USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 962 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 94 SER OG : rot 89:sc= 0.557 USER MOD Set 1.2: B 100 HIS : no HD1:sc= 0 X(o=0.56,f=0.56) USER MOD Set 2.1: B 24 ASN :FLIP amide:sc= -1.32 X(o=-2.3,f=-2) USER MOD Set 2.2: B 30 GLN :FLIP amide:sc= -0.653 F(o=-3.9!,f=-2) USER MOD Single : B 10 SER OG : rot -55:sc= -0.972! USER MOD Single : B 16 HIS :FLIP no HD1:sc= 0 F(o=-0.65,f=0) USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 HIS :FLIP no HE2:sc= 0.398 F(o=-1.6,f=0.4) USER MOD Single : B 41 ASN :FLIP amide:sc= -0.0535 F(o=-2.9!,f=-0.054) USER MOD Single : B 42 THR OG1 : rot -66:sc= 1.25 USER MOD Single : B 46 THR OG1 : rot -169:sc= -0.768! USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -1.55! C(o=-1.5!,f=-6.4!) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 53 HIS : no HD1:sc= -0.0549 K(o=-0.055,f=-1.3) USER MOD Single : B 56 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 57 MET CE :methyl -164:sc= -0.188 (180deg=-0.633) USER MOD Single : B 62 SER OG : rot 180:sc= -0.215 USER MOD Single : B 64 LYS NZ :NH3+ 160:sc= 0.599 (180deg=-0.203!) USER MOD Single : B 77 THR OG1 : rot 180:sc= 0.493 USER MOD Single : B 80 GLN : amide:sc= -1.96 X(o=-2,f=-2.3) USER MOD Single : B 85 GLN : amide:sc= -1.41 X(o=-1.4,f=-1.4) USER MOD Single : B 102 MET CE :methyl -175:sc= -0.514 (180deg=-0.725) USER MOD Single : B 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 ASN : amide:sc= -0.0205 K(o=-0.02,f=-2.5!) USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00911) USER MOD Single : B 110 SER OG : rot 180:sc= 0 USER MOD Single : B 117 LYS NZ :NH3+ -176:sc= 1.22 (180deg=1.06) USER MOD Single : B 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 126 N TRP B 9 -22.113 9.332 5.173 1.00 0.00 N ATOM 127 CA TRP B 9 -21.989 8.185 6.065 1.00 0.00 C ATOM 128 C TRP B 9 -22.418 8.487 7.492 1.00 0.00 C ATOM 129 O TRP B 9 -22.344 9.626 7.962 1.00 0.00 O ATOM 130 CB TRP B 9 -20.553 7.662 6.070 1.00 0.00 C ATOM 131 CG TRP B 9 -20.169 7.001 4.789 1.00 0.00 C ATOM 132 CD1 TRP B 9 -19.508 7.568 3.743 1.00 0.00 C ATOM 133 CD2 TRP B 9 -20.440 5.648 4.410 1.00 0.00 C ATOM 134 NE1 TRP B 9 -19.346 6.648 2.737 1.00 0.00 N ATOM 135 CE2 TRP B 9 -19.914 5.465 3.126 1.00 0.00 C ATOM 136 CE3 TRP B 9 -21.075 4.571 5.031 1.00 0.00 C ATOM 137 CZ2 TRP B 9 -20.002 4.259 2.452 1.00 0.00 C ATOM 138 CZ3 TRP B 9 -21.164 3.368 4.355 1.00 0.00 C ATOM 139 CH2 TRP B 9 -20.629 3.224 3.076 1.00 0.00 C ATOM 0 HA TRP B 9 -22.666 7.425 5.675 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -19.871 8.490 6.264 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -20.433 6.952 6.889 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -19.162 8.591 3.709 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -18.879 6.818 1.846 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -21.490 4.676 6.023 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -19.586 4.143 1.462 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -21.655 2.528 4.825 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -20.713 2.273 2.570 1.00 0.00 H new ATOM 150 N SER B 10 -22.862 7.435 8.161 1.00 0.00 N ATOM 151 CA SER B 10 -23.223 7.480 9.566 1.00 0.00 C ATOM 152 C SER B 10 -22.475 6.372 10.323 1.00 0.00 C ATOM 153 O SER B 10 -21.957 5.446 9.698 1.00 0.00 O ATOM 154 CB SER B 10 -24.742 7.330 9.701 1.00 0.00 C ATOM 155 OG SER B 10 -25.234 6.317 8.836 1.00 0.00 O ATOM 0 H SER B 10 -22.983 6.515 7.737 1.00 0.00 H new ATOM 0 HA SER B 10 -22.935 8.437 10.002 1.00 0.00 H new ATOM 0 HB2 SER B 10 -24.996 7.087 10.733 1.00 0.00 H new ATOM 0 HB3 SER B 10 -25.226 8.278 9.468 1.00 0.00 H new ATOM 0 HG SER B 10 -24.959 6.511 7.916 1.00 0.00 H new ATOM 161 N PRO B 11 -22.395 6.454 11.669 1.00 0.00 N ATOM 162 CA PRO B 11 -21.626 5.494 12.487 1.00 0.00 C ATOM 163 C PRO B 11 -21.933 4.025 12.170 1.00 0.00 C ATOM 164 O PRO B 11 -21.026 3.248 11.863 1.00 0.00 O ATOM 165 CB PRO B 11 -22.061 5.828 13.915 1.00 0.00 C ATOM 166 CG PRO B 11 -22.432 7.267 13.865 1.00 0.00 C ATOM 167 CD PRO B 11 -23.031 7.493 12.505 1.00 0.00 C ATOM 0 HA PRO B 11 -20.556 5.589 12.303 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -22.904 5.212 14.227 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -21.255 5.651 14.627 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -23.145 7.514 14.651 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -21.558 7.901 14.017 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -24.116 7.386 12.522 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -22.815 8.495 12.133 1.00 0.00 H new ATOM 175 N GLU B 12 -23.209 3.656 12.244 1.00 0.00 N ATOM 176 CA GLU B 12 -23.640 2.279 11.983 1.00 0.00 C ATOM 177 C GLU B 12 -23.322 1.896 10.543 1.00 0.00 C ATOM 178 O GLU B 12 -22.884 0.784 10.259 1.00 0.00 O ATOM 179 CB GLU B 12 -25.152 2.163 12.237 1.00 0.00 C ATOM 180 CG GLU B 12 -25.679 0.745 12.429 1.00 0.00 C ATOM 181 CD GLU B 12 -25.600 -0.124 11.187 1.00 0.00 C ATOM 182 OE1 GLU B 12 -24.953 -1.190 11.249 1.00 0.00 O ATOM 183 OE2 GLU B 12 -26.193 0.243 10.150 1.00 0.00 O ATOM 0 H GLU B 12 -23.969 4.293 12.484 1.00 0.00 H new ATOM 0 HA GLU B 12 -23.108 1.601 12.650 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -25.400 2.747 13.123 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -25.679 2.617 11.398 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -25.116 0.266 13.230 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -26.717 0.797 12.756 1.00 0.00 H new ATOM 190 N GLU B 13 -23.512 2.852 9.657 1.00 0.00 N ATOM 191 CA GLU B 13 -23.396 2.635 8.227 1.00 0.00 C ATOM 192 C GLU B 13 -22.001 2.133 7.844 1.00 0.00 C ATOM 193 O GLU B 13 -21.868 1.192 7.061 1.00 0.00 O ATOM 194 CB GLU B 13 -23.719 3.943 7.523 1.00 0.00 C ATOM 195 CG GLU B 13 -24.171 3.797 6.086 1.00 0.00 C ATOM 196 CD GLU B 13 -24.686 5.110 5.539 1.00 0.00 C ATOM 197 OE1 GLU B 13 -24.455 6.152 6.188 1.00 0.00 O ATOM 198 OE2 GLU B 13 -25.341 5.104 4.476 1.00 0.00 O ATOM 0 H GLU B 13 -23.753 3.810 9.910 1.00 0.00 H new ATOM 0 HA GLU B 13 -24.098 1.861 7.918 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -24.499 4.458 8.084 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -22.835 4.580 7.548 