USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=17 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 49 GLN : amide:sc= 0.114! C(o=0.56!,f=-6.1!) USER MOD Set 1.2: B 53 HIS : no HD1:sc= 0.445 K(o=0.56,f=-5.6!) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 16 HIS : no HE2:sc= 0.936 K(o=0.94,f=-4.4!) USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 24 ASN : amide:sc= 0.29 X(o=0.29,f=0) USER MOD Single : B 25 LYS NZ :NH3+ -168:sc= -0.0398 (180deg=-0.25) USER MOD Single : B 30 GLN : amide:sc= -1.92 X(o=-1.9,f=-2.4) USER MOD Single : B 39 HIS : no HD1:sc= -0.636 K(o=-0.64,f=0.1) USER MOD Single : B 41 ASN : amide:sc= 0.00812 X(o=0.0081,f=0) USER MOD Single : B 42 THR OG1 : rot -160:sc= 1.21 USER MOD Single : B 46 THR OG1 : rot 180:sc= -0.0434 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=-0.031) USER MOD Single : B 56 GLN : amide:sc= -0.49 X(o=-0.49,f=-0.36) USER MOD Single : B 57 MET CE :methyl -169:sc= -0.795 (180deg=-1.23) USER MOD Single : B 62 SER OG : rot 99:sc= 1.16 USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 THR OG1 : rot 180:sc= 0.427 USER MOD Single : B 80 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.014) USER MOD Single : B 85 GLN : amide:sc= -0.916 X(o=-0.92,f=-1.3) USER MOD Single : B 94 SER OG : rot -53:sc= 1.24 USER MOD Single : B 100 HIS : no HD1:sc= -0.041 X(o=-0.041,f=0.0031) USER MOD Single : B 102 MET CE :methyl 155:sc= -1.88 (180deg=-3.7!) USER MOD Single : B 103 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0515) USER MOD Single : B 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -170:sc= 2.02 (180deg=1.62) USER MOD Single : B 110 SER OG : rot 180:sc= 0 USER MOD Single : B 117 LYS NZ :NH3+ -112:sc= 2.21 (180deg=-0.584) USER MOD Single : B 131 TYR OH : rot 180:sc= -0.646 USER MOD ----------------------------------------------------------------- ATOM 126 N TRP B 9 -20.671 8.602 5.698 1.00 0.00 N ATOM 127 CA TRP B 9 -20.651 7.301 6.345 1.00 0.00 C ATOM 128 C TRP B 9 -20.609 7.456 7.858 1.00 0.00 C ATOM 129 O TRP B 9 -19.564 7.768 8.433 1.00 0.00 O ATOM 130 CB TRP B 9 -19.451 6.473 5.882 1.00 0.00 C ATOM 131 CG TRP B 9 -19.577 5.957 4.483 1.00 0.00 C ATOM 132 CD1 TRP B 9 -19.257 6.618 3.336 1.00 0.00 C ATOM 133 CD2 TRP B 9 -20.049 4.664 4.084 1.00 0.00 C ATOM 134 NE1 TRP B 9 -19.504 5.817 2.247 1.00 0.00 N ATOM 135 CE2 TRP B 9 -19.991 4.613 2.680 1.00 0.00 C ATOM 136 CE3 TRP B 9 -20.517 3.545 4.777 1.00 0.00 C ATOM 137 CZ2 TRP B 9 -20.381 3.491 1.957 1.00 0.00 C ATOM 138 CZ3 TRP B 9 -20.906 2.431 4.057 1.00 0.00 C ATOM 139 CH2 TRP B 9 -20.834 2.411 2.661 1.00 0.00 C ATOM 0 HA TRP B 9 -21.565 6.779 6.063 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -18.551 7.083 5.955 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -19.320 5.630 6.560 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -18.867 7.624 3.289 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -19.349 6.078 1.273 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -20.574 3.550 5.855 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -20.328 3.474 0.878 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -21.272 1.561 4.582 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -21.143 1.524 2.128 1.00 0.00 H new ATOM 150 N SER B 10 -21.758 7.278 8.485 1.00 0.00 N ATOM 151 CA SER B 10 -21.843 7.253 9.930 1.00 0.00 C ATOM 152 C SER B 10 -21.158 5.990 10.456 1.00 0.00 C ATOM 153 O SER B 10 -21.104 4.983 9.751 1.00 0.00 O ATOM 154 CB SER B 10 -23.312 7.284 10.352 1.00 0.00 C ATOM 155 OG SER B 10 -24.001 8.341 9.704 1.00 0.00 O ATOM 0 H SER B 10 -22.651 7.148 8.009 1.00 0.00 H new ATOM 0 HA SER B 10 -21.340 8.125 10.349 1.00 0.00 H new ATOM 0 HB2 SER B 10 -23.785 6.333 10.108 1.00 0.00 H new ATOM 0 HB3 SER B 10 -23.382 7.407 11.433 1.00 0.00 H new ATOM 0 HG SER B 10 -24.939 8.342 9.987 1.00 0.00 H new ATOM 161 N PRO B 11 -20.609 6.029 11.682 1.00 0.00 N ATOM 162 CA PRO B 11 -19.928 4.874 12.288 1.00 0.00 C ATOM 163 C PRO B 11 -20.732 3.577 12.172 1.00 0.00 C ATOM 164 O PRO B 11 -20.174 2.518 11.881 1.00 0.00 O ATOM 165 CB PRO B 11 -19.782 5.289 13.750 1.00 0.00 C ATOM 166 CG PRO B 11 -19.689 6.775 13.700 1.00 0.00 C ATOM 167 CD PRO B 11 -20.588 7.206 12.574 1.00 0.00 C ATOM 0 HA PRO B 11 -18.984 4.653 11.791 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -20.636 4.963 14.344 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -18.893 4.849 14.202 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -20.005 7.218 14.644 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -18.662 7.097 13.525 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -21.587 7.457 12.931 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -20.200 8.089 12.065 1.00 0.00 H new ATOM 175 N GLU B 12 -22.043 3.669 12.385 1.00 0.00 N ATOM 176 CA GLU B 12 -22.925 2.510 12.258 1.00 0.00 C ATOM 177 C GLU B 12 -22.868 1.953 10.843 1.00 0.00 C ATOM 178 O GLU B 12 -22.800 0.740 10.639 1.00 0.00 O ATOM 179 CB GLU B 12 -24.380 2.871 12.582 1.00 0.00 C ATOM 180 CG GLU B 12 -24.562 3.731 13.822 1.00 0.00 C ATOM 181 CD GLU B 12 -24.348 5.202 13.542 1.00 0.00 C ATOM 182 OE1 GLU B 12 -25.299 5.874 13.102 1.00 0.00 O ATOM 183 OE2 GLU B 12 -23.225 5.695 13.750 1.00 0.00 O ATOM 0 H GLU B 12 -22.518 4.533 12.646 1.00 0.00 H new ATOM 0 HA GLU B 12 -22.577 1.763 12.971 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -24.809 3.395 11.728 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -24.949 1.950 12.709 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -25.566 3.582 14.219 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -23.863 3.405 14.592 1.00 0.00 H new ATOM 190 N GLU B 13 -22.879 2.853 9.868 1.00 0.00 N ATOM 191 CA GLU B 13 -22.898 2.466 8.468 1.00 0.00 C ATOM 192 C GLU B 13 -21.546 1.885 8.063 1.00 0.00 C ATOM 193 O GLU B 13 -21.475 0.986 7.231 1.00 0.00 O ATOM 194 CB GLU B 13 -23.254 3.664 7.585 1.00 0.00 C ATOM 195 CG GLU B 13 -23.840 3.270 6.240 1.00 0.00 C ATOM 196 CD GLU B 13 -25.143 2.505 6.381 1.00 0.00 C ATOM 197 OE1 GLU B 13 -25.108 1.257 6.405 1.00 0.00 O ATOM 198 OE2 GLU B 13 -26.214 3.152 6.472 1.00 0.00 O ATOM 0 H GLU B 13 -22.875 3.861 10.025 1.00 0.00 H new ATOM 0 HA GLU B 13 -23.661 1.700 8.329 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -23.968 4.295 8.113 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -22.359 4.264 7.421 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -24.010 4.166 5.644 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -23.119 2.658 5.697 1.00 0.00 H new ATOM 205 N GLU B 14 -20.476 2.388 8.669 1.00 0.00 N ATOM 206 CA GLU B 14 -19.139 1.847 8.431 1.00 0.00 C ATOM 207 C GLU B 14 -19.005 0.471 9.077 1.00 0.00 C ATOM 208 O GLU B 14 -18.327 -0.416 8.551 1.00 0.00 O ATOM 209 CB GLU B 14 -18.063 2.787 8.972 1.00 0.00 C ATOM 210 CG GLU B 14 -18.073 4.162 8.328 1.00 0.00 C ATOM 211 CD GLU B 14 -16.893 5.003 8.752 1.00 0.00 C ATOM 212 OE1 GLU B 14 -16.128 5.458 7.874 1.00 0.00 O ATOM 213 OE2 GLU B 14 -16.703 5.195 9.970 1.00 0.00 O ATOM 0 H GLU B 14 -20.506 3.167 9.327 1.00 0.00 H new ATOM 0 HA GLU B 14 -18.999 1.751 7.354 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -18.198 2.899 10.048 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -17.085 2.331 8.819 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -18.067 4.053 7.244 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -18.997 4.677 8.591 1.00 0.00 H new ATOM 220 N ALA B 15 -19.663 0.294 10.217 1.00 0.00 N ATOM 221 CA ALA B 15 -19.717 -1.005 10.877 1.00 0.00 C ATOM 222 C ALA B 15 -20.537 -1.978 10.041 1.00 0.00 C ATOM 223 O ALA B 15 -20.314 -3.182 10.067 1.00 0.00 O ATOM 224 CB ALA B 15 -20.300 -0.873 12.276 1.00 0.00 C ATOM 0 H ALA B 15 -20.167 1.035 10.704 1.00 0.00 H new ATOM 0 HA ALA B 15 -18.703 -1.393 10.971 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -20.332 -1.854 12.751 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -19.677 -0.203 12.868 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -21.310 -0.468 12.213 1.00 0.00 H new ATOM 230 N HIS B 16 -21.479 -1.426 9.294 1.00 0.00 N ATOM 231 CA HIS B 16 -22.296 -2.179 8.360 1.00 0.00 C ATOM 232 C HIS B 16 -21.515 -2.444 7.075 1.00 0.00 C ATOM 233 O HIS B 16 -21.712 -3.460 6.410 1.00 0.00 O ATOM 234 CB HIS B 16 -23.588 -1.410 8.058 1.00 0.00 C ATOM 235 CG HIS B 16 -24.480 -2.081 7.058 1.00 0.00 C ATOM 236 ND1 HIS B 16 -25.146 -1.390 6.070 1.00 0.00 N ATOM 237 CD2 HIS B 16 -24.813 -3.382 6.894 1.00 0.00 C ATOM 238 CE1 HIS B 16 -25.848 -2.238 5.343 1.00 0.00 C ATOM 239 NE2 HIS B 16 -25.663 -3.451 5.823 1.00 0.00 N ATOM 0 H HIS B 16 -21.700 -0.430 9.320 1.00 0.00 H new ATOM 0 HA HIS B 16 -22.559 -3.138 8.807 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -24.141 -1.271 8.987 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -23.330 -0.417 7.690 1.00 0.00 H new ATOM 0 HD1 HIS B 16 -25.103 -0.381 5.924 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -24.472 -4.211 7.496 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -26.469 -1.981 4.498 1.00 0.00 H new ATOM 248 N LEU B 17 -20.635 -1.516 6.733 1.00 0.00 N ATOM 249 CA LEU B 17 -19.734 -1.688 5.605 1.00 0.00 C ATOM 250 C LEU B 17 -18.886 -2.932 5.814 1.00 0.00 C ATOM 251 O LEU B 17 -18.847 -3.827 4.971 1.00 0.00 O ATOM 252 CB LEU B 17 -18.830 -0.464 5.469 1.00 0.00 C ATOM 253 CG LEU B 17 -17.841 -0.508 4.309 1.00 0.00 C ATOM 254 CD1 LEU B 17 -18.556 -0.303 2.990 1.00 0.00 C ATOM 255 CD2 LEU B 17 -16.756 0.533 4.500 1.00 0.00 C ATOM 0 H LEU B 17 -20.526 -0.629 7.225 1.00 0.00 H new ATOM 0 HA LEU B 17 -20.320 -1.800 4.693 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -19.458 0.420 5.356 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -18.271 -0.341 6.397 1.00 0.00 H new ATOM 0 HG LEU B 17 -17.373 -1.492 4.291 1.00 0.00 H new ATOM 0 HD11 LEU B 17 -17.833 -0.338 2.175 1.00 0.00 H new ATOM 0 HD12 LEU B 17 -19.297 -1.090 2.852 1.00 0.00 H new ATOM 0 HD13 LEU B 17 -19.053 0.667 2.993 1.00 0.00 H new ATOM 0 HD21 LEU B 17 -16.058 0.489 3.664 1.00 0.00 H new ATOM 0 HD22 LEU B 17 -17.207 1.524 4.544 1.00 0.00 H new ATOM 0 HD23 LEU B 17 -16.222 0.335 5.429 1.00 0.00 H new ATOM 267 N ARG B 18 -18.228 -2.991 6.965 1.00 0.00 N ATOM 268 CA ARG B 18 -17.431 -4.147 7.321 1.00 0.00 C ATOM 269 C ARG B 18 -18.347 -5.318 7.639 1.00 0.00 C ATOM 270 O ARG B 18 -17.980 -6.462 7.431 1.00 0.00 O ATOM 271 CB ARG B 18 -16.506 -3.832 8.504 1.00 0.00 C ATOM 272 CG ARG B 18 -17.237 -3.454 9.779 1.00 0.00 C ATOM 273 CD ARG B 18 -16.306 -2.811 10.795 1.00 0.00 C ATOM 274 NE ARG B 18 -15.240 -3.711 11.235 1.00 0.00 N ATOM 275 CZ ARG B 18 -14.184 -3.314 11.950 1.00 0.00 C ATOM 276 NH1 ARG B 18 -14.029 -2.028 12.244 1.00 0.00 N ATOM 277 NH2 ARG B 18 -13.276 -4.198 12.348 1.00 0.00 N ATOM 0 H ARG B 18 -18.234 -2.249 7.665 1.00 0.00 H new ATOM 0 HA ARG B 18 -16.798 -4.415 6.475 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -15.878 -4.701 8.702 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -15.841 -3.015 8.224 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -18.048 -2.765 9.542 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -17.691 -4.344 10.215 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -15.863 -1.916 10.359 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -16.886 -2.491 11.661 1.00 0.00 H new ATOM 0 HE ARG B 18 -15.307 -4.697 10.982 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -14.716 -1.345 11.924 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -13.223 -1.723 12.790 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -13.384 -5.183 12.108 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -12.471 -3.891 12.894 1.00 0.00 H new ATOM 291 N GLU B 19 -19.556 -5.016 8.112 1.00 0.00 N ATOM 292 CA GLU B 19 -20.556 -6.041 8.397 1.00 0.00 C ATOM 293 C GLU B 19 -20.742 -6.953 7.187 1.00 0.00 C ATOM 294 O GLU B 19 -20.691 -8.180 7.288 1.00 0.00 O ATOM 295 CB GLU B 19 -21.895 -5.391 8.745 1.00 0.00 C ATOM 296 CG GLU B 19 -23.036 -6.373 8.926 1.00 0.00 C ATOM 297 CD GLU B 19 -22.853 -7.275 10.129 1.00 0.00 C ATOM 298 OE1 GLU B 19 -22.200 -8.329 10.000 1.00 0.00 O ATOM 299 OE2 GLU B 19 -23.364 -6.928 11.216 1.00 0.00 O ATOM 0 H GLU B 19 -19.866 -4.064 8.306 1.00 0.00 H new ATOM 0 HA GLU B 19 -20.207 -6.632 9.244 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -21.778 -4.814 9.663 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -22.159 -4.686 7.957 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -23.970 -5.821 9.031 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -23.127 -6.986 8.029 1.00 0.00 H new ATOM 306 N LEU B 20 -20.942 -6.323 6.040 1.00 0.00 N ATOM 307 CA LEU B 20 -21.183 -7.026 4.793 1.00 0.00 C ATOM 308 C LEU B 20 -19.890 -7.662 4.278 1.00 0.00 C ATOM 309 O LEU B 20 -19.908 -8.736 3.665 1.00 0.00 O ATOM 310 CB LEU B 20 -21.745 -6.030 3.778 1.00 0.00 C ATOM 311 CG LEU B 20 -22.963 -6.499 2.986 1.00 0.00 C ATOM 312 CD1 LEU B 20 -23.650 -5.306 2.344 1.00 0.00 C ATOM 313 CD2 LEU B 20 -22.562 -7.515 1.931 1.00 0.00 C ATOM 0 H LEU B 20 -20.941 -5.307 5.949 1.00 0.00 H new ATOM 0 HA LEU B 20 -21.902 -7.830 4.951 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -22.010 -5.114 4.306 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -20.954 -5.774 3.073 1.00 0.00 H new ATOM 0 HG LEU B 20 -23.660 -6.983 3.670 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -24.518 -5.646 1.780 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -23.971 -4.610 3.119 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -22.954 -4.804 1.671 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -23.446 -7.835 1.379 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -21.849 -7.062 1.242 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -22.103 -8.378 2.413 1.00 0.00 H new ATOM 325 N TYR B 21 -18.768 -7.008 4.566 1.00 0.00 N ATOM 326 CA TYR B 21 -17.465 -7.490 4.137 1.00 0.00 C ATOM 327 C TYR B 21 -17.109 -8.758 4.888 1.00 0.00 C ATOM 328 O TYR B 21 -16.787 -9.775 4.291 1.00 0.00 O ATOM 329 CB TYR B 21 -16.390 -6.427 4.387 1.00 0.00 C ATOM 330 CG TYR B 21 -14.981 -6.894 4.074 1.00 0.00 C ATOM 331 CD1 TYR B 21 -14.058 -7.095 5.093 1.00 0.00 C ATOM 332 CD2 TYR B 21 -14.575 -7.134 2.768 1.00 0.00 C ATOM 333 CE1 TYR B 21 -12.771 -7.520 4.818 1.00 0.00 C ATOM 334 CE2 TYR B 21 -13.291 -7.560 2.487 1.00 0.00 C ATOM 335 CZ TYR B 21 -12.393 -7.750 3.515 1.00 0.00 C ATOM 336 OH TYR B 21 -11.114 -8.174 3.235 1.00 0.00 O ATOM 0 H TYR B 21 -18.739 -6.138 5.098 1.00 0.00 H new ATOM 0 HA TYR B 21 -17.510 -7.702 3.069 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -16.614 -5.548 3.782 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -16.436 -6.116 5.431 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -14.351 -6.916 6.117 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -15.274 -6.985 1.959 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -12.066 -7.671 5.622 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -12.992 -7.743 1.465 1.00 0.00 H new ATOM 0 HH TYR B 21 -11.012 -8.290 2.267 1.00 0.00 H new ATOM 346 N LEU B 22 -17.202 -8.683 6.204 1.00 0.00 N ATOM 347 CA LEU B 22 -16.835 -9.786 7.079 1.00 0.00 C ATOM 348 C LEU B 22 -17.762 -10.981 6.865 1.00 0.00 C ATOM 349 O LEU B 22 -17.403 -12.119 7.164 1.00 0.00 O ATOM 350 CB LEU B 22 -16.894 -9.326 8.537 1.00 0.00 C ATOM 351 CG LEU B 22 -16.128 -8.034 8.846 1.00 0.00 C ATOM 352 CD1 LEU B 22 -16.314 -7.627 10.297 1.00 0.00 C ATOM 353 CD2 LEU B 22 -14.652 -8.179 8.526 1.00 0.00 C ATOM 0 H LEU B 22 -17.534 -7.855 6.698 1.00 0.00 H new ATOM 0 HA LEU B 22 -15.819 -10.099 6.840 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -17.939 -9.185 8.815 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.501 -10.122 9.169 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.539 -7.250 8.210 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -15.761 -6.708 10.491 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.373 -7.462 10.496 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.942 -8.418 10.947 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -14.137 -7.246 8.756 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -14.228 -8.985 9.124 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -14.530 -8.410 7.468 1.00 0.00 H new ATOM 365 N ALA B 23 -18.946 -10.710 6.336 1.00 0.00 N ATOM 366 CA ALA B 23 -19.929 -11.752 6.082 1.00 0.00 C ATOM 367 C ALA B 23 -19.559 -12.595 4.863 1.00 0.00 C ATOM 368 O ALA B 23 -19.770 -13.807 4.852 1.00 0.00 O ATOM 369 CB ALA B 23 -21.309 -11.134 5.900 1.00 0.00 C ATOM 0 H ALA B 23 -19.250 -9.772 6.073 1.00 0.00 H new ATOM 0 HA ALA B 23 -19.943 -12.416 6.947 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -22.038 -11.922 5.710 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -21.587 -10.592 6.804 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -21.291 -10.445 5.055 1.00 0.00 H new ATOM 375 N ASN B 24 -19.003 -11.962 3.836 1.00 0.00 N ATOM 376 CA ASN B 24 -18.720 -12.663 2.590 1.00 0.00 C ATOM 377 C ASN B 24 -17.229 -12.645 2.248 1.00 0.00 C ATOM 378 O ASN B 24 -16.847 -12.961 1.124 1.00 0.00 O ATOM 379 CB ASN B 24 -19.517 -12.029 1.444 1.00 0.00 C ATOM 380 CG ASN B 24 -21.017 -12.040 1.684 1.00 0.00 C ATOM 381 OD1 ASN B 24 -21.711 -12.985 1.308 1.00 0.00 O ATOM 382 ND2 ASN B 24 -21.528 -10.981 2.298 1.00 0.00 N ATOM 0 H ASN B 24 -18.742 -10.976 3.841 1.00 0.00 H new ATOM 0 HA ASN B 24 -19.019 -13.703 2.723 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -19.185 -11.000 1.304 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -19.299 -12.563 0.519 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -22.531 -10.929 2.475 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -20.918 -10.219 2.594 1.00 0.00 H new ATOM 389 N LYS B 25 -16.386 -12.302 3.219 1.00 0.00 N ATOM 390 CA LYS B 25 -14.946 -12.168 2.968 1.00 0.00 C ATOM 391 C LYS B 25 -14.286 -13.528 2.772 1.00 0.00 C ATOM 392 O LYS B 25 -13.230 -13.636 2.151 1.00 0.00 O ATOM 393 CB LYS B 25 -14.251 -11.424 4.119 1.00 0.00 C ATOM 394 CG LYS B 25 -14.272 -12.177 5.444 1.00 0.00 C ATOM 395 CD LYS B 25 -13.512 -11.430 6.535 1.00 0.00 C ATOM 396 CE LYS B 25 -12.021 -11.317 6.228 1.00 0.00 C ATOM 397 NZ LYS B 25 -11.376 -12.646 6.052 1.00 0.00 N ATOM 0 H LYS B 25 -16.668 -12.112 4.181 1.00 0.00 H new ATOM 0 HA LYS B 25 -14.835 -11.589 2.051 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -13.216 -11.229 3.840 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -14.732 -10.455 4.255 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -15.304 -12.328 5.759 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -13.833 -13.165 5.307 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -13.934 -10.432 6.650 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -13.647 -11.945 7.486 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -11.883 -10.726 5.322 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -11.526 -10.780 7.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -10.342 -12.532 6.049 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -11.653 -13.273 6.834 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -11.681 -13.063 5.150 1.00 0.00 H new ATOM 411 N ASP B 26 -14.920 -14.562 3.299 1.00 0.00 N ATOM 412 CA ASP B 26 -14.355 -15.909 3.263 1.00 0.00 C ATOM 413 C ASP B 26 -14.887 -16.700 2.074 1.00 0.00 C ATOM 414 O ASP B 26 -14.585 -17.884 1.916 1.00 0.00 O ATOM 415 CB ASP B 26 -14.658 -16.656 4.565 1.00 0.00 C ATOM 416 CG ASP B 26 -16.141 -16.706 4.882 1.00 0.00 C ATOM 417 OD1 ASP B 26 -16.794 -17.724 4.567 1.00 0.00 O ATOM 418 OD2 ASP B 26 -16.658 -15.723 5.455 1.00 0.00 O ATOM 0 H ASP B 26 -15.828 -14.499 3.759 1.00 0.00 H new ATOM 0 HA ASP B 26 -13.275 -15.811 3.153 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -14.272 -17.673 4.494 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -14.131 -16.172 5.387 1.00 0.00 H new ATOM 423 N VAL B 27 -15.669 -16.042 1.235 1.00 0.00 N ATOM 424 CA VAL B 27 -16.213 -16.678 0.048 1.00 0.00 C ATOM 425 C VAL B 27 -15.258 -16.479 -1.125 1.00 0.00 C ATOM 426 O VAL B 27 -15.117 -15.372 -1.644 1.00 0.00 O ATOM 427 CB VAL B 27 -17.607 -16.117 -0.312 1.00 0.00 C ATOM 428 CG1 VAL B 27 -18.214 -16.890 -1.474 1.00 0.00 C ATOM 429 CG2 VAL B 27 -18.531 -16.160 0.898 1.00 0.00 C ATOM 0 H VAL B 27 -15.941 -15.066 1.354 1.00 0.00 H new ATOM 0 HA VAL B 27 -16.325 -17.742 0.259 1.00 0.00 H new ATOM 0 HB VAL B 27 -17.488 -15.077 -0.617 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -19.195 -16.479 -1.711 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -17.565 -16.806 -2.346 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -18.317 -17.940 -1.198 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -19.508 -15.761 0.624 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -18.642 -17.191 1.235 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -18.106 -15.559 1.702 1.00 0.00 H new ATOM 439 N GLU B 28 -14.589 -17.551 -1.521 1.00 0.00 N ATOM 440 CA GLU B 28 -13.600 -17.484 -2.586 1.00 0.00 C ATOM 441 C GLU B 28 -14.254 -17.719 -3.939 1.00 0.00 C ATOM 442 O GLU B 28 -15.073 -18.628 -4.094 1.00 0.00 O ATOM 443 CB GLU B 28 -12.490 -18.506 -2.350 1.00 0.00 C ATOM 444 CG GLU B 28 -11.725 -18.277 -1.058 1.00 0.00 C ATOM 445 CD GLU B 28 -10.602 -19.274 -0.863 1.00 0.00 C ATOM 446 OE1 GLU B 28 -10.861 -20.372 -0.327 1.00 0.00 O ATOM 447 OE2 GLU B 28 -9.457 -18.968 -1.247 1.00 0.00 O ATOM 0 H GLU B 28 -14.714 -18.480 -1.120 1.00 0.00 H new ATOM 0 HA GLU B 28 -13.161 -16.486 -2.583 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -12.924 -19.506 -2.334 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -11.793 -18.474 -3.187 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -11.314 -17.267 -1.057 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -12.414 -18.341 -0.216 1.00 0.00 H new ATOM 454 N GLY B 29 -13.887 -16.899 -4.911 1.00 0.00 N ATOM 455 CA GLY B 29 -14.499 -16.979 -6.220 1.00 0.00 C ATOM 456 C GLY B 29 -15.687 -16.051 -6.320 1.00 0.00 C ATOM 457 O GLY B 29 -16.557 -16.215 -7.176 1.00 0.00 O ATOM 0 H GLY B 29 -13.173 -16.177 -4.816 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -13.766 -16.721 -6.984 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -14.816 -18.003 -6.415 1.00 0.00 H new ATOM 461 N GLN B 30 -15.720 -15.078 -5.426 1.00 0.00 N ATOM 462 CA GLN B 30 -16.812 -14.130 -5.348 1.00 0.00 C ATOM 463 C GLN B 30 -16.274 -12.704 -5.250 1.00 0.00 C ATOM 464 O GLN B 30 -15.216 -12.468 -4.661 1.00 0.00 O ATOM 465 CB GLN B 30 -17.700 -14.481 -4.140 1.00 0.00 C ATOM 466 CG GLN B 30 -18.657 -13.378 -3.705 1.00 0.00 C ATOM 467 CD GLN B 30 -18.138 -12.590 -2.514 1.00 0.00 C ATOM 468 OE1 GLN B 30 -16.936 -12.488 -2.296 1.00 0.00 O ATOM 469 NE2 GLN B 30 -19.040 -12.010 -1.744 1.00 0.00 N ATOM 0 H GLN B 30 -14.987 -14.925 -4.733 1.00 0.00 H new ATOM 0 HA GLN B 30 -17.416 -14.188 -6.254 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -18.281 -15.371 -4.381 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -17.058 -14.738 -3.298 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -18.826 -12.698 -4.540 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -19.622 -13.818 -3.452 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -20.033 -12.115 -1.953 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -18.744 -11.457 -0.940 1.00 0.00 H new ATOM 478 N ASP B 31 -16.989 -11.764 -5.855 1.00 0.00 N ATOM 479 CA ASP B 31 -16.670 -10.351 -5.712 1.00 0.00 C ATOM 480 C ASP B 31 -17.163 -9.856 -4.368 1.00 0.00 C ATOM 481 O ASP B 31 -18.340 -9.510 -4.227 1.00 0.00 O ATOM 482 CB ASP B 31 -17.329 -9.508 -6.808 1.00 0.00 C ATOM 483 CG ASP B 31 -16.778 -9.772 -8.191 1.00 0.00 C ATOM 484 OD1 ASP B 31 -17.424 -10.515 -8.956 1.00 0.00 O ATOM 485 OD2 ASP B 31 -15.710 -9.222 -8.527 1.00 0.00 O ATOM 0 H ASP B 31 -17.795 -11.956 -6.450 1.00 0.00 H new ATOM 0 HA ASP B 31 -15.588 -10.247 -5.794 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -18.401 -9.704 -6.810 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -17.199 -8.452 -6.570 1.00 0.00 H new ATOM 490 N VAL B 32 -16.285 -9.843 -3.373 1.00 0.00 N ATOM 491 CA VAL B 32 -16.653 -9.350 -2.056 1.00 0.00 C ATOM 492 C VAL B 32 -17.005 -7.873 -2.157 1.00 0.00 C ATOM 493 O VAL B 32 -17.821 -7.361 -1.400 1.00 0.00 O ATOM 494 CB VAL B 32 -15.520 -9.565 -1.020 1.00 0.00 C ATOM 495 CG1 VAL B 32 -14.414 -8.530 -1.185 1.00 0.00 C ATOM 496 CG2 VAL B 32 -16.076 -9.558 0.401 1.00 0.00 C ATOM 0 H VAL B 32 -15.321 -10.166 -3.453 1.00 0.00 H new ATOM 0 HA VAL B 32 -17.517 -9.916 -1.707 1.00 0.00 H new ATOM 0 HB VAL B 32 -15.080 -10.545 -1.204 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -13.635 -8.709 -0.444 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -13.988 -8.609 -2.185 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -14.827 -7.531 -1.044 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -15.263 -9.711 1.111 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -16.556 -8.599 0.599 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -16.807 -10.359 0.510 1.00 0.00 H new ATOM 506 N VAL B 33 -16.398 -7.214 -3.139 1.00 0.00 N ATOM 507 CA VAL B 33 -16.640 -5.813 -3.407 1.00 0.00 C ATOM 508 C VAL B 33 -18.092 -5.599 -3.799 1.00 0.00 C ATOM 509 O VAL B 33 -18.826 -4.900 -3.109 1.00 0.00 O ATOM 510 CB VAL B 33 -15.751 -5.301 -4.556 1.00 0.00 C ATOM 511 CG1 VAL B 33 -15.514 -3.808 -4.427 1.00 0.00 C ATOM 512 CG2 VAL B 33 -14.440 -6.072 -4.629 1.00 0.00 C ATOM 0 H VAL B 33 -15.723 -7.645 -3.770 1.00 0.00 H new ATOM 0 HA VAL B 33 -16.405 -5.262 -2.496 1.00 0.00 H new ATOM 0 HB VAL B 33 -16.278 -5.475 -5.494 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -14.884 -3.467 -5.249 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -16.469 -3.284 -4.461 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -15.019 -3.599 -3.479 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -13.836 -5.686 -5.450 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -13.896 -5.954 -3.692 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -14.648 -7.129 -4.797 1.00 0.00 H new ATOM 522 N GLU B 34 -18.504 -6.241 -4.892 1.00 0.00 N ATOM 523 CA GLU B 34 -19.856 -6.080 -5.417 1.00 0.00 C ATOM 524 C GLU B 34 -20.884 -6.534 -4.391 1.00 0.00 C ATOM 525 O GLU B 34 -21.974 -5.969 -4.303 1.00 0.00 O ATOM 526 CB GLU B 34 -20.028 -6.874 -6.711 1.00 0.00 C ATOM 527 CG GLU B 34 -21.278 -6.502 -7.492 1.00 0.00 C ATOM 528 CD GLU B 34 -21.174 -5.141 -8.158 1.00 0.00 C ATOM 529 OE1 GLU B 34 -21.694 -4.149 -7.607 1.00 0.00 O ATOM 530 OE2 GLU B 34 -20.568 -5.060 -9.248 1.00 0.00 O ATOM 0 H GLU B 34 -17.918 -6.879 -5.431 1.00 0.00 H new ATOM 0 HA GLU B 34 -20.014 -5.023 -5.630 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.154 -6.716 -7.343 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -20.061 -7.937 -6.473 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.464 -7.260 -8.253 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -22.136 -6.508 -6.820 1.00 0.00 H new ATOM 537 N ALA B 35 -20.523 -7.551 -3.612 1.00 0.00 N ATOM 538 CA ALA B 35 -21.372 -8.017 -2.524 1.00 0.00 C ATOM 539 C ALA B 35 -21.728 -6.849 -1.619 1.00 0.00 C ATOM 540 O ALA B 35 -22.887 -6.633 -1.280 1.00 0.00 O ATOM 541 CB ALA B 35 -20.667 -9.103 -1.727 1.00 0.00 C ATOM 0 H ALA B 35 -19.649 -8.066 -3.716 1.00 0.00 H new ATOM 0 HA ALA B 35 -22.286 -8.438 -2.943 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -21.315 -9.440 -0.918 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -20.437 -9.944 -2.382 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -19.742 -8.705 -1.309 1.00 0.00 H new ATOM 547 N ILE B 36 -20.720 -6.075 -1.266 1.00 0.00 N ATOM 548 CA ILE B 36 -20.915 -4.918 -0.418 1.00 0.00 C ATOM 549 C ILE B 36 -21.577 -3.786 -1.191 1.00 0.00 C ATOM 550 O ILE B 36 -22.660 -3.338 -0.822 1.00 0.00 O ATOM 551 CB ILE B 36 -19.582 -4.425 0.161 1.00 0.00 C ATOM 552 CG1 ILE B 36 -18.854 -5.583 0.832 1.00 0.00 C ATOM 553 CG2 ILE B 36 -19.822 -3.301 1.156 1.00 0.00 C ATOM 554 CD1 ILE B 36 -17.427 -5.263 1.199 1.00 0.00 C ATOM 0 H ILE B 36 -19.754 -6.229 -1.556 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.566 -5.222 0.402 1.00 0.00 H new ATOM 0 HB ILE B 36 -18.963 -4.039 -0.649 