USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 962 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: B 94 SER OG : rot 170:sc= 0 USER MOD Set 1.2: B 100 HIS : no HD1:sc= -1.34 K(o=-1.3,f=0.4) USER MOD Set 2.1: B 49 GLN : amide:sc= 0.637 K(o=1,f=-7.1!) USER MOD Set 2.2: B 53 HIS : no HD1:sc= 0.383 K(o=1,f=-9.9!) USER MOD Set 3.1: B 24 ASN : amide:sc= 0.0542 K(o=-1.4,f=-0.37) USER MOD Set 3.2: B 30 GLN : amide:sc= -1.47 K(o=-1.4,f=-0.19) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 16 HIS : no HD1:sc= -0.291 K(o=-0.29,f=-1) USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 HIS : no HD1:sc= -0.965 K(o=-0.96,f=0.27) USER MOD Single : B 41 ASN : amide:sc= -0.152 K(o=-0.15,f=-1.6!) USER MOD Single : B 42 THR OG1 : rot -131:sc= 1.23 USER MOD Single : B 46 THR OG1 : rot 180:sc= -0.0269 USER MOD Single : B 48 LYS NZ :NH3+ 160:sc= -0.0549 (180deg=-0.448) USER MOD Single : B 52 HIS : no HD1:sc= -0.0807 X(o=-0.081,f=0) USER MOD Single : B 56 GLN : amide:sc= -1.53 K(o=-1.5,f=-0.26) USER MOD Single : B 57 MET CE :methyl 148:sc= -0.831 (180deg=-1.93!) USER MOD Single : B 62 SER OG : rot 83:sc= 1.12 USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 THR OG1 : rot 180:sc= 0.0988 USER MOD Single : B 80 GLN : amide:sc= -0.51 X(o=-0.51,f=-0.11) USER MOD Single : B 85 GLN : amide:sc= -1.47 K(o=-1.5,f=-0.53) USER MOD Single : B 102 MET CE :methyl -144:sc= -0.806 (180deg=-3.6!) USER MOD Single : B 103 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0947) USER MOD Single : B 104 ASN : amide:sc= -1.87! K(o=-1.9!,f=-1.1) USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 144:sc= 1.25 (180deg=0.73) USER MOD Single : B 110 SER OG : rot 180:sc= 0 USER MOD Single : B 117 LYS NZ :NH3+ -157:sc= 1.15 (180deg=0.709) USER MOD Single : B 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 126 N TRP B 9 -19.845 9.048 5.788 1.00 0.00 N ATOM 127 CA TRP B 9 -20.323 7.810 6.391 1.00 0.00 C ATOM 128 C TRP B 9 -20.364 7.896 7.910 1.00 0.00 C ATOM 129 O TRP B 9 -19.369 8.232 8.557 1.00 0.00 O ATOM 130 CB TRP B 9 -19.429 6.639 5.989 1.00 0.00 C ATOM 131 CG TRP B 9 -19.569 6.199 4.565 1.00 0.00 C ATOM 132 CD1 TRP B 9 -19.318 6.933 3.444 1.00 0.00 C ATOM 133 CD2 TRP B 9 -19.975 4.902 4.116 1.00 0.00 C ATOM 134 NE1 TRP B 9 -19.528 6.166 2.324 1.00 0.00 N ATOM 135 CE2 TRP B 9 -19.936 4.915 2.712 1.00 0.00 C ATOM 136 CE3 TRP B 9 -20.361 3.728 4.768 1.00 0.00 C ATOM 137 CZ2 TRP B 9 -20.272 3.798 1.951 1.00 0.00 C ATOM 138 CZ3 TRP B 9 -20.698 2.625 4.008 1.00 0.00 C ATOM 139 CH2 TRP B 9 -20.647 2.667 2.613 1.00 0.00 C ATOM 0 HA TRP B 9 -21.337 7.651 6.024 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -18.390 6.916 6.168 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -19.650 5.792 6.639 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -19.001 7.965 3.437 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -19.401 6.476 1.361 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -20.395 3.684 5.847 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -20.237 3.827 0.872 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -21.006 1.715 4.501 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -20.910 1.785 2.047 1.00 0.00 H new ATOM 150 N SER B 10 -21.526 7.600 8.465 1.00 0.00 N ATOM 151 CA SER B 10 -21.670 7.463 9.897 1.00 0.00 C ATOM 152 C SER B 10 -21.059 6.134 10.329 1.00 0.00 C ATOM 153 O SER B 10 -21.048 5.182 9.546 1.00 0.00 O ATOM 154 CB SER B 10 -23.149 7.522 10.272 1.00 0.00 C ATOM 155 OG SER B 10 -23.758 8.688 9.741 1.00 0.00 O ATOM 0 H SER B 10 -22.387 7.450 7.939 1.00 0.00 H new ATOM 0 HA SER B 10 -21.154 8.277 10.406 1.00 0.00 H new ATOM 0 HB2 SER B 10 -23.660 6.636 9.895 1.00 0.00 H new ATOM 0 HB3 SER B 10 -23.254 7.513 11.357 1.00 0.00 H new ATOM 0 HG SER B 10 -24.705 8.705 9.991 1.00 0.00 H new ATOM 161 N PRO B 11 -20.532 6.049 11.563 1.00 0.00 N ATOM 162 CA PRO B 11 -19.882 4.830 12.065 1.00 0.00 C ATOM 163 C PRO B 11 -20.744 3.581 11.873 1.00 0.00 C ATOM 164 O PRO B 11 -20.242 2.523 11.500 1.00 0.00 O ATOM 165 CB PRO B 11 -19.683 5.122 13.553 1.00 0.00 C ATOM 166 CG PRO B 11 -19.613 6.605 13.643 1.00 0.00 C ATOM 167 CD PRO B 11 -20.518 7.134 12.564 1.00 0.00 C ATOM 0 HA PRO B 11 -18.957 4.615 11.530 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -20.508 4.728 14.147 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -18.770 4.659 13.928 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -19.935 6.951 14.625 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -18.591 6.956 13.501 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -21.518 7.342 12.945 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -20.138 8.064 12.142 1.00 0.00 H new ATOM 175 N GLU B 12 -22.045 3.725 12.110 1.00 0.00 N ATOM 176 CA GLU B 12 -22.997 2.627 11.952 1.00 0.00 C ATOM 177 C GLU B 12 -22.989 2.086 10.520 1.00 0.00 C ATOM 178 O GLU B 12 -23.053 0.873 10.304 1.00 0.00 O ATOM 179 CB GLU B 12 -24.406 3.101 12.313 1.00 0.00 C ATOM 180 CG GLU B 12 -25.105 2.234 13.350 1.00 0.00 C ATOM 181 CD GLU B 12 -25.276 0.798 12.898 1.00 0.00 C ATOM 182 OE1 GLU B 12 -24.624 -0.096 13.479 1.00 0.00 O ATOM 183 OE2 GLU B 12 -26.065 0.551 11.960 1.00 0.00 O ATOM 0 H GLU B 12 -22.469 4.601 12.416 1.00 0.00 H new ATOM 0 HA GLU B 12 -22.696 1.823 12.624 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -24.349 4.123 12.688 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -25.013 3.127 11.408 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -24.532 2.252 14.277 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -26.084 2.659 13.572 1.00 0.00 H new ATOM 190 N GLU B 13 -22.892 2.987 9.545 1.00 0.00 N ATOM 191 CA GLU B 13 -22.941 2.592 8.144 1.00 0.00 C ATOM 192 C GLU B 13 -21.657 1.869 7.753 1.00 0.00 C ATOM 193 O GLU B 13 -21.687 0.901 6.999 1.00 0.00 O ATOM 194 CB GLU B 13 -23.169 3.806 7.237 1.00 0.00 C ATOM 195 CG GLU B 13 -23.632 3.434 5.833 1.00 0.00 C ATOM 196 CD GLU B 13 -24.954 2.690 5.841 1.00 0.00 C ATOM 197 OE1 GLU B 13 -26.014 3.350 5.770 1.00 0.00 O ATOM 198 OE2 GLU B 13 -24.945 1.441 5.920 1.00 0.00 O ATOM 0 H GLU B 13 -22.780 3.989 9.700 1.00 0.00 H new ATOM 0 HA GLU B 13 -23.782 1.911 8.013 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -23.912 4.458 7.696 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -22.243 4.377 7.167 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -23.731 4.339 5.234 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -22.873 2.816 5.354 1.00 0.00 H new ATOM 205 N GLU B 14 -20.524 2.322 8.283 1.00 0.00 N ATOM 206 CA GLU B 14 -19.253 1.657 8.013 1.00 0.00 C ATOM 207 C GLU B 14 -19.154 0.354 8.799 1.00 0.00 C ATOM 208 O GLU B 14 -18.479 -0.588 8.381 1.00 0.00 O ATOM 209 CB GLU B 14 -18.067 2.567 8.322 1.00 0.00 C ATOM 210 CG GLU B 14 -18.012 3.796 7.435 1.00 0.00 C ATOM 211 CD GLU B 14 -16.668 4.485 7.466 1.00 0.00 C ATOM 212 OE1 GLU B 14 -15.833 4.208 6.580 1.00 0.00 O ATOM 213 OE2 GLU B 14 -16.437 5.308 8.374 1.00 0.00 O ATOM 0 H GLU B 14 -20.459 3.136 8.894 1.00 0.00 H new ATOM 0 HA GLU B 14 -19.219 1.424 6.949 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -18.120 2.881 9.364 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -17.143 2.001 8.206 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -18.243 3.508 6.409 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -18.783 4.500 7.750 1.00 0.00 H new ATOM 220 N ALA B 15 -19.849 0.296 9.929 1.00 0.00 N ATOM 221 CA ALA B 15 -19.964 -0.938 10.691 1.00 0.00 C ATOM 222 C ALA B 15 -20.803 -1.946 9.913 1.00 0.00 C ATOM 223 O ALA B 15 -20.705 -3.150 10.122 1.00 0.00 O ATOM 224 CB ALA B 15 -20.574 -0.668 12.058 1.00 0.00 C ATOM 0 H ALA B 15 -20.341 1.091 10.337 1.00 0.00 H new ATOM 0 HA ALA B 15 -18.968 -1.354 10.845 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -20.652 -1.603 12.613 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -19.941 0.029 12.608 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -21.567 -0.236 11.934 1.00 0.00 H new ATOM 230 N HIS B 16 -21.615 -1.426 9.003 1.00 0.00 N ATOM 231 CA HIS B 16 -22.428 -2.237 8.112 1.00 0.00 C ATOM 232 C HIS B 16 -21.647 -2.518 6.829 1.00 0.00 C ATOM 233 O HIS B 16 -21.842 -3.542 6.175 1.00 0.00 O ATOM 234 CB HIS B 16 -23.749 -1.524 7.796 1.00 0.00 C ATOM 235 CG HIS B 16 -24.715 -2.351 6.999 1.00 0.00 C ATOM 236 ND1 HIS B 16 -25.659 -1.809 6.157 1.00 0.00 N ATOM 237 CD2 HIS B 16 -24.879 -3.693 6.923 1.00 0.00 C ATOM 238 CE1 HIS B 16 -26.357 -2.784 5.602 1.00 0.00 C ATOM 239 NE2 HIS B 16 -25.906 -3.934 6.052 1.00 0.00 N ATOM 0 H HIS B 16 -21.728 -0.422 8.863 1.00 0.00 H new ATOM 0 HA HIS B 16 -22.664 -3.183 8.600 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -24.224 -1.231 8.732 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -23.533 -0.607 7.247 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -24.304 -4.437 7.453 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -27.164 -2.657 4.896 1.00 0.00 H new ATOM 0 HE2 HIS B 16 -26.263 -4.854 5.794 1.00 0.00 H new ATOM 248 N LEU B 17 -20.755 -1.601 6.487 1.00 0.00 N ATOM 249 CA LEU B 17 -19.856 -1.785 5.362 1.00 0.00 C ATOM 250 C LEU B 17 -18.909 -2.937 5.653 1.00 0.00 C ATOM 251 O LEU B 17 -18.708 -3.820 4.820 1.00 0.00 O ATOM 252 CB LEU B 17 -19.062 -0.503 5.109 1.00 0.00 C ATOM 253 CG LEU B 17 -18.241 -0.486 3.823 1.00 0.00 C ATOM 254 CD1 LEU B 17 -19.143 -0.610 2.612 1.00 0.00 C ATOM 255 CD2 LEU B 17 -17.422 0.783 3.737 1.00 0.00 C ATOM 0 H LEU B 17 -20.635 -0.715 6.978 1.00 0.00 H new ATOM 0 HA LEU B 17 -20.439 -2.015 4.470 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -19.757 0.337 5.088 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -18.390 -0.339 5.951 1.00 0.00 H new ATOM 0 HG LEU B 17 -17.563 -1.340 3.838 1.00 0.00 H new ATOM 0 HD11 LEU B 17 -18.539 -0.596 1.705 1.00 0.00 H new ATOM 0 HD12 LEU B 17 -19.696 -1.548 2.665 1.00 0.00 H new ATOM 0 HD13 LEU B 17 -19.844 0.224 2.594 1.00 0.00 H new ATOM 0 HD21 LEU B 17 -16.842 0.780 2.814 1.00 0.00 H new ATOM 0 HD22 LEU B 17 -18.087 1.647 3.745 1.00 0.00 H new ATOM 0 HD23 LEU B 17 -16.746 0.838 4.590 1.00 0.00 H new ATOM 267 N ARG B 18 -18.347 -2.936 6.858 1.00 0.00 N ATOM 268 CA ARG B 18 -17.502 -4.024 7.293 1.00 0.00 C ATOM 269 C ARG B 18 -18.369 -5.238 7.549 1.00 0.00 C ATOM 270 O ARG B 18 -17.946 -6.362 7.344 1.00 0.00 O ATOM 271 CB ARG B 18 -16.719 -3.653 8.561 1.00 0.00 C ATOM 272 CG ARG B 18 -17.559 -3.636 9.830 1.00 0.00 C ATOM 273 CD ARG B 18 -16.746 -3.217 11.044 1.00 0.00 C ATOM 274 NE ARG B 18 -17.481 -3.440 12.290 1.00 0.00 N ATOM 275 CZ ARG B 18 -17.178 -2.860 13.453 1.00 0.00 C ATOM 276 NH1 ARG B 18 -16.204 -1.959 13.522 1.00 0.00 N ATOM 277 NH2 ARG B 18 -17.860 -3.175 14.547 1.00 0.00 N ATOM 0 H ARG B 18 -18.466 -2.191 7.544 1.00 0.00 H new ATOM 0 HA ARG B 18 -16.773 -4.241 6.512 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -15.901 -4.362 8.690 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -16.270 -2.669 8.423 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -18.397 -2.951 9.701 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -17.980 -4.627 10.000 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -15.811 -3.777 11.067 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -16.483 -2.162 10.960 1.00 0.00 H new ATOM 0 HE ARG B 18 -18.275 -4.079 12.268 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -15.682 -1.707 12.683 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -15.978 -1.520 14.414 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -18.615 -3.860 14.498 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -17.630 -2.733 15.437 1.00 0.00 H new ATOM 291 N GLU B 19 -19.606 -4.983 7.964 1.00 0.00 N ATOM 292 CA GLU B 19 -20.556 -6.041 8.270 1.00 0.00 C ATOM 293 C GLU B 19 -20.679 -6.997 7.089 1.00 0.00 C ATOM 294 O GLU B 19 -20.543 -8.215 7.226 1.00 0.00 O ATOM 295 CB GLU B 19 -21.921 -5.437 8.592 1.00 0.00 C ATOM 296 CG GLU B 19 -22.954 -6.439 9.056 1.00 0.00 C ATOM 297 CD GLU B 19 -22.604 -7.036 10.402 1.00 0.00 C ATOM 298 OE1 GLU B 19 -22.070 -8.161 10.440 1.00 0.00 O ATOM 299 OE2 GLU B 19 -22.854 -6.370 11.432 1.00 0.00 O ATOM 0 H GLU B 19 -19.974 -4.041 8.096 1.00 0.00 H new ATOM 0 HA GLU B 19 -20.196 -6.596 9.136 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -21.796 -4.678 9.365 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -22.298 -4.929 7.705 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -23.928 -5.953 9.118 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -23.042 -7.236 8.318 1.00 0.00 H new ATOM 306 N LEU B 20 -20.902 -6.415 5.921 1.00 0.00 N ATOM 307 CA LEU B 20 -21.084 -7.178 4.701 1.00 0.00 C ATOM 308 C LEU B 20 -19.750 -7.741 4.205 1.00 0.00 C ATOM 309 O LEU B 20 -19.711 -8.781 3.538 1.00 0.00 O ATOM 310 CB LEU B 20 -21.738 -6.284 3.644 1.00 0.00 C ATOM 311 CG LEU B 20 -23.052 -6.812 3.068 1.00 0.00 C ATOM 312 CD1 LEU B 20 -23.884 -5.674 2.508 1.00 0.00 C ATOM 313 CD2 LEU B 20 -22.771 -7.834 1.986 1.00 0.00 C ATOM 0 H LEU B 20 -20.961 -5.405 5.794 1.00 0.00 H new ATOM 0 HA LEU B 20 -21.737 -8.028 4.899 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -21.920 -5.303 4.083 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -21.033 -6.141 2.826 1.00 0.00 H new ATOM 0 HG LEU B 20 -23.615 -7.289 3.870 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -24.815 -6.069 2.103 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -24.108 -4.962 3.302 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -23.328 -5.172 1.716 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -23.713 -8.204 1.582 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -22.192 -7.369 1.188 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -22.206 -8.665 2.408 1.00 0.00 H new ATOM 325 N TYR B 21 -18.658 -7.070 4.561 1.00 0.00 N ATOM 326 CA TYR B 21 -17.325 -7.525 4.182 1.00 0.00 C ATOM 327 C TYR B 21 -16.954 -8.761 4.974 1.00 0.00 C ATOM 328 O TYR B 21 -16.579 -9.785 4.412 1.00 0.00 O ATOM 329 CB TYR B 21 -16.283 -6.428 4.427 1.00 0.00 C ATOM 330 CG TYR B 21 -14.854 -6.865 4.156 1.00 0.00 C ATOM 331 CD1 TYR B 21 -13.966 -7.090 5.201 1.00 0.00 C ATOM 332 