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -23.340 3.446 5.474 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -24.954 3.042 6.023 1.00 0.00 H new ATOM 205 N GLU B 14 -20.963 2.745 8.409 1.00 0.00 N ATOM 206 CA GLU B 14 -19.594 2.323 8.125 1.00 0.00 C ATOM 207 C GLU B 14 -19.264 1.010 8.835 1.00 0.00 C ATOM 208 O GLU B 14 -18.403 0.250 8.387 1.00 0.00 O ATOM 209 CB GLU B 14 -18.590 3.411 8.512 1.00 0.00 C ATOM 210 CG GLU B 14 -18.763 4.695 7.719 1.00 0.00 C ATOM 211 CD GLU B 14 -17.597 5.648 7.882 1.00 0.00 C ATOM 212 OE1 GLU B 14 -17.496 6.300 8.943 1.00 0.00 O ATOM 213 OE2 GLU B 14 -16.778 5.761 6.946 1.00 0.00 O ATOM 0 H GLU B 14 -21.042 3.527 9.060 1.00 0.00 H new ATOM 0 HA GLU B 14 -19.517 2.157 7.051 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -18.694 3.631 9.574 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -17.579 3.033 8.362 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -18.882 4.451 6.663 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -19.680 5.192 8.037 1.00 0.00 H new ATOM 220 N ALA B 15 -19.959 0.737 9.931 1.00 0.00 N ATOM 221 CA ALA B 15 -19.811 -0.535 10.627 1.00 0.00 C ATOM 222 C ALA B 15 -20.419 -1.653 9.785 1.00 0.00 C ATOM 223 O ALA B 15 -19.878 -2.747 9.692 1.00 0.00 O ATOM 224 CB ALA B 15 -20.469 -0.468 11.999 1.00 0.00 C ATOM 0 H ALA B 15 -20.629 1.377 10.357 1.00 0.00 H new ATOM 0 HA ALA B 15 -18.751 -0.744 10.773 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -20.350 -1.425 12.507 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -19.998 0.317 12.590 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -21.530 -0.248 11.883 1.00 0.00 H new ATOM 230 N HIS B 16 -21.547 -1.343 9.169 1.00 0.00 N ATOM 231 CA HIS B 16 -22.224 -2.225 8.230 1.00 0.00 C ATOM 232 C HIS B 16 -21.380 -2.401 6.967 1.00 0.00 C ATOM 233 O HIS B 16 -21.472 -3.421 6.283 1.00 0.00 O ATOM 234 CB HIS B 16 -23.602 -1.640 7.878 1.00 0.00 C ATOM 235 CG HIS B 16 -24.488 -2.554 7.080 1.00 0.00 C ATOM 236 ND1 HIS B 16 -24.349 -3.856 6.735 1.00 0.00 N flip ATOM 237 CD2 HIS B 16 -25.692 -2.152 6.545 1.00 0.00 C flip ATOM 238 CE1 HIS B 16 -25.456 -4.210 6.010 1.00 0.00 C flip ATOM 239 NE2 HIS B 16 -26.249 -3.166 5.910 1.00 0.00 N flip ATOM 0 H HIS B 16 -22.028 -0.455 9.309 1.00 0.00 H new ATOM 0 HA HIS B 16 -22.360 -3.204 8.690 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -24.115 -1.375 8.802 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -23.457 -0.717 7.317 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -26.114 -1.162 6.632 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -25.646 -5.186 5.590 1.00 0.00 H new ATOM 0 HE2 HIS B 16 -27.145 -3.144 5.423 1.00 0.00 H new ATOM 248 N LEU B 17 -20.547 -1.410 6.674 1.00 0.00 N ATOM 249 CA LEU B 17 -19.686 -1.453 5.505 1.00 0.00 C ATOM 250 C LEU B 17 -18.674 -2.581 5.665 1.00 0.00 C ATOM 251 O LEU B 17 -18.503 -3.419 4.781 1.00 0.00 O ATOM 252 CB LEU B 17 -18.973 -0.110 5.334 1.00 0.00 C ATOM 253 CG LEU B 17 -18.160 0.058 4.052 1.00 0.00 C ATOM 254 CD1 LEU B 17 -19.063 0.014 2.831 1.00 0.00 C ATOM 255 CD2 LEU B 17 -17.383 1.358 4.093 1.00 0.00 C ATOM 0 H LEU B 17 -20.451 -0.564 7.235 1.00 0.00 H new ATOM 0 HA LEU B 17 -20.286 -1.640 4.614 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -19.720 0.683 5.374 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -18.307 0.036 6.185 1.00 0.00 H new ATOM 0 HG LEU B 17 -17.454 -0.769 3.980 1.00 0.00 H new ATOM 0 HD11 LEU B 17 -18.462 0.136 1.930 1.00 0.00 H new ATOM 0 HD12 LEU B 17 -19.580 -0.945 2.796 1.00 0.00 H new ATOM 0 HD13 LEU B 17 -19.795 0.819 2.891 1.00 0.00 H new ATOM 0 HD21 LEU B 17 -16.807 1.467 3.174 1.00 0.00 H new ATOM 0 HD22 LEU B 17 -18.077 2.194 4.188 1.00 0.00 H new ATOM 0 HD23 LEU B 17 -16.705 1.350 4.947 1.00 0.00 H new ATOM 267 N ARG B 18 -18.032 -2.617 6.827 1.00 0.00 N ATOM 268 CA ARG B 18 -17.105 -3.681 7.140 1.00 0.00 C ATOM 269 C ARG B 18 -17.878 -4.939 7.477 1.00 0.00 C ATOM 270 O ARG B 18 -17.420 -6.041 7.211 1.00 0.00 O ATOM 271 CB ARG B 18 -16.185 -3.286 8.298 1.00 0.00 C ATOM 272 CG ARG B 18 -16.908 -2.976 9.595 1.00 0.00 C ATOM 273 CD ARG B 18 -15.943 -2.497 10.664 1.00 0.00 C ATOM 274 NE ARG B 18 -16.606 -2.262 11.943 1.00 0.00 N ATOM 275 CZ ARG B 18 -16.041 -1.615 12.960 1.00 0.00 C ATOM 276 NH1 ARG B 18 -14.824 -1.099 12.832 1.00 0.00 N ATOM 277 NH2 ARG B 18 -16.698 -1.479 14.102 1.00 0.00 N ATOM 0 H ARG B 18 -18.141 -1.919 7.563 1.00 0.00 H new ATOM 0 HA ARG B 18 -16.476 -3.868 6.269 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -15.477 -4.095 8.476 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -15.604 -2.413 8.003 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -17.666 -2.213 9.418 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -17.429 -3.867 9.945 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -15.154 -3.238 10.797 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -15.463 -1.577 10.331 1.00 0.00 H new ATOM 0 HE ARG B 18 -17.556 -2.613 12.064 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -14.318 -1.198 11.952 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -14.395 -0.604 13.614 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -17.635 -1.870 14.201 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -16.267 -0.984 14.883 1.00 0.00 H new ATOM 291 N GLU B 19 -19.071 -4.753 8.037 1.00 0.00 N ATOM 292 CA GLU B 19 -19.937 -5.861 8.401 1.00 0.00 C ATOM 293 C GLU B 19 -20.118 -6.803 7.213 1.00 0.00 C ATOM 294 O GLU B 19 -19.861 -8.009 7.292 1.00 0.00 O ATOM 295 CB GLU B 19 -21.299 -5.342 8.852 1.00 0.00 C ATOM 296 CG GLU B 19 -22.216 -6.425 9.386 1.00 0.00 C ATOM 297 CD GLU B 19 -21.657 -7.104 10.623 1.00 0.00 C ATOM 298 OE1 GLU B 19 -21.013 -8.167 10.493 1.00 0.00 O ATOM 299 OE2 GLU B 19 -21.850 -6.567 11.734 1.00 0.00 O ATOM 0 H GLU B 19 -19.459 -3.834 8.248 1.00 0.00 H new ATOM 0 HA GLU B 19 -19.472 -6.406 9.223 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -21.153 -4.588 9.625 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -21.786 -4.847 8.012 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -23.187 -5.990 9.622 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -22.381 -7.172 8.609 1.00 0.00 H new ATOM 306 N LEU B 20 -20.531 -6.219 6.098 1.00 0.00 N ATOM 307 CA LEU B 20 -20.798 -6.965 4.881 