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -19.397 -5.870 1.732 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -18.865 -6.445 0.164 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -18.868 -2.961 1.558 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -20.320 -2.471 0.654 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -20.451 -3.663 1.970 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -16.969 -6.132 1.672 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -16.869 -5.004 0.299 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -17.409 -4.421 1.891 1.00 0.00 H new ATOM 566 N LEU B 37 -20.930 -3.365 -2.285 1.00 0.00 N ATOM 567 CA LEU B 37 -21.386 -2.212 -3.083 1.00 0.00 C ATOM 568 C LEU B 37 -22.884 -2.281 -3.359 1.00 0.00 C ATOM 569 O LEU B 37 -23.606 -1.291 -3.237 1.00 0.00 O ATOM 570 CB LEU B 37 -20.695 -2.161 -4.454 1.00 0.00 C ATOM 571 CG LEU B 37 -19.193 -2.435 -4.511 1.00 0.00 C ATOM 572 CD1 LEU B 37 -18.749 -2.622 -5.953 1.00 0.00 C ATOM 573 CD2 LEU B 37 -18.419 -1.306 -3.881 1.00 0.00 C ATOM 0 H LEU B 37 -20.083 -3.807 -2.642 1.00 0.00 H new ATOM 0 HA LEU B 37 -21.138 -1.330 -2.492 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -21.191 -2.881 -5.105 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -20.871 -1.173 -4.880 1.00 0.00 H new ATOM 0 HG LEU B 37 -18.992 -3.349 -3.952 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -17.677 -2.817 -5.981 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -19.283 -3.465 -6.392 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -18.969 -1.718 -6.521 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -17.352 -1.523 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -18.627 -0.379 -4.416 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -18.717 -1.198 -2.838 1.00 0.00 H new ATOM 585 N ALA B 38 -23.332 -3.464 -3.743 1.00 0.00 N ATOM 586 CA ALA B 38 -24.673 -3.649 -4.262 1.00 0.00 C ATOM 587 C ALA B 38 -25.705 -3.942 -3.181 1.00 0.00 C ATOM 588 O ALA B 38 -26.890 -3.667 -3.371 1.00 0.00 O ATOM 589 CB ALA B 38 -24.659 -4.764 -5.281 1.00 0.00 C ATOM 0 H ALA B 38 -22.778 -4.319 -3.703 1.00 0.00 H new ATOM 0 HA ALA B 38 -24.974 -2.708 -4.723 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -25.665 -4.909 -5.676 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -23.983 -4.504 -6.096 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -24.319 -5.685 -4.808 1.00 0.00 H new ATOM 595 N HIS B 39 -25.275 -4.505 -2.057 1.00 0.00 N ATOM 596 CA HIS B 39 -26.222 -4.924 -1.025 1.00 0.00 C ATOM 597 C HIS B 39 -26.582 -3.794 -0.071 1.00 0.00 C ATOM 598 O HIS B 39 -27.659 -3.810 0.526 1.00 0.00 O ATOM 599 CB HIS B 39 -25.702 -6.124 -0.236 1.00 0.00 C ATOM 600 CG HIS B 39 -25.993 -7.439 -0.884 1.00 0.00 C ATOM 601 ND1 HIS B 39 -27.096 -8.200 -0.572 1.00 0.00 N ATOM 602 CD2 HIS B 39 -25.318 -8.127 -1.830 1.00 0.00 C ATOM 603 CE1 HIS B 39 -27.087 -9.300 -1.298 1.00 0.00 C ATOM 604 NE2 HIS B 39 -26.019 -9.282 -2.072 1.00 0.00 N ATOM 0 H HIS B 39 -24.295 -4.680 -1.837 1.00 0.00 H new ATOM 0 HA HIS B 39 -27.129 -5.218 -1.553 1.00 0.00 H new ATOM 0 HB2 HIS B 39 -24.624 -6.023 -0.106 1.00 0.00 H new ATOM 0 HB3 HIS B 39 -26.146 -6.113 0.760 1.00 0.00 H new ATOM 0 HD2 HIS B 39 -24.398 -7.825 -2.307 1.00 0.00 H new ATOM 0 HE1 HIS B 39 -27.829 -10.084 -1.265 1.00 0.00 H new ATOM 0 HE2 HIS B 39 -25.757 -10.007 -2.740 1.00 0.00 H new ATOM 613 N LEU B 40 -25.701 -2.819 0.094 1.00 0.00 N ATOM 614 CA LEU B 40 -26.027 -1.685 0.942 1.00 0.00 C ATOM 615 C LEU B 40 -26.519 -0.496 0.120 1.00 0.00 C ATOM 616 O LEU B 40 -25.771 0.421 -0.207 1.00 0.00 O ATOM 617 CB LEU B 40 -24.868 -1.293 1.886 1.00 0.00 C ATOM 618 CG LEU B 40 -23.431 -1.483 1.374 1.00 0.00 C ATOM 619 CD1 LEU B 40 -23.077 -0.479 0.289 1.00 0.00 C ATOM 620 CD2 LEU B 40 -22.451 -1.371 2.531 1.00 0.00 C ATOM 0 H LEU B 40 -24.777 -2.789 -0.337 1.00 0.00 H new ATOM 0 HA LEU B 40 -26.848 -2.002 1.585 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -24.993 -0.243 2.152 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -24.975 -1.869 2.805 1.00 0.00 H new ATOM 0 HG LEU B 40 -23.365 -2.478 0.933 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -22.053 -0.649 -0.044 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -23.758 -0.599 -0.554 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -23.166 0.532 0.686 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -21.435 -1.507 2.161 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -22.542 -0.387 2.991 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -22.673 -2.139 3.272 1.00 0.00 H new ATOM 632 N ASN B 41 -27.800 -0.513 -0.210 1.00 0.00 N ATOM 633 CA ASN B 41 -28.401 0.580 -0.965 1.00 0.00 C ATOM 634 C ASN B 41 -28.793 1.710 -0.025 1.00 0.00 C ATOM 635 O ASN B 41 -29.833 2.346 -0.180 1.00 0.00 O ATOM 636 CB ASN B 41 -29.616 0.095 -1.758 1.00 0.00 C ATOM 637 CG ASN B 41 -29.245 -0.907 -2.832 1.00 0.00 C ATOM 638 OD1 ASN B 41 -28.887 -0.533 -3.947 1.00 0.00 O ATOM 639 ND2 ASN B 41 -29.339 -2.188 -2.508 1.00 0.00 N ATOM 0 H ASN B 41 -28.443 -1.267 0.031 1.00 0.00 H new ATOM 0 HA ASN B 41 -27.664 0.953 -1.676 1.00 0.00 H new ATOM 0 HB2 ASN B 41 -30.334 -0.358 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN B 41 -30.110 0.950 -2.219 1.00 0.00 H new ATOM 0 HD21 ASN B 41 -29.110 -2.906 -3.195 1.00 0.00 H new ATOM 0 HD22 ASN B 41 -29.640 -2.456 -1.571 1.00 0.00 H new ATOM 646 N THR B 42 -27.925 1.951 0.942 1.00 0.00 N ATOM 647 CA THR B 42 -28.072 3.041 1.884 1.00 0.00 C ATOM 648 C THR B 42 -27.188 4.207 1.445 1.00 0.00 C ATOM 649 O THR B 42 -27.299 5.327 1.942 1.00 0.00 O ATOM 650 CB THR B 42 -27.692 2.575 3.314 1.00 0.00 C ATOM 651 OG1 THR B 42 -27.659 3.679 4.229 1.00 0.00 O ATOM 652 CG2 THR B 42 -26.343 1.864 3.318 1.00 0.00 C ATOM 0 H THR B 42 -27.089 1.387 1.095 1.00 0.00 H new ATOM 0 HA THR B 42 -29.112 3.367 1.902 1.00 0.00 H new ATOM 0 HB THR B 42 -28.461 1.874 3.640 1.00 0.00 H new ATOM 0 HG1 THR B 42 -27.129 3.436 5.016 1.00 0.00 H new ATOM 0 HG21 THR B 42 -26.101 1.548 4.333 1.00 0.00 H new ATOM 0 HG22 THR B 42 -26.390 0.991 2.668 1.00 0.00 H new ATOM 0 HG23 THR B 42 -25.572 2.544 2.957 1.00 0.00 H new ATOM 660 N VAL B 43 -26.323 3.926 0.475 1.00 0.00 N ATOM 661 CA VAL B 43 -25.375 4.909 -0.023 1.00 0.00 C ATOM 662 C VAL B 43 -25.222 4.821 -1.543 1.00 0.00 C ATOM 663 O VAL B 43 -24.577 3.906 -2.056 1.00 0.00 O ATOM 664 CB VAL B 43 -23.984 4.735 0.628 1.00 0.00 C ATOM 665 CG1 VAL B 43 -23.937 5.383 2.003 1.00 0.00 C ATOM 666 CG2 VAL B 43 -23.615 3.259 0.719 1.00 0.00 C ATOM 0 H VAL B 43 -26.262 3.017 0.017 1.00 0.00 H new ATOM 0 HA VAL B 43 -25.777 5.887 0.242 1.00 0.00 H new ATOM 0 HB VAL B 43 -23.252 5.237 -0.005 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -22.947 5.245 2.437 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -24.147 6.449 1.910 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -24.684 4.921 2.649 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -22.633 3.157 1.180 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -24.356 2.735 1.324 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -23.593 2.827 -0.282 1.00 0.00 H new ATOM 676 N PRO B 44 -25.839 5.748 -2.288 1.00 0.00 N ATOM 677 CA PRO B 44 -25.630 5.849 -3.732 1.00 0.00 C ATOM 678 C PRO B 44 -24.296 6.527 -4.058 1.00 0.00 C ATOM 679 O PRO B 44 -24.194 7.758 -4.070 1.00 0.00 O ATOM 680 CB PRO B 44 -26.813 6.698 -4.201 1.00 0.00 C ATOM 681 CG PRO B 44 -27.176 7.538 -3.023 1.00 0.00 C ATOM 682 CD PRO B 44 -26.809 6.742 -1.793 1.00 0.00 C ATOM 0 HA PRO B 44 -25.583 4.876 -4.222 1.00 0.00 H new ATOM 0 HB2 PRO B 44 -26.541 7.315 -5.057 1.00 0.00 H new ATOM 0 HB3 PRO B 44 -27.649 6.072 -4.512 1.00 0.00 H new ATOM 0 HG2 PRO B 44 -26.640 8.487 -3.044 1.00 0.00 H new ATOM 0 HG3 PRO B 44 -28.240 7.773 -3.029 1.00 0.00 H new ATOM 0 HD2 PRO B 44 -26.372 7.377 -1.022 1.00 0.00 H new ATOM 0 HD3 PRO B 44 -27.683 6.262 -1.353 1.00 0.00 H new ATOM 690 N ARG B 45 -23.267 5.721 -4.290 1.00 0.00 N ATOM 691 CA ARG B 45 -21.931 6.245 -4.539 1.00 0.00 C ATOM 692 C ARG B 45 -21.102 5.293 -5.390 1.00 0.00 C ATOM 693 O ARG B 45 -21.489 4.146 -5.622 1.00 0.00 O ATOM 694 CB ARG B 45 -21.211 6.555 -3.221 1.00 0.00 C ATOM 695 CG ARG B 45 -21.325 5.480 -2.153 1.00 0.00 C ATOM 696 CD ARG B 45 -21.157 6.079 -0.766 1.00 0.00 C ATOM 697 NE ARG B 45 -19.977 6.942 -0.664 1.00 0.00 N ATOM 698 CZ ARG B 45 -19.923 8.028 0.111 1.00 0.00 C ATOM 699 NH1 ARG B 45 -20.970 8.365 0.846 1.00 0.00 N ATOM 700 NH2 ARG B 45 -18.823 8.771 0.159 1.00 0.00 N ATOM 0 H ARG B 45 -23.333 4.703 -4.311 1.00 0.00 H new ATOM 0 HA ARG B 45 -22.046 7.174 -5.098 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -20.155 6.723 -3.433 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -21.608 7.487 -2.819 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -22.295 4.989 -2.227 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -20.567 4.715 -2.318 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -22.047 6.655 -0.513 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -21.079 5.275 -0.034 1.00 0.00 H new ATOM 0 HE ARG B 45 -19.153 6.700 -1.214 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -21.816 7.796 0.820 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -20.931 9.194 1.439 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -18.009 8.514 -0.399 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -18.792 9.599 0.754 1.00 0.00 H new ATOM 714 N THR B 46 -19.962 5.790 -5.855 1.00 0.00 N ATOM 715 CA THR B 46 -19.082 5.022 -6.719 1.00 0.00 C ATOM 716 C THR B 46 -18.497 3.826 -5.970 1.00 0.00 C ATOM 717 O THR B 46 -18.465 3.796 -4.734 1.00 0.00 O ATOM 718 CB THR B 46 -17.946 5.900 -7.299 1.00 0.00 C ATOM 719 OG1 THR B 46 -17.163 5.150 -8.236 1.00 0.00 O ATOM 720 CG2 THR B 46 -17.040 6.433 -6.200 1.00 0.00 C ATOM 0 H THR B 46 -19.626 6.730 -5.644 1.00 0.00 H new ATOM 0 HA THR B 46 -19.681 4.655 -7.552 1.00 0.00 H new ATOM 0 HB THR B 46 -18.413 6.745 -7.805 1.00 0.00 H new ATOM 0 HG1 THR B 46 -16.450 5.718 -8.595 1.00 0.00 H new ATOM 0 HG21 THR B 46 -16.254 7.045 -6.642 1.00 0.00 H new ATOM 0 HG22 THR B 46 -17.625 7.038 -5.508 1.00 0.00 H new ATOM 0 HG23 THR B 46 -16.591 5.598 -5.662 1.00 0.00 H new ATOM 728 N ARG B 47 -18.014 2.852 -6.726 1.00 0.00 N ATOM 729 CA ARG B 47 -17.590 1.580 -6.160 1.00 0.00 C ATOM 730 C ARG B 47 -16.279 1.760 -5.403 1.00 0.00 C ATOM 731 O ARG B 47 -15.990 1.039 -4.447 1.00 0.00 O ATOM 732 CB ARG B 47 -17.437 0.516 -7.262 1.00 0.00 C ATOM 733 CG ARG B 47 -18.399 0.679 -8.443 1.00 0.00 C ATOM 734 CD ARG B 47 -19.853 0.869 -8.010 1.00 0.00 C ATOM 735 NE ARG B 47 -20.545 -0.389 -7.745 1.00 0.00 N ATOM 736 CZ ARG B 47 -21.770 -0.459 -7.218 1.00 0.00 C ATOM 737 NH1 ARG B 47 -22.399 0.647 -6.843 1.00 0.00 N ATOM 738 NH2 ARG B 47 -22.367 -1.632 -7.057 1.00 0.00 N ATOM 0 H ARG B 47 -17.905 2.919 -7.738 1.00 0.00 H new ATOM 0 HA ARG B 47 -18.355 1.236 -5.464 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -16.414 0.545 -7.637 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -17.587 -0.469 -6.821 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -18.089 1.536 -9.041 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -18.329 -0.199 -9.085 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -19.880 1.487 -7.112 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -20.388 1.414 -8.788 1.00 0.00 H new ATOM 0 HE ARG B 47 -20.067 -1.261 -7.975 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -21.947 1.554 -6.957 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -23.335 0.590 -6.441 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -21.890 -2.489 -7.336 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -23.303 -1.677 -6.654 1.00 0.00 H new ATOM 752 N LYS B 48 -15.510 2.755 -5.834 1.00 0.00 N ATOM 753 CA LYS B 48 -14.255 3.128 -5.187 1.00 0.00 C ATOM 754 C LYS B 48 -14.461 3.442 -3.707 1.00 0.00 C ATOM 755 O LYS B 48 -13.613 3.129 -2.868 1.00 0.00 O ATOM 756 CB LYS B 48 -13.675 4.360 -5.885 1.00 0.00 C ATOM 757 CG LYS B 48 -12.470 4.959 -5.177 1.00 0.00 C ATOM 758 CD LYS B 48 -12.180 6.372 -5.659 1.00 0.00 C ATOM 759 CE LYS B 48 -13.225 7.361 -5.160 1.00 0.00 C ATOM 760 NZ LYS B 48 -12.962 8.742 -5.639 1.00 0.00 N ATOM 0 H LYS B 48 -15.740 3.328 -6.646 1.00 0.00 H new ATOM 0 HA LYS B 48 -13.568 2.285 -5.265 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -13.389 4.089 -6.901 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.452 5.120 -5.965 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.648 4.971 -4.102 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.597 4.329 -5.349 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.193 6.679 -5.313 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -12.155 6.387 -6.749 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.213 7.044 -5.495 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.240 7.353 -4.070 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.697 9.381 -5.276 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.031 9.056 -5.