CD2 TYR B 21 -14.397 -7.057 2.857 1.00 0.00 C ATOM 333 CE1 TYR B 21 -12.666 -7.494 4.958 1.00 0.00 C ATOM 334 CE2 TYR B 21 -13.100 -7.460 2.609 1.00 0.00 C ATOM 335 CZ TYR B 21 -12.239 -7.675 3.660 1.00 0.00 C ATOM 336 OH TYR B 21 -10.948 -8.079 3.410 1.00 0.00 O ATOM 0 H TYR B 21 -18.670 -6.211 5.110 1.00 0.00 H new ATOM 0 HA TYR B 21 -17.337 -7.763 3.118 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -16.517 -5.571 3.795 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -16.360 -6.092 5.461 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -14.296 -6.947 6.219 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -15.068 -6.888 2.028 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -11.989 -7.667 5.781 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -12.763 -7.606 1.593 1.00 0.00 H new ATOM 0 HH TYR B 21 -10.812 -8.160 2.443 1.00 0.00 H new ATOM 346 N LEU B 22 -17.089 -8.657 6.283 1.00 0.00 N ATOM 347 CA LEU B 22 -16.740 -9.739 7.191 1.00 0.00 C ATOM 348 C LEU B 22 -17.613 -10.966 6.940 1.00 0.00 C ATOM 349 O LEU B 22 -17.267 -12.079 7.337 1.00 0.00 O ATOM 350 CB LEU B 22 -16.890 -9.260 8.636 1.00 0.00 C ATOM 351 CG LEU B 22 -16.222 -7.914 8.938 1.00 0.00 C ATOM 352 CD1 LEU B 22 -16.573 -7.437 10.331 1.00 0.00 C ATOM 353 CD2 LEU B 22 -14.715 -7.992 8.776 1.00 0.00 C ATOM 0 H LEU B 22 -17.443 -7.822 6.749 1.00 0.00 H new ATOM 0 HA LEU B 22 -15.704 -10.027 7.013 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -17.952 -9.184 8.871 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.470 -10.015 9.300 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.604 -7.193 8.215 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -16.087 -6.480 10.521 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.653 -7.318 10.413 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -16.232 -8.169 11.063 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -14.274 -7.020 8.998 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -14.313 -8.738 9.462 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -14.473 -8.274 7.751 1.00 0.00 H new ATOM 365 N ALA B 23 -18.742 -10.751 6.275 1.00 0.00 N ATOM 366 CA ALA B 23 -19.652 -11.834 5.934 1.00 0.00 C ATOM 367 C ALA B 23 -19.183 -12.614 4.704 1.00 0.00 C ATOM 368 O ALA B 23 -19.305 -13.837 4.661 1.00 0.00 O ATOM 369 CB ALA B 23 -21.051 -11.283 5.704 1.00 0.00 C ATOM 0 H ALA B 23 -19.049 -9.831 5.960 1.00 0.00 H new ATOM 0 HA ALA B 23 -19.666 -12.529 6.773 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -21.726 -12.100 5.449 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -21.402 -10.791 6.611 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -21.028 -10.562 4.886 1.00 0.00 H new ATOM 375 N ASN B 24 -18.636 -11.919 3.707 1.00 0.00 N ATOM 376 CA ASN B 24 -18.279 -12.566 2.444 1.00 0.00 C ATOM 377 C ASN B 24 -16.771 -12.562 2.198 1.00 0.00 C ATOM 378 O ASN B 24 -16.324 -12.863 1.093 1.00 0.00 O ATOM 379 CB ASN B 24 -18.976 -11.869 1.271 1.00 0.00 C ATOM 380 CG ASN B 24 -20.486 -11.992 1.319 1.00 0.00 C ATOM 381 OD1 ASN B 24 -21.054 -12.962 0.820 1.00 0.00 O ATOM 382 ND2 ASN B 24 -21.148 -10.999 1.899 1.00 0.00 N ATOM 0 H ASN B 24 -18.432 -10.920 3.747 1.00 0.00 H new ATOM 0 HA ASN B 24 -18.611 -13.602 2.517 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -18.703 -10.814 1.269 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -18.612 -12.294 0.335 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -22.167 -11.022 1.943 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -20.638 -10.212 2.301 1.00 0.00 H new ATOM 389 N LYS B 25 -15.992 -12.240 3.221 1.00 0.00 N ATOM 390 CA LYS B 25 -14.542 -12.091 3.064 1.00 0.00 C ATOM 391 C LYS B 25 -13.853 -13.425 2.783 1.00 0.00 C ATOM 392 O LYS B 25 -12.792 -13.466 2.162 1.00 0.00 O ATOM 393 CB LYS B 25 -13.925 -11.447 4.312 1.00 0.00 C ATOM 394 CG LYS B 25 -14.217 -12.201 5.602 1.00 0.00 C ATOM 395 CD LYS B 25 -13.563 -11.540 6.807 1.00 0.00 C ATOM 396 CE LYS B 25 -12.048 -11.596 6.729 1.00 0.00 C ATOM 397 NZ LYS B 25 -11.411 -11.014 7.937 1.00 0.00 N ATOM 0 H LYS B 25 -16.333 -12.076 4.168 1.00 0.00 H new ATOM 0 HA LYS B 25 -14.383 -11.442 2.203 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -12.845 -11.379 4.178 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -14.299 -10.427 4.406 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -15.295 -12.252 5.757 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -13.859 -13.227 5.512 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -13.885 -10.501 6.871 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -13.898 -12.034 7.719 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -11.728 -12.632 6.613 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -11.710 -11.057 5.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -10.377 -11.071 7.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -11.696 -10.018 8.034 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -11.714 -11.544 8.779 1.00 0.00 H new ATOM 411 N ASP B 26 -14.459 -14.509 3.236 1.00 0.00 N ATOM 412 CA ASP B 26 -13.848 -15.825 3.117 1.00 0.00 C ATOM 413 C ASP B 26 -14.554 -16.652 2.044 1.00 0.00 C ATOM 414 O ASP B 26 -14.338 -17.862 1.926 1.00 0.00 O ATOM 415 CB ASP B 26 -13.900 -16.541 4.469 1.00 0.00 C ATOM 416 CG ASP B 26 -12.901 -17.680 4.571 1.00 0.00 C ATOM 417 OD1 ASP B 26 -11.684 -17.415 4.480 1.00 0.00 O ATOM 418 OD2 ASP B 26 -13.325 -18.837 4.775 1.00 0.00 O ATOM 0 H ASP B 26 -15.373 -14.506 3.689 1.00 0.00 H new ATOM 0 HA ASP B 26 -12.807 -15.705 2.818 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -13.705 -15.821 5.264 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -14.905 -16.930 4.630 1.00 0.00 H new ATOM 423 N VAL B 27 -15.391 -15.992 1.255 1.00 0.00 N ATOM 424 CA VAL B 27 -16.119 -16.659 0.189 1.00 0.00 C ATOM 425 C VAL B 27 -15.354 -16.548 -1.119 1.00 0.00 C ATOM 426 O VAL B 27 -15.275 -15.476 -1.721 1.00 0.00 O ATOM 427 CB VAL B 27 -17.537 -16.074 0.010 1.00 0.00 C ATOM 428 CG1 VAL B 27 -18.290 -16.808 -1.090 1.00 0.00 C ATOM 429 CG2 VAL B 27 -18.313 -16.132 1.317 1.00 0.00 C ATOM 0 H VAL B 27 -15.582 -14.993 1.335 1.00 0.00 H new ATOM 0 HA VAL B 27 -16.218 -17.708 0.469 1.00 0.00 H new ATOM 0 HB VAL B 27 -17.436 -15.029 -0.283 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -19.286 -16.379 -1.198 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -17.748 -16.709 -2.031 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -18.376 -17.863 -0.830 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -19.309 -15.715 1.168 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -18.399 -17.168 1.643 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -17.788 -15.554 2.078 1.00 0.00 H new ATOM 439 N GLU B 28 -14.785 -17.658 -1.551 1.00 0.00 N ATOM 440 CA GLU B 28 -14.024 -17.687 -2.783 1.00 0.00 C ATOM 441 C GLU B 28 -14.947 -17.942 -3.963 1.00 0.00 C ATOM 442 O GLU B 28 -15.968 -18.619 -3.834 1.00 0.00 O ATOM 443 CB GLU B 28 -12.936 -18.754 -2.713 1.00 0.00 C ATOM 444 CG GLU B 28 -11.905 -18.483 -1.634 1.00 0.00 C ATOM 445 CD GLU B 28 -10.877 -19.582 -1.538 1.00 0.00 C ATOM 446 OE1 GLU B 28 -11.070 -20.512 -0.727 1.00 0.00 O ATOM 447 OE2 GLU B 28 -9.873 -19.526 -2.278 1.00 0.00 O ATOM 0 H GLU B 28 -14.837 -18.553 -1.064 1.00 0.00 H new ATOM 0 HA GLU B 28 -13.544 -16.718 -2.920 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -13.398 -19.724 -2.530 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -12.434 -18.817 -3.679 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -11.405 -17.537 -1.842 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -12.408 -18.373 -0.673 1.00 0.00 H new ATOM 454 N GLY B 29 -14.592 -17.378 -5.103 1.00 0.00 N ATOM 455 CA GLY B 29 -15.422 -17.508 -6.282 1.00 0.00 C ATOM 456 C GLY B 29 -16.395 -16.359 -6.404 1.00 0.00 C ATOM 457 O GLY B 29 -17.135 -16.254 -7.381 1.00 0.00 O ATOM 0 H GLY B 29 -13.742 -16.830 -5.235 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -14.791 -17.547 -7.170 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -15.971 -18.448 -6.239 1.00 0.00 H new ATOM 461 N GLN B 30 -16.391 -15.492 -5.406 1.00 0.00 N ATOM 462 CA GLN B 30 -17.267 -14.340 -5.390 1.00 0.00 C ATOM 463 C GLN B 30 -16.478 -13.082 -5.071 1.00 0.00 C ATOM 464 O GLN B 30 -15.489 -13.125 -4.338 1.00 0.00 O ATOM 465 CB GLN B 30 -18.371 -14.512 -4.345 1.00 0.00 C ATOM 466 CG GLN B 30 -19.316 -13.324 -4.272 1.00 0.00 C ATOM 467 CD GLN B 30 -20.108 -13.275 -2.995 1.00 0.00 C ATOM 468 OE1 GLN B 30 -21.185 -13.859 -2.881 1.00 0.00 O ATOM 469 NE2 GLN B 30 -19.586 -12.550 -2.036 1.00 0.00 N ATOM 0 H GLN B 30 -15.783 -15.568 -4.590 1.00 0.00 H new ATOM 0 HA GLN B 30 -17.719 -14.250 -6.378 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -18.944 -15.410 -4.575 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -17.916 -14.667 -3.367 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -18.741 -12.404 -4.371 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -20.003 -13.362 -5.117 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -18.690 -12.085 -2.179 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -20.076 -12.451 -1.147 1.00 0.00 H new ATOM 478 N ASP B 31 -16.911 -11.970 -5.631 1.00 0.00 N ATOM 479 CA ASP B 31 -16.376 -10.677 -5.256 1.00 0.00 C ATOM 480 C ASP B 31 -16.951 -10.256 -3.922 1.00 0.00 C ATOM 481 O ASP B 31 -18.141 -9.951 -3.835 1.00 0.00 O ATOM 482 CB ASP B 31 -16.744 -9.616 -6.288 1.00 0.00 C ATOM 483 CG ASP B 31 -16.018 -9.783 -7.607 1.00 0.00 C ATOM 484 OD1 ASP B 31 -14.944 -9.170 -7.777 1.00 0.00 O ATOM 485 OD2 ASP B 31 -16.523 -10.511 -8.485 1.00 0.00 O ATOM 0 H ASP B 31 -17.634 -11.936 -6.350 1.00 0.00 H new ATOM 0 HA ASP B 31 -15.291 -10.766 -5.197 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -17.819 -9.650 -6.466 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -16.520 -8.630 -5.881 1.00 0.00 H new ATOM 490 N VAL B 32 -16.134 -10.257 -2.880 1.00 0.00 N ATOM 491 CA VAL B 32 -16.554 -9.669 -1.617 1.00 0.00 C ATOM 492 C VAL B 32 -16.892 -8.204 -1.871 1.00 0.00 C ATOM 493 O VAL B 32 -17.838 -7.659 -1.317 1.00 0.00 O ATOM 494 CB VAL B 32 -15.461 -9.776 -0.524 1.00 0.00 C ATOM 495 CG1 VAL B 32 -14.282 -8.865 -0.830 1.00 0.00 C ATOM 496 CG2 VAL B 32 -16.041 -9.464 0.846 1.00 0.00 C ATOM 0 H VAL B 32 -15.193 -10.651 -2.881 1.00 0.00 H new ATOM 0 HA VAL B 32 -17.421 -10.216 -1.247 1.00 0.00 H new ATOM 0 HB VAL B 32 -15.094 -10.802 -0.518 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -13.533 -8.963 -0.044 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -13.843 -9.147 -1.787 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -14.624 -7.831 -0.878 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -15.258 -9.545 1.600 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -16.444 -8.451 0.848 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -16.838 -10.172 1.074 1.00 0.00 H new ATOM 506 N VAL B 33 -16.117 -7.615 -2.778 1.00 0.00 N ATOM 507 CA VAL B 33 -16.278 -6.240 -3.203 1.00 0.00 C ATOM 508 C VAL B 33 -17.701 -5.988 -3.659 1.00 0.00 C ATOM 509 O VAL B 33 -18.411 -5.165 -3.085 1.00 0.00 O ATOM 510 CB VAL B 33 -15.337 -5.927 -4.383 1.00 0.00 C ATOM 511 CG1 VAL B 33 -15.191 -4.431 -4.590 1.00 0.00 C ATOM 512 CG2 VAL B 33 -13.989 -6.603 -4.198 1.00 0.00 C ATOM 0 H VAL B 33 -15.347 -8.095 -3.243 1.00 0.00 H new ATOM 0 HA VAL B 33 -16.039 -5.602 -2.352 1.00 0.00 H new ATOM 0 HB VAL B 33 -15.787 -6.335 -5.288 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -14.521 -4.243 -5.429 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -16.168 -3.996 -4.801 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -14.779 -3.977 -3.689 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -13.344 -6.366 -5.044 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -13.526 -6.246 -3.278 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -14.128 -7.682 -4.139 1.00 0.00 H new ATOM 522 N GLU B 34 -18.119 -6.732 -4.680 1.00 0.00 N ATOM 523 CA GLU B 34 -19.424 -6.530 -5.271 1.00 0.00 C ATOM 524 C GLU B 34 -20.521 -6.929 -4.303 1.00 0.00 C ATOM 525 O GLU B 34 -21.566 -6.296 -4.266 1.00 0.00 O ATOM 526 CB GLU B 34 -19.578 -7.292 -6.586 1.00 0.00 C ATOM 527 CG GLU B 34 -20.872 -6.948 -7.301 1.00 0.00 C ATOM 528 CD GLU B 34 -20.953 -7.519 -8.699 1.00 0.00 C ATOM 529 OE1 GLU B 34 -21.068 -8.753 -8.844 1.00 0.00 O ATOM 530 OE2 GLU B 34 -20.921 -6.729 -9.666 1.00 0.00 O ATOM 0 H GLU B 34 -17.569 -7.476 -5.109 1.00 0.00 H new ATOM 0 HA GLU B 34 -19.516 -5.466 -5.490 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.734 -7.064 -7.237 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.548 -8.364 -6.388 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.713 -7.320 -6.715 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.974 -5.864 -7.352 1.00 0.00 H new ATOM 537 N ALA B 35 -20.274 -7.957 -3.500 1.00 0.00 N ATOM 538 CA ALA B 35 -21.255 -8.381 -2.503 1.00 0.00 C ATOM 539 C ALA B 35 -21.622 -7.208 -1.605 1.00 0.00 C ATOM 540 O ALA B 35 -22.791 -6.973 -1.293 1.00 0.00 O ATOM 541 CB ALA B 35 -20.711 -9.527 -1.666 1.00 0.00 C ATOM 0 H ALA B 35 -19.415 -8.507 -3.517 1.00 0.00 H new ATOM 0 HA ALA B 35 -22.148 -8.728 -3.023 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -21.457 -9.827 -0.930 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -20.480 -10.373 -2.314 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -19.805 -9.205 -1.153 1.00 0.00 H new ATOM 547 N ILE B 36 -20.605 -6.457 -1.230 1.00 0.00 N ATOM 548 CA ILE B 36 -20.765 -5.301 -0.374 1.00 0.00 C ATOM 549 C ILE B 36 -21.412 -4.144 -1.124 1.00 0.00 C ATOM 550 O ILE B 36 -22.512 -3.703 -0.783 1.00 0.00 O ATOM 551 CB ILE B 36 -19.396 -4.847 0.147 1.00 0.00 C ATOM 552 CG1 ILE B 36 -18.745 -5.960 0.951 1.00 0.00 C ATOM 553 CG2 ILE B 36 -19.533 -3.594 0.987 1.00 0.00 C ATOM 554 CD1 ILE B 36 -17.279 -5.723 1.200 1.00 0.00 C ATOM 0 H ILE B 36 -19.641 -6.633 -1.512 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.410 -5.588 0.456 1.00 0.00 H new ATOM 0 HB ILE B 36 -18.759 -4.616 -0.707 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -19.259 -6.059 1.907 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -18.870 -6.905 0.422 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -18.551 -3.288 1.347 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -19.962 -2.795 0.382 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -20.185 -3.795 1.837 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -16.870 -6.551 1.779 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -16.755 -5.652 0.247 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -17.150 -4.794 1.755 1.00 0.00 H new ATOM 566 N LEU B 37 -20.726 -3.677 -2.161 1.00 0.00 N ATOM 567 CA LEU B 37 -21.131 -2.466 -2.874 1.00 0.00 C ATOM 568 C LEU B 37 -22.495 -2.609 -3.552 1.00 0.00 C ATOM 569 O LEU B 37 -23.132 -1.613 -3.890 1.00 0.00 O ATOM 570 CB LEU B 37 -20.045 -2.039 -3.876 1.00 0.00 C ATOM 571 CG LEU B 37 -19.520 -3.115 -4.834 1.00 0.00 C ATOM 572 CD1 LEU B 37 -20.520 -3.403 -5.945 1.00 0.00 C ATOM 573 CD2 LEU B 37 -18.187 -2.688 -5.419 1.00 0.00 C ATOM 0 H LEU B 37 -19.884 -4.119 -2.529 1.00 0.00 H new ATOM 0 HA LEU B 37 -21.243 -1.677 -2.130 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -20.440 -1.217 -4.473 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -19.199 -1.646 -3.312 1.00 0.00 H new ATOM 0 HG LEU B 37 -19.380 -4.035 -4.266 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -20.118 -4.170 -6.607 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -21.456 -3.754 -5.510 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -20.703 -2.492 -6.515 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -17.824 -3.460 -6.098 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -18.312 -1.753 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -17.466 -2.544 -4.614 1.00 0.00 H new ATOM 585 N ALA B 38 -22.933 -3.841 -3.750 1.00 0.00 N ATOM 586 CA ALA B 38 -24.225 -4.103 -4.366 1.00 0.00 C ATOM 587 C ALA B 38 -25.357 -3.991 -3.357 1.00 0.00 C ATOM 588 O ALA B 38 -26.349 -3.304 -3.599 1.00 0.00 O ATOM 589 CB ALA B 38 -24.236 -5.483 -4.981 1.00 0.00 C ATOM 0 H ALA B 38 -22.411 -4.679 -3.492 1.00 0.00 H new ATOM 0 HA ALA B 38 -24.380 -3.352 -5.140 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -25.207 -5.669 -5.439 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -23.457 -5.549 -5.741 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -24.051 -6.228 -4.207 1.00 0.00 H new ATOM 595 N HIS B 39 -25.210 -4.669 -2.224 1.00 0.00 N ATOM 596 CA HIS B 39 -26.289 -4.741 -1.246 1.00 0.00 C ATOM 597 C HIS B 39 -26.413 -3.437 -0.480 1.00 0.00 C ATOM 598 O HIS B 39 -27.503 -3.061 -0.046 1.00 0.00 O ATOM 599 CB HIS B 39 -26.071 -5.895 -0.263 1.00 0.00 C ATOM 600 CG HIS B 39 -26.281 -7.255 -0.857 1.00 0.00 C ATOM 601 ND1 HIS B 39 -27.391 -8.029 -0.592 1.00 0.00 N ATOM 602 CD2 HIS B 39 -25.510 -7.987 -1.696 1.00 0.00 C ATOM 603 CE1 HIS B 39 -27.291 -9.174 -1.240 1.00 0.00 C ATOM 604 NE2 HIS B 39 -26.161 -9.174 -1.918 1.00 0.00 N ATOM 0 H HIS B 39 -24.362 -5.172 -1.962 1.00 0.00 H new ATOM 0 HA HIS B 39 -27.213 -4.920 -1.795 1.00 0.00 H new ATOM 0 HB2 HIS B 39 -25.056 -5.835 0.131 1.00 0.00 H new ATOM 0 HB3 HIS B 39 -26.749 -5.771 0.582 1.00 0.00 H new ATOM 0 HD2 HIS B 39 -24.559 -7.691 -2.113 1.00 0.00 H new ATOM 0 HE1 HIS B 39 -28.014 -9.976 -1.218 1.00 0.00 H new ATOM 0 HE2 HIS B 39 -25.825 -9.933 -2.511 1.00 0.00 H new ATOM 613 N LEU B 40 -25.301 -2.735 -0.327 1.00 0.00 N ATOM 614 CA LEU B 40 -25.309 -1.478 0.394 1.00 0.00 C ATOM 615 C LEU B 40 -25.629 -0.315 -0.527 1.00 0.00 C ATOM 616 O LEU B 40 -24.734 0.419 -0.944 1.00 0.00 O ATOM 617 CB LEU B 40 -23.963 -1.230 1.065 1.00 0.00 C ATOM 618 CG LEU B 40 -23.718 -2.024 2.340 1.00 0.00 C ATOM 619 CD1 LEU B 40 -22.328 -2.619 2.322 1.00 0.00 C ATOM 620 CD2 LEU B 40 -23.890 -1.131 3.553 1.00 0.00 C ATOM 0 H LEU B 40 -24.390 -3.014 -0.690 1.00 0.00 H new ATOM 0 HA LEU B 40 -26.086 -1.549 1.155 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -23.172 -1.464 0.353 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -23.881 -0.168 1.296 1.00 0.00 H new ATOM 0 HG LEU B 40 -24.446 -2.834 2.396 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -22.163 -3.185 3.239 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -22.227 -3.282 1.463 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -21.591 -1.819 2.252 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -23.712 -1.710 4.459 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -23.177 -0.308 3.503 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -24.904 -0.732 3.570 1.00 0.00 H new ATOM 632 N ASN B 41 -26.901 -0.136 -0.832 1.00 0.00 N ATOM 633 CA ASN B 41 -27.334 1.040 -1.569 1.00 0.00 C ATOM 634 C ASN B 41 -28.151 1.927 -0.649 1.00 0.00 C ATOM 635 O ASN B 41 -29.108 2.584 -1.055 1.00 0.00 O ATOM 636 CB ASN B 41 -28.124 0.646 -2.820 1.00 0.00 C ATOM 637 CG ASN B 41 -27.216 0.193 -3.950 1.00 0.00 C ATOM 638 OD1 ASN B 41 -26.073 0.638 -4.063 1.00 0.00 O ATOM 639 ND2 ASN B 41 -27.715 -0.690 -4.799 1.00 0.00 N ATOM 0 H ASN B 41 -27.649 -0.784 -0.584 1.00 0.00 H new ATOM 0 HA ASN B 41 -26.461 1.596 -1.911 1.00 0.00 H new ATOM 0 HB2 ASN B 41 -28.820 -0.155 -2.571 1.00 0.00 H new ATOM 0 HB3 ASN B 41 -28.721 1.495 -3.153 1.00 0.00 H new ATOM 0 HD21 ASN B 41 -27.149 -1.024 -5.579 1.00 0.00 H new ATOM 0 HD22 ASN B 41 -28.666 -1.037 -4.674 1.00 0.00 H new ATOM 646 N THR B 42 -27.710 1.955 0.600 1.00 0.00 N ATOM 647 CA THR B 42 -28.247 2.848 1.608 1.00 0.00 C ATOM 648 C THR B 42 -27.589 4.217 1.461 1.00 0.00 C ATOM 649 O THR B 42 -28.187 5.257 1.727 1.00 0.00 O ATOM 650 CB THR B 42 -28.027 2.268 3.033 1.00 0.00 C ATOM 651 OG1 THR B 42 -28.157 3.284 4.037 1.00 0.00 O ATOM 652 CG2 THR B 42 -26.667 1.581 3.160 1.00 0.00 C ATOM 0 H THR B 42 -26.962 1.352 0.942 1.00 0.00 H new ATOM 0 HA THR B 42 -29.322 2.953 1.465 1.00 0.00 H new ATOM 0 HB THR B 42 -28.804 1.520 3.191 1.00 0.00 H new ATOM 0 HG1 THR B 42 -27.389 3.244 4.644 1.00 0.00 H new ATOM 0 HG21 THR B 42 -26.551 1.189 4.170 1.00 0.00 H new ATOM 0 HG22 THR B 42 -26.605 0.762 2.443 1.00 0.00 H new ATOM 0 HG23 THR B 42 -25.875 2.302 2.957 1.00 0.00 H new ATOM 660 N VAL B 43 -26.350 4.190 0.996 1.00 0.00 N ATOM 661 CA VAL B 43 -25.615 5.395 0.664 1.00 0.00 C ATOM 662 C VAL B 43 -25.425 5.456 -0.843 1.00 0.00 C ATOM 663 O VAL B 43 -24.819 4.557 -1.418 1.00 0.00 O ATOM 664 CB VAL B 43 -24.224 5.426 1.341 1.00 0.00 C ATOM 665 CG1 VAL B 43 -24.143 6.532 2.377 1.00 0.00 C ATOM 666 CG2 VAL B 43 -23.894 4.085 1.976 1.00 0.00 C ATOM 0 H VAL B 43 -25.827 3.329 0.839 1.00 0.00 H new ATOM 0 HA VAL B 43 -26.188 6.249 1.024 1.00 0.00 H new ATOM 0 HB VAL B 43 -23.487 5.629 0.564 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -23.154 6.529 2.836 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -24.317 7.495 1.896 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -24.899 6.368 3.144 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -22.911 4.136 2.444 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -24.643 3.846 2.731 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -23.891 3.310 1.209 1.00 0.00 H new ATOM 676 N PRO B 44 -25.967 6.477 -1.517 1.00 0.00 N ATOM 677 CA PRO B 44 -25.788 6.640 -2.954 1.00 0.00 C ATOM 678 C PRO B 44 -24.434 7.257 -3.283 1.00 0.00 C ATOM 679 O PRO B 44 -24.215 8.454 -3.095 1.00 0.00 O ATOM 680 CB PRO B 44 -26.931 7.577 -3.374 1.00 0.00 C ATOM 681 CG PRO B 44 -27.689 7.908 -2.121 1.00 0.00 C ATOM 682 CD PRO B 44 -26.807 7.538 -0.959 1.00 0.00 C ATOM 0 HA PRO B 44 -25.811 5.685 -3.479 1.00 0.00 H new ATOM 0 HB2 PRO B 44 -26.540 8.481 -3.842 1.00 0.00 H new ATOM 0 HB3 PRO B 44 -27.580 7.095 -4.105 1.00 0.00 H new ATOM 0 HG2 PRO B 44 -27.940 8.968 -2.092 1.00 0.00 H new ATOM 0 HG3 PRO B 44 -28.629 7.357 -2.082 1.00 0.00 H new ATOM 0 HD2 PRO B 44 -26.214 8.385 -0.615 1.00 0.00 H new ATOM 0 HD3 PRO B 44 -27.388 7.188 -0.105 1.00 0.00 H new ATOM 690 N ARG B 45 -23.522 6.415 -3.744 1.00 0.00 N ATOM 691 CA ARG B 45 -22.151 6.825 -4.024 1.00 0.00 C ATOM 692 C ARG B 45 -21.573 5.945 -5.117 1.00 0.00 C ATOM 693 O ARG B 45 -22.232 5.020 -5.590 1.00 0.00 O ATOM 694 CB ARG B 45 -21.256 6.702 -2.781 1.00 0.00 C ATOM 695 CG ARG B 45 -21.981 6.323 -1.501 1.00 0.00 C ATOM 696 CD ARG B 45 -21.308 5.155 -0.794 1.00 0.00 C ATOM 697 NE ARG B 45 -22.064 3.904 -0.922 1.00 0.00 N ATOM 698 CZ ARG B 45 -22.219 3.206 -2.058 1.00 0.00 C ATOM 699 NH1 ARG B 45 -21.558 3.535 -3.157 1.00 0.00 N ATOM 700 NH2 ARG B 45 -23.007 2.142 -2.083 1.00 0.00 N ATOM 0 H ARG B 45 -23.709 5.431 -3.935 1.00 0.00 H new ATOM 0 HA ARG B 45 -22.177 7.869 -4.335 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -20.486 5.956 -2.979 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -20.746 7.652 -2.624 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -22.012 7.183 -0.833 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -23.014 6.062 -1.732 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -20.308 5.014 -1.205 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -21.188 5.396 0.262 1.00 0.00 H new ATOM 0 HE ARG B 45 -22.507 3.535 -0.081 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -20.919 4.330 -3.149 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -21.688 2.993 -4.012 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -23.498 1.851 -1.238 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -23.123 1.613 -2.948 1.00 0.00 H new ATOM 714 N THR B 46 -20.342 6.220 -5.513 1.00 0.00 N ATOM 715 CA THR B 46 -19.645 5.350 -6.442 1.00 0.00 C ATOM 716 C THR B 46 -19.119 4.124 -5.688 1.00 0.00 C ATOM 717 O THR B 46 -19.027 4.140 -4.456 1.00 0.00 O ATOM 718 CB THR B 46 -18.482 6.083 -7.149 1.00 0.00 C ATOM 719 OG1 THR B 46 -17.892 5.230 -8.138 1.00 0.00 O ATOM 720 CG2 THR B 46 -17.420 6.520 -6.151 1.00 0.00 C ATOM 0 H THR B 46 -19.808 7.034 -5.208 1.00 0.00 H new ATOM 0 HA THR B 46 -20.348 5.037 -7.214 1.00 0.00 H new ATOM 0 HB THR B 46 -18.888 6.973 -7.630 1.00 0.00 H new ATOM 0 HG1 THR B 46 -17.157 5.703 -8.582 1.00 0.00 H new ATOM 0 HG21 THR B 46 -16.615 7.033 -6.677 1.00 0.00 H new ATOM 0 HG22 THR B 46 -17.864 7.196 -5.420 1.00 0.00 H new ATOM 0 HG23 THR B 46 -17.019 5.645 -5.639 1.00 0.00 H new ATOM 728 N ARG B 47 -18.780 3.070 -6.417 1.00 0.00 N ATOM 729 CA ARG B 47 -18.303 1.832 -5.802 1.00 0.00 C ATOM 730 C ARG B 47 -16.946 2.050 -5.134 1.00 0.00 C ATOM 731 O ARG B 47 -16.626 1.412 -4.130 1.00 0.00 O ATOM 732 CB ARG B 47 -18.224 0.708 -6.843 1.00 0.00 C ATOM 733 CG ARG B 47 -19.552 -0.010 -7.088 1.00 0.00 C ATOM 734 CD ARG B 47 -20.657 0.935 -7.530 1.00 0.00 C ATOM 735 NE ARG B 47 -20.346 1.594 -8.793 1.00 0.00 N ATOM 736 CZ ARG B 47 -21.128 2.509 -9.360 1.00 0.00 C ATOM 737 NH1 ARG B 47 -22.272 2.860 -8.785 1.00 0.00 N ATOM 738 NH2 ARG B 47 -20.772 3.065 -10.509 1.00 0.00 N ATOM 0 H ARG B 47 -18.825 3.044 -7.436 1.00 0.00 H new ATOM 0 HA ARG B 47 -19.016 1.534 -5.033 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -17.869 1.125 -7.786 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -17.483 -0.022 -6.518 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -19.410 -0.778 -7.849 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -19.859 -0.519 -6.174 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -21.589 0.379 -7.632 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -20.818 1.689 -6.759 1.00 0.00 H new ATOM 0 HE ARG B 47 -19.480 1.339 -9.269 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -22.554 2.428 -7.905 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -22.869 3.562 -9.223 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -19.898 2.791 -10.959 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -21.372 3.766 -10.944 1.00 0.00 H new ATOM 752 N LYS B 48 -16.178 2.982 -5.691 1.00 0.00 N ATOM 753 CA LYS B 48 -14.881 3.391 -5.147 1.00 0.00 C ATOM 754 C LYS B 48 -14.958 3.694 -3.646 1.00 0.00 C ATOM 755 O LYS B 48 -13.993 3.476 -2.907 1.00 0.00 O ATOM 756 CB LYS B 48 -14.382 4.605 -5.957 1.00 0.00 C ATOM 757 CG LYS B 48 -13.395 5.531 -5.254 1.00 0.00 C ATOM 758 CD LYS B 48 -14.108 6.619 -4.458 1.00 0.00 C ATOM 759 CE LYS B 48 -13.154 7.722 -4.031 1.00 0.00 C ATOM 760 NZ LYS B 48 -12.594 8.457 -5.196 1.00 0.00 N ATOM 0 H LYS B 48 -16.439 3.481 -6.541 1.00 0.00 H new ATOM 0 HA LYS B 48 -14.169 2.571 -5.243 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -13.914 4.237 -6.870 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -15.248 5.194 -6.258 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.762 4.947 -4.586 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -12.739 5.992 -5.993 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -14.909 7.045 -5.062 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -14.573 6.179 -3.576 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -13.677 8.421 -3.379 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.339 7.291 -3.449 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.236 9.382 -4.