1.00 0.00 C ATOM 308 C LEU B 20 -19.510 -7.507 4.268 1.00 0.00 C ATOM 309 O LEU B 20 -19.509 -8.573 3.643 1.00 0.00 O ATOM 310 CB LEU B 20 -21.524 -6.061 3.889 1.00 0.00 C ATOM 311 CG LEU B 20 -22.898 -6.557 3.451 1.00 0.00 C ATOM 312 CD1 LEU B 20 -23.693 -5.431 2.817 1.00 0.00 C ATOM 313 CD2 LEU B 20 -22.754 -7.720 2.483 1.00 0.00 C ATOM 0 H LEU B 20 -20.690 -5.215 6.013 1.00 0.00 H new ATOM 0 HA LEU B 20 -21.427 -7.821 5.125 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -21.636 -5.073 4.336 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -20.899 -5.941 3.004 1.00 0.00 H new ATOM 0 HG LEU B 20 -23.439 -6.904 4.331 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -24.671 -5.803 2.511 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -23.822 -4.625 3.539 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -23.159 -5.054 1.945 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -23.742 -8.064 2.178 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -22.196 -7.395 1.605 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -22.220 -8.536 2.971 1.00 0.00 H new ATOM 325 N TYR B 21 -18.413 -6.780 4.461 1.00 0.00 N ATOM 326 CA TYR B 21 -17.119 -7.199 3.945 1.00 0.00 C ATOM 327 C TYR B 21 -16.645 -8.442 4.670 1.00 0.00 C ATOM 328 O TYR B 21 -16.265 -9.429 4.046 1.00 0.00 O ATOM 329 CB TYR B 21 -16.082 -6.085 4.102 1.00 0.00 C ATOM 330 CG TYR B 21 -14.673 -6.522 3.769 1.00 0.00 C ATOM 331 CD1 TYR B 21 -13.703 -6.602 4.755 1.00 0.00 C ATOM 332 CD2 TYR B 21 -14.318 -6.866 2.471 1.00 0.00 C ATOM 333 CE1 TYR B 21 -12.419 -7.010 4.464 1.00 0.00 C ATOM 334 CE2 TYR B 21 -13.033 -7.276 2.170 1.00 0.00 C ATOM 335 CZ TYR B 21 -12.086 -7.344 3.172 1.00 0.00 C ATOM 336 OH TYR B 21 -10.807 -7.756 2.884 1.00 0.00 O ATOM 0 H TYR B 21 -18.397 -5.897 4.972 1.00 0.00 H new ATOM 0 HA TYR B 21 -17.234 -7.421 2.884 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -16.357 -5.250 3.458 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -16.107 -5.718 5.128 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -13.958 -6.340 5.771 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -15.057 -6.812 1.685 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -11.678 -7.067 5.247 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -12.771 -7.542 1.156 1.00 0.00 H new ATOM 0 HH TYR B 21 -10.735 -7.956 1.927 1.00 0.00 H new ATOM 346 N LEU B 22 -16.695 -8.382 5.992 1.00 0.00 N ATOM 347 CA LEU B 22 -16.250 -9.480 6.838 1.00 0.00 C ATOM 348 C LEU B 22 -17.016 -10.766 6.523 1.00 0.00 C ATOM 349 O LEU B 22 -16.520 -11.868 6.754 1.00 0.00 O ATOM 350 CB LEU B 22 -16.426 -9.111 8.313 1.00 0.00 C ATOM 351 CG LEU B 22 -15.789 -7.784 8.745 1.00 0.00 C ATOM 352 CD1 LEU B 22 -15.974 -7.556 10.237 1.00 0.00 C ATOM 353 CD2 LEU B 22 -14.316 -7.732 8.378 1.00 0.00 C ATOM 0 H LEU B 22 -17.044 -7.574 6.508 1.00 0.00 H new ATOM 0 HA LEU B 22 -15.194 -9.657 6.636 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -17.493 -9.070 8.534 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.005 -9.911 8.922 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.298 -6.984 8.207 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -15.514 -6.609 10.520 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.038 -7.527 10.471 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.502 -8.368 10.790 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -13.895 -6.779 8.698 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -13.788 -8.547 8.874 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -14.206 -7.833 7.298 1.00 0.00 H new ATOM 365 N ALA B 23 -18.222 -10.618 5.989 1.00 0.00 N ATOM 366 CA ALA B 23 -19.036 -11.768 5.613 1.00 0.00 C ATOM 367 C ALA B 23 -18.607 -12.352 4.266 1.00 0.00 C ATOM 368 O ALA B 23 -18.337 -13.547 4.151 1.00 0.00 O ATOM 369 CB ALA B 23 -20.504 -11.377 5.562 1.00 0.00 C ATOM 0 H ALA B 23 -18.658 -9.714 5.807 1.00 0.00 H new ATOM 0 HA ALA B 23 -18.889 -12.536 6.372 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -21.102 -12.244 5.280 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -20.820 -11.021 6.543 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -20.644 -10.585 4.826 1.00 0.00 H new ATOM 375 N ASN B 24 -18.528 -11.500 3.250 1.00 0.00 N ATOM 376 CA ASN B 24 -18.342 -11.966 1.879 1.00 0.00 C ATOM 377 C ASN B 24 -16.875 -12.073 1.480 1.00 0.00 C ATOM 378 O ASN B 24 -16.568 -12.532 0.381 1.00 0.00 O ATOM 379 CB ASN B 24 -19.072 -11.044 0.905 1.00 0.00 C ATOM 380 CG ASN B 24 -20.574 -11.229 0.945 1.00 0.00 C ATOM 381 OD1 ASN B 24 -21.243 -10.465 1.792 1.00 0.00 O flip ATOM 382 ND2 ASN B 24 -21.130 -12.044 0.209 1.00 0.00 N flip ATOM 0 H ASN B 24 -18.589 -10.487 3.348 1.00 0.00 H new ATOM 0 HA ASN B 24 -18.763 -12.971 1.833 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -18.831 -10.008 1.141 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -18.713 -11.232 -0.107 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -20.577 -12.614 -0.430 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -22.144 -12.149 0.239 1.00 0.00 H new ATOM 389 N LYS B 25 -15.971 -11.661 2.363 1.00 0.00 N ATOM 390 CA LYS B 25 -14.537 -11.750 2.078 1.00 0.00 C ATOM 391 C LYS B 25 -14.112 -13.206 1.904 1.00 0.00 C ATOM 392 O LYS B 25 -13.117 -13.504 1.243 1.00 0.00 O ATOM 393 CB LYS B 25 -13.712 -11.111 3.199 1.00 0.00 C ATOM 394 CG LYS B 25 -13.953 -11.732 4.567 1.00 0.00 C ATOM 395 CD LYS B 25 -12.906 -11.299 5.582 1.00 0.00 C ATOM 396 CE LYS B 25 -11.535 -11.876 5.256 1.00 0.00 C ATOM 397 NZ LYS B 25 -10.539 -11.583 6.319 1.00 0.00 N ATOM 0 H LYS B 25 -16.199 -11.265 3.275 1.00 0.00 H new ATOM 0 HA LYS B 25 -14.352 -11.207 1.151 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -12.654 -11.196 2.953 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -13.944 -10.047 3.247 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -14.943 -11.449 4.924 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -13.945 -12.818 4.479 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -12.847 -10.211 5.603 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -13.209 -11.621 6.578 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -11.618 -12.955 5.125 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -11.185 -11.466 4.309 