884 -3.407 1.00 0.00 C ATOM 1958 C GLY A 125 131.839 -14.170 -2.316 1.00 0.00 C ATOM 1959 O GLY A 125 132.363 -14.795 -1.415 1.00 0.00 O ATOM 0 H GLY A 125 130.008 -13.035 -3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.673 -15.842 -3.034 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.678 -15.097 -4.261 1.00 0.00 H new ATOM 1963 N ASN A 126 131.949 -12.867 -2.386 1.00 0.00 N ATOM 1964 CA ASN A 126 132.730 -12.135 -1.347 1.00 0.00 C ATOM 1965 C ASN A 126 131.825 -11.150 -0.598 1.00 0.00 C ATOM 1966 O ASN A 126 130.633 -11.092 -0.823 1.00 0.00 O ATOM 1967 CB ASN A 126 133.888 -11.385 -2.008 1.00 0.00 C ATOM 1968 CG ASN A 126 135.166 -12.220 -1.897 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.108 -13.425 -1.755 1.00 0.00 O ATOM 1970 ND2 ASN A 126 136.326 -11.625 -1.954 1.00 0.00 N ATOM 0 H ASN A 126 131.534 -12.283 -3.113 1.00 0.00 H new ATOM 0 HA ASN A 126 133.129 -12.853 -0.631 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.658 -11.190 -3.055 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.030 -10.417 -1.527 1.00 0.00 H new ATOM 0 HD21 ASN A 126 137.184 -12.172 -1.879 1.00 0.00 H new ATOM 0 HD22 ASN A 126 136.375 -10.613 -2.073 1.00 0.00 H new ATOM 1977 N PHE A 127 132.391 -10.388 0.303 1.00 0.00 N ATOM 1978 CA PHE A 127 131.587 -9.407 1.095 1.00 0.00 C ATOM 1979 C PHE A 127 131.061 -10.071 2.363 1.00 0.00 C ATOM 1980 O PHE A 127 131.027 -11.279 2.483 1.00 0.00 O ATOM 1981 CB PHE A 127 130.402 -8.890 0.278 1.00 0.00 C ATOM 1982 CG PHE A 127 130.031 -7.516 0.782 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.884 -6.437 0.541 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.841 -7.320 1.496 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.552 -5.161 1.011 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.509 -6.042 1.966 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.367 -4.963 1.723 1.00 0.00 C ATOM 0 H PHE A 127 133.386 -10.404 0.526 1.00 0.00 H new ATOM 0 HA PHE A 127 132.234 -8.569 1.353 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.662 -8.847 -0.780 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.554 -9.569 0.371 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.801 -6.587 -0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.180 -8.153 1.684 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.213 -4.328 0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.592 -5.890 2.515 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.113 -3.978 2.086 1.00 0.00 H new ATOM 1997 N ASP A 128 130.648 -9.277 3.309 1.00 0.00 N ATOM 1998 CA ASP A 128 130.114 -9.825 4.577 1.00 0.00 C ATOM 1999 C ASP A 128 131.270 -10.308 5.456 1.00 0.00 C ATOM 2000 O ASP A 128 131.068 -10.787 6.551 1.00 0.00 O ATOM 2001 CB ASP A 128 129.163 -10.982 4.268 1.00 0.00 C ATOM 2002 CG ASP A 128 128.443 -10.712 2.945 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.523 -9.911 2.946 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.822 -11.313 1.953 1.00 0.00 O ATOM 0 H ASP A 128 130.659 -8.259 3.253 1.00 0.00 H new ATOM 0 HA ASP A 128 129.568 -9.048 5.112 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.719 -11.917 4.207 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.437 -11.095 5.073 1.00 0.00 H new ATOM 2009 N ASP A 129 132.484 -10.169 4.994 1.00 0.00 N ATOM 2010 CA ASP A 129 133.649 -10.609 5.818 1.00 0.00 C ATOM 2011 C ASP A 129 134.352 -9.376 6.376 1.00 0.00 C ATOM 2012 O ASP A 129 134.778 -9.354 7.512 1.00 0.00 O ATOM 2013 CB ASP A 129 134.623 -11.409 4.949 1.00 0.00 C ATOM 2014 CG ASP A 129 134.556 -10.903 3.507 1.00 0.00 C ATOM 2015 OD1 ASP A 129 133.548 -11.144 2.862 1.00 0.00 O ATOM 2016 OD2 ASP A 129 135.513 -10.285 3.072 1.00 0.00 O ATOM 0 H ASP A 129 132.720 -9.771 4.085 1.00 0.00 H new ATOM 0 HA ASP A 129 133.304 -11.240 6.637 1.00 0.00 H new ATOM 0 HB2 ASP A 129 135.638 -11.308 5.334 1.00 0.00 H new ATOM 0 HB3 ASP A 129 134.373 -12.469 4.985 1.00 0.00 H new ATOM 2021 N ASP A 130 134.459 -8.342 5.595 1.00 0.00 N ATOM 2022 CA ASP A 130 135.112 -7.108 6.101 1.00 0.00 C ATOM 2023 C ASP A 130 134.113 -6.376 6.992 1.00 0.00 C ATOM 2024 O ASP A 130 134.475 -5.552 7.806 1.00 0.00 O ATOM 2025 CB ASP A 130 135.508 -6.215 4.927 1.00 0.00 C ATOM 2026 CG ASP A 130 136.827 -5.506 5.242 1.00 0.00 C ATOM 2027 OD1 ASP A 130 136.824 -4.651 6.112 1.00 0.00 O ATOM 2028 OD2 ASP A 130 137.817 -5.832 4.609 1.00 0.00 O ATOM 0 H ASP A 130 134.124 -8.297 4.633 1.00 0.00 H new ATOM 0 HA ASP A 130 136.010 -7.359 6.666 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.612 -6.813 4.022 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.726 -5.481 4.736 1.00 0.00 H new ATOM 2033 N GLU A 131 132.852 -6.681 6.844 1.00 0.00 N ATOM 2034 CA GLU A 131 131.818 -6.014 7.679 1.00 0.00 C ATOM 2035 C GLU A 131 132.225 -6.111 9.149 1.00 0.00 C ATOM 2036 O GLU A 131 131.895 -5.269 9.950 1.00 0.00 O ATOM 2037 CB GLU A 131 130.470 -6.708 7.471 1.00 0.00 C ATOM 2038 CG GLU A 131 129.649 -5.940 6.436 1.00 0.00 C ATOM 2039 CD GLU A 131 130.382 -5.960 5.094 1.00 0.00 C ATOM 2040 OE1 GLU A 131 131.572 -5.695 5.087 1.00 0.00 O ATOM 2041 OE2 GLU A 131 129.741 -6.244 4.097 1.00 0.00 O ATOM 0 H GLU A 131 132.495 -7.366 6.178 1.00 0.00 H new ATOM 0 HA GLU A 131 131.730 -4.966 7.392 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.626 -7.734 7.137 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.927 -6.759 8.415 1.00 0.00 H new ATOM 0 HG2 GLU A 131 128.662 -6.390 6.331 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.497 -4.912 6.765 1.00 0.00 H new ATOM 2048 N LYS A 132 132.950 -7.122 9.514 1.00 0.00 N ATOM 2049 CA LYS A 132 133.373 -7.236 10.934 1.00 0.00 C ATOM 2050 C LYS A 132 134.326 -6.082 11.249 1.00 0.00 C ATOM 2051 O LYS A 132 134.118 -5.327 12.178 1.00 0.00 O ATOM 2052 CB LYS A 132 134.068 -8.581 11.146 1.00 0.00 C ATOM 2053 CG LYS A 132 133.364 -9.642 10.294 1.00 0.00 C ATOM 2054 CD LYS A 132 133.125 -10.903 11.124 1.00 0.00 C ATOM 2055 CE LYS A 132 132.737 -12.065 10.206 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.433 -13.305 10.654 1.00 0.00 N ATOM 0 H LYS A 132 133.268 -7.871 8.898 1.00 0.00 H new ATOM 0 HA LYS A 132 132.511 -7.183 11.598 1.00 0.00 H new ATOM 0 HB2 LYS A 132 135.119 -8.510 10.867 1.00 0.00 H new ATOM 0 HB3 LYS A 132 134.035 -8.860 12.199 1.00 0.00 H new ATOM 0 HG2 LYS A 132 132.415 -9.253 9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.971 -9.881 9.421 1.00 0.00 H new ATOM 0 HD2 LYS A 132 134.025 -11.156 11.685 1.00 0.00 H new ATOM 0 HD3 LYS A 132 132.335 -10.725 11.853 1.00 0.00 H new ATOM 0 HE2 LYS A 132 131.657 -12.214 10.226 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.008 -11.835 9.