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.816 7.907 -5.612 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -13.338 8.597 -5.909 1.00 0.00 H new ATOM 774 N GLN B 49 -16.114 4.179 -3.204 1.00 0.00 N ATOM 775 CA GLN B 49 -16.344 4.480 -1.796 1.00 0.00 C ATOM 776 C GLN B 49 -16.170 3.244 -0.924 1.00 0.00 C ATOM 777 O GLN B 49 -15.407 3.263 0.044 1.00 0.00 O ATOM 778 CB GLN B 49 -17.748 5.045 -1.614 1.00 0.00 C ATOM 779 CG GLN B 49 -17.865 6.497 -2.029 1.00 0.00 C ATOM 780 CD GLN B 49 -17.369 7.435 -0.953 1.00 0.00 C ATOM 781 OE1 GLN B 49 -17.494 7.146 0.237 1.00 0.00 O ATOM 782 NE2 GLN B 49 -16.801 8.553 -1.360 1.00 0.00 N ATOM 0 H GLN B 49 -16.913 4.373 -3.808 1.00 0.00 H new ATOM 0 HA GLN B 49 -15.605 5.218 -1.484 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -18.451 4.449 -2.197 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -18.039 4.948 -0.568 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -17.294 6.660 -2.943 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -18.906 6.726 -2.258 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -16.720 8.750 -2.357 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -16.443 9.221 -0.677 1.00 0.00 H new ATOM 791 N ILE B 50 -16.874 2.175 -1.286 1.00 0.00 N ATOM 792 CA ILE B 50 -16.851 0.933 -0.520 1.00 0.00 C ATOM 793 C ILE B 50 -15.423 0.449 -0.313 1.00 0.00 C ATOM 794 O ILE B 50 -14.991 0.220 0.818 1.00 0.00 O ATOM 795 CB ILE B 50 -17.672 -0.190 -1.207 1.00 0.00 C ATOM 796 CG1 ILE B 50 -19.179 0.055 -1.052 1.00 0.00 C ATOM 797 CG2 ILE B 50 -17.299 -1.558 -0.652 1.00 0.00 C ATOM 798 CD1 ILE B 50 -19.748 1.058 -2.032 1.00 0.00 C ATOM 0 H ILE B 50 -17.472 2.145 -2.112 1.00 0.00 H new ATOM 0 HA ILE B 50 -17.307 1.154 0.445 1.00 0.00 H new ATOM 0 HB ILE B 50 -17.429 -0.173 -2.269 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -19.704 -0.892 -1.173 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -19.377 0.402 -0.038 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -17.889 -2.326 -1.151 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -16.239 -1.745 -0.826 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -17.501 -1.584 0.419 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -20.817 1.173 -1.855 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -19.252 2.019 -1.898 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -19.585 0.705 -3.050 1.00 0.00 H new ATOM 810 N ILE B 51 -14.688 0.336 -1.411 1.00 0.00 N ATOM 811 CA ILE B 51 -13.338 -0.215 -1.364 1.00 0.00 C ATOM 812 C ILE B 51 -12.439 0.669 -0.514 1.00 0.00 C ATOM 813 O ILE B 51 -11.665 0.181 0.313 1.00 0.00 O ATOM 814 CB ILE B 51 -12.708 -0.367 -2.770 1.00 0.00 C ATOM 815 CG1 ILE B 51 -13.436 -1.431 -3.597 1.00 0.00 C ATOM 816 CG2 ILE B 51 -11.225 -0.711 -2.664 1.00 0.00 C ATOM 817 CD1 ILE B 51 -14.745 -0.978 -4.203 1.00 0.00 C ATOM 0 H ILE B 51 -15.000 0.616 -2.341 1.00 0.00 H new ATOM 0 HA ILE B 51 -13.422 -1.209 -0.924 1.00 0.00 H new ATOM 0 HB ILE B 51 -12.812 0.591 -3.280 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -12.776 -1.762 -4.399 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -13.626 -2.297 -2.963 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -10.803 -0.813 -3.664 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -10.704 0.084 -2.130 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -11.107 -1.650 -2.123 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -15.187 -1.798 -4.770 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -15.428 -0.676 -3.409 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -14.565 -0.133 -4.868 1.00 0.00 H new ATOM 829 N HIS B 52 -12.568 1.973 -0.707 1.00 0.00 N ATOM 830 CA HIS B 52 -11.736 2.930 -0.001 1.00 0.00 C ATOM 831 C HIS B 52 -11.931 2.848 1.505 1.00 0.00 C ATOM 832 O HIS B 52 -10.957 2.810 2.244 1.00 0.00 O ATOM 833 CB HIS B 52 -12.002 4.349 -0.496 1.00 0.00 C ATOM 834 CG HIS B 52 -11.043 4.790 -1.559 1.00 0.00 C ATOM 835 ND1 HIS B 52 -10.222 5.887 -1.420 1.00 0.00 N ATOM 836 CD2 HIS B 52 -10.764 4.268 -2.777 1.00 0.00 C ATOM 837 CE1 HIS B 52 -9.480 6.021 -2.501 1.00 0.00 C ATOM 838 NE2 HIS B 52 -9.789 5.053 -3.342 1.00 0.00 N ATOM 0 H HIS B 52 -13.242 2.391 -1.348 1.00 0.00 H new ATOM 0 HA HIS B 52 -10.698 2.673 -0.214 1.00 0.00 H new ATOM 0 HB2 HIS B 52 -13.018 4.407 -0.885 1.00 0.00 H new ATOM 0 HB3 HIS B 52 -11.943 5.038 0.346 1.00 0.00 H new ATOM 0 HD2 HIS B 52 -11.223 3.397 -3.221 1.00 0.00 H new ATOM 0 HE1 HIS B 52 -8.744 6.793 -2.670 1.00 0.00 H new ATOM 0 HE2 HIS B 52 -9.372 4.911 -4.262 1.00 0.00 H new ATOM 847 N HIS B 53 -13.175 2.803 1.965 1.00 0.00 N ATOM 848 CA HIS B 53 -13.437 2.779 3.406 1.00 0.00 C ATOM 849 C HIS B 53 -12.920 1.498 4.049 1.00 0.00 C ATOM 850 O HIS B 53 -12.407 1.518 5.161 1.00 0.00 O ATOM 851 CB HIS B 53 -14.927 2.926 3.703 1.00 0.00 C ATOM 852 CG HIS B 53 -15.493 4.243 3.296 1.00 0.00 C ATOM 853 ND1 HIS B 53 -14.951 5.444 3.691 1.00 0.00 N ATOM 854 CD2 HIS B 53 -16.540 4.547 2.496 1.00 0.00 C ATOM 855 CE1 HIS B 53 -15.634 6.428 3.154 1.00 0.00 C ATOM 856 NE2 HIS B 53 -16.601 5.916 2.420 1.00 0.00 N ATOM 0 H HIS B 53 -14.008 2.783 1.377 1.00 0.00 H new ATOM 0 HA HIS B 53 -12.903 3.628 3.834 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -15.471 2.133 3.190 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -15.091 2.785 4.771 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -17.202 3.846 2.010 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -15.436 7.481 3.291 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -17.284 6.450 1.883 1.00 0.00 H new ATOM 865 N LEU B 54 -13.039 0.395 3.333 1.00 0.00 N ATOM 866 CA LEU B 54 -12.654 -0.912 3.860 1.00 0.00 C ATOM 867 C LEU B 54 -11.156 -0.969 4.134 1.00 0.00 C ATOM 868 O LEU B 54 -10.720 -1.412 5.199 1.00 0.00 O ATOM 869 CB LEU B 54 -13.063 -2.022 2.888 1.00 0.00 C ATOM 870 CG LEU B 54 -14.570 -2.286 2.792 1.00 0.00 C ATOM 871 CD1 LEU B 54 -14.871 -3.209 1.622 1.00 0.00 C ATOM 872 CD2 LEU B 54 -15.096 -2.894 4.091 1.00 0.00 C ATOM 0 H LEU B 54 -13.401 0.373 2.379 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.177 -1.065 4.804 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.691 -1.768 1.895 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.567 -2.945 3.187 1.00 0.00 H new ATOM 0 HG LEU B 54 -15.074 -1.334 2.628 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -15.945 -3.388 1.566 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -14.532 -2.745 0.696 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -14.352 -4.157 1.764 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -16.167 -3.073 4.001 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -14.585 -3.837 4.284 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -14.911 -2.206 4.916 1.00 0.00 H new ATOM 884 N VAL B 55 -10.367 -0.493 3.184 1.00 0.00 N ATOM 885 CA VAL B 55 -8.919 -0.521 3.326 1.00 0.00 C ATOM 886 C VAL B 55 -8.452 0.608 4.236 1.00 0.00 C ATOM 887 O VAL B 55 -7.397 0.529 4.862 1.00 0.00 O ATOM 888 CB VAL B 55 -8.218 -0.426 1.955 1.00 0.00 C ATOM 889 CG1 VAL B 55 -8.768 -1.491 1.023 1.00 0.00 C ATOM 890 CG2 VAL B 55 -8.376 0.957 1.335 1.00 0.00 C ATOM 0 H VAL B 55 -10.702 -0.085 2.311 1.00 0.00 H new ATOM 0 HA VAL B 55 -8.647 -1.475 3.777 1.00 0.00 H new ATOM 0 HB VAL B 55 -7.152 -0.593 2.108 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -8.270 -1.420 0.056 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -8.590 -2.477 1.452 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -9.840 -1.341 0.891 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.869 0.984 0.371 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.435 1.174 1.194 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -7.938 1.704 1.996 1.00 0.00 H new ATOM 900 N GLN B 56 -9.273 1.646 4.327 1.00 0.00 N ATOM 901 CA GLN B 56 -8.981 2.789 5.175 1.00 0.00 C ATOM 902 C GLN B 56 -9.285 2.486 6.634 1.00 0.00 C ATOM 903 O GLN B 56 -8.714 3.097 7.536 1.00 0.00 O ATOM 904 CB GLN B 56 -9.780 4.002 4.710 1.00 0.00 C ATOM 905 CG GLN B 56 -9.044 4.859 3.690 1.00 0.00 C ATOM 906 CD GLN B 56 -9.859 6.049 3.236 1.00 0.00 C ATOM 907 OE1 GLN B 56 -9.789 7.124 3.823 1.00 0.00 O ATOM 908 NE2 GLN B 56 -10.641 5.860 2.189 1.00 0.00 N ATOM 0 H GLN B 56 -10.154 1.717 3.818 1.00 0.00 H new ATOM 0 HA GLN B 56 -7.916 3.008 5.094 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -10.721 3.663 4.277 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -10.030 4.616 5.575 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -8.107 5.209 4.123 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -8.787 4.248 2.825 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -10.668 4.949 1.731 1.00 0.00 H new ATOM 0 HE22 GLN B 56 -11.218 6.625 1.838 1.00 0.00 H new ATOM 917 N MET B 57 -10.184 1.538 6.866 1.00 0.00 N ATOM 918 CA MET B 57 -10.506 1.119 8.223 1.00 0.00 C ATOM 919 C MET B 57 -9.516 0.075 8.713 1.00 0.00 C ATOM 920 O MET B 57 -9.590 -0.381 9.852 1.00 0.00 O ATOM 921 CB MET B 57 -11.940 0.587 8.313 1.00 0.00 C ATOM 922 CG MET B 57 -12.990 1.686 8.332 1.00 0.00 C ATOM 923 SD MET B 57 -14.668 1.060 8.572 1.00 0.00 S ATOM 924 CE MET B 57 -15.010 0.367 6.956 1.00 0.00 C ATOM 0 H MET B 57 -10.700 1.047 6.136 1.00 0.00 H new ATOM 0 HA MET B 57 -10.432 1.994 8.869 1.00 0.00 H new ATOM 0 HB2 MET B 57 -12.129 -0.072 7.466 1.00 0.00 H new ATOM 0 HB3 MET B 57 -12.040 -0.017 9.215 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.754 2.391 9.129 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.946 2.239 7.394 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.670 -0.494 7.062 1.00 0.00 H new ATOM 0 HE2 MET B 57 -15.493 1.119 6.332 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.076 0.054 6.489 1.00 0.00 H new ATOM 934 N GLY B 58 -8.587 -0.299 7.842 1.00 0.00 N ATOM 935 CA GLY B 58 -7.548 -1.240 8.214 1.00 0.00 C ATOM 936 C GLY B 58 -8.049 -2.667 8.296 1.00 0.00 C ATOM 937 O GLY B 58 -7.300 -3.575 8.647 1.00 0.00 O ATOM 0 H GLY B 58 -8.535 0.035 6.880 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -6.738 -1.186 7.487 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -7.131 -0.951 9.178 1.00 0.00 H new ATOM 941 N LEU B 59 -9.314 -2.873 7.964 1.00 0.00 N ATOM 942 CA LEU B 59 -9.899 -4.207 8.004 1.00 0.00 C ATOM 943 C LEU B 59 -9.629 -4.934 6.693 1.00 0.00 C ATOM 944 O LEU B 59 -9.722 -6.160 6.607 1.00 0.00 O ATOM 945 CB LEU B 59 -11.399 -4.130 8.313 1.00 0.00 C ATOM 946 CG LEU B 59 -12.231 -3.244 7.387 1.00 0.00 C ATOM 947 CD1 LEU B 59 -12.586 -3.977 6.108 1.00 0.00 C ATOM 948 CD2 LEU B 59 -13.484 -2.773 8.099 1.00 0.00 C ATOM 0 H LEU B 59 -9.954 -2.138 7.665 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.432 -4.778 8.807 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.808 -5.140 8.281 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -11.521 -3.769 9.334 1.00 0.00 H new ATOM 0 HG LEU B 59 -11.634 -2.373 7.118 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -13.178 -3.324 5.467 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.672 -4.265 5.588 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -13.163 -4.870 6.349 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -14.068 -2.143 7.429 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -14.080 -3.636 8.397 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -13.206 -2.201 8.984 1.00 0.00 H new ATOM 960 N ALA B 60 -9.307 -4.156 5.673 1.00 0.00 N ATOM 961 CA ALA B 60 -8.885 -4.696 4.392 1.00 0.00 C ATOM 962 C ALA B 60 -7.448 -4.281 4.114 1.00 0.00 C ATOM 963 O ALA B 60 -6.890 -3.460 4.842 1.00 0.00 O ATOM 964 CB ALA B 60 -9.806 -4.225 3.280 1.00 0.00 C ATOM 0 H ALA B 60 -9.331 -3.137 5.709 1.00 0.00 H new ATOM 0 HA ALA B 60 -8.939 -5.784 4.430 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -9.472 -4.641 2.330 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -10.823 -4.559 3.484 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -9.785 -3.137 3.227 1.00 0.00 H new ATOM 970 N ASP B 61 -6.842 -4.849 3.081 1.00 0.00 N ATOM 971 CA ASP B 61 -5.446 -4.554 2.782 1.00 0.00 C ATOM 972 C ASP B 61 -5.302 -3.269 1.974 1.00 0.00 C ATOM 973 O ASP B 61 -4.804 -2.264 2.479 1.00 0.00 O ATOM 974 CB ASP B 61 -4.805 -5.701 2.000 1.00 0.00 C ATOM 975 CG ASP B 61 -3.313 -5.501 1.824 1.00 0.00 C ATOM 976 OD1 ASP B 61 -2.539 -6.008 2.663 1.00 0.00 O ATOM 977 OD2 ASP B 61 -2.907 -4.834 0.849 1.00 0.00 O ATOM 0 H ASP B 61 -7.287 -5.508 2.443 1.00 0.00 H new ATOM 0 HA ASP B 61 -4.938 -4.429 3.738 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -4.986 -6.641 2.521 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -5.278 -5.782 1.021 1.00 0.00 H new ATOM 982 N SER B 62 -5.765 -3.303 0.728 1.00 0.00 N ATOM 983 CA SER B 62 -5.573 -2.191 -0.195 1.00 0.00 C ATOM 984 C SER B 62 -6.611 -2.230 -1.309 1.00 0.00 C ATOM 985 O SER B 62 -7.274 -3.248 -1.521 1.00 0.00 O ATOM 986 CB SER B 62 -4.180 -2.256 -0.828 1.00 0.00 C ATOM 987 OG SER B 62 -3.149 -2.281 0.147 1.00 0.00 O ATOM 0 H SER B 62 -6.278 -4.092 0.334 1.00 0.00 H new ATOM 0 HA SER B 62 -5.680 -1.267 0.374 1.00 0.00 H new ATOM 0 HB2 SER B 62 -4.108 -3.146 -1.453 1.00 0.00 H new ATOM 0 HB3 SER B 62 -4.039 -1.395 -1.481 1.00 0.00 H new ATOM 0 HG SER B 62 -3.031 -3.197 0.475 1.00 0.00 H new ATOM 993 N VAL B 63 -6.725 -1.120 -2.032 1.00 0.00 N ATOM 994 CA VAL B 63 -7.600 -1.033 -3.197 1.00 0.00 C ATOM 995 C VAL B 63 -7.152 -2.026 -4.262 1.00 0.00 C ATOM 996 O VAL B 63 -7.954 -2.522 -5.055 1.00 0.00 O ATOM 997 CB VAL B 63 -7.586 0.399 -3.785 1.00 0.00 C ATOM 998 CG1 VAL B 63 -8.365 0.471 -5.089 1.00 0.00 C ATOM 999 CG2 VAL B 63 -8.143 1.391 -2.779 1.00 0.00 C ATOM 0 H VAL B 63 -6.216 -0.260 -1.829 1.00 0.00 H new ATOM 0 HA VAL B 63 -8.615 -1.273 -2.881 1.00 0.00 H new ATOM 0 HB VAL B 63 -6.550 0.661 -4.000 1.00 0.00 H new ATOM 0 HG11 VAL B 63 -8.335 1.490 -5.475 1.00 0.00 H new ATOM 0 HG12 VAL B 63 -7.919 -0.206 -5.817 1.00 0.00 H new ATOM 0 HG13 VAL B 63 -9.400 0.181 -4.911 1.00 0.00 H new ATOM 0 HG21 VAL B 63 -8.126 2.393 -3.208 1.00 0.00 H new ATOM 0 HG22 VAL B 63 -9.169 1.120 -2.531 1.00 0.00 H new ATOM 0 HG23 VAL B 63 -7.534 1.373 -1.875 1.00 0.00 H new ATOM 1009 N LYS B 64 -5.863 -2.332 -4.232 1.00 0.00 N ATOM 1010 CA LYS B 64 -5.239 -3.234 -5.188 1.00 0.00 C ATOM 1011 C LYS B 64 -5.893 -4.613 -5.184 1.00 0.00 C ATOM 1012 O LYS B 64 -5.962 -5.281 -6.215 1.00 0.00 O ATOM 1013 CB LYS B 64 -3.752 -3.359 -4.867 1.00 0.00 C ATOM 1014 CG LYS B 64 -3.012 -2.032 -4.944 1.00 0.00 C ATOM 1015 CD LYS B 64 -1.506 -2.215 -4.822 1.00 0.00 C ATOM 1016 CE LYS B 64 -1.111 -2.856 -3.500 1.00 0.00 C ATOM 1017 NZ LYS B 64 0.330 -3.225 -3.473 1.00 0.00 N ATOM 0 H LYS B 64 -5.216 -1.958 -3.538 1.00 0.00 H new ATOM 0 HA LYS B 64 -5.373 -2.815 -6.185 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -3.636 -3.775 -3.866 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -3.295 -4.064 -5.561 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -3.243 -1.542 -5.890 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -3.363 -1.374 -4.150 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -1.149 -2.834 -5.645 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -1.015 -1.246 -4.915 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.325 -2.166 -2.684 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -1.717 -3.746 -3.