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -9.620 -11.994 6.057 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -10.440 -10.553 6.427 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -10.859 -11.997 7.218 1.00 0.00 H new ATOM 411 N ASP B 26 -14.887 -14.101 2.498 1.00 0.00 N ATOM 412 CA ASP B 26 -14.591 -15.527 2.472 1.00 0.00 C ATOM 413 C ASP B 26 -14.912 -16.128 1.107 1.00 0.00 C ATOM 414 O ASP B 26 -14.356 -17.158 0.720 1.00 0.00 O ATOM 415 CB ASP B 26 -15.386 -16.237 3.572 1.00 0.00 C ATOM 416 CG ASP B 26 -15.280 -17.746 3.499 1.00 0.00 C ATOM 417 OD1 ASP B 26 -14.206 -18.288 3.832 1.00 0.00 O ATOM 418 OD2 ASP B 26 -16.279 -18.392 3.121 1.00 0.00 O ATOM 0 H ASP B 26 -15.736 -13.861 3.010 1.00 0.00 H new ATOM 0 HA ASP B 26 -13.525 -15.666 2.653 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -15.030 -15.900 4.545 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -16.434 -15.948 3.499 1.00 0.00 H new ATOM 423 N VAL B 27 -15.788 -15.465 0.367 1.00 0.00 N ATOM 424 CA VAL B 27 -16.224 -15.964 -0.926 1.00 0.00 C ATOM 425 C VAL B 27 -15.166 -15.666 -1.979 1.00 0.00 C ATOM 426 O VAL B 27 -14.982 -14.515 -2.381 1.00 0.00 O ATOM 427 CB VAL B 27 -17.565 -15.334 -1.352 1.00 0.00 C ATOM 428 CG1 VAL B 27 -18.124 -16.033 -2.584 1.00 0.00 C ATOM 429 CG2 VAL B 27 -18.564 -15.372 -0.203 1.00 0.00 C ATOM 0 H VAL B 27 -16.211 -14.578 0.642 1.00 0.00 H new ATOM 0 HA VAL B 27 -16.366 -17.041 -0.837 1.00 0.00 H new ATOM 0 HB VAL B 27 -17.386 -14.291 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -19.070 -15.572 -2.866 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -17.416 -15.941 -3.407 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -18.287 -17.088 -2.362 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -19.504 -14.923 -0.523 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -18.738 -16.406 0.093 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -18.165 -14.814 0.644 1.00 0.00 H new ATOM 439 N GLU B 28 -14.467 -16.700 -2.413 1.00 0.00 N ATOM 440 CA GLU B 28 -13.386 -16.544 -3.373 1.00 0.00 C ATOM 441 C GLU B 28 -13.927 -16.592 -4.790 1.00 0.00 C ATOM 442 O GLU B 28 -14.824 -17.375 -5.094 1.00 0.00 O ATOM 443 CB GLU B 28 -12.337 -17.634 -3.169 1.00 0.00 C ATOM 444 CG GLU B 28 -11.761 -17.656 -1.764 1.00 0.00 C ATOM 445 CD GLU B 28 -10.753 -18.768 -1.569 1.00 0.00 C ATOM 446 OE1 GLU B 28 -9.568 -18.464 -1.320 1.00 0.00 O ATOM 447 OE2 GLU B 28 -11.138 -19.951 -1.668 1.00 0.00 O ATOM 0 H GLU B 28 -14.629 -17.662 -2.115 1.00 0.00 H new ATOM 0 HA GLU B 28 -12.916 -15.573 -3.214 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -12.784 -18.604 -3.387 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -11.527 -17.488 -3.884 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -11.285 -16.698 -1.555 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -12.571 -17.774 -1.044 1.00 0.00 H new ATOM 454 N GLY B 29 -13.395 -15.737 -5.648 1.00 0.00 N ATOM 455 CA GLY B 29 -13.863 -15.671 -7.018 1.00 0.00 C ATOM 456 C GLY B 29 -15.006 -14.693 -7.168 1.00 0.00 C ATOM 457 O GLY B 29 -15.538 -14.501 -8.266 1.00 0.00 O ATOM 0 H GLY B 29 -12.645 -15.085 -5.420 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -13.041 -15.374 -7.670 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -14.185 -16.661 -7.341 1.00 0.00 H new ATOM 461 N GLN B 30 -15.386 -14.072 -6.060 1.00 0.00 N ATOM 462 CA GLN B 30 -16.450 -13.086 -6.066 1.00 0.00 C ATOM 463 C GLN B 30 -15.899 -11.685 -5.865 1.00 0.00 C ATOM 464 O GLN B 30 -14.915 -11.483 -5.148 1.00 0.00 O ATOM 465 CB GLN B 30 -17.485 -13.370 -4.972 1.00 0.00 C ATOM 466 CG GLN B 30 -18.525 -12.264 -4.856 1.00 0.00 C ATOM 467 CD GLN B 30 -19.425 -12.403 -3.655 1.00 0.00 C ATOM 468 OE1 GLN B 30 -19.045 -11.761 -2.565 1.00 0.00 O flip ATOM 469 NE2 GLN B 30 -20.460 -13.059 -3.706 1.00 0.00 N flip ATOM 0 H GLN B 30 -14.969 -14.237 -5.144 1.00 0.00 H new ATOM 0 HA GLN B 30 -16.933 -13.152 -7.041 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -17.985 -14.315 -5.185 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -16.976 -13.488 -4.016 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -18.015 -11.302 -4.808 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -19.136 -12.256 -5.758 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -20.717 -13.540 -4.568 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -21.064 -13.124 -2.886 1.00 0.00 H new ATOM 478 N ASP B 31 -16.536 -10.726 -6.517 1.00 0.00 N ATOM 479 CA ASP B 31 -16.316 -9.321 -6.234 1.00 0.00 C ATOM 480 C ASP B 31 -16.888 -9.009 -4.857 1.00 0.00 C ATOM 481 O ASP B 31 -18.109 -8.911 -4.698 1.00 0.00 O ATOM 482 CB ASP B 31 -17.036 -8.468 -7.266 1.00 0.00 C ATOM 483 CG ASP B 31 -16.537 -7.038 -7.302 1.00 0.00 C ATOM 484 OD1 ASP B 31 -16.869 -6.269 -6.382 1.00 0.00 O ATOM 485 OD2 ASP B 31 -15.821 -6.676 -8.269 1.00 0.00 O ATOM 0 H ASP B 31 -17.218 -10.901 -7.255 1.00 0.00 H new ATOM 0 HA ASP B 31 -15.248 -9.104 -6.266 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -16.910 -8.916 -8.252 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -18.104 -8.469 -7.049 1.00 0.00 H new ATOM 490 N VAL B 32 -16.032 -8.891 -3.857 1.00 0.00 N ATOM 491 CA VAL B 32 -16.505 -8.662 -2.498 1.00 0.00 C ATOM 492 C VAL B 32 -17.075 -7.251 -2.360 1.00 0.00 C ATOM 493 O VAL B 32 -17.946 -7.004 -1.530 1.00 0.00 O ATOM 494 CB VAL B 32 -15.391 -8.871 -1.453 1.00 0.00 C ATOM 495 CG1 VAL B 32 -14.364 -7.765 -1.549 1.00 0.00 C ATOM 496 CG2 VAL B 32 -15.974 -8.953 -0.050 1.00 0.00 C ATOM 0 H VAL B 32 -15.018 -8.949 -3.955 1.00 0.00 H new ATOM 0 HA VAL B 32 -17.289 -9.395 -2.307 1.00 0.00 H new ATOM 0 HB VAL B 32 -14.894 -9.818 -1.664 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -13.584 -7.927 -0.805 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -13.921 -7.765 -2.545 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -14.846 -6.804 -1.367 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -15.169 -9.101 0.670 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -16.501 -8.027 0.180 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -16.670 -9.790 0.007 1.00 0.00 H new ATOM 506 N VAL B 33 -16.593 -6.335 -3.195 1.00 0.00 N ATOM 507 CA VAL B 33 -17.051 -4.956 -3.148 1.00 0.00 C ATOM 508 C VAL B 33 -18.521 -4.898 -3.493 1.00 0.00 C ATOM 509 O VAL B 33 -19.314 -4.324 -2.751 1.00 0.00 O ATOM 510 CB VAL B 33 -16.303 -4.043 -4.130 1.00 0.00 C ATOM 511 CG1 VAL B 33 -16.132 -2.651 -3.551 1.00 0.00 C ATOM 512 CG2 VAL B 33 -14.979 -4.652 -4.548 1.00 0.00 C ATOM 0 H VAL B 33 -15.889 -6.524 -3.908 1.00 0.00 H new ATOM 0 HA VAL B 33 -16.859 -4.601 -2.135 1.00 0.00 H new ATOM 0 HB VAL B 33 -16.907 -3.947 -5.032 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -15.599 -2.023 -4.265 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -17.112 -2.219 -3.348 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -15.562 -2.710 -2.624 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -14.474 -3.982 -5.243 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -14.353 -4.801 -3.668 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -15.157 -5.611 -5.034 1.00 0.00 H new ATOM 522 N GLU B 34 -18.879 -5.507 -4.621 1.00 0.00 N ATOM 523 CA GLU B 34 -20.267 -5.561 -5.046 1.00 0.00 C ATOM 524 C GLU B 34 -21.121 -6.271 -4.014 1.00 0.00 C ATOM 525 O GLU B 34 -22.273 -5.913 -3.810 1.00 0.00 O ATOM 526 CB GLU B 34 -20.409 -6.233 -6.409 1.00 0.00 C ATOM 527 CG GLU B 34 -19.931 -5.359 -7.553 1.00 0.00 C ATOM 528 CD GLU B 34 -20.302 -5.916 -8.906 1.00 0.00 C ATOM 529 OE1 GLU B 34 -19.389 -6.257 -9.684 1.00 0.00 O ATOM 530 OE2 GLU B 34 -21.513 -6.012 -9.202 1.00 0.00 O ATOM 0 H GLU B 34 -18.225 -5.968 -5.253 1.00 0.00 H new ATOM 0 HA GLU B 34 -20.620 -4.534 -5.141 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.843 -7.164 -6.410 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -21.454 -6.495 -6.572 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.358 -4.362 -7.446 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -18.848 -5.250 -7.494 1.00 0.00 H new ATOM 537 N ALA B 35 -20.550 -7.257 -3.344 1.00 0.00 N ATOM 538 CA ALA B 35 -21.244 -7.916 -2.253 1.00 0.00 C ATOM 539 C ALA B 35 -21.637 -6.891 -1.197 1.00 0.00 C ATOM 540 O ALA B 35 -22.769 -6.860 -0.726 1.00 0.00 O ATOM 541 CB ALA B 35 -20.368 -8.990 -1.641 1.00 0.00 C ATOM 0 H ALA B 35 -19.615 -7.616 -3.535 1.00 0.00 H new ATOM 0 HA ALA B 35 -22.146 -8.388 -2.643 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -20.903 -9.474 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -20.117 -9.731 -2.400 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -19.453 -8.538 -1.258 1.00 0.00 H new ATOM 547 N ILE B 36 -20.698 -6.032 -0.858 1.00 0.00 N ATOM 548 CA ILE B 36 -20.929 -5.001 0.136 1.00 0.00 C ATOM 549 C ILE B 36 -21.875 -3.929 -0.391 1.00 0.00 C ATOM 550 O ILE B 36 -22.994 -3.771 0.100 1.00 0.00 O ATOM 551 CB ILE B 36 -19.609 -4.322 0.537 1.00 0.00 C ATOM 552 CG1 ILE B 36 -18.591 -5.362 0.987 1.00 0.00 C ATOM 553 CG2 ILE B 36 -19.850 -3.304 1.640 1.00 0.00 C ATOM 554 CD1 ILE B 36 -17.169 -4.854 0.962 1.00 0.00 C ATOM 0 H ILE B 36 -19.760 -6.027 -1.259 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.375 -5.489 1.002 1.00 0.00 H new ATOM 0 HB ILE B 36 -19.210 -3.801 -0.333 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -18.836 -5.687 1.998 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -18.668 -6.238 0.343 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -18.906 -2.832 1.912 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -20.547 -2.544 1.287 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -20.270 -3.805 2.512 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -16.495 -5.644 1.294 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -16.907 -4.556 -0.053 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -17.078 -3.996 1.627 1.00 0.00 H new ATOM 566 N LEU B 37 -21.428 -3.225 -1.423 1.00 0.00 N ATOM 567 CA LEU B 37 -22.119 -2.025 -1.892 1.00 0.00 C ATOM 568 C LEU B 37 -23.507 -2.313 -2.457 1.00 0.00 C ATOM 569 O LEU B 37 -24.362 -1.431 -2.480 1.00 0.00 O ATOM 570 CB LEU B 37 -21.254 -1.253 -2.908 1.00 0.00 C ATOM 571 CG LEU B 37 -20.601 -2.057 -4.051 1.00 0.00 C ATOM 572 CD1 LEU B 37 -21.639 -2.525 -5.056 1.00 0.00 C ATOM 573 CD2 LEU B 37 -19.546 -1.223 -4.764 1.00 0.00 C ATOM 0 H LEU B 37 -20.590 -3.462 -1.953 1.00 0.00 H new ATOM 0 HA LEU B 37 -22.273 -1.396 -1.015 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -21.875 -0.477 -3.356 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -20.460 -0.748 -2.357 1.00 0.00 H new ATOM 0 HG LEU B 37 -20.126 -2.931 -3.604 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -21.149 -3.089 -5.850 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -22.368 -3.162 -4.556 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -22.146 -1.661 -5.485 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -19.099 -1.810 -5.566 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -20.010 -0.330 -5.183 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -18.772 -0.930 -4.054 1.00 0.00 H new ATOM 585 N ALA B 38 -23.735 -3.534 -2.910 1.00 0.00 N ATOM 586 CA ALA B 38 -25.018 -3.887 -3.500 1.00 0.00 C ATOM 587 C ALA B 38 -26.009 -4.389 -2.458 1.00 0.00 C ATOM 588 O ALA B 38 -27.213 -4.158 -2.586 1.00 0.00 O ATOM 589 CB ALA B 38 -24.839 -4.920 -4.595 1.00 0.00 C ATOM 0 H ALA B 38 -23.055 -4.294 -2.882 1.00 0.00 H new ATOM 0 HA ALA B 38 -25.431 -2.977 -3.935 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -25.810 -5.169 -5.022 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -24.193 -4.516 -5.374 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -24.385 -5.818 -4.177 1.00 0.00 H new ATOM 595 N HIS B 39 -25.516 -5.069 -1.425 1.00 0.00 N ATOM 596 CA HIS B 39 -26.409 -5.635 -0.418 1.00 0.00 C ATOM 597 C HIS B 39 -26.935 -4.552 0.513 1.00 0.00 C ATOM 598 O HIS B 39 -28.048 -4.656 1.026 1.00 0.00 O ATOM 599 CB HIS B 39 -25.737 -6.753 0.384 1.00 0.00 C ATOM 600 CG HIS B 39 -25.764 -8.089 -0.302 1.00 0.00 C ATOM 601 ND1 HIS B 39 -24.906 -8.653 -1.180 1.00 0.00 N flip ATOM 602 CD2 HIS B 39 -26.765 -9.016 -0.105 1.00 0.00 C flip ATOM 603 CE1 HIS B 39 -25.396 -9.894 -1.499 1.00 0.00 C flip ATOM 604 NE2 HIS B 39 -26.518 -10.089 -0.836 1.00 0.00 N flip ATOM 0 H HIS B 39 -24.523 -5.239 -1.265 1.00 0.00 H new ATOM 0 HA HIS B 39 -27.251 -6.076 -0.951 1.00 0.00 H new ATOM 0 HB2 HIS B 39 -24.701 -6.476 0.579 1.00 0.00 H new ATOM 0 HB3 HIS B 39 -26.231 -6.841 1.352 1.00 0.00 H new ATOM 0 HD1 HIS B 39 -24.049 -8.232 -1.540 1.00 0.00 H new ATOM 0 HD2 HIS B 39 -27.618 -8.886 0.545 1.00 0.00 H new ATOM 0 HE1 HIS B 39 -24.938 -10.595 -2.181 1.00 0.00 H new ATOM 613 N LEU B 40 -26.152 -3.501 0.722 1.00 0.00 N ATOM 614 CA LEU B 40 -26.644 -2.359 1.470 1.00 0.00 C ATOM 615 C LEU B 40 -27.134 -1.270 0.520 1.00 0.00 C ATOM 616 O LEU B 40 -26.436 -0.874 -0.409 1.00 0.00 O ATOM 617 CB LEU B 40 -25.601 -1.822 2.477 1.00 0.00 C ATOM 618 CG LEU B 40 -24.142 -1.684 1.997 1.00 0.00 C ATOM 619 CD1 LEU B 40 -23.948 -0.467 1.103 1.00 0.00 C ATOM 620 CD2 LEU B 40 -23.202 -1.598 3.191 1.00 0.00 C ATOM 0 H LEU B 40 -25.191 -3.418 0.390 1.00 0.00 H new ATOM 0 HA LEU B 40 -27.492 -2.695 2.066 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -25.936 -0.842 2.815 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -25.607 -2.479 3.347 1.00 0.00 H new ATOM 0 HG LEU B 40 -23.909 -2.571 1.408 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -22.906 -0.409 0.788 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -24.588 -0.555 0.225 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -24.211 0.435 1.655 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -22.175 -1.501 2.839 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -23.462 -0.730 3.797 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -23.295 -2.502 3.793 1.00 0.00 H new ATOM 632 N ASN B 41 -28.358 -0.821 0.732 1.00 0.00 N ATOM 633 CA ASN B 41 -28.915 0.260 -0.074 1.00 0.00 C ATOM 634 C ASN B 41 -29.032 1.516 0.778 1.00 0.00 C ATOM 635 O ASN B 41 -29.947 2.324 0.621 1.00 0.00 O ATOM 636 CB ASN B 41 -30.284 -0.128 -0.670 1.00 0.00 C ATOM 637 CG ASN B 41 -31.445 -0.137 0.327 1.00 0.00 C ATOM 638 OD1 ASN B 41 -31.192 -0.519 1.568 1.00 0.00 O flip ATOM 639 ND2 ASN B 41 -32.575 0.194 -0.030 1.00 0.00 N flip ATOM 0 H ASN B 41 -28.985 -1.183 1.450 1.00 0.00 H new ATOM 0 HA ASN B 41 -28.244 0.453 -0.911 1.00 0.00 H new ATOM 0 HB2 ASN B 41 -30.522 0.566 -1.476 1.00 0.00 H new ATOM 0 HB3 ASN B 41 -30.201 -1.119 -1.117 1.00 0.00 H new ATOM 0 HD21 ASN B 41 -32.741 0.484 -0.994 1.00 0.00 H new ATOM 0 HD22 ASN B 41 -33.346 0.178 0.638 1.00 0.00 H new ATOM 646 N THR B 42 -28.049 1.698 1.640 1.00 0.00 N ATOM 647 CA THR B 42 -28.049 2.807 2.572 1.00 0.00 C ATOM 648 C THR B 42 -27.391 4.037 1.952 1.00 0.00 C ATOM 649 O THR B 42 -27.804 5.168 2.204 1.00 0.00 O ATOM 650 CB THR B 42 -27.336 2.421 3.891 1.00 0.00 C ATOM 651 OG1 THR B 42 -27.389 3.506 4.824 1.00 0.00 O ATOM 652 CG2 THR B 42 -25.882 2.025 3.639 1.00 0.00 C ATOM 0 H THR B 42 -27.236 1.087 1.713 1.00 0.00 H new ATOM 0 HA THR B 42 -29.086 3.050 2.802 1.00 0.00 H new ATOM 0 HB THR B 42 -27.858 1.561 4.311 1.00 0.00 H new ATOM 0 HG1 THR B 42 -26.859 4.256 4.483 1.00 0.00 H new ATOM 0 HG21 THR B 42 -25.408 1.759 4.584 1.00 0.00 H new ATOM 0 HG22 THR B 42 -25.850 1.170 2.964 1.00 0.00 H new ATOM 0 HG23 THR B 42 -25.349 2.863 3.189 1.00 0.00 H new ATOM 660 N VAL B 43 -26.389 3.811 1.112 1.00 0.00 N ATOM 661 CA VAL B 43 -25.644 4.906 0.519 1.00 0.00 C ATOM 662 C VAL B 43 -25.253 4.582 -0.926 1.00 0.00 C ATOM 663 O VAL B 43 -24.828 3.464 -1.229 1.00 0.00 O ATOM 664 CB VAL B 43 -24.375 5.232 1.348 1.00 0.00 C ATOM 665 CG1 VAL B 43 -23.397 4.069 1.344 1.00 0.00 C ATOM 666 CG2 VAL B 43 -23.723 6.508 0.854 1.00 0.00 C ATOM 0 H VAL B 43 -26.077 2.882 0.829 1.00 0.00 H new ATOM 0 HA VAL B 43 -26.293 5.782 0.519 1.00 0.00 H new ATOM 0 HB VAL B 43 -24.681 5.392 2.382 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -22.519 4.330 1.934 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -23.875 3.190 1.775 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -23.094 3.852 0.320 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -22.835 6.717 1.450 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -23.439 6.390 -0.192 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -24.426 7.336 0.948 1.00 0.00 H new ATOM 676 N PRO B 44 -25.447 5.535 -1.849 1.00 0.00 N ATOM 677 CA PRO B 44 -24.955 5.418 -3.222 1.00 0.00 C ATOM 678 C PRO B 44 -23.447 5.668 -3.287 1.00 0.00 C ATOM 679 O PRO B 44 -22.969 6.721 -2.867 1.00 0.00 O ATOM 680 CB PRO B 44 -25.715 6.513 -3.982 1.00 0.00 C ATOM 681 CG PRO B 44 -26.708 7.079 -3.018 1.00 0.00 C ATOM 682 CD PRO B 44 -26.178 6.790 -1.647 1.00 0.00 C ATOM 0 HA PRO B 44 -25.115 4.423 -3.638 1.00 0.00 H new ATOM 0 HB2 PRO B 44 -25.033 7.286 -4.336 1.00 0.00 H new ATOM 0 HB3 PRO B 44 -26.215 6.102 -4.859 1.00 0.00 H new ATOM 0 HG2 PRO B 44 -26.829 8.152 -3.170 1.00 0.00 H new ATOM 0 HG3 PRO B 44 -27.689 6.625 -3.159 1.00 0.00 H new ATOM 0 HD2 PRO B 44 -25.526 7.586 -1.287 1.00 0.00 H new ATOM 0 HD3 PRO B 44 -26.980 6.680 -0.917 1.00 0.00 H new ATOM 690 N ARG B 45 -22.690 4.696 -3.778 1.00 0.00 N ATOM 691 CA ARG B 45 -21.239 4.826 -3.828 1.00 0.00 C ATOM 692 C ARG B 45 -20.687 4.398 -5.166 1.00 0.00 C ATOM 693 O ARG B 45 -21.412 3.963 -6.057 1.00 0.00 O ATOM 694 CB ARG B 45 -20.544 3.961 -2.783 1.00 0.00 C ATOM 695 CG ARG B 45 -21.139 4.026 -1.401 1.00 0.00 C ATOM 696 CD ARG B 45 -20.996 5.389 -0.753 1.00 0.00 C ATOM 697 NE ARG B 45 -19.641 5.951 -0.703 1.00 0.00 N ATOM 698 CZ ARG B 45 -18.540 5.370 -0.192 1.00 0.00 C ATOM 699 NH1 ARG B 45 -18.484 4.066 0.036 1.00 0.00 N ATOM 700 NH2 ARG B 45 -17.460 6.112 0.048 1.00 0.00 N ATOM 0 H ARG B 45 -23.052 3.816 -4.145 1.00 0.00 H new ATOM 0 HA ARG B 45 -21.044 5.882 -3.641 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -20.562 2.925 -3.121 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -19.497 4.259 -2.725 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -22.196 3.766 -1.455 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -20.658 3.279 -0.770 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -21.637 6.090 -1.288 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -21.376 5.324 0.266 1.00 0.00 H new ATOM 0 HE ARG B 45 -19.521 6.883 -1.099 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -19.288 3.476 -0.177 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -17.636 3.652 0.424 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -17.472 7.111 -0.155 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -16.621 5.681 0.435 1.00 0.00 H new ATOM 714 N THR B 46 -19.383 4.545 -5.271 1.00 0.00 N ATOM 715 CA THR B 46 -18.612 3.986 -6.356 1.00 0.00 