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 133.170 -14.095 10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 134.462 -13.160 10.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 133.153 -13.527 11.631 1.00 0.00 H new ATOM 2070 N SER A 133 135.357 -5.922 10.465 1.00 0.00 N ATOM 2071 CA SER A 133 136.306 -4.799 10.705 1.00 0.00 C ATOM 2072 C SER A 133 135.693 -3.511 10.150 1.00 0.00 C ATOM 2073 O SER A 133 135.831 -2.444 10.721 1.00 0.00 O ATOM 2074 CB SER A 133 137.629 -5.085 9.993 1.00 0.00 C ATOM 2075 OG SER A 133 137.367 -5.746 8.762 1.00 0.00 O ATOM 0 H SER A 133 135.583 -6.520 9.670 1.00 0.00 H new ATOM 0 HA SER A 133 136.492 -4.692 11.774 1.00 0.00 H new ATOM 0 HB2 SER A 133 138.166 -4.154 9.812 1.00 0.00 H new ATOM 0 HB3 SER A 133 138.268 -5.704 10.623 1.00 0.00 H new ATOM 0 HG SER A 133 137.224 -5.080 8.057 1.00 0.00 H new ATOM 2081 N ALA A 134 134.999 -3.606 9.046 1.00 0.00 N ATOM 2082 CA ALA A 134 134.363 -2.396 8.462 1.00 0.00 C ATOM 2083 C ALA A 134 133.315 -1.890 9.446 1.00 0.00 C ATOM 2084 O ALA A 134 133.316 -0.738 9.832 1.00 0.00 O ATOM 2085 CB ALA A 134 133.697 -2.749 7.129 1.00 0.00 C ATOM 0 H ALA A 134 134.847 -4.470 8.526 1.00 0.00 H new ATOM 0 HA ALA A 134 135.113 -1.626 8.280 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.233 -1.858 6.707 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.448 -3.130 6.437 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.935 -3.511 7.293 1.00 0.00 H new ATOM 2091 N VAL A 135 132.432 -2.749 9.877 1.00 0.00 N ATOM 2092 CA VAL A 135 131.410 -2.310 10.858 1.00 0.00 C ATOM 2093 C VAL A 135 132.140 -1.640 12.021 1.00 0.00 C ATOM 2094 O VAL A 135 131.656 -0.699 12.613 1.00 0.00 O ATOM 2095 CB VAL A 135 130.602 -3.516 11.347 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.628 -3.080 12.443 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.812 -4.095 10.170 1.00 0.00 C ATOM 0 H VAL A 135 132.377 -3.727 9.593 1.00 0.00 H new ATOM 0 HA VAL A 135 130.713 -1.607 10.401 1.00 0.00 H new ATOM 0 HB VAL A 135 131.280 -4.269 11.750 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.057 -3.942 12.786 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.186 -2.658 13.279 1.00 0.00 H new ATOM 0 HG13 VAL A 135 128.946 -2.328 12.046 1.00 0.00 H new ATOM 0 HG21 VAL A 135 129.233 -4.955 10.508 1.00 0.00 H new ATOM 0 HG22 VAL A 135 129.137 -3.335 9.776 1.00 0.00 H new ATOM 0 HG23 VAL A 135 130.503 -4.408 9.387 1.00 0.00 H new ATOM 2107 N ARG A 136 133.318 -2.108 12.340 1.00 0.00 N ATOM 2108 CA ARG A 136 134.091 -1.479 13.449 1.00 0.00 C ATOM 2109 C ARG A 136 134.158 0.028 13.204 1.00 0.00 C ATOM 2110 O ARG A 136 133.812 0.830 14.051 1.00 0.00 O ATOM 2111 CB ARG A 136 135.520 -2.039 13.450 1.00 0.00 C ATOM 2112 CG ARG A 136 136.087 -2.055 14.880 1.00 0.00 C ATOM 2113 CD ARG A 136 136.482 -3.482 15.281 1.00 0.00 C ATOM 2114 NE ARG A 136 137.965 -3.572 15.400 1.00 0.00 N ATOM 2115 CZ ARG A 136 138.719 -3.409 14.347 1.00 0.00 C ATOM 2116 NH1 ARG A 136 138.176 -3.166 13.185 1.00 0.00 N ATOM 2117 NH2 ARG A 136 140.017 -3.488 14.455 1.00 0.00 N ATOM 0 H ARG A 136 133.776 -2.896 11.882 1.00 0.00 H new ATOM 0 HA ARG A 136 133.609 -1.690 14.404 