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 0.560 -3.659 -2.556 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 0.529 -3.903 -4.236 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 0.909 -2.372 -3.608 1.00 0.00 H new ATOM 1031 N ASP B 65 -6.387 -5.028 -4.026 1.00 0.00 N ATOM 1032 CA ASP B 65 -6.979 -6.354 -3.884 1.00 0.00 C ATOM 1033 C ASP B 65 -8.431 -6.356 -4.362 1.00 0.00 C ATOM 1034 O ASP B 65 -8.952 -7.378 -4.810 1.00 0.00 O ATOM 1035 CB ASP B 65 -6.896 -6.811 -2.424 1.00 0.00 C ATOM 1036 CG ASP B 65 -7.318 -8.255 -2.231 1.00 0.00 C ATOM 1037 OD1 ASP B 65 -8.392 -8.493 -1.645 1.00 0.00 O ATOM 1038 OD2 ASP B 65 -6.566 -9.161 -2.657 1.00 0.00 O ATOM 0 H ASP B 65 -6.391 -4.469 -3.173 1.00 0.00 H new ATOM 0 HA ASP B 65 -6.418 -7.052 -4.506 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -5.874 -6.686 -2.067 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -7.528 -6.168 -1.811 1.00 0.00 H new ATOM 1043 N PHE B 66 -9.064 -5.192 -4.293 1.00 0.00 N ATOM 1044 CA PHE B 66 -10.476 -5.061 -4.641 1.00 0.00 C ATOM 1045 C PHE B 66 -10.669 -4.685 -6.104 1.00 0.00 C ATOM 1046 O PHE B 66 -11.542 -5.225 -6.778 1.00 0.00 O ATOM 1047 CB PHE B 66 -11.144 -3.984 -3.789 1.00 0.00 C ATOM 1048 CG PHE B 66 -11.324 -4.328 -2.339 1.00 0.00 C ATOM 1049 CD1 PHE B 66 -12.594 -4.503 -1.811 1.00 0.00 C ATOM 1050 CD2 PHE B 66 -10.230 -4.458 -1.503 1.00 0.00 C ATOM 1051 CE1 PHE B 66 -12.767 -4.797 -0.476 1.00 0.00 C ATOM 1052 CE2 PHE B 66 -10.396 -4.757 -0.167 1.00 0.00 C ATOM 1053 CZ PHE B 66 -11.668 -4.925 0.349 1.00 0.00 C ATOM 0 H PHE B 66 -8.622 -4.321 -3.998 1.00 0.00 H new ATOM 0 HA PHE B 66 -10.931 -6.034 -4.455 1.00 0.00 H new ATOM 0 HB2 PHE B 66 -10.552 -3.072 -3.857 1.00 0.00 H new ATOM 0 HB3 PHE B 66 -12.122 -3.762 -4.216 1.00 0.00 H new ATOM 0 HD1 PHE B 66 -13.457 -4.408 -2.453 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -9.235 -4.324 -1.901 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -13.762 -4.927 -0.076 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -9.534 -4.860 0.475 1.00 0.00 H new ATOM 0 HZ PHE B 66 -11.801 -5.156 1.396 1.00 0.00 H new ATOM 1184 N VAL B 74 -0.132 9.846 -4.506 1.00 0.00 N ATOM 1185 CA VAL B 74 -0.035 11.274 -4.362 1.00 0.00 C ATOM 1186 C VAL B 74 0.990 11.784 -5.349 1.00 0.00 C ATOM 1187 O VAL B 74 2.054 11.199 -5.483 1.00 0.00 O ATOM 1188 CB VAL B 74 0.342 11.642 -2.903 1.00 0.00 C ATOM 1189 CG1 VAL B 74 0.941 10.438 -2.172 1.00 0.00 C ATOM 1190 CG2 VAL B 74 1.304 12.819 -2.850 1.00 0.00 C ATOM 0 HA VAL B 74 -0.995 11.744 -4.573 1.00 0.00 H new ATOM 0 HB VAL B 74 -0.578 11.937 -2.398 1.00 0.00 H new ATOM 0 HG11 VAL B 74 1.197 10.722 -1.151 1.00 0.00 H new ATOM 0 HG12 VAL B 74 0.214 9.626 -2.151 1.00 0.00 H new ATOM 0 HG13 VAL B 74 1.840 10.107 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL B 74 1.544 13.046 -1.811 1.00 0.00 H new ATOM 0 HG22 VAL B 74 2.218 12.566 -3.387 1.00 0.00 H new ATOM 0 HG23 VAL B 74 0.840 13.689 -3.314 1.00 0.00 H new ATOM 1200 N LEU B 75 0.643 12.853 -6.039 1.00 0.00 N ATOM 1201 CA LEU B 75 1.396 13.322 -7.193 1.00 0.00 C ATOM 1202 C LEU B 75 2.889 13.503 -6.914 1.00 0.00 C ATOM 1203 O LEU B 75 3.326 14.586 -6.526 1.00 0.00 O ATOM 1204 CB LEU B 75 0.816 14.639 -7.675 1.00 0.00 C ATOM 1205 CG LEU B 75 1.488 15.188 -8.920 1.00 0.00 C ATOM 1206 CD1 LEU B 75 1.188 14.283 -10.102 1.00 0.00 C ATOM 1207 CD2 LEU B 75 1.046 16.618 -9.190 1.00 0.00 C ATOM 0 H LEU B 75 -0.172 13.425 -5.817 1.00 0.00 H new ATOM 0 HA LEU B 75 1.307 12.550 -7.957 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -0.247 14.504 -7.877 1.00 0.00 H new ATOM 0 HB3 LEU B 75 0.898 15.375 -6.875 1.00 0.00 H new ATOM 0 HG LEU B 75 2.566 15.208 -8.763 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.671 14.679 -10.995 1.00 0.00 H new ATOM 0 HD12 LEU B 75 1.566 13.281 -9.898 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.111 14.239 -10.262 1.00 0.00 H new ATOM 0 HD21 LEU B 75 1.542 16.989 -10.087 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -0.034 16.644 -9.335 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.313 17.248 -8.341 1.00 0.00 H new ATOM 1219 N TRP B 76 3.669 12.452 -7.131 1.00 0.00 N ATOM 1220 CA TRP B 76 5.106 12.522 -6.928 1.00 0.00 C ATOM 1221 C TRP B 76 5.806 12.962 -8.203 1.00 0.00 C ATOM 1222 O TRP B 76 5.867 12.218 -9.181 1.00 0.00 O ATOM 1223 CB TRP B 76 5.675 11.171 -6.473 1.00 0.00 C ATOM 1224 CG TRP B 76 5.252 10.763 -5.093 1.00 0.00 C ATOM 1225 CD1 TRP B 76 4.386 9.768 -4.766 1.00 0.00 C ATOM 1226 CD2 TRP B 76 5.677 11.340 -3.856 1.00 0.00 C ATOM 1227 NE1 TRP B 76 4.245 9.684 -3.407 1.00 0.00 N ATOM 1228 CE2 TRP B 76 5.030 10.640 -2.823 1.00 0.00 C ATOM 1229 CE3 TRP B 76 6.549 12.380 -3.523 1.00 0.00 C ATOM 1230 CZ2 TRP B 76 5.219 10.947 -1.482 1.00 0.00 C ATOM 1231 CZ3 TRP B 76 6.733 12.687 -2.190 1.00 0.00 C ATOM 1232 CH2 TRP B 76 6.075 11.970 -1.183 1.00 0.00 C ATOM 0 H TRP B 76 3.329 11.544 -7.447 1.00 0.00 H new ATOM 0 HA TRP B 76 5.287 13.257 -6.143 1.00 0.00 H new ATOM 0 HB2 TRP B 76 5.364 10.401 -7.179 1.00 0.00 H new ATOM 0 HB3 TRP B 76 6.763 11.216 -6.510 1.00 0.00 H new ATOM 0 HD1 TRP B 76 3.880 9.133 -5.478 1.00 0.00 H new ATOM 0 HE1 TRP B 76 3.652 9.018 -2.911 1.00 0.00 H new ATOM 0 HE3 TRP B 76 7.068 12.932 -4.293 1.00 0.00 H new ATOM 0 HZ2 TRP B 76 4.709 10.398 -0.704 1.00 0.00 H new ATOM 0 HZ3 TRP B 76 7.396 13.495 -1.919 1.00 0.00 H new ATOM 0 HH2 TRP B 76 6.247 12.231 -0.149 1.00 0.00 H new ATOM 1243 N THR B 77 6.315 14.175 -8.186 1.00 0.00 N ATOM 1244 CA THR B 77 7.131 14.682 -9.270 1.00 0.00 C ATOM 1245 C THR B 77 8.556 14.840 -8.774 1.00 0.00 C ATOM 1246 O THR B 77 8.785 14.788 -7.567 1.00 0.00 O ATOM 1247 CB THR B 77 6.611 16.043 -9.763 1.00 0.00 C ATOM 1248 OG1 THR B 77 6.525 16.953 -8.658 1.00 0.00 O ATOM 1249 CG2 THR B 77 5.245 15.902 -10.416 1.00 0.00 C ATOM 0 H THR B 77 6.176 14.837 -7.423 1.00 0.00 H new ATOM 0 HA THR B 77 7.089 13.978 -10.101 1.00 0.00 H new ATOM 0 HB THR B 77 7.308 16.429 -10.507 1.00 0.00 H new ATOM 0 HG1 THR B 77 6.195 17.820 -8.973 1.00 0.00 H new ATOM 0 HG21 THR B 77 4.901 16.879 -10.755 1.00 0.00 H new ATOM 0 HG22 THR B 77 5.317 15.227 -11.269 1.00 0.00 H new ATOM 0 HG23 THR B 77 4.536 15.499 -9.693 1.00 0.00 H new ATOM 1257 N GLY B 78 9.501 15.046 -9.683 1.00 0.00 N ATOM 1258 CA GLY B 78 10.875 15.288 -9.278 1.00 0.00 C ATOM 1259 C GLY B 78 10.971 16.433 -8.289 1.00 0.00 C ATOM 1260 O GLY B 78 11.812 16.423 -7.390 1.00 0.00 O ATOM 0 H GLY B 78 9.343 15.050 -10.691 1.00 0.00 H new ATOM 0 HA2 GLY B 78 11.288 14.384 -8.830 1.00 0.00 H new ATOM 0 HA3 GLY B 78 11.480 15.513 -10.156 1.00 0.00 H new ATOM 1264 N ASP B 79 10.079 17.401 -8.449 1.00 0.00 N ATOM 1265 CA ASP B 79 9.990 18.539 -7.545 1.00 0.00 C ATOM 1266 C ASP B 79 9.556 18.086 -6.150 1.00 0.00 C ATOM 1267 O ASP B 79 10.250 18.333 -5.165 1.00 0.00 O ATOM 1268 CB ASP B 79 8.989 19.558 -8.093 1.00 0.00 C ATOM 1269 CG ASP B 79 8.917 20.823 -7.263 1.00 0.00 C ATOM 1270 OD1 ASP B 79 8.201 20.834 -6.242 1.00 0.00 O ATOM 1271 OD2 ASP B 79 9.558 21.826 -7.647 1.00 0.00 O ATOM 0 H ASP B 79 9.398 17.419 -9.208 1.00 0.00 H new ATOM 0 HA ASP B 79 10.974 19.001 -7.470 1.00 0.00 H new ATOM 0 HB2 ASP B 79 9.265 19.816 -9.115 1.00 0.00 H new ATOM 0 HB3 ASP B 79 8.000 19.101 -8.135 1.00 0.00 H new ATOM 1276 N GLN B 80 8.418 17.393 -6.079 1.00 0.00 N ATOM 1277 CA GLN B 80 7.868 16.959 -4.795 1.00 0.00 C ATOM 1278 C GLN B 80 8.768 15.925 -4.124 1.00 0.00 C ATOM 1279 O GLN B 80 8.895 15.907 -2.896 1.00 0.00 O ATOM 1280 CB GLN B 80 6.451 16.393 -4.959 1.00 0.00 C ATOM 1281 CG GLN B 80 5.847 15.932 -3.641 1.00 0.00 C ATOM 1282 CD GLN B 80 4.387 15.565 -3.741 1.00 0.00 C ATOM 1283 OE1 GLN B 80 3.508 16.411 -3.577 1.00 0.00 O ATOM 1284 NE2 GLN B 80 4.116 14.297 -3.966 1.00 0.00 N ATOM 0 H GLN B 80 7.863 17.122 -6.891 1.00 0.00 H new ATOM 0 HA GLN B 80 7.818 17.840 -4.155 1.00 0.00 H new ATOM 0 HB2 GLN B 80 5.809 17.155 -5.402 1.00 0.00 H new ATOM 0 HB3 GLN B 80 6.477 15.555 -5.655 1.00 0.00 H new ATOM 0 HG2 GLN B 80 6.406 15.070 -3.277 1.00 0.00 H new ATOM 0 HG3 GLN B 80 5.964 16.723 -2.901 1.00 0.00 H new ATOM 0 HE21 GLN B 80 4.875 13.629 -4.096 1.00 0.00 H new ATOM 0 HE22 GLN B 80 3.147 13.983 -4.010 1.00 0.00 H new ATOM 1293 N GLU B 81 9.391 15.068 -4.922 1.00 0.00 N ATOM 1294 CA GLU B 81 10.326 14.081 -4.399 1.00 0.00 C ATOM 1295 C GLU B 81 11.498 14.783 -3.725 1.00 0.00 C ATOM 1296 O GLU B 81 11.961 14.363 -2.667 1.00 0.00 O ATOM 1297 CB GLU B 81 10.823 13.162 -5.517 1.00 0.00 C ATOM 1298 CG GLU B 81 9.730 12.301 -6.128 1.00 0.00 C ATOM 1299 CD GLU B 81 10.236 11.426 -7.257 1.00 0.00 C ATOM 1300 OE1 GLU B 81 10.168 10.187 -7.127 1.00 0.00 O ATOM 1301 OE2 GLU B 81 10.710 11.972 -8.274 1.00 0.00 O ATOM 0 H GLU B 81 9.266 15.036 -5.934 1.00 0.00 H new ATOM 0 HA GLU B 81 9.810 13.467 -3.661 1.00 0.00 H new ATOM 0 HB2 GLU B 81 11.276 13.769 -6.301 1.00 0.00 H new ATOM 0 HB3 GLU B 81 11.606 12.515 -5.123 1.00 0.00 H new ATOM 0 HG2 GLU B 81 9.294 11.671 -5.353 1.00 0.00 H new ATOM 0 HG3 GLU B 81 8.933 12.944 -6.502 1.00 0.00 H new ATOM 1308 N LEU B 82 11.953 15.874 -4.331 1.00 0.00 N ATOM 1309 CA LEU B 82 13.019 16.679 -3.754 1.00 0.00 C ATOM 1310 C LEU B 82 12.547 17.348 -2.472 1.00 0.00 C ATOM 1311 O LEU B 82 13.272 17.380 -1.481 1.00 0.00 O ATOM 1312 CB LEU B 82 13.490 17.750 -4.734 1.00 0.00 C ATOM 1313 CG LEU B 82 14.571 18.678 -4.181 1.00 0.00 C ATOM 1314 CD1 LEU B 82 15.903 17.950 -4.074 1.00 0.00 C ATOM 1315 CD2 LEU B 82 14.697 19.921 -5.037 1.00 0.00 C ATOM 0 H LEU B 82 11.599 16.220 -5.223 1.00 0.00 H new ATOM 0 HA LEU B 82 13.852 16.012 -3.532 1.00 0.00 H new ATOM 0 HB2 LEU B 82 13.871 17.262 -5.631 1.00 0.00 H new ATOM 0 HB3 LEU B 82 12.632 18.351 -5.037 1.00 0.00 H new ATOM 0 HG LEU B 82 14.277 18.988 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU B 82 16.658 18.629 -3.678 1.00 0.00 H new ATOM 0 HD12 LEU B 82 15.798 17.095 -3.406 1.00 0.00 H new ATOM 0 HD13 LEU B 82 16.209 17.603 -5.061 1.00 0.00 H new ATOM 0 HD21 LEU B 82 15.472 20.569 -4.626 1.00 0.00 H new ATOM 0 HD22 LEU B 82 14.964 19.636 -6.055 1.00 0.00 H new ATOM 0 HD23 LEU B 82 13.746 20.454 -5.047 1.00 0.00 H new ATOM 1327 N GLU B 83 11.332 17.888 -2.501 1.00 0.00 N ATOM 1328 CA GLU B 83 10.766 18.548 -1.331 1.00 0.00 C ATOM 1329 C GLU B 83 10.667 17.581 -0.164 1.00 0.00 C ATOM 1330 O GLU B 83 10.971 17.936 0.974 1.00 0.00 O ATOM 1331 CB GLU B 83 9.395 19.138 -1.652 1.00 0.00 C ATOM 1332 CG GLU B 83 9.461 20.260 -2.670 1.00 0.00 C ATOM 1333 CD GLU B 83 10.431 21.348 -2.259 1.00 0.00 C ATOM 1334 OE1 GLU B 83 11.644 21.205 -2.520 1.00 0.00 O ATOM 1335 OE2 GLU B 83 9.991 22.353 -1.665 1.00 0.00 O ATOM 0 H GLU B 83 10.723 17.881 -3.319 1.00 0.00 H new ATOM 0 HA GLU B 83 11.432 19.363 -1.048 1.00 0.00 H new ATOM 0 HB2 GLU B 83 8.745 18.349 -2.030 1.00 0.00 H new ATOM 0 HB3 GLU B 83 8.942 19.513 -0.734 1.00 0.00 H new ATOM 0 HG2 GLU B 83 9.761 19.854 -3.636 1.00 0.00 H new ATOM 0 HG3 GLU B 83 8.468 20.690 -2.799 1.00 0.00 H new ATOM 1342 N LEU B 84 10.251 16.355 -0.454 1.00 0.00 N ATOM 1343 CA LEU B 84 10.230 15.310 0.555 1.00 0.00 C ATOM 1344 C LEU B 84 11.646 15.032 1.031 1.00 0.00 C ATOM 1345 O LEU B 84 11.905 14.989 2.227 1.00 0.00 O ATOM 1346 CB LEU B 84 9.610 14.022 0.006 1.00 0.00 C ATOM 1347 CG LEU B 84 9.618 12.840 0.979 1.00 0.00 C ATOM 1348 CD1 LEU B 84 8.733 13.128 2.179 1.00 0.00 C ATOM 1349 CD2 LEU B 84 9.173 11.567 0.281 1.00 0.00 C ATOM 0 H LEU B 84 9.926 16.063 -1.376 1.00 0.00 H new ATOM 0 HA LEU B 84 9.619 15.654 1.390 1.00 0.00 H new ATOM 0 HB2 LEU B 84 8.580 14.227 -0.286 1.00 0.00 H new ATOM 0 HB3 LEU B 84 10.146 13.734 -0.898 1.00 0.00 H new ATOM 0 HG LEU B 84 10.639 12.697 1.333 1.00 0.00 H new ATOM 0 HD11 LEU B 84 8.752 12.276 2.858 1.00 0.00 H new ATOM 0 HD12 LEU B 84 9.100 14.014 2.698 1.00 0.00 H new ATOM 0 HD13 LEU B 84 7.710 13.301 1.844 1.00 0.00 H new ATOM 0 HD21 LEU B 84 9.186 10.740 0.990 1.00 0.00 H new ATOM 0 HD22 LEU B 84 8.162 11.698 -0.105 1.00 0.00 H new ATOM 0 HD23 LEU B 84 9.851 11.348 -0.544 1.00 0.00 H new ATOM 1361 N GLN B 85 12.548 14.871 0.071 1.00 0.00 N ATOM 1362 CA GLN B 85 13.949 14.579 0.341 1.00 0.00 C ATOM 1363 C GLN B 85 14.548 15.616 1.293 1.00 0.00 C ATOM 1364 O GLN B 85 15.110 15.262 2.328 1.00 0.00 O ATOM 1365 CB GLN B 85 14.716 14.543 -0.991 1.00 0.00 C ATOM 1366 CG GLN B 85 16.109 13.925 -0.912 1.00 0.00 C ATOM 1367 CD GLN B 85 17.184 14.844 -0.353 1.00 0.00 C ATOM 1368 OE1 GLN B 85 18.112 14.381 0.307 1.00 0.00 O ATOM 1369 NE2 GLN B 85 17.108 16.134 -0.653 1.00 0.00 N ATOM 0 H GLN B 85 12.326 14.940 -0.922 1.00 0.00 H new ATOM 0 HA GLN B 85 14.030 13.608 0.829 1.00 0.00 H new ATOM 0 HB2 GLN B 85 14.127 13.984 -1.718 1.00 0.00 H new ATOM 0 HB3 GLN B 85 14.807 15.561 -1.369 1.00 0.00 H new ATOM 0 HG2 GLN B 85 16.059 13.029 -0.293 1.00 0.00 H new ATOM 0 HG3 GLN B 85 16.407 13.606 -1.911 1.00 0.00 H new ATOM 0 HE21 GLN B 85 16.324 16.484 -1.203 1.00 0.00 H new ATOM 0 HE22 GLN B 85 17.834 16.775 -0.334 1.00 0.00 H new ATOM 1378 N ARG B 86 14.408 16.893 0.945 1.00 0.00 N ATOM 1379 CA ARG B 86 14.954 17.978 1.758 1.00 0.00 C ATOM 1380 C ARG B 86 14.342 17.990 3.157 1.00 0.00 C ATOM 1381 O ARG B 86 15.055 18.031 4.160 1.00 0.00 O ATOM 1382 CB ARG B 86 14.710 19.333 1.089 1.00 0.00 C ATOM 1383 CG ARG B 86 15.274 19.435 -0.316 1.00 0.00 C ATOM 1384 CD ARG B 86 15.277 20.871 -0.820 1.00 0.00 C ATOM 1385 NE ARG B 86 13.936 21.458 -0.892 1.00 0.00 N ATOM 1386 CZ ARG B 86 13.611 22.637 -0.358 1.00 0.00 C ATOM 1387 NH1 ARG B 86 14.485 23.306 0.384 1.00 0.00 N ATOM 1388 NH2 ARG B 86 12.400 23.140 -0.549 1.00 0.00 N ATOM 0 H ARG B 86 13.920 17.203 0.104 1.00 0.00 H new ATOM 0 HA ARG B 86 16.027 17.805 1.847 1.00 0.00 H new ATOM 0 HB2 ARG B 86 13.637 19.522 1.054 1.00 0.00 H new ATOM 0 HB3 ARG B 86 15.152 20.116 1.705 1.00 0.00 H new ATOM 0 HG2 ARG B 86 16.291 19.043 -0.329 1.00 0.00 H new ATOM 0 HG3 ARG B 86 14.684 18.814 -0.991 1.00 0.00 H new ATOM 0 HD2 ARG B 86 15.898 21.479 -0.163 1.00 0.00 H new ATOM 0 HD3 ARG B 86 15.734 20.902 -1.809 1.00 0.00 H new ATOM 0 HE ARG B 86 13.208 20.935 -1.379 1.00 0.00 H new ATOM 0 HH11 