C ATOM 716 C THR B 46 -17.881 2.756 -5.822 1.00 0.00 C ATOM 717 O THR B 46 -17.720 2.626 -4.603 1.00 0.00 O ATOM 718 CB THR B 46 -17.601 5.035 -6.870 1.00 0.00 C ATOM 719 OG1 THR B 46 -16.451 5.091 -6.017 1.00 0.00 O ATOM 720 CG2 THR B 46 -18.259 6.409 -6.892 1.00 0.00 C ATOM 0 H THR B 46 -18.823 5.064 -4.594 1.00 0.00 H new ATOM 0 HA THR B 46 -19.259 3.704 -7.186 1.00 0.00 H new ATOM 0 HB THR B 46 -17.289 4.747 -7.874 1.00 0.00 H new ATOM 0 HG1 THR B 46 -15.907 5.871 -6.252 1.00 0.00 H new ATOM 0 HG21 THR B 46 -17.545 7.149 -7.255 1.00 0.00 H new ATOM 0 HG22 THR B 46 -19.126 6.387 -7.553 1.00 0.00 H new ATOM 0 HG23 THR B 46 -18.578 6.676 -5.884 1.00 0.00 H new ATOM 728 N ARG B 47 -17.460 1.852 -6.700 1.00 0.00 N ATOM 729 CA ARG B 47 -16.680 0.691 -6.273 1.00 0.00 C ATOM 730 C ARG B 47 -15.451 1.160 -5.505 1.00 0.00 C ATOM 731 O ARG B 47 -15.096 0.607 -4.464 1.00 0.00 O ATOM 732 CB ARG B 47 -16.248 -0.158 -7.473 1.00 0.00 C ATOM 733 CG ARG B 47 -17.245 -1.238 -7.884 1.00 0.00 C ATOM 734 CD ARG B 47 -18.609 -0.671 -8.247 1.00 0.00 C ATOM 735 NE ARG B 47 -19.441 -1.657 -8.938 1.00 0.00 N ATOM 736 CZ ARG B 47 -20.762 -1.773 -8.784 1.00 0.00 C ATOM 737 NH1 ARG B 47 -21.414 -0.990 -7.937 1.00 0.00 N ATOM 738 NH2 ARG B 47 -21.434 -2.673 -9.482 1.00 0.00 N ATOM 0 H ARG B 47 -17.642 1.897 -7.703 1.00 0.00 H new ATOM 0 HA ARG B 47 -17.306 0.073 -5.629 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -16.076 0.501 -8.324 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -15.295 -0.633 -7.240 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -16.847 -1.789 -8.736 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -17.358 -1.952 -7.068 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -19.117 -0.337 -7.342 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -18.481 0.206 -8.882 1.00 0.00 H new ATOM 0 HE ARG B 47 -18.980 -2.300 -9.582 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -20.907 -0.290 -7.395 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -22.423 -1.087 -7.827 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -20.943 -3.280 -10.139 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -22.443 -2.761 -9.363 1.00 0.00 H new ATOM 752 N LYS B 48 -14.837 2.212 -6.028 1.00 0.00 N ATOM 753 CA LYS B 48 -13.676 2.840 -5.415 1.00 0.00 C ATOM 754 C LYS B 48 -13.978 3.289 -3.986 1.00 0.00 C ATOM 755 O LYS B 48 -13.232 2.987 -3.055 1.00 0.00 O ATOM 756 CB LYS B 48 -13.264 4.055 -6.246 1.00 0.00 C ATOM 757 CG LYS B 48 -12.036 4.766 -5.715 1.00 0.00 C ATOM 758 CD LYS B 48 -11.811 6.100 -6.409 1.00 0.00 C ATOM 759 CE LYS B 48 -12.915 7.100 -6.089 1.00 0.00 C ATOM 760 NZ LYS B 48 -12.610 8.452 -6.630 1.00 0.00 N ATOM 0 H LYS B 48 -15.133 2.657 -6.897 1.00 0.00 H new ATOM 0 HA LYS B 48 -12.868 2.109 -5.382 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -13.074 3.736 -7.271 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.095 4.760 -6.280 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.145 4.928 -4.643 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.160 4.132 -5.854 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.849 6.511 -6.103 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -11.763 5.945 -7.487 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -13.858 6.746 -6.506 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.047 7.162 -5.009 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.384 9.104 -6.392 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.723 8.801 -6.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.509 8.398 -7.664 1.00 0.00 H new ATOM 774 N GLN B 49 -15.078 4.015 -3.835 1.00 0.00 N ATOM 775 CA GLN B 49 -15.476 4.590 -2.556 1.00 0.00 C ATOM 776 C GLN B 49 -15.628 3.544 -1.460 1.00 0.00 C ATOM 777 O GLN B 49 -15.285 3.791 -0.300 1.00 0.00 O ATOM 778 CB GLN B 49 -16.797 5.325 -2.713 1.00 0.00 C ATOM 779 CG GLN B 49 -16.693 6.656 -3.428 1.00 0.00 C ATOM 780 CD GLN B 49 -15.909 7.690 -2.645 1.00 0.00 C ATOM 781 OE1 GLN B 49 -15.007 7.360 -1.878 1.00 0.00 O ATOM 782 NE2 GLN B 49 -16.257 8.952 -2.826 1.00 0.00 N ATOM 0 H GLN B 49 -15.722 4.223 -4.598 1.00 0.00 H new ATOM 0 HA GLN B 49 -14.681 5.273 -2.258 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -17.491 4.686 -3.259 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -17.226 5.490 -1.725 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -16.218 6.505 -4.397 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -17.696 7.038 -3.621 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -17.011 9.185 -3.472 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -15.771 9.693 -2.320 1.00 0.00 H new ATOM 791 N ILE B 50 -16.193 2.404 -1.815 1.00 0.00 N ATOM 792 CA ILE B 50 -16.395 1.330 -0.864 1.00 0.00 C ATOM 793 C ILE B 50 -15.060 0.767 -0.417 1.00 0.00 C ATOM 794 O ILE B 50 -14.770 0.694 0.781 1.00 0.00 O ATOM 795 CB ILE B 50 -17.228 0.204 -1.484 1.00 0.00 C ATOM 796 CG1 ILE B 50 -18.511 0.773 -2.082 1.00 0.00 C ATOM 797 CG2 ILE B 50 -17.541 -0.849 -0.437 1.00 0.00 C ATOM 798 CD1 ILE B 50 -19.557 1.149 -1.059 1.00 0.00 C ATOM 0 H ILE B 50 -16.521 2.199 -2.759 1.00 0.00 H new ATOM 0 HA ILE B 50 -16.928 1.739 -0.006 1.00 0.00 H new ATOM 0 HB ILE B 50 -16.656 -0.267 -2.283 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -18.263 1.655 -2.673 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -18.936 0.039 -2.767 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -18.134 -1.645 -0.888 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -16.611 -1.264 -0.049 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -18.104 -0.395 0.379 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -20.437 1.545 -1.567 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -19.837 0.267 -0.483 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -19.154 1.907 -0.388 1.00 0.00 H new ATOM 810 N ILE B 51 -14.239 0.415 -1.400 1.00 0.00 N ATOM 811 CA ILE B 51 -12.931 -0.162 -1.136 1.00 0.00 C ATOM 812 C ILE B 51 -12.125 0.787 -0.269 1.00 0.00 C ATOM 813 O ILE B 51 -11.471 0.377 0.688 1.00 0.00 O ATOM 814 CB ILE B 51 -12.146 -0.434 -2.441 1.00 0.00 C ATOM 815 CG1 ILE B 51 -12.945 -1.340 -3.376 1.00 0.00 C ATOM 816 CG2 ILE B 51 -10.795 -1.059 -2.125 1.00 0.00 C ATOM 817 CD1 ILE B 51 -12.290 -1.558 -4.723 