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.973 8.757 -6.679 1.00 0.00 H new ATOM 774 N GLN B 49 -15.589 4.068 -3.400 1.00 0.00 N ATOM 775 CA GLN B 49 -15.889 4.516 -2.049 1.00 0.00 C ATOM 776 C GLN B 49 -15.890 3.359 -1.066 1.00 0.00 C ATOM 777 O GLN B 49 -15.203 3.407 -0.045 1.00 0.00 O ATOM 778 CB GLN B 49 -17.239 5.219 -2.020 1.00 0.00 C ATOM 779 CG GLN B 49 -17.221 6.596 -2.656 1.00 0.00 C ATOM 780 CD GLN B 49 -16.490 7.613 -1.809 1.00 0.00 C ATOM 781 OE1 GLN B 49 -16.450 7.492 -0.584 1.00 0.00 O ATOM 782 NE2 GLN B 49 -15.955 8.642 -2.441 1.00 0.00 N ATOM 0 H GLN B 49 -16.320 4.279 -4.080 1.00 0.00 H new ATOM 0 HA GLN B 49 -15.108 5.214 -1.748 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -17.973 4.600 -2.536 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -17.569 5.310 -0.985 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -16.747 6.535 -3.635 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -18.245 6.932 -2.819 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -16.012 8.702 -3.458 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -15.485 9.377 -1.912 1.00 0.00 H new ATOM 791 N ILE B 50 -16.658 2.325 -1.378 1.00 0.00 N ATOM 792 CA ILE B 50 -16.767 1.163 -0.508 1.00 0.00 C ATOM 793 C ILE B 50 -15.394 0.535 -0.264 1.00 0.00 C ATOM 794 O ILE B 50 -15.010 0.291 0.882 1.00 0.00 O ATOM 795 CB ILE B 50 -17.732 0.110 -1.100 1.00 0.00 C ATOM 796 CG1 ILE B 50 -19.199 0.564 -0.959 1.00 0.00 C ATOM 797 CG2 ILE B 50 -17.522 -1.253 -0.455 1.00 0.00 C ATOM 798 CD1 ILE B 50 -19.720 1.391 -2.126 1.00 0.00 C ATOM 0 H ILE B 50 -17.216 2.267 -2.230 1.00 0.00 H new ATOM 0 HA ILE B 50 -17.172 1.504 0.445 1.00 0.00 H new ATOM 0 HB ILE B 50 -17.508 0.015 -2.163 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -19.829 -0.318 -0.845 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -19.299 1.147 -0.044 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -18.215 -1.973 -0.892 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -16.498 -1.584 -0.628 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -17.703 -1.180 0.617 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -20.758 1.666 -1.942 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -19.118 2.294 -2.229 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -19.657 0.806 -3.043 1.00 0.00 H new ATOM 810 N ILE B 51 -14.654 0.312 -1.347 1.00 0.00 N ATOM 811 CA ILE B 51 -13.308 -0.250 -1.265 1.00 0.00 C ATOM 812 C ILE B 51 -12.429 0.598 -0.360 1.00 0.00 C ATOM 813 O ILE B 51 -11.730 0.089 0.519 1.00 0.00 O ATOM 814 CB ILE B 51 -12.651 -0.305 -2.655 1.00 0.00 C ATOM 815 CG1 ILE B 51 -13.507 -1.128 -3.612 1.00 0.00 C ATOM 816 CG2 ILE B 51 -11.244 -0.875 -2.556 1.00 0.00 C ATOM 817 CD1 ILE B 51 -13.036 -1.068 -5.046 1.00 0.00 C ATOM 0 H ILE B 51 -14.966 0.513 -2.297 1.00 0.00 H new ATOM 0 HA ILE B 51 -13.401 -1.258 -0.860 1.00 0.00 H new ATOM 0 HB ILE B 51 -12.578 0.709 -3.049 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -13.510 -2.167 -3.282 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -14.537 -0.774 -3.561 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -10.794 -0.907 -3.548 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -10.641 -0.244 -1.904 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -11.288 -1.884 -2.145 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -13.691 -1.676 -5.670 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -13.060 -0.035 -5.394 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -12.017 -1.449 -5.111 1.00 0.00 H new ATOM 829 N HIS B 52 -12.485 1.902 -0.590 1.00 0.00 N ATOM 830 CA HIS B 52 -11.688 2.853 0.159 1.00 0.00 C ATOM 831 C HIS B 52 -11.900 2.706 1.654 1.00 0.00 C ATOM 832 O HIS B 52 -10.948 2.576 2.405 1.00 0.00 O ATOM 833 CB HIS B 52 -12.016 4.284 -0.273 1.00 0.00 C ATOM 834 CG HIS B 52 -10.913 4.926 -1.047 1.00 0.00 C ATOM 835 ND1 HIS B 52 -10.255 6.051 -0.605 1.00 0.00 N ATOM 836 CD2 HIS B 52 -10.341 4.592 -2.232 1.00 0.00 C ATOM 837 CE1 HIS B 52 -9.324 6.386 -1.475 1.00 0.00 C ATOM 838 NE2 HIS B 52 -9.353 5.517 -2.472 1.00 0.00 N ATOM 0 H HIS B 52 -13.083 2.326 -1.299 1.00 0.00 H new ATOM 0 HA HIS B 52 -10.641 2.642 -0.057 1.00 0.00 H new ATOM 0 HB2 HIS B 52 -12.922 4.276 -0.880 1.00 0.00 H new ATOM 0 HB3 HIS B 52 -12.230 4.885 0.611 1.00 0.00 H new ATOM 0 HD2 HIS B 52 -10.611 3.759 -2.865 1.00 0.00 H new ATOM 0 HE1 HIS B 52 -8.652 7.227 -1.389 1.00 0.00 H new ATOM 0 HE2 HIS B 52 -8.741 5.531 -3.288 1.00 0.00 H new ATOM 847 N HIS B 53 -13.143 2.686 2.079 1.00 0.00 N ATOM 848 CA HIS B 53 -13.450 2.750 3.503 1.00 0.00 C ATOM 849 C HIS B 53 -13.123 1.441 4.204 1.00 0.00 C ATOM 850 O HIS B 53 -12.906 1.417 5.413 1.00 0.00 O ATOM 851 CB HIS B 53 -14.904 3.170 3.705 1.00 0.00 C ATOM 852 CG HIS B 53 -15.200 4.444 2.985 1.00 0.00 C ATOM 853 ND1 HIS B 53 -14.243 5.416 2.808 1.00 0.00 N ATOM 854 CD2 HIS B 53 -16.292 4.862 2.308 1.00 0.00 C ATOM 855 CE1 HIS B 53 -14.718 6.373 2.049 1.00 0.00 C ATOM 856 NE2 HIS B 53 -15.965 6.073 1.728 1.00 0.00 N ATOM 0 H HIS B 53 -13.958 2.626 1.469 1.00 0.00 H new ATOM 0 HA HIS B 53 -12.816 3.508 3.964 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -15.567 2.383 3.345 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -15.105 3.295 4.769 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -17.239 4.348 2.234 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -14.181 7.257 1.738 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -16.583 6.641 1.149 1.00 0.00 H new ATOM 865 N LEU B 54 -13.066 0.360 3.443 1.00 0.00 N ATOM 866 CA LEU B 54 -12.623 -0.917 3.977 1.00 0.00 C ATOM 867 C LEU B 54 -11.129 -0.874 4.293 1.00 0.00 C ATOM 868 O LEU B 54 -10.708 -1.216 5.399 1.00 0.00 O ATOM 869 CB LEU B 54 -12.927 -2.044 2.990 1.00 0.00 C ATOM 870 CG LEU B 54 -14.409 -2.381 2.822 1.00 0.00 C ATOM 871 CD1 LEU B 54 -14.604 -3.282 1.616 1.00 0.00 C ATOM 872 CD2 LEU B 54 -14.950 -3.052 4.084 1.00 0.00 C ATOM 0 H LEU B 54 -13.320 0.341 2.455 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.167 -1.111 4.901 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.520 -1.772 2.016 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.401 -2.942 3.315 1.00 0.00 H new ATOM 0 HG LEU B 54 -14.963 -1.456 2.661 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -15.663 -3.517 1.504 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -14.249 -2.773 0.720 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -14.041 -4.205 1.756 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -16.006 -3.285 3.948 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -14.397 -3.972 4.273 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -14.834 -2.378 4.933 1.00 0.00 H new ATOM 884 N VAL B 55 -10.326 -0.431 3.333 1.00 0.00 N ATOM 885 CA VAL B 55 -8.882 -0.381 3.530 1.00 0.00 C ATOM 886 C VAL B 55 -8.482 0.800 4.413 1.00 0.00 C ATOM 887 O VAL B 55 -7.509 0.720 5.159 1.00 0.00 O ATOM 888 CB VAL B 55 -8.108 -0.342 2.192 1.00 0.00 C ATOM 889 CG1 VAL B 55 -8.422 -1.575 1.366 1.00 0.00 C ATOM 890 CG2 VAL B 55 -8.420 0.911 1.395 1.00 0.00 C ATOM 0 H VAL B 55 -10.645 -0.105 2.421 1.00 0.00 H new ATOM 0 HA VAL B 55 -8.607 -1.304 4.040 1.00 0.00 H new ATOM 0 HB VAL B 55 -7.044 -0.328 2.430 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -7.870 -1.534 0.427 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -8.131 -2.468 1.919 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -9.491 -1.611 1.157 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.856 0.899 0.462 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.487 0.945 1.173 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -8.142 1.790 1.976 1.00 0.00 H new ATOM 900 N GLN B 56 -9.245 1.889 4.344 1.00 0.00 N ATOM 901 CA GLN B 56 -9.046 3.027 5.218 1.00 0.00 C ATOM 902 C GLN B 56 -9.241 2.626 6.674 1.00 0.00 C ATOM 903 O GLN B 56 -8.629 3.195 7.575 1.00 0.00 O ATOM 904 CB GLN B 56 -10.054 4.112 4.858 1.00 0.00 C ATOM 905 CG GLN B 56 -9.452 5.424 4.397 1.00 0.00 C ATOM 906 CD GLN B 56 -8.776 5.377 3.043 1.00 0.00 C ATOM 907 OE1 GLN B 56 -7.782 6.060 2.807 1.00 0.00 O ATOM 908 NE2 GLN B 56 -9.340 4.617 2.128 1.00 0.00 N ATOM 0 H GLN B 56 -10.013 2.000 3.682 1.00 0.00 H new ATOM 0 HA GLN B 56 -8.029 3.397 5.090 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -10.706 3.733 4.071 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -10.683 4.305 5.727 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -10.239 6.177 4.367 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -8.724 5.753 5.139 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -10.165 4.064 2.362 1.00 0.00 H new ATOM 0 HE22 GLN B 56 -8.952 4.581 1.185 1.00 0.00 H new ATOM 917 N MET B 57 -10.094 1.632 6.898 1.00 0.00 N ATOM 918 CA MET B 57 -10.424 1.210 8.252 1.00 0.00 C ATOM 919 C MET B 57 -9.411 0.197 8.769 1.00 0.00 C ATOM 920 O MET B 57 -9.507 -0.270 9.904 1.00 0.00 O ATOM 921 CB MET B 57 -11.836 0.621 8.297 1.00 0.00 C ATOM 922 CG MET B 57 -12.527 0.780 9.644 1.00 0.00 C ATOM 923 SD MET B 57 -14.188 0.067 9.673 1.00 0.00 S ATOM 924 CE MET B 57 -14.900 0.776 8.187 1.00 0.00 C ATOM 0 H MET B 57 -10.567 1.107 6.163 1.00 0.00 H new ATOM 0 HA MET B 57 -10.389 2.087 8.899 1.00 0.00 H new ATOM 0 HB2 MET B 57 -12.444 1.100 7.529 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.785 -0.439 8.048 1.00 0.00 H new ATOM 0 HG2 MET B 57 -11.920 0.306 10.416 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.588 1.840 9.892 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.974 0.588 8.173 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.719 1.851 8.174 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.440 0.320 7.310 1.00 0.00 H new ATOM 934 N GLY B 58 -8.437 -0.135 7.930 1.00 0.00 N ATOM 935 CA GLY B 58 -7.397 -1.067 8.319 1.00 0.00 C ATOM 936 C GLY B 58 -7.920 -2.479 8.489 1.00 0.00 C ATOM 937 O GLY B 58 -7.278 -3.314 9.125 1.00 0.00 O ATOM 0 H GLY B 58 -8.349 0.228 6.981 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -6.609 -1.063 7.566 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -6.946 -0.734 9.254 1.00 0.00 H new ATOM 941 N LEU B 59 -9.091 -2.746 7.931 1.00 0.00 N ATOM 942 CA LEU B 59 -9.671 -4.082 8.006 1.00 0.00 C ATOM 943 C LEU B 59 -9.403 -4.836 6.712 1.00 0.00 C ATOM 944 O LEU B 59 -9.472 -6.067 6.659 1.00 0.00 O ATOM 945 CB LEU B 59 -11.173 -4.017 8.326 1.00 0.00 C ATOM 946 CG LEU B 59 -12.041 -3.216 7.355 1.00 0.00 C ATOM 947 CD1 LEU B 59 -12.386 -4.033 6.125 1.00 0.00 C ATOM 948 CD2 LEU B 59 -13.305 -2.753 8.045 1.00 0.00 C ATOM 0 H LEU B 59 -9.656 -2.063 7.425 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.196 -4.627 8.822 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.558 -5.036 8.367 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -11.292 -3.591 9.322 1.00 0.00 H new ATOM 0 HG LEU B 59 -11.471 -2.345 7.033 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -13.004 -3.437 5.454 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.469 -4.324 5.612 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -12.934 -4.927 6.424 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -13.915 -2.184 7.343 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -13.867 -3.619 8.394 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -13.045 -2.122 8.895 1.00 0.00 H new ATOM 960 N ALA B 60 -9.096 -4.077 5.671 1.00 0.00 N ATOM 961 CA ALA B 60 -8.713 -4.653 4.392 1.00 0.00 C ATOM 962 C ALA B 60 -7.274 -4.276 4.067 1.00 0.00 C ATOM 963 O ALA B 60 -6.694 -3.416 4.729 1.00 0.00 O ATOM 964 CB ALA B 60 -9.657 -4.198 3.292 1.00 0.00 C ATOM 0 H ALA B 60 -9.105 -3.057 5.688 1.00 0.00 H new ATOM 0 HA ALA B 60 -8.782 -5.739 4.459 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -9.352 -4.641 2.344 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -10.672 -4.515 3.530 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -9.625 -3.111 3.212 1.00 0.00 H new ATOM 970 N ASP B 61 -6.704 -4.919 3.057 1.00 0.00 N ATOM 971 CA ASP B 61 -5.300 -4.704 2.714 1.00 0.00 C ATOM 972 C ASP B 61 -5.110 -3.449 1.875 1.00 0.00 C ATOM 973 O ASP B 61 -4.553 -2.457 2.339 1.00 0.00 O ATOM 974 CB ASP B 61 -4.760 -5.906 1.939 1.00 0.00 C ATOM 975 CG ASP B 61 -3.299 -5.748 1.553 1.00 0.00 C ATOM 976 OD1 ASP B 61 -3.025 -5.371 0.394 1.00 0.00 O ATOM 977 OD2 ASP B 61 -2.426 -5.991 2.410 1.00 0.00 O ATOM 0 H ASP B 61 -7.187 -5.591 2.462 1.00 0.00 H new ATOM 0 HA ASP B 61 -4.752 -4.581 3.648 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -4.876 -6.805 2.544 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -5.356 -6.049 1.038 1.00 0.00 H new ATOM 982 N SER B 62 -5.606 -3.492 0.644 1.00 0.00 N ATOM 983 CA SER B 62 -5.384 -2.417 -0.309 1.00 0.00 C ATOM 984 C SER B 62 -6.501 -2.374 -1.338 1.00 0.00 C ATOM 985 O SER B 62 -7.261 -3.329 -1.481 1.00 0.00 O ATOM 986 CB SER B 62 -4.059 -2.624 -1.041 1.00 0.00 C ATOM 987 OG SER B 62 -2.986 -2.785 -0.137 1.00 0.00 O ATOM 0 H SER B 62 -6.167 -4.264 0.284 1.00 0.00 H new ATOM 0 HA SER B 62 -5.361 -1.479 0.246 1.00 0.00 H new ATOM 0 HB2 SER B 62 -4.130 -3.502 -1.682 1.00 0.00 H new ATOM 0 HB3 SER B 62 -3.864 -1.770 -1.690 1.00 0.00 H new ATOM 0 HG SER B 62 -2.784 -3.739 -0.035 1.00 0.00 H new ATOM 993 N VAL B 63 -6.570 -1.273 -2.072 1.00 0.00 N ATOM 994 CA VAL B 63 -7.549 -1.110 -3.137 1.00 0.00 C ATOM 995 C VAL B 63 -7.231 -2.052 -4.300 1.00 0.00 C ATOM 996 O VAL B 63 -8.119 -2.461 -5.053 1.00 0.00 O ATOM 997 CB VAL B 63 -7.580 0.360 -3.618 1.00 0.00 C ATOM 998 CG1 VAL B 63 -8.376 0.510 -4.905 1.00 0.00 C ATOM 999 CG2 VAL B 63 -8.155 1.250 -2.526 1.00 0.00 C ATOM 0 H VAL B 63 -5.952 -0.471 -1.947 1.00 0.00 H new ATOM 0 HA VAL B 63 -8.535 -1.365 -2.748 1.00 0.00 H new ATOM 0 HB VAL B 63 -6.557 0.670 -3.830 1.00 0.00 H new ATOM 0 HG11 VAL B 63 -8.376 1.556 -5.213 1.00 0.00 H new ATOM 0 HG12 VAL B 63 -7.922 -0.098 -5.687 1.00 0.00 H new ATOM 0 HG13 VAL B 63 -9.402 0.181 -4.739 1.00 0.00 H new ATOM 0 HG21 VAL B 63 -8.174 2.284 -2.871 1.00 0.00 H new ATOM 0 HG22 VAL B 63 -9.169 0.928 -2.290 1.00 0.00 H new ATOM 0 HG23 VAL B 63 -7.534 1.177 -1.633 1.00 0.00 H new ATOM 1009 N LYS B 64 -5.958 -2.424 -4.402 1.00 0.00 N ATOM 1010 CA LYS B 64 -5.481 -3.309 -5.462 1.00 0.00 C ATOM 1011 C LYS B 64 -6.166 -4.669 -5.395 1.00 0.00 C ATOM 1012 O LYS B 64 -6.437 -5.292 -6.421 1.00 0.00 O ATOM 1013 CB LYS B 64 -3.961 -3.492 -5.346 1.00 0.00 C ATOM 1014 CG LYS B 64 -3.196 -2.177 -5.313 1.00 0.00 C ATOM 1015 CD LYS B 64 -1.688 -2.369 -5.176 1.00 0.00 C ATOM 1016 CE LYS B 64 -1.123 -3.292 -6.246 1.00 0.00 C ATOM 1017 NZ LYS B 64 0.352 -3.435 -6.130 1.00 0.00 N ATOM 0 H LYS B 64 -5.230 -2.122 -3.755 1.00 0.00 H new ATOM 0 HA LYS B 64 -5.724 -2.849 -6.420 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -3.738 -4.056 -4.441 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -3.609 -4.088 -6.188 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -3.404 -1.619 -6.226 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -3.557 -1.573 -4.480 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -1.194 -1.400 -5.238 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -1.464 -2.779 -4.191 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.591 -4.273 -6.163 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -1.374 -2.901 -7.