ARG B 86 15.414 22.920 0.550 1.00 0.00 H new ATOM 0 HH12 ARG B 86 14.227 24.206 0.788 1.00 0.00 H new ATOM 0 HH21 ARG B 86 11.716 22.626 -1.104 1.00 0.00 H new ATOM 0 HH22 ARG B 86 12.152 24.041 -0.141 1.00 0.00 H new ATOM 1402 N LEU B 87 13.016 17.945 3.214 1.00 0.00 N ATOM 1403 CA LEU B 87 12.294 18.084 4.472 1.00 0.00 C ATOM 1404 C LEU B 87 12.561 16.894 5.392 1.00 0.00 C ATOM 1405 O LEU B 87 12.710 17.051 6.606 1.00 0.00 O ATOM 1406 CB LEU B 87 10.796 18.200 4.192 1.00 0.00 C ATOM 1407 CG LEU B 87 10.004 19.009 5.215 1.00 0.00 C ATOM 1408 CD1 LEU B 87 10.333 20.490 5.092 1.00 0.00 C ATOM 1409 CD2 LEU B 87 8.519 18.772 5.035 1.00 0.00 C ATOM 0 H LEU B 87 12.417 17.813 2.399 1.00 0.00 H new ATOM 0 HA LEU B 87 12.644 18.986 4.974 1.00 0.00 H new ATOM 0 HB2 LEU B 87 10.660 18.654 3.210 1.00 0.00 H new ATOM 0 HB3 LEU B 87 10.374 17.196 4.141 1.00 0.00 H new ATOM 0 HG LEU B 87 10.286 18.680 6.215 1.00 0.00 H new ATOM 0 HD11 LEU B 87 9.760 21.053 5.829 1.00 0.00 H new ATOM 0 HD12 LEU B 87 11.398 20.642 5.268 1.00 0.00 H new ATOM 0 HD13 LEU B 87 10.077 20.838 4.091 1.00 0.00 H new ATOM 0 HD21 LEU B 87 7.966 19.355 5.771 1.00 0.00 H new ATOM 0 HD22 LEU B 87 8.221 19.077 4.032 1.00 0.00 H new ATOM 0 HD23 LEU B 87 8.300 17.713 5.172 1.00 0.00 H new ATOM 1421 N PHE B 88 12.619 15.711 4.794 1.00 0.00 N ATOM 1422 CA PHE B 88 12.874 14.474 5.510 1.00 0.00 C ATOM 1423 C PHE B 88 14.184 14.533 6.291 1.00 0.00 C ATOM 1424 O PHE B 88 14.244 14.082 7.430 1.00 0.00 O ATOM 1425 CB PHE B 88 12.850 13.307 4.511 1.00 0.00 C ATOM 1426 CG PHE B 88 13.790 12.180 4.814 1.00 0.00 C ATOM 1427 CD1 PHE B 88 13.510 11.264 5.814 1.00 0.00 C ATOM 1428 CD2 PHE B 88 14.949 12.030 4.074 1.00 0.00 C ATOM 1429 CE1 PHE B 88 14.376 10.217 6.068 1.00 0.00 C ATOM 1430 CE2 PHE B 88 15.818 10.992 4.325 1.00 0.00 C ATOM 1431 CZ PHE B 88 15.531 10.083 5.323 1.00 0.00 C ATOM 0 H PHE B 88 12.489 15.585 3.790 1.00 0.00 H new ATOM 0 HA PHE B 88 12.091 14.320 6.252 1.00 0.00 H new ATOM 0 HB2 PHE B 88 11.836 12.910 4.467 1.00 0.00 H new ATOM 0 HB3 PHE B 88 13.083 13.695 3.520 1.00 0.00 H new ATOM 0 HD1 PHE B 88 12.609 11.368 6.400 1.00 0.00 H new ATOM 0 HD2 PHE B 88 15.175 12.736 3.289 1.00 0.00 H new ATOM 0 HE1 PHE B 88 14.150 9.505 6.848 1.00 0.00 H new ATOM 0 HE2 PHE B 88 16.722 10.889 3.743 1.00 0.00 H new ATOM 0 HZ PHE B 88 16.210 9.267 5.521 1.00 0.00 H new ATOM 1441 N GLU B 89 15.224 15.099 5.697 1.00 0.00 N ATOM 1442 CA GLU B 89 16.502 15.226 6.386 1.00 0.00 C ATOM 1443 C GLU B 89 16.395 16.234 7.519 1.00 0.00 C ATOM 1444 O GLU B 89 16.922 16.021 8.611 1.00 0.00 O ATOM 1445 CB GLU B 89 17.590 15.704 5.439 1.00 0.00 C ATOM 1446 CG GLU B 89 17.699 14.916 4.155 1.00 0.00 C ATOM 1447 CD GLU B 89 18.772 15.478 3.247 1.00 0.00 C ATOM 1448 OE1 GLU B 89 19.860 14.867 3.151 1.00 0.00 O ATOM 1449 OE2 GLU B 89 18.554 16.555 2.653 1.00 0.00 O ATOM 0 H GLU B 89 15.211 15.475 4.749 1.00 0.00 H new ATOM 0 HA GLU B 89 16.758 14.240 6.774 1.00 0.00 H new ATOM 0 HB2 GLU B 89 17.405 16.750 5.193 1.00 0.00 H new ATOM 0 HB3 GLU B 89 18.548 15.663 5.957 1.00 0.00 H new ATOM 0 HG2 GLU B 89 17.924 13.874 4.384 1.00 0.00 H new ATOM 0 HG3 GLU B 89 16.740 14.928 3.637 1.00 0.00 H new ATOM 1456 N GLU B 90 15.697 17.326 7.243 1.00 0.00 N ATOM 1457 CA GLU B 90 15.640 18.460 8.151 1.00 0.00 C ATOM 1458 C GLU B 90 14.932 18.114 9.455 1.00 0.00 C ATOM 1459 O GLU B 90 15.287 18.622 10.518 1.00 0.00 O ATOM 1460 CB GLU B 90 14.952 19.633 7.456 1.00 0.00 C ATOM 1461 CG GLU B 90 15.797 20.263 6.362 1.00 0.00 C ATOM 1462 CD GLU B 90 17.165 20.685 6.857 1.00 0.00 C ATOM 1463 OE1 GLU B 90 18.144 19.947 6.619 1.00 0.00 O ATOM 1464 OE2 GLU B 90 17.268 21.753 7.498 1.00 0.00 O ATOM 0 H GLU B 90 15.157 17.450 6.387 1.00 0.00 H new ATOM 0 HA GLU B 90 16.661 18.739 8.412 1.00 0.00 H new ATOM 0 HB2 GLU B 90 14.011 19.290 7.026 1.00 0.00 H new ATOM 0 HB3 GLU B 90 14.706 20.392 8.198 1.00 0.00 H new ATOM 0 HG2 GLU B 90 15.913 19.553 5.543 1.00 0.00 H new ATOM 0 HG3 GLU B 90 15.276 21.132 5.959 1.00 0.00 H new ATOM 1471 N PHE B 91 13.940 17.244 9.379 1.00 0.00 N ATOM 1472 CA PHE B 91 13.196 16.853 10.565 1.00 0.00 C ATOM 1473 C PHE B 91 13.448 15.392 10.912 1.00 0.00 C ATOM 1474 O PHE B 91 12.706 14.794 11.689 1.00 0.00 O ATOM 1475 CB PHE B 91 11.705 17.113 10.366 1.00 0.00 C ATOM 1476 CG PHE B 91 11.384 18.565 10.179 1.00 0.00 C ATOM 1477 CD1 PHE B 91 11.024 19.052 8.935 1.00 0.00 C ATOM 1478 CD2 PHE B 91 11.447 19.443 11.248 1.00 0.00 C ATOM 1479 CE1 PHE B 91 10.736 20.389 8.759 1.00 0.00 C ATOM 1480 CE2 PHE B 91 11.159 20.782 11.077 1.00 0.00 C ATOM 1481 CZ PHE B 91 10.799 21.256 9.832 1.00 0.00 C ATOM 0 H PHE B 91 13.632 16.797 8.515 1.00 0.00 H new ATOM 0 HA PHE B 91 13.545 17.459 11.401 1.00 0.00 H new ATOM 0 HB2 PHE B 91 11.357 16.555 9.497 1.00 0.00 H new ATOM 0 HB3 PHE B 91 11.157 16.734 11.229 1.00 0.00 H new ATOM 0 HD1 PHE B 91 10.968 18.378 8.093 1.00 0.00 H new ATOM 0 HD2 PHE B 91 11.724 19.076 12.225 1.00 0.00 H new ATOM 0 HE1 PHE B 91 10.461 20.758 7.782 1.00 0.00 H new ATOM 0 HE2 PHE B 91 11.215 21.458 11.917 1.00 0.00 H new ATOM 0 HZ PHE B 91 10.567 22.302 9.697 1.00 0.00 H new ATOM 1491 N ARG B 92 14.513 14.831 10.350 1.00 0.00 N ATOM 1492 CA ARG B 92 14.902 13.455 10.646 1.00 0.00 C ATOM 1493 C ARG B 92 15.512 13.383 12.043 1.00 0.00 C ATOM 1494 O ARG B 92 15.651 12.313 12.633 1.00 0.00 O ATOM 1495 CB ARG B 92 15.903 12.958 9.609 1.00 0.00 C ATOM 1496 CG ARG B 92 16.193 11.477 9.709 1.00 0.00 C ATOM 1497 CD ARG B 92 17.302 11.077 8.756 1.00 0.00 C ATOM 1498 NE ARG B 92 17.901 9.792 9.128 1.00 0.00 N ATOM 1499 CZ ARG B 92 18.222 8.824 8.266 1.00 0.00 C ATOM 1500 NH1 ARG B 92 18.032 8.984 6.961 1.00 0.00 N ATOM 1501 NH2 ARG B 92 18.743 7.690 8.711 1.00 0.00 N ATOM 0 H ARG B 92 15.124 15.308 9.686 1.00 0.00 H new ATOM 0 HA ARG B 92 14.018 12.818 10.610 1.00 0.00 H new ATOM 0 HB2 ARG B 92 15.521 13.178 8.612 1.00 0.00 H new ATOM 0 HB3 ARG B 92 16.836 13.511 9.722 1.00 0.00 H new ATOM 0 HG2 ARG B 92 16.478 11.226 10.731 1.00 0.00 H new ATOM 0 HG3 ARG B 92 15.291 10.910 9.482 1.00 0.00 H new ATOM 0 HD2 ARG B 92 16.905 11.014 7.743 1.00 0.00 H new ATOM 0 HD3 ARG B 92 18.072 11.849 8.749 1.00 0.00 H new ATOM 0 HE ARG B 92 18.086 9.625 10.117 1.00 0.00 H new ATOM 0 HH11 ARG B 92 17.636 9.855 6.606 1.00 0.00 H new ATOM 0 HH12 ARG B 92 18.282 8.236 6.314 1.00 0.00 H new ATOM 0 HH21 ARG B 92 18.898 7.558 9.710 1.00 0.00 H new ATOM 0 HH22 ARG B 92 18.989 6.949 8.054 1.00 0.00 H new ATOM 1515 N ASP B 93 15.879 14.551 12.550 1.00 0.00 N ATOM 1516 CA ASP B 93 16.364 14.703 13.922 1.00 0.00 C ATOM 1517 C ASP B 93 15.214 14.531 14.923 1.00 0.00 C ATOM 1518 O ASP B 93 15.408 14.579 16.137 1.00 0.00 O ATOM 1519 CB ASP B 93 17.020 16.083 14.087 1.00 0.00 C ATOM 1520 CG ASP B 93 17.545 16.336 15.489 1.00 0.00 C ATOM 1521 OD1 ASP B 93 18.567 15.726 15.868 1.00 0.00 O ATOM 1522 OD2 ASP B 93 16.939 17.155 16.216 1.00 0.00 O ATOM 0 H ASP B 93 15.850 15.424 12.024 1.00 0.00 H new ATOM 0 HA ASP B 93 17.106 13.930 14.124 1.00 0.00 H new ATOM 0 HB2 ASP B 93 17.842 16.174 13.377 1.00 0.00 H new ATOM 0 HB3 ASP B 93 16.294 16.855 13.834 1.00 0.00 H new ATOM 1527 N SER B 94 14.014 14.312 14.401 1.00 0.00 N ATOM 1528 CA SER B 94 12.844 14.109 15.234 1.00 0.00 C ATOM 1529 C SER B 94 12.474 12.628 15.264 1.00 0.00 C ATOM 1530 O SER B 94 12.834 11.872 14.362 1.00 0.00 O ATOM 1531 CB SER B 94 11.674 14.937 14.699 1.00 0.00 C ATOM 1532 OG SER B 94 12.042 16.297 14.557 1.00 0.00 O ATOM 0 H SER B 94 13.829 14.271 13.399 1.00 0.00 H new ATOM 0 HA SER B 94 13.069 14.433 16.250 1.00 0.00 H new ATOM 0 HB2 SER B 94 11.353 14.540 13.736 1.00 0.00 H new ATOM 0 HB3 SER B 94 10.825 14.855 15.377 1.00 0.00 H new ATOM 0 HG SER B 94 11.341 16.776 14.067 1.00 0.00 H new ATOM 1538 N ASP B 95 11.756 12.222 16.304 1.00 0.00 N ATOM 1539 CA ASP B 95 11.378 10.819 16.478 1.00 0.00 C ATOM 1540 C ASP B 95 10.198 10.450 15.599 1.00 0.00 C ATOM 1541 O ASP B 95 9.781 9.297 15.564 1.00 0.00 O ATOM 1542 CB ASP B 95 11.052 10.508 17.939 1.00 0.00 C ATOM 1543 CG ASP B 95 9.957 11.388 18.497 1.00 0.00 C ATOM 1544 OD1 ASP B 95 10.268 12.523 18.909 1.00 0.00 O ATOM 1545 OD2 ASP B 95 8.793 10.946 18.552 1.00 0.00 O ATOM 0 H ASP B 95 11.422 12.842 17.042 1.00 0.00 H new ATOM 0 HA ASP B 95 12.237 10.219 16.177 1.00 0.00 H new ATOM 0 HB2 ASP B 95 10.751 9.464 18.025 1.00 0.00 H new ATOM 0 HB3 ASP B 95 11.952 10.631 18.541 1.00 0.00 H new ATOM 1550 N ASP B 96 9.632 11.439 14.929 1.00 0.00 N ATOM 1551 CA ASP B 96 8.587 11.193 13.952 1.00 0.00 C ATOM 1552 C ASP B 96 8.668 12.229 12.841 1.00 0.00 C ATOM 1553 O ASP B 96 7.934 13.221 12.840 1.00 0.00 O ATOM 1554 CB ASP B 96 7.208 11.218 14.620 1.00 0.00 C ATOM 1555 CG ASP B 96 6.098 10.777 13.690 1.00 0.00 C ATOM 1556 OD1 ASP B 96 6.185 9.660 13.140 1.00 0.00 O ATOM 1557 OD2 ASP B 96 5.117 11.531 13.528 1.00 0.00 O ATOM 0 H ASP B 96 9.880 12.422 15.045 1.00 0.00 H new ATOM 0 HA ASP B 96 8.732 10.203 13.520 1.00 0.00 H new ATOM 0 HB2 ASP B 96 7.222 10.569 15.496 1.00 0.00 H new ATOM 0 HB3 ASP B 96 6.999 12.227 14.975 1.00 0.00 H new ATOM 1562 N VAL B 97 9.597 12.023 11.910 1.00 0.00 N ATOM 1563 CA VAL B 97 9.834 12.997 10.852 1.00 0.00 C ATOM 1564 C VAL B 97 8.612 13.145 9.947 1.00 0.00 C ATOM 1565 O VAL B 97 8.301 14.246 9.504 1.00 0.00 O ATOM 1566 CB VAL B 97 11.111 12.683 10.018 1.00 0.00 C ATOM 1567 CG1 VAL B 97 11.156 11.242 9.543 1.00 0.00 C ATOM 1568 CG2 VAL B 97 11.222 13.617 8.823 1.00 0.00 C ATOM 0 H VAL B 97 10.193 11.196 11.868 1.00 0.00 H new ATOM 0 HA VAL B 97 10.010 13.951 11.348 1.00 0.00 H new ATOM 0 HB VAL B 97 11.959 12.841 10.684 1.00 0.00 H new ATOM 0 HG11 VAL B 97 12.066 11.077 8.967 1.00 0.00 H new ATOM 0 HG12 VAL B 97 11.146 10.574 10.405 1.00 0.00 H new ATOM 0 HG13 VAL B 97 10.288 11.038 8.916 1.00 0.00 H new ATOM 0 HG21 VAL B 97 12.122 13.378 8.256 1.00 0.00 H new ATOM 0 HG22 VAL B 97 10.348 13.495 8.184 1.00 0.00 H new ATOM 0 HG23 VAL B 97 11.276 14.648 9.171 1.00 0.00 H new ATOM 1578 N LEU B 98 7.888 12.055 9.723 1.00 0.00 N ATOM 1579 CA LEU B 98 6.702 12.100 8.871 1.00 0.00 C ATOM 1580 C LEU B 98 5.629 13.010 9.460 1.00 0.00 C ATOM 1581 O LEU B 98 4.894 13.670 8.720 1.00 0.00 O ATOM 1582 CB LEU B 98 6.132 10.702 8.631 1.00 0.00 C ATOM 1583 CG LEU B 98 6.889 9.853 7.610 1.00 0.00 C ATOM 1584 CD1 LEU B 98 8.153 9.274 8.209 1.00 0.00 C ATOM 1585 CD2 LEU B 98 6.005 8.741 7.079 1.00 0.00 C ATOM 0 H LEU B 98 8.097 11.137 10.114 1.00 0.00 H new ATOM 0 HA LEU B 98 7.015 12.512 7.911 1.00 0.00 H new ATOM 0 HB2 LEU B 98 6.113 10.167 9.581 1.00 0.00 H new ATOM 0 HB3 LEU B 98 5.098 10.801 8.301 1.00 0.00 H new ATOM 0 HG LEU B 98 7.171 10.503 6.782 1.00 0.00 H new ATOM 0 HD11 LEU B 98 8.670 8.675 7.459 1.00 0.00 H new ATOM 0 HD12 LEU B 98 8.804 10.084 8.538 1.00 0.00 H new ATOM 0 HD13 LEU B 98 7.897 8.645 9.062 1.00 0.00 H new ATOM 0 HD21 LEU B 98 6.562 8.148 6.354 1.00 0.00 H new ATOM 0 HD22 LEU B 98 5.689 8.102 7.904 1.00 0.00 H new ATOM 0 HD23 LEU B 98 5.127 9.172 6.597 1.00 0.00 H new ATOM 1597 N GLY B 99 5.550 13.059 10.785 1.00 0.00 N ATOM 1598 CA GLY B 99 4.607 13.948 11.439 1.00 0.00 C ATOM 1599 C GLY B 99 4.993 15.396 11.259 1.00 0.00 C ATOM 1600 O GLY B 99 4.138 16.275 11.181 1.00 0.00 O ATOM 0 H GLY B 99 6.122 12.499 11.418 1.00 0.00 H new ATOM 0 HA2 GLY B 99 3.609 13.784 11.033 1.00 0.00 H new ATOM 0 HA3 GLY B 99 4.561 13.712 12.502 1.00 0.00 H new ATOM 1604 N HIS B 100 6.290 15.639 11.162 1.00 0.00 N ATOM 1605 CA HIS B 100 6.797 16.982 10.943 1.00 0.00 C ATOM 1606 C HIS B 100 6.657 17.340 9.470 1.00 0.00 C ATOM 1607 O HIS B 100 6.472 18.504 9.117 1.00 0.00 O ATOM 1608 CB HIS B 100 8.257 17.094 11.389 1.00 0.00 C ATOM 1609 CG HIS B 100 8.440 17.077 12.878 1.00 0.00 C ATOM 1610 ND1 HIS B 100 8.855 18.177 13.592 1.00 0.00 N ATOM 1611 CD2 HIS B 100 8.268 16.086 13.788 1.00 0.00 C ATOM 1612 CE1 HIS B 100 8.934 17.867 14.873 1.00 0.00 C ATOM 1613 NE2 HIS B 100 8.581 16.604 15.018 1.00 0.00 N ATOM 0 H HIS B 100 7.012 14.921 11.232 1.00 0.00 H new ATOM 0 HA HIS B 100 6.214 17.683 11.540 1.00 0.00 H new ATOM 0 HB2 HIS B 100 8.824 16.271 10.954 1.00 0.00 H new ATOM 0 HB3 HIS B 100 8.679 18.017 10.991 1.00 0.00 H new ATOM 0 HD2 HIS B 100 7.945 15.076 13.582 1.00 0.00 H new ATOM 0 HE1 HIS B 100 9.236 18.534 15.667 1.00 0.00 H new ATOM 0 HE2 HIS B 100 8.547 16.096 15.902 1.00 0.00 H new ATOM 1622 N ILE B 101 6.736 16.320 8.620 1.00 0.00 N ATOM 1623 CA ILE B 101 6.506 16.488 7.197 1.00 0.00 C ATOM 1624 C ILE B 101 5.081 16.966 6.942 1.00 0.00 C ATOM 1625 O ILE B 101 4.877 18.058 6.424 1.00 0.00 O ATOM 1626 CB ILE B 101 6.751 15.174 6.414 1.00 0.00 C ATOM 1627 CG1 ILE B 101 8.225 14.767 6.502 1.00 0.00 C ATOM 1628 CG2 ILE B 101 6.332 15.333 4.956 1.00 0.00 C ATOM 1629 CD1 ILE B 101 8.541 13.464 5.796 1.00 0.00 C ATOM 0 H ILE B 101 6.959 15.365 8.899 1.00 0.00 H new ATOM 0 HA ILE B 101 7.216 17.235 6.843 1.00 0.00 H new ATOM 0 HB ILE B 101 6.145 14.388 6.864 1.00 0.00 H new ATOM 0 HG12 ILE B 101 8.838 15.560 6.073 1.00 0.00 H new ATOM 0 HG13 ILE B 101 8.506 14.679 7.551 1.00 0.00 H new ATOM 0 HG21 ILE B 101 6.512 14.400 4.422 1.00 0.00 H new ATOM 0 HG22 ILE B 101 5.272 15.581 4.907 1.00 0.00 H new ATOM 0 HG23 ILE B 101 6.913 16.132 4.496 1.00 0.00 H new ATOM 0 HD11 ILE B 101 9.603 13.241 5.901 1.00 0.00 H new ATOM 0 HD12 ILE B 101 7.956 12.659 6.239 1.00 0.00 H new ATOM 0 HD13 ILE B 101 8.292 13.554 4.739 1.00 0.00 H new ATOM 1641 N MET B 102 4.103 16.156 7.343 1.00 0.00 N ATOM 1642 CA MET B 102 2.691 16.446 7.085 1.00 0.00 C ATOM 1643 C MET B 102 2.295 17.844 7.548 1.00 0.00 C ATOM 1644 O MET B 102 1.592 18.568 6.839 1.00 0.00 O ATOM 1645 CB MET B 102 1.802 15.417 7.778 1.00 0.00 C ATOM 1646 CG MET B 102 1.863 14.034 7.157 1.00 0.00 C ATOM 1647 SD MET B 102 0.746 12.877 7.960 1.00 0.00 S ATOM 1648 CE MET B 102 0.906 11.485 6.858 1.00 0.00 C ATOM 0 H MET B 102 4.263 15.287 7.852 1.00 0.00 H new ATOM 0 HA MET B 102 2.550 16.395 6.005 1.00 0.00 H new ATOM 0 HB2 MET B 102 2.093 15.347 8.826 1.00 0.00 H new ATOM 0 HB3 MET B 102 0.771 15.769 7.756 1.00 0.00 H new ATOM 0 HG2 MET B 102 1.613 14.102 6.098 1.00 0.00 H new ATOM 