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.522 -3.049 13.039 1.00 0.00 H new ATOM 0 HB3 ARG A 136 136.156 -1.432 12.806 1.00 0.00 H new ATOM 0 HG2 ARG A 136 136.956 -1.399 14.941 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.345 -1.667 15.577 1.00 0.00 H new ATOM 0 HD2 ARG A 136 136.014 -3.748 16.229 1.00 0.00 H new ATOM 0 HD3 ARG A 136 136.122 -4.193 14.537 1.00 0.00 H new ATOM 0 HE ARG A 136 138.392 -3.761 16.307 1.00 0.00 H new ATOM 0 HH11 ARG A 136 137.162 -3.103 13.099 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.766 -3.039 12.363 1.00 0.00 H new ATOM 0 HH21 ARG A 136 140.443 -3.677 15.362 1.00 0.00 H new ATOM 0 HH22 ARG A 136 140.606 -3.361 13.632 1.00 0.00 H new ATOM 2131 N GLU A 137 134.609 0.410 12.043 1.00 0.00 N ATOM 2132 CA GLU A 137 134.719 1.860 11.712 1.00 0.00 C ATOM 2133 C GLU A 137 133.335 2.440 11.402 1.00 0.00 C ATOM 2134 O GLU A 137 133.091 3.612 11.599 1.00 0.00 O ATOM 2135 CB GLU A 137 135.625 2.034 10.491 1.00 0.00 C ATOM 2136 CG GLU A 137 136.889 1.190 10.669 1.00 0.00 C ATOM 2137 CD GLU A 137 137.713 1.743 11.834 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.450 1.351 12.959 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.593 2.549 11.580 1.00 0.00 O ATOM 0 H GLU A 137 134.909 -0.224 11.302 1.00 0.00 H new ATOM 0 HA GLU A 137 135.142 2.387 12.567 1.00 0.00 H new ATOM 0 HB2 GLU A 137 135.097 1.731 9.587 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.890 3.084 10.368 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.621 0.151 10.860 1.00 0.00 H new ATOM 0 HG3 GLU A 137 137.480 1.203 9.753 1.00 0.00 H new ATOM 2146 N ILE A 138 132.429 1.641 10.908 1.00 0.00 N ATOM 2147 CA ILE A 138 131.072 2.171 10.582 1.00 0.00 C ATOM 2148 C ILE A 138 130.326 2.497 11.882 1.00 0.00 C ATOM 2149 O ILE A 138 129.859 3.598 12.084 1.00 0.00 O ATOM 2150 CB ILE A 138 130.300 1.118 9.766 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.639 1.787 8.555 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.216 0.452 10.625 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.615 1.813 7.374 1.00 0.00 C ATOM 0 H ILE A 138 132.567 0.649 10.716 1.00 0.00 H new ATOM 0 HA ILE A 138 131.159 3.083 9.991 1.00 0.00 H new ATOM 0 HB ILE A 138 131.005 0.357 9.433 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.735 1.245 8.278 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.337 2.803 8.810 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.683 -0.288 10.029 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.680 -0.038 11.481 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.514 1.208 10.976 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.138 2.290 6.518 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.507 2.375 7.651 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.896 0.793 7.111 1.00 0.00 H new ATOM 2165 N ALA A 139 130.212 1.545 12.761 1.00 0.00 N ATOM 2166 CA ALA A 139 129.501 1.785 14.045 1.00 0.00 C ATOM 2167 C ALA A 139 130.136 2.972 14.768 1.00 0.00 C ATOM 2168 O ALA A 139 129.455 3.814 15.318 1.00 0.00 O ATOM 2169 CB ALA A 139 129.622 0.538 14.921 1.00 0.00 C ATOM 0 H ALA A 139 130.584 0.602 12.644 1.00 0.00 H new ATOM 0 HA ALA A 139 128.451 2.001 13.848 1.00 0.00 H new ATOM 0 HB1 ALA A 139 129.103 0.705 15.865 