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 0.699 -4.071 -6.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 0.800 -2.502 -6.234 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 0.590 -3.832 -5.199 1.00 0.00 H new ATOM 1031 N ASP B 65 -6.455 -5.111 -4.178 1.00 0.00 N ATOM 1032 CA ASP B 65 -7.095 -6.400 -3.954 1.00 0.00 C ATOM 1033 C ASP B 65 -8.518 -6.409 -4.506 1.00 0.00 C ATOM 1034 O ASP B 65 -9.010 -7.437 -4.972 1.00 0.00 O ATOM 1035 CB ASP B 65 -7.112 -6.719 -2.456 1.00 0.00 C ATOM 1036 CG ASP B 65 -7.886 -7.983 -2.132 1.00 0.00 C ATOM 1037 OD1 ASP B 65 -9.073 -7.878 -1.764 1.00 0.00 O ATOM 1038 OD2 ASP B 65 -7.313 -9.085 -2.239 1.00 0.00 O ATOM 0 H ASP B 65 -6.254 -4.590 -3.324 1.00 0.00 H new ATOM 0 HA ASP B 65 -6.522 -7.163 -4.480 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -6.087 -6.825 -2.100 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -7.552 -5.881 -1.916 1.00 0.00 H new ATOM 1043 N PHE B 66 -9.166 -5.254 -4.480 1.00 0.00 N ATOM 1044 CA PHE B 66 -10.557 -5.162 -4.901 1.00 0.00 C ATOM 1045 C PHE B 66 -10.670 -4.814 -6.380 1.00 0.00 C ATOM 1046 O PHE B 66 -11.364 -5.497 -7.135 1.00 0.00 O ATOM 1047 CB PHE B 66 -11.285 -4.076 -4.107 1.00 0.00 C ATOM 1048 CG PHE B 66 -11.293 -4.266 -2.617 1.00 0.00 C ATOM 1049 CD1 PHE B 66 -10.139 -4.085 -1.878 1.00 0.00 C ATOM 1050 CD2 PHE B 66 -12.462 -4.591 -1.956 1.00 0.00 C ATOM 1051 CE1 PHE B 66 -10.150 -4.221 -0.508 1.00 0.00 C ATOM 1052 CE2 PHE B 66 -12.478 -4.735 -0.587 1.00 0.00 C ATOM 1053 CZ PHE B 66 -11.319 -4.551 0.140 1.00 0.00 C ATOM 0 H PHE B 66 -8.755 -4.372 -4.174 1.00 0.00 H new ATOM 0 HA PHE B 66 -11.009 -6.137 -4.720 1.00 0.00 H new ATOM 0 HB2 PHE B 66 -10.824 -3.114 -4.332 1.00 0.00 H new ATOM 0 HB3 PHE B 66 -12.316 -4.024 -4.456 1.00 0.00 H new ATOM 0 HD1 PHE B 66 -9.217 -3.834 -2.382 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -13.373 -4.734 -2.519 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -9.243 -4.069 0.058 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -13.397 -4.992 -0.082 1.00 0.00 H new ATOM 0 HZ PHE B 66 -11.329 -4.666 1.214 1.00 0.00 H new ATOM 1184 N VAL B 74 3.020 -2.543 -1.924 1.00 0.00 N ATOM 1185 CA VAL B 74 3.912 -3.640 -2.206 1.00 0.00 C ATOM 1186 C VAL B 74 3.219 -4.957 -1.923 1.00 0.00 C ATOM 1187 O VAL B 74 2.294 -4.990 -1.119 1.00 0.00 O ATOM 1188 CB VAL B 74 5.179 -3.518 -1.354 1.00 0.00 C ATOM 1189 CG1 VAL B 74 5.916 -2.256 -1.744 1.00 0.00 C ATOM 1190 CG2 VAL B 74 4.841 -3.506 0.129 1.00 0.00 C ATOM 0 HA VAL B 74 4.191 -3.608 -3.259 1.00 0.00 H new ATOM 0 HB VAL B 74 5.817 -4.383 -1.536 1.00 0.00 H new ATOM 0 HG11 VAL B 74 6.820 -2.162 -1.142 1.00 0.00 H new ATOM 0 HG12 VAL B 74 6.186 -2.304 -2.799 1.00 0.00 H new ATOM 0 HG13 VAL B 74 5.274 -1.392 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL B 74 5.759 -3.419 0.711 1.00 0.00 H new ATOM 0 HG22 VAL B 74 4.191 -2.659 0.347 1.00 0.00 H new ATOM 0 HG23 VAL B 74 4.331 -4.432 0.393 1.00 0.00 H new ATOM 1200 N LEU B 75 3.624 -6.011 -2.622 1.00 0.00 N ATOM 1201 CA LEU B 75 3.039 -7.341 -2.439 1.00 0.00 C ATOM 1202 C LEU B 75 2.998 -7.747 -0.966 1.00 0.00 C ATOM 1203 O LEU B 75 3.937 -8.337 -0.437 1.00 0.00 O ATOM 1204 CB LEU B 75 3.819 -8.386 -3.243 1.00 0.00 C ATOM 1205 CG LEU B 75 5.321 -8.440 -2.958 1.00 0.00 C ATOM 1206 CD1 LEU B 75 5.756 -9.870 -2.693 1.00 0.00 C ATOM 1207 CD2 LEU B 75 6.106 -7.855 -4.120 1.00 0.00 C ATOM 0 H LEU B 75 4.361 -5.973 -3.327 1.00 0.00 H new ATOM 0 HA LEU B 75 2.013 -7.295 -2.804 1.00 0.00 H new ATOM 0 HB2 LEU B 75 3.392 -9.368 -3.042 1.00 0.00 H new ATOM 0 HB3 LEU B 75 3.674 -8.186 -4.305 1.00 0.00 H new ATOM 0 HG LEU B 75 5.525 -7.843 -2.069 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.827 -9.893 -2.492 1.00 0.00 H new ATOM 0 HD12 LEU B 75 5.216 -10.261 -1.830 1.00 0.00 H new ATOM 0 HD13 LEU B 75 5.538 -10.485 -3.566 1.00 0.00 H new ATOM 0 HD21 LEU B 75 7.172 -7.902 -3.899 1.00 0.00 H new ATOM 0 HD22 LEU B 75 5.897 -8.426 -5.024 1.00 0.00 H new ATOM 0 HD23 LEU B 75 5.812 -6.816 -4.271 1.00 0.00 H new ATOM 1219 N TRP B 76 1.911 -7.410 -0.306 1.00 0.00 N ATOM 1220 CA TRP B 76 1.748 -7.729 1.092 1.00 0.00 C ATOM 1221 C TRP B 76 1.277 -9.163 1.246 1.00 0.00 C ATOM 1222 O TRP B 76 0.146 -9.509 0.897 1.00 0.00 O ATOM 1223 CB TRP B 76 0.769 -6.758 1.751 1.00 0.00 C ATOM 1224 CG TRP B 76 1.412 -5.521 2.310 1.00 0.00 C ATOM 1225 CD1 TRP B 76 1.133 -4.232 1.969 1.00 0.00 C ATOM 1226 CD2 TRP B 76 2.444 -5.454 3.301 1.00 0.00 C ATOM 1227 NE1 TRP B 76 1.910 -3.368 2.702 1.00 0.00 N ATOM 1228 CE2 TRP B 76 2.725 -4.093 3.520 1.00 0.00 C ATOM 1229 CE3 TRP B 76 3.155 -6.412 4.028 1.00 0.00 C ATOM 1230 CZ2 TRP B 76 3.679 -3.666 4.434 1.00 0.00 C ATOM 1231 CZ3 TRP B 76 4.107 -5.985 4.934 1.00 0.00 C ATOM 1232 CH2 TRP B 76 4.360 -4.623 5.130 1.00 0.00 C ATOM 0 H TRP B 76 1.123 -6.912 -0.720 1.00 0.00 H new ATOM 0 HA TRP B 76 2.711 -7.627 1.593 1.00 0.00 H new ATOM 0 HB2 TRP B 76 0.017 -6.464 1.018 1.00 0.00 H new ATOM 0 HB3 TRP B 76 0.245 -7.277 2.554 1.00 0.00 H new ATOM 0 HD1 TRP B 76 0.406 -3.932 1.229 1.00 0.00 H new ATOM 0 HE1 TRP B 76 1.882 -2.350 2.644 1.00 0.00 H new ATOM 0 HE3 TRP B 76 2.964 -7.465 3.885 1.00 0.00 H new ATOM 0 HZ2 TRP B 76 3.875 -2.615 4.589 1.00 0.00 H new ATOM 0 HZ3 TRP B 76 4.665 -6.715 5.501 1.00 0.00 H new ATOM 0 HH2 TRP B 76 5.110 -4.322 5.847 1.00 0.00 H new ATOM 1243 N THR B 77 2.171 -9.995 1.739 1.00 0.00 N ATOM 1244 CA THR B 77 1.884 -11.395 1.955 1.00 0.00 C ATOM 1245 C THR B 77 1.918 -11.692 3.442 1.00 0.00 C ATOM 1246 O THR B 77 2.462 -10.898 4.209 1.00 0.00 O ATOM 1247 CB THR B 77 2.921 -12.275 1.235 1.00 0.00 C ATOM 1248 OG1 THR B 77 4.223 -12.045 1.793 1.00 0.00 O ATOM 1249 CG2 THR B 77 2.951 -11.964 -0.257 1.00 0.00 C ATOM 0 H THR B 77 3.117 -9.718 2.001 1.00 0.00 H new ATOM 0 HA THR B 77 0.895 -11.617 1.554 1.00 0.00 H new ATOM 0 HB THR B 77 2.639 -13.319 1.371 1.00 0.00 H new ATOM 0 HG1 THR B 77 4.880 -12.608 1.333 1.00 0.00 H new ATOM 0 HG21 THR B 77 3.691 -12.598 -0.746 1.00 0.00 H new ATOM 0 HG22 THR B 77 1.968 -12.155 -0.688 1.00 0.00 H new ATOM 0 HG23 THR B 77 3.215 -10.917 -0.405 1.00 0.00 H new ATOM 1257 N GLY B 78 1.352 -12.824 3.849 1.00 0.00 N ATOM 1258 CA GLY B 78 1.382 -13.201 5.252 1.00 0.00 C ATOM 1259 C GLY B 78 2.793 -13.228 5.800 1.00 0.00 C ATOM 1260 O GLY B 78 3.035 -12.850 6.948 1.00 0.00 O ATOM 0 H GLY B 78 0.875 -13.485 3.236 1.00 0.00 H new ATOM 0 HA2 GLY B 78 0.782 -12.498 5.830 1.00 0.00 H new ATOM 0 HA3 GLY B 78 0.927 -14.184 5.374 1.00 0.00 H new ATOM 1264 N ASP B 79 3.733 -13.650 4.964 1.00 0.00 N ATOM 1265 CA ASP B 79 5.133 -13.695 5.353 1.00 0.00 C ATOM 1266 C ASP B 79 5.716 -12.288 5.437 1.00 0.00 C ATOM 1267 O ASP B 79 6.468 -11.977 6.360 1.00 0.00 O ATOM 1268 CB ASP B 79 5.944 -14.542 4.366 1.00 0.00 C ATOM 1269 CG ASP B 79 5.488 -15.988 4.328 1.00 0.00 C ATOM 1270 OD1 ASP B 79 5.913 -16.778 5.196 1.00 0.00 O ATOM 1271 OD2 ASP B 79 4.699 -16.344 3.426 1.00 0.00 O ATOM 0 H ASP B 79 3.549 -13.966 4.012 1.00 0.00 H new ATOM 0 HA ASP B 79 5.193 -14.156 6.339 1.00 0.00 H new ATOM 0 HB2 ASP B 79 5.859 -14.112 3.368 1.00 0.00 H new ATOM 0 HB3 ASP B 79 6.998 -14.504 4.641 1.00 0.00 H new ATOM 1276 N GLN B 80 5.356 -11.431 4.485 1.00 0.00 N ATOM 1277 CA GLN B 80 5.861 -10.064 4.474 1.00 0.00 C ATOM 1278 C GLN B 80 5.294 -9.267 5.647 1.00 0.00 C ATOM 1279 O GLN B 80 5.988 -8.432 6.233 1.00 0.00 O ATOM 1280 CB GLN B 80 5.530 -9.351 3.158 1.00 0.00 C ATOM 1281 CG GLN B 80 6.251 -8.023 3.018 1.00 0.00 C ATOM 1282 CD GLN B 80 6.127 -7.411 1.641 1.00 0.00 C ATOM 1283 OE1 GLN B 80 6.965 -7.641 0.774 1.00 0.00 O ATOM 1284 NE2 GLN B 80 5.094 -6.613 1.435 1.00 0.00 N ATOM 0 H GLN B 80 4.722 -11.657 3.718 1.00 0.00 H new ATOM 0 HA GLN B 80 6.945 -10.121 4.570 1.00 0.00 H new ATOM 0 HB2 GLN B 80 5.799 -9.996 2.322 1.00 0.00 H new ATOM 0 HB3 GLN B 80 4.454 -9.184 3.100 1.00 0.00 H new ATOM 0 HG2 GLN B 80 5.855 -7.324 3.754 1.00 0.00 H new ATOM 0 HG3 GLN B 80 7.306 -8.166 3.250 1.00 0.00 H new ATOM 0 HE21 GLN B 80 4.420 -6.448 2.182 1.00 0.00 H new ATOM 0 HE22 GLN B 80 4.971 -6.162 0.528 1.00 0.00 H new ATOM 1293 N GLU B 81 4.036 -9.530 5.986 1.00 0.00 N ATOM 1294 CA GLU B 81 3.397 -8.868 7.114 1.00 0.00 C ATOM 1295 C GLU B 81 4.098 -9.255 8.412 1.00 0.00 C ATOM 1296 O GLU B 81 4.241 -8.438 9.323 1.00 0.00 O ATOM 1297 CB GLU B 81 1.907 -9.223 7.173 1.00 0.00 C ATOM 1298 CG GLU B 81 1.134 -8.798 5.931 1.00 0.00 C ATOM 1299 CD GLU B 81 -0.329 -9.185 5.976 1.00 0.00 C ATOM 1300 OE1 GLU B 81 -0.632 -10.396 5.982 1.00 0.00 O ATOM 1301 OE2 GLU B 81 -1.185 -8.276 5.974 1.00 0.00 O ATOM 0 H GLU B 81 3.440 -10.197 5.495 1.00 0.00 H new ATOM 0 HA GLU B 81 3.481 -7.789 6.982 1.00 0.00 H new ATOM 0 HB2 GLU B 81 1.803 -10.300 7.306 1.00 0.00 H new ATOM 0 HB3 GLU B 81 1.463 -8.749 8.048 1.00 0.00 H new ATOM 0 HG2 GLU B 81 1.214 -7.717 5.814 1.00 0.00 H new ATOM 0 HG3 GLU B 81 1.595 -9.249 5.052 1.00 0.00 H new ATOM 1308 N LEU B 82 4.559 -10.499 8.478 1.00 0.00 N ATOM 1309 CA LEU B 82 5.336 -10.960 9.617 1.00 0.00 C ATOM 1310 C LEU B 82 6.695 -10.276 9.651 1.00 0.00 C ATOM 1311 O LEU B 82 7.172 -9.873 10.711 1.00 0.00 O ATOM 1312 CB LEU B 82 5.539 -12.469 9.568 1.00 0.00 C ATOM 1313 CG LEU B 82 6.443 -13.014 10.672 1.00 0.00 C ATOM 1314 CD1 LEU B 82 5.775 -12.868 12.031 1.00 0.00 C ATOM 1315 CD2 LEU B 82 6.821 -14.455 10.393 1.00 0.00 C ATOM 0 H LEU B 82 4.407 -11.204 7.756 1.00 0.00 H new ATOM 0 HA LEU B 82 4.778 -10.706 10.518 1.00 0.00 H new ATOM 0 HB2 LEU B 82 4.567 -12.958 9.635 1.00 0.00 H new ATOM 0 HB3 LEU B 82 5.964 -12.736 8.600 1.00 0.00 H new ATOM 0 HG LEU B 82 7.362 -12.428 10.688 1.00 0.00 H new ATOM 0 HD11 LEU B 82 6.434 -13.262 12.805 1.00 0.00 H new ATOM 0 HD12 LEU B 82 5.575 -11.815 12.227 1.00 0.00 H new ATOM 0 HD13 LEU B 82 4.837 -13.423 12.037 1.00 0.00 H new ATOM 0 HD21 LEU B 82 7.465 -14.823 11.192 1.00 0.00 H new ATOM 0 HD22 LEU B 82 5.919 -15.065 10.344 1.00 0.00 H new ATOM 0 HD23 LEU B 82 7.351 -14.515 9.443 1.00 0.00 H new ATOM 1327 N GLU B 83 7.318 -10.153 8.486 1.00 0.00 N ATOM 1328 CA GLU B 83 8.603 -9.478 8.384 1.00 0.00 C ATOM 1329 C GLU B 83 8.473 -8.010 8.779 1.00 0.00 C ATOM 1330 O GLU B 83 9.431 -7.393 9.236 1.00 0.00 O ATOM 1331 CB GLU B 83 9.167 -9.608 6.970 1.00 0.00 C ATOM 1332 CG GLU B 83 9.601 -11.021 6.620 1.00 0.00 C ATOM 1333 CD GLU B 83 10.681 -11.541 7.549 1.00 0.00 C ATOM 1334 OE1 GLU B 83 11.870 -11.242 7.309 1.00 0.00 O ATOM 1335 OE2 GLU B 83 10.349 -12.242 8.528 1.00 0.00 O ATOM 0 H GLU B 83 6.955 -10.511 7.602 1.00 0.00 H new ATOM 0 HA GLU B 83 9.297 -9.957 9.075 1.00 0.00 H new ATOM 0 HB2 GLU B 83 8.413 -9.280 6.255 1.00 0.00 H new ATOM 0 HB3 GLU B 83 10.020 -8.937 6.864 1.00 0.00 H new ATOM 0 HG2 GLU B 83 8.737 -11.685 6.664 1.00 0.00 H new ATOM 0 HG3 GLU B 83 9.967 -11.042 5.594 1.00 0.00 H new ATOM 1342 N LEU B 84 7.285 -7.449 8.592 1.00 0.00 N ATOM 1343 CA LEU B 84 6.996 -6.114 9.092 1.00 0.00 C ATOM 1344 C LEU B 84 6.859 -6.158 10.604 1.00 0.00 C ATOM 1345 O LEU B 84 7.492 -5.383 11.313 1.00 0.00 O ATOM 1346 CB LEU B 84 5.713 -5.557 8.472 1.00 0.00 C ATOM 1347 CG LEU B 84 5.284 -4.187 9.009 1.00 0.00 C ATOM 1348 CD1 LEU B 84 6.336 -3.135 8.690 1.00 0.00 C ATOM 1349 CD2 LEU B 84 3.931 -3.780 8.443 1.00 0.00 C ATOM 0 H LEU B 84 6.511 -7.896 8.100 1.00 0.00 H new ATOM 0 HA LEU B 84 7.820 -5.457 8.814 1.00 0.00 H new ATOM 0 HB2 LEU B 84 5.850 -5.483 7.393 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.905 -6.268 8.643 1.00 0.00 H new ATOM 0 HG LEU B 84 5.188 -4.263 10.092 1.00 0.00 H new ATOM 0 HD11 LEU B 84 6.014 -2.169 9.079 1.00 0.00 H new ATOM 0 HD12 LEU B 84 7.283 -3.415 9.152 1.00 0.00 H new ATOM 0 HD13 LEU B 84 6.466 -3.066 7.610 1.00 0.00 H new ATOM 0 HD21 LEU B 84 3.649 -2.805 8.839 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.993 -3.726 7.356 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.181 -4.518 8.728 1.00 0.00 H new ATOM 1361 N GLN B 85 6.032 -7.088 11.070 1.00 0.00 N ATOM 1362 CA GLN B 85 5.784 -7.298 12.492 1.00 0.00 C ATOM 1363 C GLN B 85 7.096 -7.363 13.271 1.00 0.00 C ATOM 1364 O GLN B 85 7.358 -6.529 14.138 1.00 0.00 O ATOM 1365 CB GLN B 85 5.003 -8.610 12.664 1.00 0.00 C ATOM 1366 CG GLN B 85 4.245 -8.762 13.978 1.00 0.00 C ATOM 1367 CD GLN B 85 5.129 -8.736 15.207 1.00 0.00 C ATOM 1368 OE1 GLN B 85 5.313 -7.695 15.824 1.00 0.00 O ATOM 1369 NE2 GLN B 85 5.688 -9.880 15.565 1.00 0.00 N ATOM 0 H GLN B 85 5.510 -7.723 10.466 1.00 0.00 H new ATOM 0 HA GLN B 85 5.205 -6.462 12.884 1.00 0.00 H new ATOM 0 HB2 GLN B 85 4.291 -8.698 11.843 1.00 0.00 H new ATOM 0 HB3 GLN B 85 5.701 -9.442 12.571 1.00 0.00 H new ATOM 0 HG2 GLN B 85 3.509 -7.961 14.056 1.00 0.00 H new ATOM 0 HG3 GLN B 85 3.693 -9.702 13.960 1.00 0.00 H new ATOM 0 HE21 GLN B 85 5.509 -10.726 15.024 1.00 0.00 H new ATOM 0 HE22 GLN B 85 6.298 -9.916 16.382 1.00 0.00 H new ATOM 1378 N ARG B 86 7.922 -8.348 12.932 1.00 0.00 N ATOM 1379 CA ARG B 86 9.156 -8.604 13.660 1.00 0.00 C ATOM 1380 C ARG B 86 10.064 -7.377 13.695 1.00 0.00 C ATOM 1381 O ARG B 86 10.484 -6.941 14.768 1.00 0.00 O ATOM 1382 CB ARG B 86 9.895 -9.788 13.039 1.00 0.00 C ATOM 1383 CG ARG B 86 9.094 -11.079 13.064 1.00 0.00 C ATOM 1384 CD ARG B 86 9.968 -12.288 12.759 1.00 0.00 C ATOM 1385 NE ARG B 86 9.227 -13.545 12.877 1.00 0.00 N ATOM 1386 CZ ARG B 86 9.787 -14.720 13.177 1.00 0.00 C ATOM 1387 NH1 ARG B 86 11.098 -14.810 13.372 1.00 0.00 N ATOM 1388 NH2 ARG B 86 9.034 -15.810 13.273 1.00 0.00 N ATOM 0 H ARG B 86 7.756 -8.984 12.152 1.00 0.00 H new ATOM 0 HA ARG B 86 8.887 -8.842 14.689 1.00 0.00 H new ATOM 0 HB2 ARG B 86 10.150 -9.547 12.007 1.00 0.00 H new ATOM 0 HB3 ARG B 86 10.834 -9.941 13.572 1.00 0.00 H new ATOM 0 HG2 ARG B 86 8.631 -11.202 14.043 1.00 0.00 H new ATOM 0 HG3 ARG B 86 8.286 -11.020 12.335 1.00 0.00 H new ATOM 0 HD2 ARG B 86 10.371 -12.198 11.750 1.00 0.00 H new ATOM 0 HD3 ARG B 86 10.817 -12.303 13.442 1.00 0.00 H new ATOM 0 HE ARG B 86 8.219 -13.522 12.720 1.00 0.00 H new ATOM 0 HH11 ARG B 86 11.684 -13.979 13.293 1.00 0.00 H new ATOM 0 HH12 