0 HG3 MET B 102 2.883 13.654 7.220 1.00 0.00 H new ATOM 0 HE1 MET B 102 -0.056 10.981 6.766 1.00 0.00 H new ATOM 0 HE2 MET B 102 1.229 11.833 5.877 1.00 0.00 H new ATOM 0 HE3 MET B 102 1.644 10.788 7.256 1.00 0.00 H new ATOM 1658 N LYS B 103 2.751 18.222 8.731 1.00 0.00 N ATOM 1659 CA LYS B 103 2.374 19.502 9.315 1.00 0.00 C ATOM 1660 C LYS B 103 3.091 20.673 8.641 1.00 0.00 C ATOM 1661 O LYS B 103 2.587 21.795 8.647 1.00 0.00 O ATOM 1662 CB LYS B 103 2.666 19.508 10.819 1.00 0.00 C ATOM 1663 CG LYS B 103 1.884 18.458 11.602 1.00 0.00 C ATOM 1664 CD LYS B 103 0.382 18.687 11.515 1.00 0.00 C ATOM 1665 CE LYS B 103 -0.396 17.587 12.222 1.00 0.00 C ATOM 1666 NZ LYS B 103 -0.077 17.512 13.673 1.00 0.00 N ATOM 0 H LYS B 103 3.382 17.663 9.306 1.00 0.00 H new ATOM 0 HA LYS B 103 1.304 19.629 9.152 1.00 0.00 H new ATOM 0 HB2 LYS B 103 3.732 19.343 10.973 1.00 0.00 H new ATOM 0 HB3 LYS B 103 2.434 20.494 11.221 1.00 0.00 H new ATOM 0 HG2 LYS B 103 2.123 17.466 11.218 1.00 0.00 H new ATOM 0 HG3 LYS B 103 2.194 18.478 12.647 1.00 0.00 H new ATOM 0 HD2 LYS B 103 0.134 19.651 11.959 1.00 0.00 H new ATOM 0 HD3 LYS B 103 0.080 18.731 10.468 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -1.464 17.762 12.096 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -0.173 16.629 11.753 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -0.725 16.844 14.137 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 0.903 17.186 13.797 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -0.185 18.454 14.101 1.00 0.00 H new ATOM 1680 N ASN B 104 4.253 20.420 8.051 1.00 0.00 N ATOM 1681 CA ASN B 104 5.052 21.507 7.488 1.00 0.00 C ATOM 1682 C ASN B 104 4.967 21.567 5.960 1.00 0.00 C ATOM 1683 O ASN B 104 5.253 22.603 5.361 1.00 0.00 O ATOM 1684 CB ASN B 104 6.513 21.368 7.917 1.00 0.00 C ATOM 1685 CG ASN B 104 7.301 22.647 7.701 1.00 0.00 C ATOM 1686 OD1 ASN B 104 6.766 23.748 7.824 1.00 0.00 O ATOM 1687 ND2 ASN B 104 8.580 22.514 7.394 1.00 0.00 N ATOM 0 H ASN B 104 4.660 19.490 7.950 1.00 0.00 H new ATOM 0 HA ASN B 104 4.638 22.438 7.876 1.00 0.00 H new ATOM 0 HB2 ASN B 104 6.555 21.091 8.970 1.00 0.00 H new ATOM 0 HB3 ASN B 104 6.979 20.558 7.356 1.00 0.00 H new ATOM 0 HD21 ASN B 104 9.159 23.342 7.251 1.00 0.00 H new ATOM 0 HD22 ASN B 104 8.988 21.584 7.301 1.00 0.00 H new ATOM 1694 N ILE B 105 4.573 20.470 5.325 1.00 0.00 N ATOM 1695 CA ILE B 105 4.553 20.415 3.863 1.00 0.00 C ATOM 1696 C ILE B 105 3.199 20.845 3.309 1.00 0.00 C ATOM 1697 O ILE B 105 2.182 20.811 4.001 1.00 0.00 O ATOM 1698 CB ILE B 105 4.924 19.005 3.327 1.00 0.00 C ATOM 1699 CG1 ILE B 105 5.216 19.036 1.821 1.00 0.00 C ATOM 1700 CG2 ILE B 105 3.821 17.994 3.625 1.00 0.00 C ATOM 1701 CD1 ILE B 105 6.433 19.856 1.445 1.00 0.00 C ATOM 0 H ILE B 105 4.266 19.615 5.789 1.00 0.00 H new ATOM 0 HA ILE B 105 5.311 21.117 3.516 1.00 0.00 H new ATOM 0 HB ILE B 105 5.831 18.693 3.845 1.00 0.00 H new ATOM 0 HG12 ILE B 105 5.356 18.014 1.468 1.00 0.00 H new ATOM 0 HG13 ILE B 105 4.346 19.437 1.301 1.00 0.00 H new ATOM 0 HG21 ILE B 105 4.109 17.017 3.238 1.00 0.00 H new ATOM 0 HG22 ILE B 105 3.670 17.928 4.702 1.00 0.00 H new ATOM 0 HG23 ILE B 105 2.895 18.315 3.148 1.00 0.00 H new ATOM 0 HD11 ILE B 105 6.571 19.828 0.364 1.00 0.00 H new ATOM 0 HD12 ILE B 105 6.290 20.888 1.765 1.00 0.00 H new ATOM 0 HD13 ILE B 105 7.315 19.443 1.935 1.00 0.00 H new ATOM 1713 N THR B 106 3.212 21.249 2.051 1.00 0.00 N ATOM 1714 CA THR B 106 2.043 21.789 1.387 1.00 0.00 C ATOM 1715 C THR B 106 1.067 20.684 0.961 1.00 0.00 C ATOM 1716 O THR B 106 -0.102 20.949 0.684 1.00 0.00 O ATOM 1717 CB THR B 106 2.497 22.611 0.165 1.00 0.00 C ATOM 1718 OG1 THR B 106 1.425 23.420 -0.334 1.00 0.00 O ATOM 1719 CG2 THR B 106 3.018 21.713 -0.949 1.00 0.00 C ATOM 0 H THR B 106 4.041 21.210 1.459 1.00 0.00 H new ATOM 0 HA THR B 106 1.509 22.430 2.089 1.00 0.00 H new ATOM 0 HB THR B 106 3.309 23.258 0.497 1.00 0.00 H new ATOM 0 HG1 THR B 106 1.736 23.934 -1.108 1.00 0.00 H new ATOM 0 HG21 THR B 106 3.329 22.326 -1.795 1.00 0.00 H new ATOM 0 HG22 THR B 106 3.869 21.138 -0.585 1.00 0.00 H new ATOM 0 HG23 THR B 106 2.229 21.031 -1.266 1.00 0.00 H new ATOM 1727 N ALA B 107 1.540 19.443 0.933 1.00 0.00 N ATOM 1728 CA ALA B 107 0.710 18.329 0.497 1.00 0.00 C ATOM 1729 C ALA B 107 0.389 17.394 1.652 1.00 0.00 C ATOM 1730 O ALA B 107 1.287 16.942 2.361 1.00 0.00 O ATOM 1731 CB ALA B 107 1.404 17.555 -0.612 1.00 0.00 C ATOM 0 H ALA B 107 2.488 19.185 1.206 1.00 0.00 H new ATOM 0 HA ALA B 107 -0.226 18.741 0.119 1.00 0.00 H new ATOM 0 HB1 ALA B 107 0.771 16.725 -0.928 1.00 0.00 H new ATOM 0 HB2 ALA B 107 1.584 18.216 -1.459 1.00 0.00 H new ATOM 0 HB3 ALA B 107 2.355 17.167 -0.245 1.00 0.00 H new ATOM 1737 N LYS B 108 -0.886 17.092 1.831 1.00 0.00 N ATOM 1738 CA LYS B 108 -1.303 16.141 2.849 1.00 0.00 C ATOM 1739 C LYS B 108 -1.237 14.738 2.272 1.00 0.00 C ATOM 1740 O LYS B 108 -2.093 14.333 1.486 1.00 0.00 O ATOM 1741 CB LYS B 108 -2.720 16.451 3.353 1.00 0.00 C ATOM 1742 CG LYS B 108 -2.805 17.561 4.405 1.00 0.00 C ATOM 1743 CD LYS B 108 -2.224 18.882 3.914 1.00 0.00 C ATOM 1744 CE LYS B 108 -0.817 19.109 4.455 1.00 0.00 C ATOM 1745 NZ LYS B 108 -0.828 19.530 5.880 1.00 0.00 N ATOM 0 H LYS B 108 -1.650 17.491 1.285 1.00 0.00 H new ATOM 0 HA LYS B 108 -0.630 16.218 3.703 1.00 0.00 H new ATOM 0 HB2 LYS B 108 -3.339 16.731 2.501 1.00 0.00 H new ATOM 0 HB3 LYS B 108 -3.147 15.540 3.772 1.00 0.00 H new ATOM 0 HG2 LYS B 108 -3.847 17.710 4.687 1.00 0.00 H new ATOM 0 HG3 LYS B 108 -2.273 17.246 5.303 1.00 0.00 H new ATOM 0 HD2 LYS B 108 -2.201 18.888 2.824 1.00 0.00 H new ATOM 0 HD3 LYS B 108 -2.871 19.703 4.224 1.00 0.00 H new ATOM 0 HE2 LYS B 108 -0.237 18.192 4.353 1.00 0.00 H new ATOM 0 HE3 LYS B 108 -0.317 19.870 3.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 -0.012 19.113 6.372 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 -0.773 20.567 5.936 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 -1.707 19.205 6.331 1.00 0.00 H new ATOM 1759 N ARG B 109 -0.196 14.014 2.636 1.00 0.00 N ATOM 1760 CA ARG B 109 0.028 12.689 2.090 1.00 0.00 C ATOM 1761 C ARG B 109 -0.233 11.637 3.152 1.00 0.00 C ATOM 1762 O ARG B 109 -0.579 11.962 4.283 1.00 0.00 O ATOM 1763 CB ARG B 109 1.461 12.563 1.565 1.00 0.00 C ATOM 1764 CG ARG B 109 1.917 13.767 0.755 1.00 0.00 C ATOM 1765 CD ARG B 109 3.348 13.606 0.267 1.00 0.00 C ATOM 1766 NE ARG B 109 3.884 14.859 -0.275 1.00 0.00 N ATOM 1767 CZ ARG B 109 5.048 15.397 0.093 1.00 0.00 C ATOM 1768 NH1 ARG B 109 5.820 14.782 0.986 1.00 0.00 N ATOM 1769 NH2 ARG B 109 5.443 16.551 -0.434 1.00 0.00 N ATOM 0 H ARG B 109 0.508 14.321 3.307 1.00 0.00 H new ATOM 0 HA ARG B 109 -0.661 12.533 1.260 1.00 0.00 H new ATOM 0 HB2 ARG B 109 2.138 12.425 2.408 1.00 0.00 H new ATOM 0 HB3 ARG B 109 1.536 11.669 0.946 1.00 0.00 H new ATOM 0 HG2 ARG B 109 1.254 13.903 -0.099 1.00 0.00 H new ATOM 0 HG3 ARG B 109 1.839 14.667 1.365 1.00 0.00 H new ATOM 0 HD2 ARG B 109 3.977 13.268 1.091 1.00 0.00 H new ATOM 0 HD3 ARG B 109 3.385 12.833 -0.500 1.00 0.00 H new ATOM 0 HE ARG B 109 3.332 15.350 -0.978 1.00 0.00 H new ATOM 0 HH11 ARG B 109 5.523 13.895 1.392 1.00 0.00 H new ATOM 0 HH12 ARG B 109 6.709 15.198 1.264 1.00 0.00 H new ATOM 0 HH21 ARG B 109 4.856 17.026 -1.120 1.00 0.00 H new ATOM 0 HH22 ARG B 109 6.333 16.962 -0.152 1.00 0.00 H new ATOM 1783 N SER B 110 -0.076 10.380 2.782 1.00 0.00 N ATOM 1784 CA SER B 110 -0.290 9.283 3.712 1.00 0.00 C ATOM 1785 C SER B 110 1.042 8.791 4.263 1.00 0.00 C ATOM 1786 O SER B 110 2.070 8.896 3.591 1.00 0.00 O ATOM 1787 CB SER B 110 -1.027 8.142 3.010 1.00 0.00 C ATOM 1788 OG SER B 110 -2.100 8.636 2.224 1.00 0.00 O ATOM 0 H SER B 110 0.199 10.091 1.843 1.00 0.00 H new ATOM 0 HA SER B 110 -0.899 9.638 4.543 1.00 0.00 H new ATOM 0 HB2 SER B 110 -0.332 7.591 2.377 1.00 0.00 H new ATOM 0 HB3 SER B 110 -1.408 7.440 3.752 1.00 0.00 H new ATOM 0 HG SER B 110 -2.555 7.888 1.784 1.00 0.00 H new ATOM 1794 N ARG B 111 1.018 8.241 5.472 1.00 0.00 N ATOM 1795 CA ARG B 111 2.223 7.721 6.109 1.00 0.00 C ATOM 1796 C ARG B 111 2.869 6.637 5.254 1.00 0.00 C ATOM 1797 O ARG B 111 4.061 6.701 4.958 1.00 0.00 O ATOM 1798 CB ARG B 111 1.896 7.170 7.499 1.00 0.00 C ATOM 1799 CG ARG B 111 1.645 8.248 8.543 1.00 0.00 C ATOM 1800 CD ARG B 111 2.913 9.035 8.830 1.00 0.00 C ATOM 1801 NE ARG B 111 2.699 10.125 9.776 1.00 0.00 N ATOM 1802 CZ ARG B 111 3.373 10.258 10.919 1.00 0.00 C ATOM 1803 NH1 ARG B 111 4.303 9.376 11.258 1.00 0.00 N ATOM 1804 NH2 ARG B 111 3.123 11.277 11.723 1.00 0.00 N ATOM 0 H ARG B 111 0.172 8.143 6.034 1.00 0.00 H new ATOM 0 HA ARG B 111 2.931 8.543 6.212 1.00 0.00 H new ATOM 0 HB2 ARG B 111 1.014 6.533 7.429 1.00 0.00 H new ATOM 0 HB3 ARG B 111 2.720 6.539 7.833 1.00 0.00 H new ATOM 0 HG2 ARG B 111 0.865 8.924 8.193 1.00 0.00 H new ATOM 0 HG3 ARG B 111 1.281 7.790 9.463 1.00 0.00 H new ATOM 0 HD2 ARG B 111 3.672 8.360 9.225 1.00 0.00 H new ATOM 0 HD3 ARG B 111 3.302 9.441 7.896 1.00 0.00 H new ATOM 0 HE ARG B 111 1.993 10.826 9.550 1.00 0.00 H new ATOM 0 HH11 ARG B 111 4.507 8.589 10.643 1.00 0.00 H new ATOM 0 HH12 ARG B 111 4.814 9.485 12.134 1.00 0.00 H new ATOM 0 HH21 ARG B 111 2.413 11.964 11.470 1.00 0.00 H new ATOM 0 HH22 ARG B 111 3.640 11.376 12.597 1.00 0.00 H new ATOM 1818 N ALA B 112 2.070 5.659 4.839 1.00 0.00 N ATOM 1819 CA ALA B 112 2.568 4.559 4.019 1.00 0.00 C ATOM 1820 C ALA B 112 3.134 5.069 2.697 1.00 0.00 C ATOM 1821 O ALA B 112 4.066 4.491 2.147 1.00 0.00 O ATOM 1822 CB ALA B 112 1.465 3.545 3.763 1.00 0.00 C ATOM 0 H ALA B 112 1.075 5.605 5.057 1.00 0.00 H new ATOM 0 HA ALA B 112 3.374 4.072 4.567 1.00 0.00 H new ATOM 0 HB1 ALA B 112 1.854 2.732 3.150 1.00 0.00 H new ATOM 0 HB2 ALA B 112 1.110 3.146 4.713 1.00 0.00 H new ATOM 0 HB3 ALA B 112 0.639 4.029 3.242 1.00 0.00 H new ATOM 1828 N ARG B 113 2.581 6.170 2.205 1.00 0.00 N ATOM 1829 CA ARG B 113 3.020 6.737 0.939 1.00 0.00 C ATOM 1830 C ARG B 113 4.366 7.428 1.077 1.00 0.00 C ATOM 1831 O ARG B 113 5.165 7.429 0.145 1.00 0.00 O ATOM 1832 CB ARG B 113 1.981 7.713 0.388 1.00 0.00 C ATOM 1833 CG ARG B 113 0.959 7.065 -0.529 1.00 0.00 C ATOM 1834 CD ARG B 113 1.528 6.811 -1.919 1.00 0.00 C ATOM 1835 NE ARG B 113 2.688 5.918 -1.904 1.00 0.00 N ATOM 1836 CZ ARG B 113 2.778 4.790 -2.610 1.00 0.00 C ATOM 1837 NH1 ARG B 113 1.769 4.390 -3.378 1.00 0.00 N ATOM 1838 NH2 ARG B 113 3.887 4.068 -2.561 1.00 0.00 N ATOM 0 H ARG B 113 1.830 6.686 2.663 1.00 0.00 H new ATOM 0 HA ARG B 113 3.132 5.912 0.235 1.00 0.00 H new ATOM 0 HB2 ARG B 113 1.460 8.184 1.222 1.00 0.00 H new ATOM 0 HB3 ARG B 113 2.494 8.506 -0.157 1.00 0.00 H new ATOM 0 HG2 ARG B 113 0.627 6.122 -0.094 1.00 0.00 H new ATOM 0 HG3 ARG B 113 0.082 7.707 -0.607 1.00 0.00 H new ATOM 0 HD2 ARG B 113 0.752 6.380 -2.551 1.00 0.00 H new ATOM 0 HD3 ARG B 113 1.813 7.762 -2.369 1.00 0.00 H new ATOM 0 HE ARG B 113 3.480 6.175 -1.315 1.00 0.00 H new ATOM 0 HH11 ARG B 113 0.916 4.947 -3.431 1.00 0.00 H new ATOM 0 HH12 ARG B 113 1.848 3.526 -3.914 1.00 0.00 H new ATOM 0 HH21 ARG B 113 4.670 4.375 -1.984 1.00 0.00 H new ATOM 0 HH22 ARG B 113 3.958 3.205 -3.100 1.00 0.00 H new ATOM 1852 N ILE B 114 4.607 8.010 2.240 1.00 0.00 N ATOM 1853 CA ILE B 114 5.863 8.692 2.501 1.00 0.00 C ATOM 1854 C ILE B 114 6.955 7.679 2.829 1.00 0.00 C ATOM 1855 O ILE B 114 8.075 7.769 2.320 1.00 0.00 O ATOM 1856 CB ILE B 114 5.717 9.696 3.662 1.00 0.00 C ATOM 1857 CG1 ILE B 114 4.632 10.728 3.338 1.00 0.00 C ATOM 1858 CG2 ILE B 114 7.044 10.387 3.940 1.00 0.00 C ATOM 1859 CD1 ILE B 114 4.317 11.664 4.489 1.00 0.00 C ATOM 0 H ILE B 114 3.949 8.024 3.019 1.00 0.00 H new ATOM 0 HA ILE B 114 6.140 9.242 1.602 1.00 0.00 H new ATOM 0 HB ILE B 114 5.421 9.150 4.558 1.00 0.00 H new ATOM 0 HG12 ILE B 114 4.949 11.318 2.478 1.00 0.00 H new ATOM 0 HG13 ILE B 114 3.721 10.205 3.047 1.00 0.00 H new ATOM 0 HG21 ILE B 114 6.922 11.092 4.762 1.00 0.00 H new ATOM 0 HG22 ILE B 114 7.793 9.642 4.209 1.00 0.00 H new ATOM 0 HG23 ILE B 114 7.369 10.923 3.048 1.00 0.00 H new ATOM 0 HD11 ILE B 114 3.540 12.366 4.185 1.00 0.00 H new ATOM 0 HD12 ILE B 114 3.968 11.085 5.344 1.00 0.00 H new ATOM 0 HD13 ILE B 114 5.216 12.215 4.766 1.00 0.00 H new ATOM 1871 N VAL B 115 6.611 6.709 3.668 1.00 0.00 N ATOM 1872 CA VAL B 115 7.526 5.633 4.024 1.00 0.00 C ATOM 1873 C VAL B 115 8.024 4.909 2.779 1.00 0.00 C ATOM 1874 O VAL B 115 9.231 4.795 2.556 1.00 0.00 O ATOM 1875 CB VAL B 115 6.850 4.610 4.965 1.00 0.00 C ATOM 1876 CG1 VAL B 115 7.699 3.356 5.108 1.00 0.00 C ATOM 1877 CG2 VAL B 115 6.589 5.228 6.330 1.00 0.00 C ATOM 0 H VAL B 115 5.697 6.647 4.117 1.00 0.00 H new ATOM 0 HA VAL B 115 8.370 6.088 4.541 1.00 0.00 H new ATOM 0 HB VAL B 115 5.895 4.327 4.522 1.00 0.00 H new ATOM 0 HG11 VAL B 115 7.200 2.653 5.775 1.00 0.00 H new ATOM 0 HG12 VAL B 115 7.834 2.894 4.130 1.00 0.00 H new ATOM 0 HG13 VAL B 115 8.672 3.621 5.522 1.00 0.00 H new ATOM 0 HG21 VAL B 115 6.113 4.492 6.978 1.00 0.00 H new ATOM 0 HG22 VAL B 115 7.533 5.544 6.773 1.00 0.00 H new ATOM 0 HG23 VAL B 115 5.933 6.092 6.219 1.00 0.00 H new ATOM 1887 N ASP B 116 7.082 4.447 1.961 1.00 0.00 N ATOM 1888 CA ASP B 116 7.409 3.710 0.745 1.00 0.00 C ATOM 1889 C ASP B 116 8.292 4.545 -0.166 1.00 0.00 C ATOM 1890 O ASP B 116 9.211 4.032 -0.803 1.00 0.00 O ATOM 1891 CB ASP B 116 6.136 3.316 -0.007 1.00 0.00 C ATOM 1892 CG ASP B 116 6.428 2.447 -1.211 1.00 0.00 C ATOM 1893 OD1 ASP B 116 6.653 1.231 -1.032 1.00 0.00 O ATOM 1894 OD2 ASP B 116 6.408 2.969 -2.344 1.00 0.00 O ATOM 0 H ASP B 116 6.082 4.571 2.120 1.00 0.00 H new ATOM 0 HA ASP B 116 7.946 2.808 1.037 1.00 0.00 H new ATOM 0 HB2 ASP B 116 5.467 2.784 0.669 1.00 0.00 H new ATOM 0 HB3 ASP B 116 5.613 4.217 -0.329 1.00 0.00 H new ATOM 1899 N LYS B 117 8.025 5.842 -0.198 1.00 0.00 N ATOM 1900 CA LYS B 117 8.743 6.738 -1.079 1.00 0.00 C ATOM 1901 C LYS B 117 10.203 6.881 -0.646 1.00 0.00 C ATOM 1902 O LYS B 117 11.100 6.909 -1.488 1.00 0.00 O ATOM 1903 CB LYS B 117 8.054 8.104 -1.124 1.00 0.00 C ATOM 1904 CG LYS B 117 8.458 8.949 -2.321 1.00 0.00 C ATOM 1905 CD LYS B 117 8.135 8.245 -3.632 1.00 0.00 C ATOM 1906 CE LYS B 117 8.521 9.095 -4.825 1.00 0.00 C ATOM 1907 NZ LYS B 117 8.473 8.326 -6.095 1.00 0.00 N ATOM 0 H LYS B 117 7.315 6.294 0.378 1.00 0.00 H new ATOM 0 HA LYS B 117 8.733 6.311 -2.082 1.00 0.00 H new ATOM 0 HB2 LYS B 117 6.974 7.957 -1.141 1.00 0.00 H new ATOM 0 HB3 LYS B 117 8.287 8.649 -0.209 1.00 0.00 H new ATOM 0 HG2 LYS B 117 7.940 9.907 -2.283 1.00 0.00 H new ATOM 0 HG3 LYS B 117 9.526 9.162 -2.274 1.00 0.00 H new ATOM 0 HD2 LYS B 117 8.664 7.293 -3.675 1.00 0.00 H new ATOM 0 HD3 LYS B 117 7.069 8.020 -3.673 1.00 0.00 H new ATOM 0 HE2 LYS B 117 7.849 9.950 -4.893 1.00 0.00 H new ATOM 0 HE3 LYS B 117 9.526 9.490 -4.