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.175 -0.313 14.407 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.674 0.331 15.117 1.00 0.00 H new ATOM 2175 N ARG A 140 131.438 3.040 14.779 1.00 0.00 N ATOM 2176 CA ARG A 140 132.117 4.166 15.475 1.00 0.00 C ATOM 2177 C ARG A 140 131.972 5.448 14.650 1.00 0.00 C ATOM 2178 O ARG A 140 131.555 6.475 15.149 1.00 0.00 O ATOM 2179 CB ARG A 140 133.601 3.833 15.644 1.00 0.00 C ATOM 2180 CG ARG A 140 133.795 2.982 16.900 1.00 0.00 C ATOM 2181 CD ARG A 140 133.948 3.896 18.117 1.00 0.00 C ATOM 2182 NE ARG A 140 134.159 3.067 19.337 1.00 0.00 N ATOM 2183 CZ ARG A 140 133.853 3.546 20.512 1.00 0.00 C ATOM 2184 NH1 ARG A 140 133.361 4.750 20.617 1.00 0.00 N ATOM 2185 NH2 ARG A 140 134.038 2.820 21.581 1.00 0.00 N ATOM 0 H ARG A 140 132.060 2.364 14.336 1.00 0.00 H new ATOM 0 HA ARG A 140 131.660 4.316 16.453 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.966 3.296 14.768 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.184 4.751 15.721 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.943 2.317 17.037 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.678 2.351 16.792 1.00 0.00 H new ATOM 0 HD2 ARG A 140 134.791 4.572 17.974 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.059 4.515 18.234 1.00 0.00 H new ATOM 0 HE ARG A 140 134.542 2.125 19.254 1.00 0.00 H new ATOM 0 HH11 ARG A 140 133.216 5.316 19.781 1.00 0.00 H new ATOM 0 HH12 ARG A 140 133.122 5.125 21.535 1.00 0.00 H new ATOM 0 HH21 ARG A 140 134.422 1.879 21.498 1.00 0.00 H new ATOM 0 HH22 ARG A 140 133.799 3.194 22.499 1.00 0.00 H new ATOM 2199 N SER A 141 132.315 5.399 13.392 1.00 0.00 N ATOM 2200 CA SER A 141 132.199 6.615 12.538 1.00 0.00 C ATOM 2201 C SER A 141 130.771 7.156 12.616 1.00 0.00 C ATOM 2202 O SER A 141 130.553 8.340 12.783 1.00 0.00 O ATOM 2203 CB SER A 141 132.529 6.254 11.089 1.00 0.00 C ATOM 2204 OG SER A 141 133.832 5.690 11.031 1.00 0.00 O ATOM 0 H SER A 141 132.671 4.569 12.918 1.00 0.00 H new ATOM 0 HA SER A 141 132.896 7.375 12.890 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.796 5.546 10.703 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.476 7.142 10.460 1.00 0.00 H new ATOM 0 HG SER A 141 133.764 4.721 10.901 1.00 0.00 H new ATOM 2210 N LEU A 142 129.797 6.297 12.501 1.00 0.00 N ATOM 2211 CA LEU A 142 128.385 6.760 12.573 1.00 0.00 C ATOM 2212 C LEU A 142 127.935 6.759 14.036 1.00 0.00 C ATOM 2213 O LEU A 142 127.644 7.794 14.602 1.00 0.00 O ATOM 2214 CB LEU A 142 127.495 5.824 11.751 1.00 0.00 C ATOM 2215 CG LEU A 142 128.208 5.444 10.450 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.441 4.317 9.765 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.262 6.654 9.518 1.00 0.00 C ATOM 0 H LEU A 142 129.919 5.294 12.360 1.00 0.00 H new ATOM 0 HA LEU A 142 128.304 7.769 12.168 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.265 4.927 12.326 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.546 6.312 11.528 1.00 0.00 H new ATOM 0 HG LEU A 142 129.222 5.117 10.678 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.946 4.044 8.838 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.401 3.451 10.425 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.428 4.650 9.541 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.770 