ARG B 86 11.519 -15.710 13.601 1.00 0.00 H new ATOM 0 HH21 ARG B 86 8.028 -15.750 13.118 1.00 0.00 H new ATOM 0 HH22 ARG B 86 9.462 -16.707 13.502 1.00 0.00 H new ATOM 1402 N LEU B 87 10.350 -6.809 12.529 1.00 0.00 N ATOM 1403 CA LEU B 87 11.261 -5.673 12.451 1.00 0.00 C ATOM 1404 C LEU B 87 10.684 -4.437 13.123 1.00 0.00 C ATOM 1405 O LEU B 87 11.425 -3.631 13.687 1.00 0.00 O ATOM 1406 CB LEU B 87 11.626 -5.344 11.009 1.00 0.00 C ATOM 1407 CG LEU B 87 12.841 -6.090 10.461 1.00 0.00 C ATOM 1408 CD1 LEU B 87 12.504 -7.537 10.148 1.00 0.00 C ATOM 1409 CD2 LEU B 87 13.373 -5.379 9.234 1.00 0.00 C ATOM 0 H LEU B 87 9.969 -7.113 11.633 1.00 0.00 H new ATOM 0 HA LEU B 87 12.165 -5.968 12.984 1.00 0.00 H new ATOM 0 HB2 LEU B 87 10.768 -5.564 10.374 1.00 0.00 H new ATOM 0 HB3 LEU B 87 11.812 -4.273 10.933 1.00 0.00 H new ATOM 0 HG LEU B 87 13.617 -6.096 11.227 1.00 0.00 H new ATOM 0 HD11 LEU B 87 13.389 -8.041 9.760 1.00 0.00 H new ATOM 0 HD12 LEU B 87 12.171 -8.038 11.057 1.00 0.00 H new ATOM 0 HD13 LEU B 87 11.710 -7.573 9.402 1.00 0.00 H new ATOM 0 HD21 LEU B 87 14.239 -5.917 8.849 1.00 0.00 H new ATOM 0 HD22 LEU B 87 12.598 -5.345 8.469 1.00 0.00 H new ATOM 0 HD23 LEU B 87 13.665 -4.363 9.500 1.00 0.00 H new ATOM 1421 N PHE B 88 9.367 -4.289 13.063 1.00 0.00 N ATOM 1422 CA PHE B 88 8.697 -3.161 13.688 1.00 0.00 C ATOM 1423 C PHE B 88 9.048 -3.077 15.167 1.00 0.00 C ATOM 1424 O PHE B 88 9.452 -2.027 15.653 1.00 0.00 O ATOM 1425 CB PHE B 88 7.181 -3.268 13.497 1.00 0.00 C ATOM 1426 CG PHE B 88 6.383 -2.479 14.493 1.00 0.00 C ATOM 1427 CD1 PHE B 88 5.609 -3.129 15.439 1.00 0.00 C ATOM 1428 CD2 PHE B 88 6.410 -1.095 14.487 1.00 0.00 C ATOM 1429 CE1 PHE B 88 4.880 -2.415 16.364 1.00 0.00 C ATOM 1430 CE2 PHE B 88 5.680 -0.375 15.410 1.00 0.00 C ATOM 1431 CZ PHE B 88 4.913 -1.036 16.350 1.00 0.00 C ATOM 0 H PHE B 88 8.742 -4.939 12.586 1.00 0.00 H new ATOM 0 HA PHE B 88 9.042 -2.246 13.206 1.00 0.00 H new ATOM 0 HB2 PHE B 88 6.927 -2.929 12.493 1.00 0.00 H new ATOM 0 HB3 PHE B 88 6.890 -4.316 13.562 1.00 0.00 H new ATOM 0 HD1 PHE B 88 5.576 -4.208 15.452 1.00 0.00 H new ATOM 0 HD2 PHE B 88 7.008 -0.574 13.753 1.00 0.00 H new ATOM 0 HE1 PHE B 88 4.283 -2.934 17.099 1.00 0.00 H new ATOM 0 HE2 PHE B 88 5.708 0.705 15.398 1.00 0.00 H new ATOM 0 HZ PHE B 88 4.340 -0.474 17.073 1.00 0.00 H new ATOM 1441 N GLU B 89 8.912 -4.184 15.877 1.00 0.00 N ATOM 1442 CA GLU B 89 9.222 -4.207 17.295 1.00 0.00 C ATOM 1443 C GLU B 89 10.717 -4.148 17.519 1.00 0.00 C ATOM 1444 O GLU B 89 11.192 -3.482 18.441 1.00 0.00 O ATOM 1445 CB GLU B 89 8.672 -5.459 17.944 1.00 0.00 C ATOM 1446 CG GLU B 89 7.172 -5.579 17.831 1.00 0.00 C ATOM 1447 CD GLU B 89 6.590 -6.536 18.849 1.00 0.00 C ATOM 1448 OE1 GLU B 89 5.969 -6.060 19.823 1.00 0.00 O ATOM 1449 OE2 GLU B 89 6.766 -7.761 18.699 1.00 0.00 O ATOM 0 H GLU B 89 8.591 -5.074 15.497 1.00 0.00 H new ATOM 0 HA GLU B 89 8.756 -3.332 17.748 1.00 0.00 H new ATOM 0 HB2 GLU B 89 9.135 -6.332 17.484 1.00 0.00 H new ATOM 0 HB3 GLU B 89 8.952 -5.467 18.997 1.00 0.00 H new ATOM 0 HG2 GLU B 89 6.721 -4.595 17.962 1.00 0.00 H new ATOM 0 HG3 GLU B 89 6.912 -5.918 16.828 1.00 0.00 H new ATOM 1456 N GLU B 90 11.449 -4.830 16.655 1.00 0.00 N ATOM 1457 CA GLU B 90 12.889 -4.929 16.775 1.00 0.00 C ATOM 1458 C GLU B 90 13.553 -3.557 16.703 1.00 0.00 C ATOM 1459 O GLU B 90 14.621 -3.341 17.282 1.00 0.00 O ATOM 1460 CB GLU B 90 13.421 -5.834 15.675 1.00 0.00 C ATOM 1461 CG GLU B 90 13.541 -7.296 16.080 1.00 0.00 C ATOM 1462 CD GLU B 90 13.985 -8.184 14.933 1.00 0.00 C ATOM 1463 OE1 GLU B 90 13.201 -9.062 14.517 1.00 0.00 O ATOM 1464 OE2 GLU B 90 15.121 -8.008 14.437 1.00 0.00 O ATOM 0 H GLU B 90 11.061 -5.328 15.854 1.00 0.00 H new ATOM 0 HA GLU B 90 13.128 -5.354 17.750 1.00 0.00 H new ATOM 0 HB2 GLU B 90 12.764 -5.760 14.809 1.00 0.00 H new ATOM 0 HB3 GLU B 90 14.401 -5.472 15.363 1.00 0.00 H new ATOM 0 HG2 GLU B 90 14.253 -7.385 16.900 1.00 0.00 H new ATOM 0 HG3 GLU B 90 12.579 -7.646 16.454 1.00 0.00 H new ATOM 1471 N PHE B 91 12.915 -2.629 16.003 1.00 0.00 N ATOM 1472 CA PHE B 91 13.457 -1.288 15.859 1.00 0.00 C ATOM 1473 C PHE B 91 12.491 -0.234 16.395 1.00 0.00 C ATOM 1474 O PHE B 91 12.685 0.958 16.171 1.00 0.00 O ATOM 1475 CB PHE B 91 13.783 -1.006 14.390 1.00 0.00 C ATOM 1476 CG PHE B 91 14.766 -1.971 13.793 1.00 0.00 C ATOM 1477 CD1 PHE B 91 14.371 -2.873 12.820 1.00 0.00 C ATOM 1478 CD2 PHE B 91 16.084 -1.979 14.211 1.00 0.00 C ATOM 1479 CE1 PHE B 91 15.274 -3.762 12.272 1.00 0.00 C ATOM 1480 CE2 PHE B 91 16.994 -2.864 13.668 1.00 0.00 C ATOM 1481 CZ PHE B 91 16.588 -3.759 12.698 1.00 0.00 C ATOM 0 H PHE B 91 12.025 -2.781 15.528 1.00 0.00 H new ATOM 0 HA PHE B 91 14.373 -1.232 16.448 1.00 0.00 H new ATOM 0 HB2 PHE B 91 12.860 -1.036 13.810 1.00 0.00 H new ATOM 0 HB3 PHE B 91 14.181 0.005 14.303 1.00 0.00 H new ATOM 0 HD1 PHE B 91 13.344 -2.881 12.486 1.00 0.00 H new ATOM 0 HD2 PHE B 91 16.406 -1.284 14.972 1.00 0.00 H new ATOM 0 HE1 PHE B 91 14.954 -4.459 11.511 1.00 0.00 H new ATOM 0 HE2 PHE B 91 18.021 -2.856 14.001 1.00 0.00 H new ATOM 0 HZ PHE B 91 17.296 -4.455 12.273 1.00 0.00 H new ATOM 1491 N ARG B 92 11.468 -0.667 17.125 1.00 0.00 N ATOM 1492 CA ARG B 92 10.463 0.261 17.648 1.00 0.00 C ATOM 1493 C ARG B 92 11.068 1.195 18.689 1.00 0.00 C ATOM 1494 O ARG B 92 10.642 2.342 18.836 1.00 0.00 O ATOM 1495 CB ARG B 92 9.273 -0.496 18.256 1.00 0.00 C ATOM 1496 CG ARG B 92 8.217 0.428 18.844 1.00 0.00 C ATOM 1497 CD ARG B 92 6.990 -0.323 19.339 1.00 0.00 C ATOM 1498 NE ARG B 92 6.056 0.587 20.013 1.00 0.00 N ATOM 1499 CZ ARG B 92 4.738 0.399 20.093 1.00 0.00 C ATOM 1500 NH1 ARG B 92 4.193 -0.726 19.639 1.00 0.00 N ATOM 1501 NH2 ARG B 92 3.968 1.330 20.656 1.00 0.00 N ATOM 0 H ARG B 92 11.311 -1.645 17.368 1.00 0.00 H new ATOM 0 HA ARG B 92 10.105 0.858 16.809 1.00 0.00 H new ATOM 0 HB2 ARG B 92 8.815 -1.119 17.488 1.00 0.00 H new ATOM 0 HB3 ARG B 92 9.636 -1.166 19.035 1.00 0.00 H new ATOM 0 HG2 ARG B 92 8.652 0.990 19.670 1.00 0.00 H new ATOM 0 HG3 ARG B 92 7.914 1.154 18.089 1.00 0.00 H new ATOM 0 HD2 ARG B 92 6.491 -0.806 18.499 1.00 0.00 H new ATOM 0 HD3 ARG B 92 7.294 -1.113 20.026 1.00 0.00 H new ATOM 0 HE ARG B 92 6.443 1.423 20.452 1.00 0.00 H new ATOM 0 HH11 ARG B 92 4.783 -1.449 19.228 1.00 0.00 H new ATOM 0 HH12 ARG B 92 3.185 -0.866 19.702 1.00 0.00 H new ATOM 0 HH21 ARG B 92 4.387 2.184 21.024 1.00 0.00 H new ATOM 0 HH22 ARG B 92 2.960 1.189 20.718 1.00 0.00 H new ATOM 1515 N ASP B 93 12.078 0.713 19.399 1.00 0.00 N ATOM 1516 CA ASP B 93 12.688 1.490 20.468 1.00 0.00 C ATOM 1517 C ASP B 93 13.874 2.303 19.947 1.00 0.00 C ATOM 1518 O ASP B 93 14.700 2.791 20.717 1.00 0.00 O ATOM 1519 CB ASP B 93 13.119 0.570 21.613 1.00 0.00 C ATOM 1520 CG ASP B 93 13.451 1.336 22.881 1.00 0.00 C ATOM 1521 OD1 ASP B 93 12.607 2.143 23.332 1.00 0.00 O ATOM 1522 OD2 ASP B 93 14.542 1.114 23.444 1.00 0.00 O ATOM 0 H ASP B 93 12.491 -0.209 19.255 1.00 0.00 H new ATOM 0 HA ASP B 93 11.946 2.192 20.849 1.00 0.00 H new ATOM 0 HB2 ASP B 93 12.322 -0.143 21.822 1.00 0.00 H new ATOM 0 HB3 ASP B 93 13.990 -0.007 21.303 1.00 0.00 H new ATOM 1527 N SER B 94 13.937 2.477 18.633 1.00 0.00 N ATOM 1528 CA SER B 94 14.974 3.304 18.037 1.00 0.00 C ATOM 1529 C SER B 94 14.373 4.645 17.629 1.00 0.00 C ATOM 1530 O SER B 94 13.185 4.881 17.852 1.00 0.00 O ATOM 1531 CB SER B 94 15.617 2.601 16.832 1.00 0.00 C ATOM 1532 OG SER B 94 14.722 2.497 15.736 1.00 0.00 O ATOM 0 H SER B 94 13.288 2.060 17.966 1.00 0.00 H new ATOM 0 HA SER B 94 15.762 3.472 18.771 1.00 0.00 H new ATOM 0 HB2 SER B 94 16.506 3.152 16.523 1.00 0.00 H new ATOM 0 HB3 SER B 94 15.946 1.605 17.127 1.00 0.00 H new ATOM 0 HG SER B 94 13.888 2.078 16.034 1.00 0.00 H new ATOM 1538 N ASP B 95 15.177 5.521 17.044 1.00 0.00 N ATOM 1539 CA ASP B 95 14.720 6.868 16.719 1.00 0.00 C ATOM 1540 C ASP B 95 13.644 6.831 15.646 1.00 0.00 C ATOM 1541 O ASP B 95 12.585 7.443 15.789 1.00 0.00 O ATOM 1542 CB ASP B 95 15.895 7.730 16.257 1.00 0.00 C ATOM 1543 CG ASP B 95 15.528 9.188 16.107 1.00 0.00 C ATOM 1544 OD1 ASP B 95 15.243 9.627 14.971 1.00 0.00 O ATOM 1545 OD2 ASP B 95 15.541 9.911 17.123 1.00 0.00 O ATOM 0 H ASP B 95 16.144 5.327 16.785 1.00 0.00 H new ATOM 0 HA ASP B 95 14.291 7.308 17.619 1.00 0.00 H new ATOM 0 HB2 ASP B 95 16.711 7.637 16.973 1.00 0.00 H new ATOM 0 HB3 ASP B 95 16.264 7.353 15.303 1.00 0.00 H new ATOM 1550 N ASP B 96 13.913 6.102 14.578 1.00 0.00 N ATOM 1551 CA ASP B 96 12.939 5.941 13.514 1.00 0.00 C ATOM 1552 C ASP B 96 12.879 4.483 13.086 1.00 0.00 C ATOM 1553 O ASP B 96 13.798 3.967 12.444 1.00 0.00 O ATOM 1554 CB ASP B 96 13.270 6.837 12.322 1.00 0.00 C ATOM 1555 CG ASP B 96 12.176 6.815 11.278 1.00 0.00 C ATOM 1556 OD1 ASP B 96 11.272 7.682 11.337 1.00 0.00 O ATOM 1557 OD2 ASP B 96 12.214 5.940 10.389 1.00 0.00 O ATOM 0 H ASP B 96 14.795 5.613 14.425 1.00 0.00 H new ATOM 0 HA ASP B 96 11.962 6.242 13.893 1.00 0.00 H new ATOM 0 HB2 ASP B 96 13.421 7.860 12.668 1.00 0.00 H new ATOM 0 HB3 ASP B 96 14.208 6.511 11.872 1.00 0.00 H new ATOM 1562 N VAL B 97 11.798 3.824 13.464 1.00 0.00 N ATOM 1563 CA VAL B 97 11.641 2.397 13.224 1.00 0.00 C ATOM 1564 C VAL B 97 11.559 2.068 11.731 1.00 0.00 C ATOM 1565 O VAL B 97 12.150 1.086 11.286 1.00 0.00 O ATOM 1566 CB VAL B 97 10.410 1.832 13.982 1.00 0.00 C ATOM 1567 CG1 VAL B 97 9.165 2.655 13.718 1.00 0.00 C ATOM 1568 CG2 VAL B 97 10.160 0.375 13.631 1.00 0.00 C ATOM 0 H VAL B 97 11.008 4.257 13.943 1.00 0.00 H new ATOM 0 HA VAL B 97 12.535 1.911 13.614 1.00 0.00 H new ATOM 0 HB VAL B 97 10.640 1.894 15.046 1.00 0.00 H new ATOM 0 HG11 VAL B 97 8.324 2.229 14.265 1.00 0.00 H new ATOM 0 HG12 VAL B 97 9.330 3.681 14.048 1.00 0.00 H new ATOM 0 HG13 VAL B 97 8.944 2.648 12.651 1.00 0.00 H new ATOM 0 HG21 VAL B 97 9.291 0.012 14.180 1.00 0.00 H new ATOM 0 HG22 VAL B 97 9.976 0.285 12.560 1.00 0.00 H new ATOM 0 HG23 VAL B 97 11.033 -0.219 13.901 1.00 0.00 H new ATOM 1578 N LEU B 98 10.878 2.904 10.946 1.00 0.00 N ATOM 1579 CA LEU B 98 10.662 2.587 9.534 1.00 0.00 C ATOM 1580 C LEU B 98 11.959 2.676 8.744 1.00 0.00 C ATOM 1581 O LEU B 98 12.177 1.900 7.812 1.00 0.00 O ATOM 1582 CB LEU B 98 9.618 3.499 8.887 1.00 0.00 C ATOM 1583 CG LEU B 98 8.228 3.502 9.529 1.00 0.00 C ATOM 1584 CD1 LEU B 98 7.188 3.972 8.536 1.00 0.00 C ATOM 1585 CD2 LEU B 98 7.855 2.140 10.070 1.00 0.00 C ATOM 0 H LEU B 98 10.474 3.788 11.255 1.00 0.00 H new ATOM 0 HA LEU B 98 10.289 1.563 9.507 1.00 0.00 H new ATOM 0 HB2 LEU B 98 10.002 4.519 8.897 1.00 0.00 H new ATOM 0 HB3 LEU B 98 9.511 3.209 7.842 1.00 0.00 H new ATOM 0 HG LEU B 98 8.259 4.195 10.370 1.00 0.00 H new ATOM 0 HD11 LEU B 98 6.206 3.968 9.009 1.00 0.00 H new ATOM 0 HD12 LEU B 98 7.429 4.983 8.208 1.00 0.00 H new ATOM 0 HD13 LEU B 98 7.179 3.304 7.675 1.00 0.00 H new ATOM 0 HD21 LEU B 98 6.862 2.186 10.517 1.00 0.00 H new ATOM 0 HD22 LEU B 98 7.854 1.413 9.257 1.00 0.00 H new ATOM 0 HD23 LEU B 98 8.580 1.838 10.826 1.00 0.00 H new ATOM 1597 N GLY B 99 12.805 3.633 9.102 1.00 0.00 N ATOM 1598 CA GLY B 99 14.104 3.742 8.473 1.00 0.00 C ATOM 1599 C GLY B 99 14.923 2.488 8.677 1.00 0.00 C ATOM 1600 O GLY B 99 15.520 1.964 7.742 1.00 0.00 O ATOM 0 H GLY B 99 12.614 4.335 9.817 1.00 0.00 H new ATOM 0 HA2 GLY B 99 13.979 3.927 7.406 1.00 0.00 H new ATOM 0 HA3 GLY B 99 14.638 4.598 8.884 1.00 0.00 H new ATOM 1604 N HIS B 100 14.914 1.979 9.900 1.00 0.00 N ATOM 1605 CA HIS B 100 15.643 0.765 10.226 1.00 0.00 C ATOM 1606 C HIS B 100 14.996 -0.432 9.542 1.00 0.00 C ATOM 1607 O HIS B 100 15.669 -1.410 9.212 1.00 0.00 O ATOM 1608 CB HIS B 100 15.699 0.556 11.740 1.00 0.00 C ATOM 1609 CG HIS B 100 16.624 1.498 12.449 1.00 0.00 C ATOM 1610 ND1 HIS B 100 17.644 1.073 13.276 1.00 0.00 N ATOM 1611 CD2 HIS B 100 16.680 2.850 12.455 1.00 0.00 C ATOM 1612 CE1 HIS B 100 18.281 2.123 13.757 1.00 0.00 C ATOM 1613 NE2 HIS B 100 17.717 3.212 13.274 1.00 0.00 N ATOM 0 H HIS B 100 14.408 2.390 10.684 1.00 0.00 H new ATOM 0 HA HIS B 100 16.666 0.865 9.862 1.00 0.00 H new ATOM 0 HB2 HIS B 100 14.696 0.670 12.150 1.00 0.00 H new ATOM 0 HB3 HIS B 100 16.012 -0.468 11.944 1.00 0.00 H new ATOM 0 HD2 HIS B 100 16.028 3.520 11.914 1.00 0.00 H new ATOM 0 HE1 HIS B 100 19.123 2.095 14.433 1.00 0.00 H new ATOM 0 HE2 HIS B 100 18.006 4.169 13.477 1.00 0.00 H new ATOM 1622 N ILE B 101 13.685 -0.340 9.323 1.00 0.00 N ATOM 1623 CA ILE B 101 12.968 -1.350 8.563 1.00 0.00 C ATOM 1624 C ILE B 101 13.530 -1.440 7.152 1.00 0.00 C ATOM 1625 O ILE B 101 14.031 -2.485 6.753 1.00 0.00 O ATOM 1626 CB ILE B 101 11.442 -1.075 8.510 1.00 0.00 C ATOM 1627 CG1 ILE B 101 10.818 -1.325 9.888 1.00 0.00 C ATOM 1628 CG2 ILE B 101 10.770 -1.948 7.453 1.00 0.00 C ATOM 1629 CD1 ILE B 101 9.315 -1.162 9.915 1.00 0.00 C ATOM 0 H ILE B 101 13.102 0.425 9.663 1.00 0.00 H new ATOM 0 HA ILE B 101 13.109 -2.301 9.076 1.00 0.00 H new ATOM 0 HB ILE B 101 11.286 -0.032 8.235 1.00 0.00 H new ATOM 0 HG12 ILE B 101 11.071 -2.334 10.213 1.00 0.00 H new ATOM 0 HG13 ILE B 101 11.262 -0.637 10.608 1.00 0.00 H new ATOM 0 HG21 ILE B 101 9.701 -1.738 7.434 1.00 0.00 H new ATOM 0 HG22 ILE B 101 11.200 -1.731 6.475 1.00 0.00 H new ATOM 0 HG23 ILE B 101 10.929 -2.999 7.694 1.00 0.00 H new ATOM 0 HD11 ILE B 101 8.946 -1.355 10.922 1.00 0.00 H new ATOM 0 HD12 ILE B 101 9.054 -0.145 9.621 1.00 0.00 H new ATOM 0 HD13 ILE B 101 8.860 -1.868 9.221 1.00 0.00 H new ATOM 1641 N MET B 102 13.494 -0.327 6.424 1.00 0.00 N ATOM 1642 CA MET B 102 13.944 -0.301 5.032 1.00 0.00 C ATOM 1643 C MET B 102 15.393 -0.755 4.904 1.00 0.00 C ATOM 1644 O MET B 102 15.755 -1.436 3.945 1.00 0.00 O ATOM 1645 CB MET B 102 13.816 1.102 4.441 1.00 0.00 C ATOM 1646 CG MET B 102 12.396 1.630 4.391 1.00 0.00 C ATOM 1647 SD MET B 102 12.315 3.296 3.712 1.00 0.00 S ATOM 1648 CE MET B 102 10.546 3.526 3.633 1.00 0.00 C ATOM 0 H MET B 102 13.158 0.570 6.774 1.00 0.00 H new ATOM 0 HA MET B 102 13.304 -0.991 4.482 1.00 0.00 H new ATOM 0 HB2 MET B 102 14.426 1.788 5.029 1.00 0.00 H new ATOM 0 HB3 MET B 102 14.225 1.097 3.431 1.00 0.00 H new ATOM 0 HG2 MET B 102 11.783 0.962 3.786 1.00 0.00 H new ATOM 0 HG3 MET B 102 11.973 1.628 5.396 1.00 0.00 H new ATOM 0 HE1 MET B 102 10.316 4.591 3.670 1.00 0.00 H new ATOM 0 HE2 MET B 102 10.165 3.104 2.703 1.00 0.00 H new ATOM 0 HE3 MET B 102 10.076 3.024 4.478 1.00 0.00 H new ATOM 1658 N LYS B 103 16.213 -0.372 5.873 1.00 0.00 N ATOM 1659 CA LYS B 103 17.635 -0.697 5.851 1.00 0.00 C ATOM 1660 C LYS B 103 17.871 -2.190 6.067 1.00 0.00 C ATOM 1661 O LYS B 103 18.803 -2.764 5.500 1.00 0.00 O ATOM 1662 CB LYS B 103 18.389 0.106 6.924 1.00 0.00 C ATOM 1663 CG LYS B 103 18.896 1.470 6.465 1.00 0.00 C ATOM 1664 CD LYS B 103 17.783 2.344 5.910 1.00 0.00 C ATOM 1665 CE LYS B 103 18.202 3.802 5.814 1.00 0.00 C ATOM 1666 NZ LYS B 103 19.421 3.986 4.985 1.00 0.00 N ATOM 0 H LYS B 103 15.918 0.166 6.688 1.00 0.00 H new ATOM 0 HA LYS B 103 18.016 -0.428 4.866 1.00 0.00 H new ATOM 0 HB2 LYS B 103 17.730 0.249 7.781 1.00 0.00 H new ATOM 0 HB3 LYS B 103 19.238 -0.484 7.269 1.00 0.00 H new ATOM 0 HG2 LYS B 103 19.371 1.979 7.304 1.00 0.00 H new ATOM 0 HG3 LYS B 103 19.661 1.332 5.701 1.00 0.00 H new ATOM 0 HD2 LYS B 103 17.496 1.983 4.922 1.00 0.00 H new ATOM 0 HD3 LYS B 103 16.903 2.260 6.548 1.00 0.00 H new ATOM 0 HE2 LYS B 103 17.385 4.385 5.389 1.00 0.00 H new ATOM 0 HE3 LYS B 103 18.384 4.192 6.815 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 19.580 5.001 4.822 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 20.242 3.582 5.