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 9.088 8.781 -6.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 8.801 7.354 -5.925 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 7.496 8.304 -6.451 1.00 0.00 H new ATOM 1921 N LEU B 118 10.443 6.951 0.664 1.00 0.00 N ATOM 1922 CA LEU B 118 11.809 7.030 1.177 1.00 0.00 C ATOM 1923 C LEU B 118 12.598 5.798 0.770 1.00 0.00 C ATOM 1924 O LEU B 118 13.710 5.901 0.254 1.00 0.00 O ATOM 1925 CB LEU B 118 11.852 7.116 2.699 1.00 0.00 C ATOM 1926 CG LEU B 118 11.153 8.296 3.358 1.00 0.00 C ATOM 1927 CD1 LEU B 118 11.599 8.367 4.805 1.00 0.00 C ATOM 1928 CD2 LEU B 118 11.457 9.599 2.637 1.00 0.00 C ATOM 0 H LEU B 118 9.718 6.955 1.381 1.00 0.00 H new ATOM 0 HA LEU B 118 12.242 7.936 0.753 1.00 0.00 H new ATOM 0 HB2 LEU B 118 11.416 6.201 3.100 1.00 0.00 H new ATOM 0 HB3 LEU B 118 12.898 7.131 3.005 1.00 0.00 H new ATOM 0 HG LEU B 118 10.074 8.150 3.305 1.00 0.00 H new ATOM 0 HD11 LEU B 118 11.109 9.208 5.296 1.00 0.00 H new ATOM 0 HD12 LEU B 118 11.330 7.442 5.315 1.00 0.00 H new ATOM 0 HD13 LEU B 118 12.680 8.503 4.846 1.00 0.00 H new ATOM 0 HD21 LEU B 118 10.941 10.420 3.135 1.00 0.00 H new ATOM 0 HD22 LEU B 118 12.531 9.782 2.654 1.00 0.00 H new ATOM 0 HD23 LEU B 118 11.117 9.531 1.604 1.00 0.00 H new ATOM 1940 N LEU B 119 12.009 4.634 1.028 1.00 0.00 N ATOM 1941 CA LEU B 119 12.631 3.356 0.704 1.00 0.00 C ATOM 1942 C LEU B 119 12.927 3.262 -0.781 1.00 0.00 C ATOM 1943 O LEU B 119 13.936 2.686 -1.193 1.00 0.00 O ATOM 1944 CB LEU B 119 11.711 2.197 1.107 1.00 0.00 C ATOM 1945 CG LEU B 119 11.809 1.725 2.568 1.00 0.00 C ATOM 1946 CD1 LEU B 119 13.205 1.200 2.862 1.00 0.00 C ATOM 1947 CD2 LEU B 119 11.440 2.830 3.555 1.00 0.00 C ATOM 0 H LEU B 119 11.091 4.551 1.466 1.00 0.00 H new ATOM 0 HA LEU B 119 13.566 3.290 1.260 1.00 0.00 H new ATOM 0 HB2 LEU B 119 10.681 2.494 0.912 1.00 0.00 H new ATOM 0 HB3 LEU B 119 11.926 1.348 0.458 1.00 0.00 H new ATOM 0 HG LEU B 119 11.087 0.918 2.697 1.00 0.00 H new ATOM 0 HD11 LEU B 119 13.259 0.870 3.899 1.00 0.00 H new ATOM 0 HD12 LEU B 119 13.424 0.361 2.202 1.00 0.00 H new ATOM 0 HD13 LEU B 119 13.934 1.993 2.695 1.00 0.00 H new ATOM 0 HD21 LEU B 119 11.524 2.451 4.574 1.00 0.00 H new ATOM 0 HD22 LEU B 119 12.117 3.675 3.425 1.00 0.00 H new ATOM 0 HD23 LEU B 119 10.416 3.155 3.372 1.00 0.00 H new ATOM 1959 N ALA B 120 12.044 3.838 -1.577 1.00 0.00 N ATOM 1960 CA ALA B 120 12.165 3.773 -3.022 1.00 0.00 C ATOM 1961 C ALA B 120 13.276 4.691 -3.526 1.00 0.00 C ATOM 1962 O ALA B 120 14.058 4.316 -4.399 1.00 0.00 O ATOM 1963 CB ALA B 120 10.836 4.120 -3.669 1.00 0.00 C ATOM 0 H ALA B 120 11.232 4.358 -1.245 1.00 0.00 H new ATOM 0 HA ALA B 120 12.434 2.754 -3.301 1.00 0.00 H new ATOM 0 HB1 ALA B 120 10.935 4.069 -4.753 1.00 0.00 H new ATOM 0 HB2 ALA B 120 10.075 3.412 -3.340 1.00 0.00 H new ATOM 0 HB3 ALA B 120 10.542 5.129 -3.378 1.00 0.00 H new ATOM 1969 N LEU B 121 13.345 5.894 -2.963 1.00 0.00 N ATOM 1970 CA LEU B 121 14.401 6.841 -3.297 1.00 0.00 C ATOM 1971 C LEU B 121 15.739 6.388 -2.737 1.00 0.00 C ATOM 1972 O LEU B 121 16.797 6.723 -3.268 1.00 0.00 O ATOM 1973 CB LEU B 121 14.071 8.211 -2.711 1.00 0.00 C ATOM 1974 CG LEU B 121 13.244 9.142 -3.593 1.00 0.00 C ATOM 1975 CD1 LEU B 121 11.969 8.476 -4.071 1.00 0.00 C ATOM 1976 CD2 LEU B 121 12.926 10.419 -2.830 1.00 0.00 C ATOM 0 H LEU B 121 12.678 6.236 -2.271 1.00 0.00 H new ATOM 0 HA LEU B 121 14.468 6.897 -4.384 1.00 0.00 H new ATOM 0 HB2 LEU B 121 13.535 8.062 -1.774 1.00 0.00 H new ATOM 0 HB3 LEU B 121 15.007 8.713 -2.467 1.00 0.00 H new ATOM 0 HG LEU B 121 13.832 9.385 -4.478 1.00 0.00 H new ATOM 0 HD11 LEU B 121 11.408 9.171 -4.696 1.00 0.00 H new ATOM 0 HD12 LEU B 121 12.218 7.587 -4.650 1.00 0.00 H new ATOM 0 HD13 LEU B 121 11.363 8.191 -3.211 1.00 0.00 H new ATOM 0 HD21 LEU B 121 12.335 11.083 -3.462 1.00 0.00 H new ATOM 0 HD22 LEU B 121 12.360 10.174 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU B 121 13.855 10.916 -2.550 1.00 0.00 H new ATOM 1988 N GLY B 122 15.683 5.606 -1.673 1.00 0.00 N ATOM 1989 CA GLY B 122 16.888 5.236 -0.972 1.00 0.00 C ATOM 1990 C GLY B 122 17.308 6.318 -0.004 1.00 0.00 C ATOM 1991 O GLY B 122 18.497 6.539 0.223 1.00 0.00 O ATOM 0 H GLY B 122 14.823 5.221 -1.283 1.00 0.00 H new ATOM 0 HA2 GLY B 122 16.726 4.303 -0.432 1.00 0.00 H new ATOM 0 HA3 GLY B 122 17.689 5.054 -1.689 1.00 0.00 H new ATOM 1995 N LEU B 123 16.321 7.002 0.567 1.00 0.00 N ATOM 1996 CA LEU B 123 16.582 8.039 1.550 1.00 0.00 C ATOM 1997 C LEU B 123 16.842 7.373 2.881 1.00 0.00 C ATOM 1998 O LEU B 123 17.560 7.886 3.740 1.00 0.00 O ATOM 1999 CB LEU B 123 15.396 9.001 1.638 1.00 0.00 C ATOM 2000 CG LEU B 123 15.129 9.816 0.369 1.00 0.00 C ATOM 2001 CD1 LEU B 123 14.023 10.829 0.607 1.00 0.00 C ATOM 2002 CD2 LEU B 123 16.398 10.511 -0.103 1.00 0.00 C ATOM 0 H LEU B 123 15.333 6.854 0.363 1.00 0.00 H new ATOM 0 HA LEU B 123 17.454 8.625 1.259 1.00 0.00 H new ATOM 0 HB2 LEU B 123 14.500 8.429 1.880 1.00 0.00 H new ATOM 0 HB3 LEU B 123 15.567 9.690 2.465 1.00 0.00 H new ATOM 0 HG LEU B 123 14.805 9.130 -0.414 1.00 0.00 H new ATOM 0 HD11 LEU B 123 13.848 11.398 -0.306 1.00 0.00 H new ATOM 0 HD12 LEU B 123 13.108 10.309 0.891 1.00 0.00 H new ATOM 0 HD13 LEU B 123 14.318 11.508 1.407 1.00 0.00 H new ATOM 0 HD21 LEU B 123 16.185 11.084 -1.005 1.00 0.00 H new ATOM 0 HD22 LEU B 123 16.757 11.183 0.677 1.00 0.00 H new ATOM 0 HD23 LEU B 123 17.163 9.765 -0.319 1.00 0.00 H new ATOM 2014 N VAL B 124 16.241 6.208 3.010 1.00 0.00 N ATOM 2015 CA VAL B 124 16.468 5.313 4.120 1.00 0.00 C ATOM 2016 C VAL B 124 16.597 3.905 3.579 1.00 0.00 C ATOM 2017 O VAL B 124 16.247 3.636 2.425 1.00 0.00 O ATOM 2018 CB VAL B 124 15.315 5.350 5.138 1.00 0.00 C ATOM 2019 CG1 VAL B 124 15.172 6.730 5.757 1.00 0.00 C ATOM 2020 CG2 VAL B 124 14.020 4.913 4.479 1.00 0.00 C ATOM 0 H VAL B 124 15.568 5.852 2.331 1.00 0.00 H new ATOM 0 HA VAL B 124 17.376 5.629 4.633 1.00 0.00 H new ATOM 0 HB VAL B 124 15.547 4.653 5.943 1.00 0.00 H new ATOM 0 HG11 VAL B 124 14.349 6.725 6.472 1.00 0.00 H new ATOM 0 HG12 VAL B 124 16.096 6.996 6.269 1.00 0.00 H new ATOM 0 HG13 VAL B 124 14.968 7.460 4.974 1.00 0.00 H new ATOM 0 HG21 VAL B 124 13.212 4.943 5.210 1.00 0.00 H new ATOM 0 HG22 VAL B 124 13.788 5.585 3.653 1.00 0.00 H new ATOM 0 HG23 VAL B 124 14.129 3.897 4.101 1.00 0.00 H new ATOM 2030 N ALA B 125 17.092 3.023 4.404 1.00 0.00 N ATOM 2031 CA ALA B 125 17.207 1.627 4.045 1.00 0.00 C ATOM 2032 C ALA B 125 16.145 0.835 4.780 1.00 0.00 C ATOM 2033 O ALA B 125 15.842 -0.308 4.432 1.00 0.00 O ATOM 2034 CB ALA B 125 18.594 1.100 4.378 1.00 0.00 C ATOM 0 H ALA B 125 17.427 3.246 5.341 1.00 0.00 H new ATOM 0 HA ALA B 125 17.059 1.519 2.971 1.00 0.00 H new ATOM 0 HB1 ALA B 125 18.660 0.048 4.100 1.00 0.00 H new ATOM 0 HB2 ALA B 125 19.342 1.669 3.825 1.00 0.00 H new ATOM 0 HB3 ALA B 125 18.776 1.205 5.448 1.00 0.00 H new ATOM 2040 N GLU B 126 15.563 1.469 5.785 1.00 0.00 N ATOM 2041 CA GLU B 126 14.577 0.823 6.625 1.00 0.00 C ATOM 2042 C GLU B 126 13.679 1.848 7.292 1.00 0.00 C ATOM 2043 O GLU B 126 13.930 3.045 7.209 1.00 0.00 O ATOM 2044 CB GLU B 126 15.276 -0.001 7.684 1.00 0.00 C ATOM 2045 CG GLU B 126 16.142 0.826 8.610 1.00 0.00 C ATOM 2046 CD GLU B 126 16.985 -0.055 9.499 1.00 0.00 C ATOM 2047 OE1 GLU B 126 16.525 -1.175 9.830 1.00 0.00 O ATOM 2048 OE2 GLU B 126 18.100 0.354 9.871 1.00 0.00 O ATOM 0 H GLU B 126 15.761 2.437 6.037 1.00 0.00 H new ATOM 0 HA GLU B 126 13.960 0.177 6.000 1.00 0.00 H new ATOM 0 HB2 GLU B 126 14.529 -0.532 8.274 1.00 0.00 H new ATOM 0 HB3 GLU B 126 15.894 -0.756 7.198 1.00 0.00 H new ATOM 0 HG2 GLU B 126 16.788 1.479 8.022 1.00 0.00 H new ATOM 0 HG3 GLU B 126 15.512 1.470 9.224 1.00 0.00 H new ATOM 2055 N ARG B 127 12.644 1.365 7.961 1.00 0.00 N ATOM 2056 CA ARG B 127 11.657 2.238 8.577 1.00 0.00 C ATOM 2057 C ARG B 127 12.113 2.815 9.921 1.00 0.00 C ATOM 2058 O ARG B 127 11.556 3.810 10.375 1.00 0.00 O ATOM 2059 CB ARG B 127 10.320 1.522 8.726 1.00 0.00 C ATOM 2060 CG ARG B 127 9.690 1.158 7.392 1.00 0.00 C ATOM 2061 CD ARG B 127 8.249 0.737 7.561 1.00 0.00 C ATOM 2062 NE ARG B 127 7.690 0.174 6.331 1.00 0.00 N ATOM 2063 CZ ARG B 127 6.451 -0.310 6.218 1.00 0.00 C ATOM 2064 NH1 ARG B 127 5.639 -0.318 7.268 1.00 0.00 N ATOM 2065 NH2 ARG B 127 6.028 -0.787 5.053 1.00 0.00 N ATOM 0 H ARG B 127 12.465 0.369 8.092 1.00 0.00 H new ATOM 0 HA ARG B 127 11.536 3.086 7.903 1.00 0.00 H new ATOM 0 HB2 ARG B 127 10.463 0.615 9.314 1.00 0.00 H new ATOM 0 HB3 ARG B 127 9.633 2.158 9.284 1.00 0.00 H new ATOM 0 HG2 ARG B 127 9.745 2.012 6.717 1.00 0.00 H new ATOM 0 HG3 ARG B 127 10.255 0.349 6.929 1.00 0.00 H new ATOM 0 HD2 ARG B 127 8.179 -0.000 8.361 1.00 0.00 H new ATOM 0 HD3 ARG B 127 7.654 1.597 7.868 1.00 0.00 H new ATOM 0 HE ARG B 127 8.287 0.150 5.505 1.00 0.00 H new ATOM 0 HH11 ARG B 127 5.961 0.046 8.165 1.00 0.00 H new ATOM 0 HH12 ARG B 127 4.693 -0.689 7.178 1.00 0.00 H new ATOM 0 HH21 ARG B 127 6.650 -0.784 4.244 1.00 0.00 H new ATOM 0 HH22 ARG B 127 5.081 -1.157 4.967 1.00 0.00 H new ATOM 2079 N ARG B 128 13.093 2.186 10.570 1.00 0.00 N ATOM 2080 CA ARG B 128 13.593 2.679 11.862 1.00 0.00 C ATOM 2081 C ARG B 128 13.864 4.176 11.806 1.00 0.00 C ATOM 2082 O ARG B 128 13.401 4.937 12.651 1.00 0.00 O ATOM 2083 CB ARG B 128 14.900 1.993 12.273 1.00 0.00 C ATOM 2084 CG ARG B 128 14.888 0.479 12.218 1.00 0.00 C ATOM 2085 CD ARG B 128 16.113 -0.092 12.920 1.00 0.00 C ATOM 2086 NE ARG B 128 16.419 -1.451 12.480 1.00 0.00 N ATOM 2087 CZ ARG B 128 16.816 -2.431 13.287 1.00 0.00 C ATOM 2088 NH1 ARG B 128 16.908 -2.227 14.597 1.00 0.00 N ATOM 2089 NH2 ARG B 128 17.115 -3.620 12.782 1.00 0.00 N ATOM 0 H ARG B 128 13.555 1.342 10.230 1.00 0.00 H new ATOM 0 HA ARG B 128 12.815 2.453 12.591 1.00 0.00 H new ATOM 0 HB2 ARG B 128 15.699 2.356 11.627 1.00 0.00 H new ATOM 0 HB3 ARG B 128 15.147 2.300 13.289 1.00 0.00 H new ATOM 0 HG2 ARG B 128 13.982 0.100 12.690 1.00 0.00 H new ATOM 0 HG3 ARG B 128 14.869 0.147 11.180 1.00 0.00 H new ATOM 0 HD2 ARG B 128 16.972 0.552 12.729 1.00 0.00 H new ATOM 0 HD3 ARG B 128 15.946 -0.090 13.997 1.00 0.00 H new ATOM 0 HE ARG B 128 16.322 -1.663 11.487 1.00 0.00 H new ATOM 0 HH11 ARG B 128 16.674 -1.315 14.989 1.00 0.00 H new ATOM 0 HH12 ARG B 128 17.213 -2.983 15.211 1.00 0.00 H new ATOM 0 HH21 ARG B 128 17.040 -3.781 11.778 1.00 0.00 H new ATOM 0 HH22 ARG B 128 17.420 -4.374 13.398 1.00 0.00 H new ATOM 2103 N GLU B 129 14.587 4.583 10.774 1.00 0.00 N ATOM 2104 CA GLU B 129 15.112 5.937 10.669 1.00 0.00 C ATOM 2105 C GLU B 129 14.020 6.980 10.455 1.00 0.00 C ATOM 2106 O GLU B 129 14.269 8.177 10.588 1.00 0.00 O ATOM 2107 CB GLU B 129 16.118 5.997 9.526 1.00 0.00 C ATOM 2108 CG GLU B 129 17.269 5.021 9.693 1.00 0.00 C ATOM 2109 CD GLU B 129 18.029 5.240 10.987 1.00 0.00 C ATOM 2110 OE1 GLU B 129 18.184 4.271 11.760 1.00 0.00 O ATOM 2111 OE2 GLU B 129 18.461 6.387 11.250 1.00 0.00 O ATOM 0 H GLU B 129 14.827 3.984 9.984 1.00 0.00 H new ATOM 0 HA GLU B 129 15.594 6.176 11.617 1.00 0.00 H new ATOM 0 HB2 GLU B 129 15.605 5.787 8.587 1.00 0.00 H new ATOM 0 HB3 GLU B 129 16.516 7.009 9.453 1.00 0.00 H new ATOM 0 HG2 GLU B 129 16.884 4.002 9.669 1.00 0.00 H new ATOM 0 HG3 GLU B 129 17.954 5.123 8.851 1.00 0.00 H new ATOM 2118 N LEU B 130 12.811 6.538 10.139 1.00 0.00 N ATOM 2119 CA LEU B 130 11.728 7.472 9.871 1.00 0.00 C ATOM 2120 C LEU B 130 10.992 7.820 11.162 1.00 0.00 C ATOM 2121 O LEU B 130 10.105 8.678 11.177 1.00 0.00 O ATOM 2122 CB LEU B 130 10.736 6.933 8.825 1.00 0.00 C ATOM 2123 CG LEU B 130 11.042 5.562 8.209 1.00 0.00 C ATOM 2124 CD1 LEU B 130 9.871 5.107 7.362 1.00 0.00 C ATOM 2125 CD2 LEU B 130 12.309 5.582 7.364 1.00 0.00 C ATOM 0 H LEU B 130 12.558 5.553 10.063 1.00 0.00 H new ATOM 0 HA LEU B 130 12.179 8.374 9.457 1.00 0.00 H new ATOM 0 HB2 LEU B 130 9.751 6.883 9.288 1.00 0.00 H new ATOM 0 HB3 LEU B 130 10.671 7.660 8.015 1.00 0.00 H new ATOM 0 HG LEU B 130 11.204 4.863 9.030 1.00 0.00 H new ATOM 0 HD11 LEU B 130 10.094 4.133 6.927 1.00 0.00 H new ATOM 0 HD12 LEU B 130 8.979 5.031 7.984 1.00 0.00 H new ATOM 0 HD13 LEU B 130 9.696 5.829 6.565 1.00 0.00 H new ATOM 0 HD21 LEU B 130 12.485 4.590 6.949 1.00 0.00 H new ATOM 0 HD22 LEU B 130 12.194 6.300 6.552 1.00 0.00 H new ATOM 0 HD23 LEU B 130 13.156 5.871 7.986 1.00 0.00 H new ATOM 2137 N TYR B 131 11.354 7.140 12.242 1.00 0.00 N ATOM 2138 CA TYR B 131 10.816 7.459 13.558 1.00 0.00 C ATOM 2139 C TYR B 131 11.830 7.123 14.649 1.00 0.00 C ATOM 2140 O TYR B 131 11.485 6.603 15.710 1.00 0.00 O ATOM 2141 CB TYR B 131 9.494 6.712 13.793 1.00 0.00 C ATOM 2142 CG TYR B 131 9.469 5.282 13.285 1.00 0.00 C ATOM 2143 CD1 TYR B 131 8.774 4.957 12.128 1.00 0.00 C ATOM 2144 CD2 TYR B 131 10.122 4.261 13.966 1.00 0.00 C ATOM 2145 CE1 TYR B 131 8.728 3.658 11.663 1.00 0.00 C ATOM 2146 CE2 TYR B 131 10.085 2.960 13.504 1.00 0.00 C ATOM 2147 CZ TYR B 131 9.385 2.664 12.355 1.00 0.00 C ATOM 2148 OH TYR B 131 9.338 1.369 11.898 1.00 0.00 O ATOM 0 H TYR B 131 12.017 6.365 12.233 1.00 0.00 H new ATOM 0 HA TYR B 131 10.616 8.530 13.599 1.00 0.00 H new ATOM 0 HB2 TYR B 131 9.282 6.706 14.862 1.00 0.00 H new ATOM 0 HB3 TYR B 131 8.689 7.267 13.311 1.00 0.00 H new ATOM 0 HD1 TYR B 131 8.260 5.734 11.582 1.00 0.00 H new ATOM 0 HD2 TYR B 131 10.667 4.489 14.870 1.00 0.00 H new ATOM 0 HE1 TYR B 131 8.180 3.422 10.762 1.00 0.00 H new ATOM 0 HE2 TYR B 131 10.602 2.179 14.041 1.00 0.00 H new ATOM 0 HH TYR B 131 9.853 0.791 12.499 1.00 0.00 H new