6.379 8.594 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.248 6.984 9.291 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.806 7.464 10.004 1.00 0.00 H new ATOM 2229 N GLY A 143 127.889 5.611 14.664 1.00 0.00 N ATOM 2230 CA GLY A 143 127.474 5.576 16.096 1.00 0.00 C ATOM 2231 C GLY A 143 126.704 4.289 16.414 1.00 0.00 C ATOM 2232 O GLY A 143 125.748 4.308 17.165 1.00 0.00 O ATOM 0 H GLY A 143 128.118 4.707 14.251 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.354 5.645 16.735 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.850 6.442 16.319 1.00 0.00 H new ATOM 2236 N PHE A 144 127.107 3.168 15.872 1.00 0.00 N ATOM 2237 CA PHE A 144 126.380 1.899 16.184 1.00 0.00 C ATOM 2238 C PHE A 144 127.268 0.994 17.041 1.00 0.00 C ATOM 2239 O PHE A 144 128.131 1.456 17.759 1.00 0.00 O ATOM 2240 CB PHE A 144 126.012 1.154 14.896 1.00 0.00 C ATOM 2241 CG PHE A 144 125.595 2.127 13.822 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.937 3.315 14.159 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.863 1.831 12.481 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.550 4.207 13.154 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.474 2.721 11.476 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.818 3.911 11.812 1.00 0.00 C ATOM 0 H PHE A 144 127.898 3.075 15.235 1.00 0.00 H new ATOM 0 HA PHE A 144 125.467 2.152 16.724 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.864 0.568 14.552 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.201 0.453 15.094 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.728 3.543 15.194 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.371 0.914 12.222 1.00 0.00 H new ATOM 0 HE1 PHE A 144 124.044 5.125 13.413 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.679 2.491 10.441 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.519 4.600 11.036 1.00 0.00 H new ATOM 2256 N ASP A 145 127.060 -0.295 16.968 1.00 0.00 N ATOM 2257 CA ASP A 145 127.888 -1.238 17.775 1.00 0.00 C ATOM 2258 C ASP A 145 129.278 -1.369 17.140 1.00 0.00 C ATOM 2259 O ASP A 145 129.415 -1.865 16.039 1.00 0.00 O ATOM 2260 CB ASP A 145 127.212 -2.611 17.801 1.00 0.00 C ATOM 2261 CG ASP A 145 127.528 -3.312 19.124 1.00 0.00 C ATOM 2262 OD1 ASP A 145 128.700 -3.486 19.413 1.00 0.00 O ATOM 2263 OD2 ASP A 145 126.593 -3.662 19.824 1.00 0.00 O ATOM 0 H ASP A 145 126.350 -0.736 16.383 1.00 0.00 H new ATOM 0 HA ASP A 145 127.986 -0.858 18.792 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.134 -2.499 17.685 1.00 0.00 H new ATOM 0 HB3 ASP A 145 127.562 -3.216 16.964 1.00 0.00 H new ATOM 2268 N PRO A 146 130.303 -0.926 17.823 1.00 0.00 N ATOM 2269 CA PRO A 146 131.700 -0.993 17.309 1.00 0.00 C ATOM 2270 C PRO A 146 132.061 -2.370 16.741 1.00 0.00 C ATOM 2271 O PRO A 146 132.667 -3.187 17.406 1.00 0.00 O ATOM 2272 CB PRO A 146 132.559 -0.686 18.536 1.00 0.00 C ATOM 2273 CG PRO A 146 131.687 0.113 19.445 1.00 0.00 C ATOM 2274 CD PRO A 146 130.244 -0.310 19.160 1.00 0.00 C ATOM 0 HA PRO A 146 131.849 -0.298 16.482 1.00 0.00 H new ATOM 0 HB2 PRO A 146 132.894 -1.604 19.020 1.00 0.00 H new ATOM 0 HB3 PRO A 146 133.453 -0.127 18.259 1.00 0.00 H new ATOM 0 HG2 PRO A 146 131.945 -0.071 20.488 1.00 0.00 H new ATOM 0 HG3 PRO A 146 131.819 1.180 19.268 1.00 0.00 