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 19.296 3.505 4.072 1.00 0.00 H new ATOM 1680 N ASN B 104 17.027 -2.819 6.877 1.00 0.00 N ATOM 1681 CA ASN B 104 17.240 -4.215 7.249 1.00 0.00 C ATOM 1682 C ASN B 104 16.396 -5.195 6.433 1.00 0.00 C ATOM 1683 O ASN B 104 16.781 -6.354 6.271 1.00 0.00 O ATOM 1684 CB ASN B 104 16.978 -4.417 8.744 1.00 0.00 C ATOM 1685 CG ASN B 104 18.212 -4.157 9.588 1.00 0.00 C ATOM 1686 OD1 ASN B 104 18.506 -3.018 9.954 1.00 0.00 O ATOM 1687 ND2 ASN B 104 18.932 -5.218 9.925 1.00 0.00 N ATOM 0 H ASN B 104 16.196 -2.391 7.286 1.00 0.00 H new ATOM 0 HA ASN B 104 18.283 -4.435 7.023 1.00 0.00 H new ATOM 0 HB2 ASN B 104 16.176 -3.751 9.063 1.00 0.00 H new ATOM 0 HB3 ASN B 104 16.632 -5.437 8.915 1.00 0.00 H new ATOM 0 HD21 ASN B 104 19.762 -5.107 10.507 1.00 0.00 H new ATOM 0 HD22 ASN B 104 18.656 -6.145 9.602 1.00 0.00 H new ATOM 1694 N ILE B 105 15.259 -4.755 5.911 1.00 0.00 N ATOM 1695 CA ILE B 105 14.388 -5.667 5.178 1.00 0.00 C ATOM 1696 C ILE B 105 14.711 -5.663 3.694 1.00 0.00 C ATOM 1697 O ILE B 105 15.167 -4.661 3.134 1.00 0.00 O ATOM 1698 CB ILE B 105 12.884 -5.365 5.391 1.00 0.00 C ATOM 1699 CG1 ILE B 105 12.013 -6.495 4.829 1.00 0.00 C ATOM 1700 CG2 ILE B 105 12.488 -4.034 4.761 1.00 0.00 C ATOM 1701 CD1 ILE B 105 12.203 -7.819 5.540 1.00 0.00 C ATOM 0 H ILE B 105 14.922 -3.794 5.978 1.00 0.00 H new ATOM 0 HA ILE B 105 14.583 -6.659 5.585 1.00 0.00 H new ATOM 0 HB ILE B 105 12.716 -5.296 6.466 1.00 0.00 H new ATOM 0 HG12 ILE B 105 10.965 -6.203 4.897 1.00 0.00 H new ATOM 0 HG13 ILE B 105 12.239 -6.625 3.771 1.00 0.00 H new ATOM 0 HG21 ILE B 105 11.426 -3.853 4.929 1.00 0.00 H new ATOM 0 HG22 ILE B 105 13.069 -3.230 5.213 1.00 0.00 H new ATOM 0 HG23 ILE B 105 12.685 -4.066 3.689 1.00 0.00 H new ATOM 0 HD11 ILE B 105 11.555 -8.571 5.089 1.00 0.00 H new ATOM 0 HD12 ILE B 105 13.242 -8.135 5.450 1.00 0.00 H new ATOM 0 HD13 ILE B 105 11.948 -7.706 6.594 1.00 0.00 H new ATOM 1713 N THR B 106 14.474 -6.803 3.075 1.00 0.00 N ATOM 1714 CA THR B 106 14.768 -7.007 1.677 1.00 0.00 C ATOM 1715 C THR B 106 13.826 -6.194 0.781 1.00 0.00 C ATOM 1716 O THR B 106 14.243 -5.643 -0.235 1.00 0.00 O ATOM 1717 CB THR B 106 14.677 -8.512 1.350 1.00 0.00 C ATOM 1718 OG1 THR B 106 15.256 -8.782 0.070 1.00 0.00 O ATOM 1719 CG2 THR B 106 13.237 -9.015 1.370 1.00 0.00 C ATOM 0 H THR B 106 14.069 -7.618 3.535 1.00 0.00 H new ATOM 0 HA THR B 106 15.781 -6.656 1.478 1.00 0.00 H new ATOM 0 HB THR B 106 15.233 -9.041 2.125 1.00 0.00 H new ATOM 0 HG1 THR B 106 15.192 -9.741 -0.122 1.00 0.00 H new ATOM 0 HG21 THR B 106 13.220 -10.079 1.134 1.00 0.00 H new ATOM 0 HG22 THR B 106 12.810 -8.856 2.360 1.00 0.00 H new ATOM 0 HG23 THR B 106 12.651 -8.470 0.630 1.00 0.00 H new ATOM 1727 N ALA B 107 12.562 -6.095 1.181 1.00 0.00 N ATOM 1728 CA ALA B 107 11.580 -5.348 0.411 1.00 0.00 C ATOM 1729 C ALA B 107 11.639 -3.881 0.775 1.00 0.00 C ATOM 1730 O ALA B 107 11.579 -3.527 1.950 1.00 0.00 O ATOM 1731 CB ALA B 107 10.177 -5.876 0.668 1.00 0.00 C ATOM 0 H ALA B 107 12.197 -6.522 2.032 1.00 0.00 H new ATOM 0 HA ALA B 107 11.814 -5.471 -0.646 1.00 0.00 H new ATOM 0 HB1 ALA B 107 9.459 -5.302 0.082 1.00 0.00 H new ATOM 0 HB2 ALA B 107 10.125 -6.926 0.379 1.00 0.00 H new ATOM 0 HB3 ALA B 107 9.940 -5.779 1.727 1.00 0.00 H new ATOM 1737 N LYS B 108 11.747 -3.026 -0.219 1.00 0.00 N ATOM 1738 CA LYS B 108 11.728 -1.602 0.035 1.00 0.00 C ATOM 1739 C LYS B 108 10.281 -1.167 0.184 1.00 0.00 C ATOM 1740 O LYS B 108 9.548 -1.063 -0.799 1.00 0.00 O ATOM 1741 CB LYS B 108 12.424 -0.835 -1.095 1.00 0.00 C ATOM 1742 CG LYS B 108 13.803 -1.381 -1.486 1.00 0.00 C ATOM 1743 CD LYS B 108 14.846 -1.276 -0.368 1.00 0.00 C ATOM 1744 CE LYS B 108 14.801 -2.469 0.583 1.00 0.00 C ATOM 1745 NZ LYS B 108 15.981 -2.525 1.487 1.00 0.00 N ATOM 0 H LYS B 108 11.848 -3.288 -1.200 1.00 0.00 H new ATOM 0 HA LYS B 108 12.275 -1.380 0.951 1.00 0.00 H new ATOM 0 HB2 LYS B 108 11.780 -0.848 -1.975 1.00 0.00 H new ATOM 0 HB3 LYS B 108 12.533 0.207 -0.795 1.00 0.00 H new ATOM 0 HG2 LYS B 108 13.701 -2.426 -1.779 1.00 0.00 H new ATOM 0 HG3 LYS B 108 14.164 -0.839 -2.360 1.00 0.00 H new ATOM 0 HD2 LYS B 108 15.840 -1.203 -0.808 1.00 0.00 H new ATOM 0 HD3 LYS B 108 14.679 -0.358 0.196 1.00 0.00 H new ATOM 0 HE2 LYS B 108 13.892 -2.418 1.182 1.00 0.00 H new ATOM 0 HE3 LYS B 108 14.749 -3.390 0.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 15.990 -3.435 1.991 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 16.852 -2.431 0.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 15.927 -1.748 2.177 1.00 0.00 H new ATOM 1759 N ARG B 109 9.855 -0.968 1.420 1.00 0.00 N ATOM 1760 CA ARG B 109 8.473 -0.627 1.683 1.00 0.00 C ATOM 1761 C ARG B 109 8.356 0.826 2.084 1.00 0.00 C ATOM 1762 O ARG B 109 8.895 1.236 3.103 1.00 0.00 O ATOM 1763 CB ARG B 109 7.902 -1.501 2.796 1.00 0.00 C ATOM 1764 CG ARG B 109 8.119 -2.986 2.587 1.00 0.00 C ATOM 1765 CD ARG B 109 7.489 -3.782 3.711 1.00 0.00 C ATOM 1766 NE ARG B 109 7.990 -5.157 3.761 1.00 0.00 N ATOM 1767 CZ ARG B 109 8.319 -5.794 4.888 1.00 0.00 C ATOM 1768 NH1 ARG B 109 8.221 -5.176 6.061 1.00 0.00 N ATOM 1769 NH2 ARG B 109 8.755 -7.048 4.841 1.00 0.00 N ATOM 0 H ARG B 109 10.444 -1.037 2.250 1.00 0.00 H new ATOM 0 HA ARG B 109 7.907 -0.799 0.768 1.00 0.00 H new ATOM 0 HB2 ARG B 109 8.355 -1.208 3.743 1.00 0.00 H new ATOM 0 HB3 ARG B 109 6.832 -1.309 2.882 1.00 0.00 H new ATOM 0 HG2 ARG B 109 7.689 -3.291 1.633 1.00 0.00 H new ATOM 0 HG3 ARG B 109 9.187 -3.199 2.538 1.00 0.00 H new ATOM 0 HD2 ARG B 109 7.691 -3.288 4.662 1.00 0.00 H new ATOM 0 HD3 ARG B 109 6.407 -3.796 3.583 1.00 0.00 H new ATOM 0 HE ARG B 109 8.094 -5.660 2.880 1.00 0.00 H new ATOM 0 HH11 ARG B 109 7.893 -4.211 6.103 1.00 0.00 H new ATOM 0 HH12 ARG B 109 8.473 -5.667 6.919 1.00 0.00 H new ATOM 0 HH21 ARG B 109 8.839 -7.525 3.944 1.00 0.00 H new ATOM 0 HH22 ARG B 109 9.006 -7.533 5.702 1.00 0.00 H new ATOM 1783 N SER B 110 7.624 1.578 1.287 1.00 0.00 N ATOM 1784 CA SER B 110 7.385 2.988 1.542 1.00 0.00 C ATOM 1785 C SER B 110 6.587 3.158 2.830 1.00 0.00 C ATOM 1786 O SER B 110 5.881 2.242 3.263 1.00 0.00 O ATOM 1787 CB SER B 110 6.659 3.621 0.353 1.00 0.00 C ATOM 1788 OG SER B 110 6.519 5.017 0.508 1.00 0.00 O ATOM 0 H SER B 110 7.175 1.229 0.440 1.00 0.00 H new ATOM 0 HA SER B 110 8.340 3.499 1.666 1.00 0.00 H new ATOM 0 HB2 SER B 110 7.210 3.410 -0.564 1.00 0.00 H new ATOM 0 HB3 SER B 110 5.674 3.167 0.244 1.00 0.00 H new ATOM 0 HG SER B 110 6.053 5.387 -0.270 1.00 0.00 H new ATOM 1794 N ARG B 111 6.673 4.336 3.415 1.00 0.00 N ATOM 1795 CA ARG B 111 6.218 4.546 4.779 1.00 0.00 C ATOM 1796 C ARG B 111 4.702 4.522 4.889 1.00 0.00 C ATOM 1797 O ARG B 111 4.167 4.016 5.873 1.00 0.00 O ATOM 1798 CB ARG B 111 6.792 5.850 5.312 1.00 0.00 C ATOM 1799 CG ARG B 111 8.250 6.017 4.922 1.00 0.00 C ATOM 1800 CD ARG B 111 8.967 7.037 5.783 1.00 0.00 C ATOM 1801 NE ARG B 111 9.158 6.562 7.155 1.00 0.00 N ATOM 1802 CZ ARG B 111 9.648 7.317 8.141 1.00 0.00 C ATOM 1803 NH1 ARG B 111 10.061 8.557 7.899 1.00 0.00 N ATOM 1804 NH2 ARG B 111 9.730 6.824 9.368 1.00 0.00 N ATOM 0 H ARG B 111 7.056 5.168 2.966 1.00 0.00 H new ATOM 0 HA ARG B 111 6.582 3.720 5.390 1.00 0.00 H new ATOM 0 HB2 ARG B 111 6.213 6.689 4.926 1.00 0.00 H new ATOM 0 HB3 ARG B 111 6.700 5.872 6.398 1.00 0.00 H new ATOM 0 HG2 ARG B 111 8.757 5.056 5.004 1.00 0.00 H new ATOM 0 HG3 ARG B 111 8.311 6.321 3.877 1.00 0.00 H new ATOM 0 HD2 ARG B 111 9.937 7.267 5.341 1.00 0.00 H new ATOM 0 HD3 ARG B 111 8.395 7.965 5.797 1.00 0.00 H new ATOM 0 HE ARG B 111 8.902 5.598 7.370 1.00 0.00 H new ATOM 0 HH11 ARG B 111 10.005 8.938 6.955 1.00 0.00 H new ATOM 0 HH12 ARG B 111 10.434 9.127 8.658 1.00 0.00 H new ATOM 0 HH21 ARG B 111 9.419 5.871 9.556 1.00 0.00 H new ATOM 0 HH22 ARG B 111 10.104 7.398 10.124 1.00 0.00 H new ATOM 1818 N ALA B 112 4.007 5.031 3.877 1.00 0.00 N ATOM 1819 CA ALA B 112 2.549 4.979 3.869 1.00 0.00 C ATOM 1820 C ALA B 112 2.069 3.535 3.853 1.00 0.00 C ATOM 1821 O ALA B 112 1.010 3.215 4.387 1.00 0.00 O ATOM 1822 CB ALA B 112 1.980 5.739 2.681 1.00 0.00 C ATOM 0 H ALA B 112 4.423 5.479 3.061 1.00 0.00 H new ATOM 0 HA ALA B 112 2.190 5.458 4.780 1.00 0.00 H new ATOM 0 HB1 ALA B 112 0.892 5.683 2.701 1.00 0.00 H new ATOM 0 HB2 ALA B 112 2.291 6.782 2.734 1.00 0.00 H new ATOM 0 HB3 ALA B 112 2.349 5.297 1.756 1.00 0.00 H new ATOM 1828 N ARG B 113 2.875 2.655 3.258 1.00 0.00 N ATOM 1829 CA ARG B 113 2.533 1.241 3.194 1.00 0.00 C ATOM 1830 C ARG B 113 2.662 0.636 4.577 1.00 0.00 C ATOM 1831 O ARG B 113 1.838 -0.168 5.006 1.00 0.00 O ATOM 1832 CB ARG B 113 3.469 0.486 2.248 1.00 0.00 C ATOM 1833 CG ARG B 113 3.646 1.135 0.891 1.00 0.00 C ATOM 1834 CD ARG B 113 4.632 0.357 0.039 1.00 0.00 C ATOM 1835 NE ARG B 113 4.952 1.064 -1.209 1.00 0.00 N ATOM 1836 CZ ARG B 113 6.167 1.140 -1.765 1.00 0.00 C ATOM 1837 NH1 ARG B 113 7.187 0.477 -1.250 1.00 0.00 N ATOM 1838 NH2 ARG B 113 6.344 1.832 -2.881 1.00 0.00 N ATOM 0 H ARG B 113 3.762 2.898 2.817 1.00 0.00 H new ATOM 0 HA ARG B 113 1.512 1.155 2.823 1.00 0.00 H new ATOM 0 HB2 ARG B 113 4.446 0.392 2.722 1.00 0.00 H new ATOM 0 HB3 ARG B 113 3.085 -0.524 2.106 1.00 0.00 H new ATOM 0 HG2 ARG B 113 2.684 1.189 0.382 1.00 0.00 H new ATOM 0 HG3 ARG B 113 3.998 2.159 1.017 1.00 0.00 H new ATOM 0 HD2 ARG B 113 5.548 0.188 0.606 1.00 0.00 H new ATOM 0 HD3 ARG B 113 4.216 -0.623 -0.195 1.00 0.00 H new ATOM 0 HE ARG B 113 4.186 1.535 -1.690 1.00 0.00 H new ATOM 0 HH11 ARG B 113 7.053 -0.101 -0.420 1.00 0.00 H new ATOM 0 HH12 ARG B 113 8.108 0.543 -1.682 1.00 0.00 H new ATOM 0 HH21 ARG B 113 5.554 2.307 -3.317 1.00 0.00 H new ATOM 0 HH22 ARG B 113 7.270 1.889 -3.304 1.00 0.00 H new ATOM 1852 N ILE B 114 3.721 1.038 5.258 1.00 0.00 N ATOM 1853 CA ILE B 114 4.040 0.510 6.565 1.00 0.00 C ATOM 1854 C ILE B 114 3.061 0.988 7.621 1.00 0.00 C ATOM 1855 O ILE B 114 2.410 0.186 8.292 1.00 0.00 O ATOM 1856 CB ILE B 114 5.445 0.936 7.011 1.00 0.00 C ATOM 1857 CG1 ILE B 114 6.486 0.493 5.997 1.00 0.00 C ATOM 1858 CG2 ILE B 114 5.741 0.332 8.371 1.00 0.00 C ATOM 1859 CD1 ILE B 114 7.864 1.079 6.227 1.00 0.00 C ATOM 0 H ILE B 114 4.380 1.738 4.918 1.00 0.00 H new ATOM 0 HA ILE B 114 3.984 -0.575 6.472 1.00 0.00 H new ATOM 0 HB ILE B 114 5.485 2.023 7.080 1.00 0.00 H new ATOM 0 HG12 ILE B 114 6.558 -0.594 6.018 1.00 0.00 H new ATOM 0 HG13 ILE B 114 6.147 0.771 4.999 1.00 0.00 H new ATOM 0 HG21 ILE B 114 6.738 0.632 8.693 1.00 0.00 H new ATOM 0 HG22 ILE B 114 5.005 0.685 9.094 1.00 0.00 H new ATOM 0 HG23 ILE B 114 5.692 -0.755 8.305 1.00 0.00 H new ATOM 0 HD11 ILE B 114 8.547 0.713 5.461 1.00 0.00 H new ATOM 0 HD12 ILE B 114 7.810 2.166 6.176 1.00 0.00 H new ATOM 0 HD13 ILE B 114 8.227 0.780 7.210 1.00 0.00 H new ATOM 1871 N VAL B 115 2.970 2.303 7.761 1.00 0.00 N ATOM 1872 CA VAL B 115 2.237 2.903 8.859 1.00 0.00 C ATOM 1873 C VAL B 115 0.773 2.543 8.813 1.00 0.00 C ATOM 1874 O VAL B 115 0.139 2.353 9.845 1.00 0.00 O ATOM 1875 CB VAL B 115 2.414 4.438 8.900 1.00 0.00 C ATOM 1876 CG1 VAL B 115 3.889 4.798 8.942 1.00 0.00 C ATOM 1877 CG2 VAL B 115 1.744 5.113 7.713 1.00 0.00 C ATOM 0 H VAL B 115 3.398 2.974 7.123 1.00 0.00 H new ATOM 0 HA VAL B 115 2.659 2.493 9.776 1.00 0.00 H new ATOM 0 HB VAL B 115 1.930 4.801 9.807 1.00 0.00 H new ATOM 0 HG11 VAL B 115 3.998 5.882 8.971 1.00 0.00 H new ATOM 0 HG12 VAL B 115 4.344 4.364 9.832 1.00 0.00 H new ATOM 0 HG13 VAL B 115 4.384 4.407 8.053 1.00 0.00 H new ATOM 0 HG21 VAL B 115 1.890 6.191 7.777 1.00 0.00 H new ATOM 0 HG22 VAL B 115 2.184 4.742 6.787 1.00 0.00 H new ATOM 0 HG23 VAL B 115 0.677 4.890 7.723 1.00 0.00 H new ATOM 1887 N ASP B 116 0.250 2.411 7.621 1.00 0.00 N ATOM 1888 CA ASP B 116 -1.128 2.033 7.455 1.00 0.00 C ATOM 1889 C ASP B 116 -1.319 0.560 7.779 1.00 0.00 C ATOM 1890 O ASP B 116 -2.359 0.159 8.307 1.00 0.00 O ATOM 1891 CB ASP B 116 -1.566 2.321 6.038 1.00 0.00 C ATOM 1892 CG ASP B 116 -2.488 3.520 5.944 1.00 0.00 C ATOM 1893 OD1 ASP B 116 -3.627 3.372 5.447 1.00 0.00 O ATOM 1894 OD2 ASP B 116 -2.077 4.621 6.366 1.00 0.00 O ATOM 0 H ASP B 116 0.759 2.560 6.750 1.00 0.00 H new ATOM 0 HA ASP B 116 -1.741 2.615 8.143 1.00 0.00 H new ATOM 0 HB2 ASP B 116 -0.686 2.495 5.418 1.00 0.00 H new ATOM 0 HB3 ASP B 116 -2.073 1.445 5.633 1.00 0.00 H new ATOM 1899 N LYS B 117 -0.303 -0.253 7.496 1.00 0.00 N ATOM 1900 CA LYS B 117 -0.428 -1.680 7.714 1.00 0.00 C ATOM 1901 C LYS B 117 -0.232 -2.015 9.193 1.00 0.00 C ATOM 1902 O LYS B 117 -0.770 -3.003 9.685 1.00 0.00 O ATOM 1903 CB LYS B 117 0.549 -2.463 6.827 1.00 0.00 C ATOM 1904 CG LYS B 117 0.043 -3.853 6.456 1.00 0.00 C ATOM 1905 CD LYS B 117 -1.228 -3.782 5.610 1.00 0.00 C ATOM 1906 CE LYS B 117 -1.893 -5.142 5.478 1.00 0.00 C ATOM 1907 NZ LYS B 117 -1.116 -6.071 4.623 1.00 0.00 N ATOM 0 H LYS B 117 0.596 0.050 7.123 1.00 0.00 H new ATOM 0 HA LYS B 117 -1.436 -1.983 7.431 1.00 0.00 H new ATOM 0 HB2 LYS B 117 0.736 -1.896 5.915 1.00 0.00 H new ATOM 0 HB3 LYS B 117 1.504 -2.557 7.345 1.00 0.00 H new ATOM 0 HG2 LYS B 117 0.817 -4.388 5.906 1.00 0.00 H new ATOM 0 HG3 LYS B 117 -0.155 -4.423 7.364 1.00 0.00 H new ATOM 0 HD2 LYS B 117 -1.927 -3.078 6.062 1.00 0.00 H new ATOM 0 HD3 LYS B 117 -0.985 -3.398 4.619 1.00 0.00 H new ATOM 0 HE2 LYS B 117 -2.016 -5.581 6.468 1.00 0.00 H new ATOM 0 HE3 LYS B 117 -2.891 -5.016 5.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 -1.641 -6.256 3.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 -0.196 -5.644 4.393 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 -0.965 -6.966 5.131 1.00 0.00 H new ATOM 1921 N LEU B 118 0.514 -1.176 9.907 1.00 0.00 N ATOM 1922 CA LEU B 118 0.662 -1.337 11.354 1.00 0.00 C ATOM 1923 C LEU B 118 -0.683 -1.228 12.047 1.00 0.00 C ATOM 1924 O LEU B 118 -1.034 -2.063 12.884 1.00 0.00 O ATOM 1925 CB LEU B 118 1.580 -0.279 11.952 1.00 0.00 C ATOM 1926 CG LEU B 118 3.067 -0.406 11.662 1.00 0.00 C ATOM 1927 CD1 LEU B 118 3.825 0.404 12.692 1.00 0.00 C ATOM 1928 CD2 LEU B 118 3.517 -1.858 11.686 1.00 0.00 C ATOM 0 H LEU B 118 1.022 -0.384 9.513 1.00 0.00 H new ATOM 0 HA LEU B 118 1.096 -2.325 11.511 1.00 0.00 H new ATOM 0 HB2 LEU B 118 1.248 0.696 11.596 1.00 0.00 H new ATOM 0 HB3 LEU B 118 1.445 -0.286 13.034 1.00 0.00 H new ATOM 0 HG LEU B 118 3.272 -0.026 10.661 1.00 0.00 H new ATOM 0 HD11 LEU B 118 4.895 0.326 12.501 1.00 0.00 H new ATOM 0 HD12 LEU B 118 3.521 1.449 12.629 1.00 0.00 H new ATOM 0 HD13 LEU B 118 3.606 0.022 13.689 1.00 0.00 H new ATOM 0 HD21 LEU B 118 4.585 -1.911 11.475 1.00 0.00 H new ATOM 0 HD22 LEU B 118 3.320 -2.284 12.670 1.00 0.00 H new ATOM 0 HD23 LEU B 118 2.969 -2.421 10.931 1.00 0.00 H new ATOM 1940 N LEU B 119 -1.420 -0.178 11.700 1.00 0.00 N ATOM 1941 CA LEU B 119 -2.747 0.062 12.256 1.00 0.00 C ATOM 1942 C LEU B 119 -3.674 -1.104 11.945 1.00 0.00 C ATOM 1943 O LEU B 119 -4.564 -1.435 12.725 1.00 0.00 O ATOM 1944 CB LEU B 119 -3.341 1.355 11.686 1.00 0.00 C ATOM 1945 CG LEU B 119 -2.907 2.669 12.371 1.00 0.00 C ATOM 1946 CD1 LEU B 119 -3.350 2.681 13.825 1.00 0.00 C ATOM 1947 CD2 LEU B 119 -1.400 2.892 12.282 1.00 0.00 C ATOM 0 H LEU B 119 -1.116 0.527 11.029 1.00 0.00 H new ATOM 0 HA LEU B 119 -2.649 0.161 13.337 1.00 0.00 H new ATOM 0 HB2 LEU B 119 -3.077 1.416 10.630 1.00 0.00 H new ATOM 0 HB3 LEU B 119 -4.427 1.285 11.739 1.00 0.00 H new ATOM 0 HG LEU B 119 -3.393 3.486 11.838 1.00 0.00 H new ATOM 0 HD11 LEU B 119 -3.036 3.614 14.293 1.00 0.00 H new ATOM 0 HD12 LEU B 119 -4.436 2.597 13.875 1.00 0.00 H new ATOM 0 HD13 LEU B 119 -2.896 1.841 14.351 1.00 0.00 H new ATOM 0 HD21 LEU B 119 -1.141 3.828 12.777 1.00 0.00 H new ATOM 0 HD22 LEU B 119 -0.881 2.067 12.770 1.00 0.00 H new ATOM 0 HD23 LEU B 119 -1.101 2.940 11.235 1.00 0.00 H new ATOM 1959 N ALA B 120 -3.437 -1.732 10.804 1.00 0.00 N ATOM 1960 CA ALA B 120 -4.253 -2.845 10.352 1.00 0.00 C ATOM 1961 C ALA B 120 -3.969 -4.101 11.175 1.00 0.00 C ATOM 1962 O ALA B 120 -4.894 -4.783 11.623 1.00 0.00 O ATOM 1963 CB ALA B 120 -4.004 -3.085 8.873 1.00 0.00 C ATOM 0 H ALA B 120 -2.678 -1.485 10.169 1.00 0.00 H new ATOM 0 HA ALA B 120 -5.305 -2.599 10.495 1.00 0.00 H new ATOM 0 HB1 ALA B 120 -4.616 -3.920 8.532 1.00 0.00 H new ATOM 0 HB2 ALA B 120 -4.266 -2.189 8.310 1.00 0.00 H new ATOM 0 HB3 ALA B 120 -2.951 -3.318 8.714 1.00 0.00 H new ATOM 1969 N LEU B 121 -2.683 -4.391 11.381 1.00 0.00 N ATOM 1970 CA LEU B 121 -2.263 -5.513 12.219 1.00 0.00 C ATOM 1971 C LEU B 121 -2.649 -5.285 13.676 1.00 0.00 C ATOM 1972 O LEU B 121 -2.803 -6.234 14.446 1.00 0.00 O ATOM 1973 CB LEU B 121 -0.745 -5.693 12.150 1.00 0.00 C ATOM 1974 CG LEU B 121 -0.205 -6.567 11.018 1.00 0.00 C ATOM 1975 CD1 LEU B 121 -0.630 -6.050 9.654 1.00 0.00 C ATOM 1976 CD2 LEU B 121 1.310 -6.638 11.117 1.00 0.00 C ATOM 0 H LEU B 121 -1.912 -3.861 10.976 1.00 0.00 H new ATOM 0 HA LEU B 121 -2.766 -6.404 11.843 1.00 0.00 H new ATOM 0 HB2 LEU B 121 -0.290 -4.706 12.064 1.00 0.00 H new ATOM 0 HB3 LEU B 121 -0.410 -6.118 13.096 1.00 0.00 H new ATOM 0 HG LEU B 121 -0.625 -7.567 11.124 1.00 0.00 H new ATOM 0 HD11 LEU B 121 -0.226 -6.699 8.877 1.00 0.00 H new ATOM 0 HD12 LEU B 121 -1.718 -6.042 9.591 1.00 0.00 H new ATOM 0 HD13 LEU B 121 -0.251 -5.037 9.515 1.00 0.00 H new ATOM 0 HD21 LEU B 121 1.699 -7.261 10.311 1.00 0.00 H new ATOM 0 HD22 LEU B 121 1.727 -5.635 11.034 1.00 0.00 H new ATOM 0 HD23 LEU B 121 1.592 -7.070 12.077 1.00 0.00 H new ATOM 1988 N GLY B 122 -2.797 -4.024 14.044 1.00 0.00 N ATOM 1989 CA GLY B 122 -3.041 -3.684 15.426 1.00 0.00 C ATOM 1990 C GLY B 122 -1.758 -3.677 16.225 1.00 0.00 C ATOM 1991 O GLY B 122 -1.753 -3.982 17.416 1.00 0.00 O ATOM 0 H GLY B 122 -2.752 -3.228 13.408 1.00 0.00 H new ATOM 0 HA2 GLY B 122 -3.513 -2.703 15.483 1.00 0.00 H new ATOM 0 HA3 GLY B 122 -3.739 -4.400 15.861 1.00 0.00 H new ATOM 1995 N LEU B 123 -0.660 -3.329 15.559 1.00 0.00 N ATOM 1996 CA LEU B 123 0.639 -3.262 16.209 1.00 0.00 C ATOM 1997 C LEU B 123 0.756 -1.955 16.963 1.00 0.00 C ATOM 1998 O LEU B 123 1.512 -1.828 17.927 1.00 0.00 O ATOM 1999 CB LEU B 123 1.759 -3.401 15.175 1.00 0.00 C ATOM 2000 CG LEU B 123 1.928 -4.805 14.591 1.00 0.00 C ATOM 2001 CD1 LEU B 123 3.071 -4.837 13.592 1.00 0.00 C ATOM 2002 CD2 LEU B 123 2.167 -5.819 15.698 1.00 0.00 C ATOM 0 H LEU B 123 -0.648 -3.089 14.568 1.00 0.00 H new ATOM 0 HA LEU B 123 0.735 -4.086 16.917 1.00 0.00 H new ATOM 0 HB2 LEU B 123 1.568 -2.705 14.359 1.00 0.00 H new ATOM 0 HB3 LEU B 123 2.699 -3.100 15.637 1.00 0.00 H new ATOM 0 HG LEU B 123 1.007 -5.069 14.071 1.00 0.00 H new ATOM 0 HD11 LEU B 123 3.174 -5.844 13.189 1.00 0.00 H new ATOM 0 HD12 LEU B 123 2.864 -4.141 12.780 1.00 0.00 H new ATOM 0 HD13 LEU B 123 3.997 -4.549 14.089 1.00 0.00 H new ATOM 0 HD21 LEU B 123 2.285 -6.812 15.263 1.00 0.00 H new ATOM 0 HD22 LEU B 123 3.071 -5.553 16.246 1.00 0.00 H new ATOM 0 HD23 LEU B 123 1.317 -5.820 16.380 1.00 0.00 H new ATOM 2014 N VAL B 124 -0.020 -0.992 16.512 1.00 0.00 N ATOM 2015 CA VAL B 124 -0.108 0.301 17.157 1.00 0.00 C ATOM 2016 C VAL B 124 -1.547 0.778 17.169 1.00 0.00 C ATOM 2017 O VAL B 124 -2.424 0.166 16.554 1.00 0.00 O ATOM 2018 CB VAL B 124 0.760 1.355 16.447 1.00 0.00 C ATOM 2019 CG1 VAL B 124 2.238 1.038 16.608 1.00 0.00 C ATOM 2020 CG2 VAL B 124 0.376 1.441 14.980 1.00 0.00 C ATOM 0 H VAL B 124 -0.610 -1.084 15.685 1.00 0.00 H new ATOM 0 HA VAL B 124 0.260 0.180 18.176 1.00 0.00 H new ATOM 0 HB VAL B 124 0.580 2.326 16.909 1.00 0.00 H new ATOM 0 HG11 VAL B 124 2.831 1.797 16.098 1.00 0.00 H new ATOM 0 HG12 VAL B 124 2.495 1.029 17.667 1.00 0.00 H new ATOM 0 HG13 VAL B 124 2.450 0.060 16.175 1.00 0.00 H new ATOM 0 HG21 VAL B 124 0.995 2.189 14.485 1.00 0.00 H new ATOM 0 HG22 VAL B 124 0.530 0.472 14.506 1.00 0.00 H new ATOM 0 HG23 VAL B 124 -0.673 1.724 14.895 1.00 0.00 H new ATOM 2030 N ALA B 125 -1.772 1.871 17.859 1.00 0.00 N ATOM 2031 CA ALA B 125 -3.085 2.480 17.935 1.00 0.00 C ATOM 2032 C ALA B 125 -3.059 3.818 17.223 1.00 0.00 C ATOM 2033 O ALA B 125 -4.099 4.374 16.868 1.00 0.00 O ATOM 2034 CB ALA B 125 -3.507 2.657 19.385 1.00 0.00 C ATOM 0 H ALA B 125 -1.052 2.366 18.385 1.00 0.00 H new ATOM 0 HA ALA B 125 -3.812 1.829 17.449 1.00 0.00 H new ATOM 0 HB1 ALA B 125 -4.495 3.116 19.423 1.00 0.00 H new ATOM 0 HB2 ALA B 125 -3.539 1.684 19.876 1.00 0.00 H new ATOM 0 HB3 ALA B 125 -2.790 3.298 19.897 1.00 0.00 H new ATOM 2040 N GLU B 126 -1.854 4.326 17.023 1.00 0.00 N ATOM 2041 CA GLU B 126 -1.644 5.583 16.334 1.00 0.00 C ATOM 2042 C GLU B 126 -0.310 5.550 15.606 1.00 0.00 C ATOM 2043 O GLU B 126 0.504 4.659 15.838 1.00 0.00 O ATOM 2044 CB GLU B 126 -1.654 6.728 17.339 1.00 0.00 C ATOM 2045 CG GLU B 126 -0.525 6.644 18.351 1.00 0.00 C ATOM 2046 CD GLU B 126 -0.629 7.721 19.407 1.00 0.00 C ATOM 2047 OE1 GLU B 126 -0.773 8.906 19.032 1.00 0.00 O ATOM 2048 OE2 GLU B 126 -0.570 7.394 20.610 1.00 0.00 O ATOM 0 H GLU B 126 -0.994 3.875 17.336 1.00 0.00 H new ATOM 0 HA GLU B 126 -2.445 5.735 15.610 1.00 0.00 H new ATOM 0 HB2 GLU B 126 -1.583 7.674 16.803 1.00 0.00 H new ATOM 0 HB3 GLU B 126 -2.607 6.731 17.867 1.00 0.00 H new ATOM 0 HG2 GLU B 126 -0.539 5.665 18.829 1.00 0.00 H new ATOM 0 HG3 GLU B 126 0.431 6.733 17.835 1.00 0.00 H new ATOM 2055 N ARG B 127 -0.079 6.523 14.738 1.00 0.00 N ATOM 2056 CA ARG B 127 1.181 6.600 14.012 1.00 0.00 C ATOM 2057 C ARG B 127 2.292 7.167 14.891 1.00 0.00 C ATOM 2058 O ARG B 127 3.468 6.965 14.615 1.00 0.00 O ATOM 2059 CB ARG B 127 1.033 7.429 12.739 1.00 0.00 C ATOM 2060 CG ARG B 127 0.258 6.726 11.635 1.00 0.00 C ATOM 2061 CD ARG B 127 0.304 7.530 10.356 1.00 0.00 C ATOM 2062 NE ARG B 127 -0.511 6.951 9.288 1.00 0.00 N ATOM 2063 CZ ARG B 127 -0.904 7.632 8.209 1.00 0.00 C ATOM 2064 NH1 ARG B 127 -0.618 8.924 8.092 1.00 0.00 N ATOM 2065 NH2 ARG B 127 -1.583 7.029 7.246 1.00 0.00 N ATOM 0 H ARG B 127 -0.742 7.266 14.519 1.00 0.00 H new ATOM 0 HA ARG B 127 1.457 5.584 13.728 1.00 0.00 H new ATOM 0 HB2 ARG B 127 0.531 8.365 12.983 1.00 0.00 H new ATOM 0 HB3 ARG B 127 2.025 7.686 12.367 1.00 0.00 H new ATOM 0 HG2 ARG B 127 0.678 5.735 11.463 1.00 0.00 H new ATOM 0 HG3 ARG B 127 -0.778 6.584 11.944 1.00 0.00 H new ATOM 0 HD2 ARG B 127 -0.039 8.544 10.558 1.00 0.00 H new ATOM 0 HD3 ARG B 127 1.337 7.605 10.017 1.00 0.00 H new ATOM 0 HE ARG B 127 -0.794 5.975 9.372 1.00 0.00 H new ATOM 0 HH11 ARG B 127 -0.096 9.400 8.828 1.00 0.00 H new ATOM 0 HH12 ARG B 127 -0.920 9.440 7.266 1.00 0.00 H new ATOM 0 HH21 ARG B 127 -1.809 6.038 7.325 1.00 0.00 H new ATOM 0 HH22 ARG B 127 -1.880 7.556 6.425 1.00 0.00 H new ATOM 2079 N ARG B 128 1.916 7.877 15.946 1.00 0.00 N ATOM 2080 CA ARG B 128 2.889 8.495 16.848 1.00 0.00 C ATOM 2081 C ARG B 128 3.876 7.469 17.404 1.00 0.00 C ATOM 2082 O ARG B 128 5.064 7.743 17.526 1.00 0.00 O ATOM 2083 CB ARG B 128 2.171 9.167 18.012 1.00 0.00 C ATOM 2084 CG ARG B 128 3.097 9.930 18.945 1.00 0.00 C ATOM 2085 CD ARG B 128 2.522 10.037 20.351 1.00 0.00 C ATOM 2086 NE ARG B 128 1.082 10.287 20.361 1.00 0.00 N ATOM 2087 CZ ARG B 128 0.414 10.796 21.398 1.00 0.00 C ATOM 2088 NH1 ARG B 128 1.060 11.172 22.496 1.00 0.00 N ATOM 2089 NH2 ARG B 128 -0.905 10.913 21.334 1.00 0.00 N ATOM 0 H ARG B 128 0.942 8.042 16.202 1.00 0.00 H new ATOM 0 HA ARG B 128 3.444 9.233 16.269 1.00 0.00 H new ATOM 0 HB2 ARG B 128 1.422 9.853 17.617 1.00 0.00 H new ATOM 0 HB3 ARG B 128 1.638 8.408 18.585 1.00 0.00 H new ATOM 0 HG2 ARG B 128 4.065 9.430 18.985 1.00 0.00 H new ATOM 0 HG3 ARG B 128 3.271 10.930 18.547 1.00 0.00 H new ATOM 0 HD2 ARG B 128 2.729 9.115 20.893 1.00 0.00 H new ATOM 0 HD3 ARG B 128 3.029 10.841 20.885 1.00 0.00 H new ATOM 0 HE ARG B 128 0.553 10.057 19.520 1.00 0.00 H new ATOM 0 HH11 ARG B 128 2.074 11.073 22.551 1.00 0.00 H new ATOM 0 HH12 ARG B 128 0.542 11.560 23.285 1.00 0.00 H new ATOM 0 HH21 ARG B 128 -1.403 10.615 20.496 1.00 0.00 H new ATOM 0 HH22 ARG B 128 -1.421 11.301 22.123 1.00 0.00 H new ATOM 2103 N GLU B 129 3.370 6.286 17.727 1.00 0.00 N ATOM 2104 CA GLU B 129 4.171 5.241 18.362 1.00 0.00 C ATOM 2105 C GLU B 129 5.327 4.793 17.472 1.00 0.00 C ATOM 2106 O GLU B 129 6.363 4.347 17.962 1.00 0.00 O ATOM 2107 CB GLU B 129 3.283 4.043 18.679 1.00 0.00 C ATOM 2108 CG GLU B 129 2.101 4.389 19.561 1.00 0.00 C ATOM 2109 CD GLU B 129 1.088 3.262 19.646 1.00 0.00 C ATOM 2110 OE1 GLU B 129 0.054 3.343 18.956 1.00 0.00 O ATOM 2111 OE2 GLU B 129 1.323 2.288 20.396 1.00 0.00 O ATOM 0 H GLU B 129 2.399 6.022 17.559 1.00 0.00 H new ATOM 0 HA GLU B 129 4.593 5.654 19.278 1.00 0.00 H new ATOM 0 HB2 GLU B 129 2.918 3.614 17.746 1.00 0.00 H new ATOM 0 HB3 GLU B 129 3.882 3.276 19.170 1.00 0.00 H new ATOM 0 HG2 GLU B 129 2.457 4.629 20.563 1.00 0.00 H new ATOM 0 HG3 GLU B 129 1.613 5.283 19.174 1.00 0.00 H new ATOM 2118 N LEU B 130 5.146 4.919 16.164 1.00 0.00 N ATOM 2119 CA LEU B 130 6.150 4.472 15.209 1.00 0.00 C ATOM 2120 C LEU B 130 7.096 5.612 14.837 1.00 0.00 C ATOM 2121 O LEU B 130 7.964 5.467 13.977 1.00 0.00 O ATOM 2122 CB LEU B 130 5.499 3.875 13.952 1.00 0.00 C ATOM 2123 CG LEU B 130 4.081 4.358 13.637 1.00 0.00 C ATOM 2124 CD1 LEU B 130 3.789 4.201 12.164 1.00 0.00 C ATOM 2125 CD2 LEU B 130 3.043 3.594 14.446 1.00 0.00 C ATOM 0 H LEU B 130 4.313 5.327 15.740 1.00 0.00 H new ATOM 0 HA LEU B 130 6.734 3.686 15.689 1.00 0.00 H new ATOM 0 HB2 LEU B 130 6.136 4.098 13.096 1.00 0.00 H new ATOM 0 HB3 LEU B 130 5.477 2.790 14.059 1.00 0.00 H new ATOM 0 HG LEU B 130 4.023 5.412 13.909 1.00 0.00 H new ATOM 0 HD11 LEU B 130 2.777 4.548 11.955 1.00 0.00 H new ATOM 0 HD12 LEU B 130 4.502 4.790 11.587 1.00 0.00 H new ATOM 0 HD13 LEU B 130 3.877 3.151 11.886 1.00 0.00 H new ATOM 0 HD21 LEU B 130 2.047 3.961 14.199 1.00 0.00 H new ATOM 0 HD22 LEU B 130 3.107 2.532 14.210 1.00 0.00 H new ATOM 0 HD23 LEU B 130 3.230 3.741 15.510 1.00 0.00 H new ATOM 2137 N TYR B 131 6.915 6.744 15.489 1.00 0.00 N ATOM 2138 CA TYR B 131 7.848 7.851 15.386 1.00 0.00 C ATOM 2139 C TYR B 131 8.230 8.266 16.794 1.00 0.00 C ATOM 2140 O TYR B 131 7.540 9.079 17.406 1.00 0.00 O ATOM 2141 CB TYR B 131 7.234 9.039 14.635 1.00 0.00 C ATOM 2142 CG TYR B 131 6.712 8.695 13.258 1.00 0.00 C ATOM 2143 CD1 TYR B 131 5.350 8.573 13.029 1.00 0.00 C ATOM 2144 CD2 TYR B 131 7.578 8.484 12.192 1.00 0.00 C ATOM 2145 CE1 TYR B 131 4.860 8.259 11.779 1.00 0.00 C ATOM 2146 CE2 TYR B 131 7.095 8.169 10.935 1.00 0.00 C ATOM 2147 CZ TYR B 131 5.735 8.056 10.735 1.00 0.00 C ATOM 2148 OH TYR B 131 5.247 7.746 9.484 1.00 0.00 O ATOM 0 H TYR B 131 6.120 6.923 16.103 1.00 0.00 H new ATOM 0 HA TYR B 131 8.725 7.535 14.821 1.00 0.00 H new ATOM 0 HB2 TYR B 131 6.417 9.448 15.230 1.00 0.00 H new ATOM 0 HB3 TYR B 131 7.985 9.824 14.542 1.00 0.00 H new ATOM 0 HD1 TYR B 131 4.660 8.727 13.845 1.00 0.00 H new ATOM 0 HD2 TYR B 131 8.644 8.567 12.347 1.00 0.00 H new ATOM 0 HE1 TYR B 131 3.795 8.173 11.619 1.00 0.00 H new ATOM 0 HE2 TYR B 131 7.779 8.012 10.114 1.00 0.00 H new ATOM 0 HH TYR B 131 5.994 7.636 8.860 1.00 0.00 H new