H new ATOM 0 HD2 PRO A 146 129.881 -1.016 19.907 1.00 0.00 H new ATOM 0 HD3 PRO A 146 129.568 0.545 19.175 1.00 0.00 H new ATOM 2282 N ALA A 147 131.709 -2.626 15.510 1.00 0.00 N ATOM 2283 CA ALA A 147 132.046 -3.938 14.889 1.00 0.00 C ATOM 2284 C ALA A 147 131.355 -5.075 15.634 1.00 0.00 C ATOM 2285 O ALA A 147 131.638 -5.341 16.785 1.00 0.00 O ATOM 2286 CB ALA A 147 133.558 -4.154 14.942 1.00 0.00 C ATOM 0 H ALA A 147 131.201 -1.980 14.906 1.00 0.00 H new ATOM 0 HA ALA A 147 131.705 -3.931 13.854 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.805 -5.114 14.488 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.059 -3.355 14.396 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.890 -4.148 15.980 1.00 0.00 H new ATOM 2292 N GLU A 148 130.463 -5.759 14.978 1.00 0.00 N ATOM 2293 CA GLU A 148 129.764 -6.894 15.639 1.00 0.00 C ATOM 2294 C GLU A 148 128.688 -7.460 14.707 1.00 0.00 C ATOM 2295 O GLU A 148 127.719 -8.036 15.160 1.00 0.00 O ATOM 2296 CB GLU A 148 129.107 -6.407 16.938 1.00 0.00 C ATOM 2297 CG GLU A 148 129.508 -7.326 18.095 1.00 0.00 C ATOM 2298 CD GLU A 148 130.928 -6.985 18.550 1.00 0.00 C ATOM 2299 OE1 GLU A 148 131.858 -7.360 17.855 1.00 0.00 O ATOM 2300 OE2 GLU A 148 131.062 -6.356 19.587 1.00 0.00 O ATOM 0 H GLU A 148 130.187 -5.582 14.012 1.00 0.00 H new ATOM 0 HA GLU A 148 130.490 -7.675 15.866 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.414 -5.383 17.151 1.00 0.00 H new ATOM 0 HB3 GLU A 148 128.023 -6.398 16.827 1.00 0.00 H new ATOM 0 HG2 GLU A 148 128.811 -7.209 18.925 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.456 -8.368 17.780 1.00 0.00 H new ATOM 2307 N PHE A 149 128.845 -7.317 13.413 1.00 0.00 N ATOM 2308 CA PHE A 149 127.814 -7.863 12.481 1.00 0.00 C ATOM 2309 C PHE A 149 128.465 -8.884 11.549 1.00 0.00 C ATOM 2310 O PHE A 149 128.353 -10.078 11.746 1.00 0.00 O ATOM 2311 CB PHE A 149 127.193 -6.739 11.641 1.00 0.00 C ATOM 2312 CG PHE A 149 126.841 -5.553 12.514 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.455 -5.738 13.848 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.908 -4.261 11.983 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.141 -4.633 14.646 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.592 -3.156 12.780 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.210 -3.341 14.113 1.00 0.00 C ATOM 0 H PHE A 149 129.635 -6.850 12.967 1.00 0.00 H new ATOM 0 HA PHE A 149 127.029 -8.337 13.069 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.892 -6.430 10.863 1.00 0.00 H new ATOM 0 HB3 PHE A 149 126.298 -7.106 11.138 1.00 0.00 H new ATOM 0 HD1 PHE A 149 126.400 -6.735 14.261 1.00 0.00 H new ATOM 0 HD2 PHE A 149 127.205 -4.116 10.955 1.00 0.00 H new ATOM 0 HE1 PHE A 149 125.845 -4.777 15.675 1.00 0.00 H new ATOM 0 HE2 PHE A 149 126.643 -2.160 12.366 1.00 0.00 H new ATOM 0 HZ PHE A 149 125.969 -2.488 14.730 1.00 0.00 H new ATOM 2327 N GLY A 150 129.144 -8.426 10.535 1.00 0.00 N ATOM 2328 CA GLY A 150 129.799 -9.374 9.593 1.00 0.00 C ATOM 2329 C GLY A 150 128.725 -10.160 8.836 1.00 0.00 C ATOM 2330 O GLY A 150 128.997 -11.181 8.236 1.00 0.00 O ATOM 0 H GLY A 150 129.273 -7.438 10.318 1.00 0.00 H new ATOM 0 HA2 GLY A 150 130.430 -8.829 8.891 1.00 0.00 H new ATOM 0 HA3 GLY A 150 130.448 -10.058 10.140 1.00 0.00 H new