1.00 0.00 C ATOM 0 H ILE B 51 -14.460 0.521 -2.390 1.00 0.00 H new ATOM 0 HA ILE B 51 -13.087 -1.113 -0.626 1.00 0.00 H new ATOM 0 HB ILE B 51 -11.982 0.518 -2.946 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -13.091 -2.306 -2.893 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -13.934 -0.907 -3.529 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -10.254 -1.245 -3.053 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -10.218 -0.380 -1.498 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -10.944 -2.001 -1.597 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -12.916 -2.211 -5.331 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -12.168 -0.600 -5.228 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -11.313 -2.020 -4.582 1.00 0.00 H new ATOM 829 N HIS B 52 -12.223 2.066 -0.601 1.00 0.00 N ATOM 830 CA HIS B 52 -11.465 3.100 0.072 1.00 0.00 C ATOM 831 C HIS B 52 -11.701 3.117 1.577 1.00 0.00 C ATOM 832 O HIS B 52 -10.750 3.019 2.332 1.00 0.00 O ATOM 833 CB HIS B 52 -11.754 4.461 -0.555 1.00 0.00 C ATOM 834 CG HIS B 52 -10.693 4.857 -1.532 1.00 0.00 C ATOM 835 ND1 HIS B 52 -9.953 6.009 -1.418 1.00 0.00 N ATOM 836 CD2 HIS B 52 -10.215 4.212 -2.623 1.00 0.00 C ATOM 837 CE1 HIS B 52 -9.064 6.054 -2.393 1.00 0.00 C ATOM 838 NE2 HIS B 52 -9.202 4.978 -3.139 1.00 0.00 N ATOM 0 H HIS B 52 -12.830 2.412 -1.344 1.00 0.00 H new ATOM 0 HA HIS B 52 -10.408 2.870 -0.065 1.00 0.00 H new ATOM 0 HB2 HIS B 52 -12.720 4.432 -1.059 1.00 0.00 H new ATOM 0 HB3 HIS B 52 -11.826 5.215 0.229 1.00 0.00 H new ATOM 0 HD2 HIS B 52 -10.567 3.269 -3.014 1.00 0.00 H new ATOM 0 HE1 HIS B 52 -8.343 6.842 -2.552 1.00 0.00 H new ATOM 0 HE2 HIS B 52 -8.647 4.752 -3.964 1.00 0.00 H new ATOM 847 N HIS B 53 -12.951 3.217 2.021 1.00 0.00 N ATOM 848 CA HIS B 53 -13.228 3.251 3.463 1.00 0.00 C ATOM 849 C HIS B 53 -12.708 2.008 4.168 1.00 0.00 C ATOM 850 O HIS B 53 -12.300 2.058 5.324 1.00 0.00 O ATOM 851 CB HIS B 53 -14.720 3.366 3.744 1.00 0.00 C ATOM 852 CG HIS B 53 -15.253 4.751 3.658 1.00 0.00 C ATOM 853 ND1 HIS B 53 -14.701 5.816 4.336 1.00 0.00 N ATOM 854 CD2 HIS B 53 -16.300 5.242 2.968 1.00 0.00 C ATOM 855 CE1 HIS B 53 -15.387 6.905 4.066 1.00 0.00 C ATOM 856 NE2 HIS B 53 -16.361 6.586 3.239 1.00 0.00 N ATOM 0 H HIS B 53 -13.775 3.275 1.423 1.00 0.00 H new ATOM 0 HA HIS B 53 -12.711 4.131 3.847 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -15.261 2.736 3.037 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -14.922 2.973 4.740 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -16.965 4.685 2.324 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -15.186 7.892 4.456 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -17.051 7.235 2.860 1.00 0.00 H new ATOM 865 N LEU B 54 -12.712 0.903 3.456 1.00 0.00 N ATOM 866 CA LEU B 54 -12.426 -0.391 4.049 1.00 0.00 C ATOM 867 C LEU B 54 -10.924 -0.651 4.131 1.00 0.00 C ATOM 868 O LEU B 54 -10.418 -1.061 5.178 1.00 0.00 O ATOM 869 CB LEU B 54 -13.149 -1.484 3.262 1.00 0.00 C ATOM 870 CG LEU B 54 -14.673 -1.501 3.457 1.00 0.00 C ATOM 871 CD1 LEU B 54 -15.361 -2.263 2.337 1.00 0.00 C ATOM 872 CD2 LEU B 54 -15.025 -2.116 4.805 1.00 0.00 C ATOM 0 H LEU B 54 -12.912 0.872 2.456 1.00 0.00 H new ATOM 0 HA LEU B 54 -12.796 -0.398 5.074 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.932 -1.356 2.202 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.746 -2.453 3.555 1.00 0.00 H new ATOM 0 HG LEU B 54 -15.028 -0.471 3.433 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -16.438 -2.258 2.502 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -15.138 -1.787 1.382 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -15.001 -3.292 2.322 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -16.108 -2.122 4.931 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -14.649 -3.138 4.848 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -14.570 -1.529 5.603 1.00 0.00 H new ATOM 884 N VAL B 55 -10.203 -0.390 3.046 1.00 0.00 N ATOM 885 CA VAL B 55 -8.751 -0.546 3.055 1.00 0.00 C ATOM 886 C VAL B 55 -8.108 0.543 3.906 1.00 0.00 C ATOM 887 O VAL B 55 -7.015 0.370 4.444 1.00 0.00 O ATOM 888 CB VAL B 55 -8.146 -0.521 1.632 1.00 0.00 C ATOM 889 CG1 VAL B 55 -8.710 -1.657 0.800 1.00 0.00 C ATOM 890 CG2 VAL B 55 -8.385 0.819 0.947 1.00 0.00 C ATOM 0 H VAL B 55 -10.593 -0.073 2.158 1.00 0.00 H new ATOM 0 HA VAL B 55 -8.539 -1.525 3.485 1.00 0.00 H new ATOM 0 HB VAL B 55 -7.068 -0.655 1.723 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -8.275 -1.627 -0.199 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -8.468 -2.609 1.273 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -9.793 -1.553 0.728 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.947 0.801 -0.051 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.457 1.002 0.869 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -7.923 1.614 1.532 1.00 0.00 H new ATOM 900 N GLN B 56 -8.811 1.658 4.044 1.00 0.00 N ATOM 901 CA GLN B 56 -8.349 2.761 4.871 1.00 0.00 C ATOM 902 C GLN B 56 -8.671 2.517 6.338 1.00 0.00 C ATOM 903 O GLN B 56 -8.081 3.138 7.220 1.00 0.00 O ATOM 904 CB GLN B 56 -8.972 4.079 4.409 1.00 0.00 C ATOM 905 CG GLN B 56 -8.394 4.611 3.104 1.00 0.00 C ATOM 906 CD GLN B 56 -8.930 5.984 2.743 1.00 0.00 C ATOM 907 OE1 GLN B 56 -10.060 6.016 2.055 1.00 0.00 O flip ATOM 908 NE2 GLN B 56 -8.338 7.007 3.091 1.00 0.00 N flip ATOM 0 H GLN B 56 -9.710 1.822 3.590 1.00 0.00 H new ATOM 0 HA GLN B 56 -7.266 2.827 4.763 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -10.046 3.939 4.289 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -8.833 4.828 5.189 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -7.308 4.659 3.185 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -8.623 3.913 2.299 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -7.469 6.938 3.621 1.00 0.00 H new ATOM 0 HE22 GLN B 56 -8.717 7.923 2.849 1.00 0.00 H new ATOM 917 N MET B 57 -9.605 1.610 6.605 1.00 0.00 N ATOM 918 CA MET B 57 -9.985 1.304 7.980 1.00 0.00 C ATOM 919 C MET B 57 -9.042 0.256 8.569 1.00 0.00 C ATOM 920 O MET B 57 -9.162 -0.123 9.735 1.00 0.00 O ATOM 921 CB MET B 57 -11.434 0.814 8.049 1.00 0.00 C ATOM 922 CG MET B 57 -12.071 0.990 9.421 1.00 0.00 C ATOM 923 SD MET B 57 -13.729 0.283 9.535 1.00 0.00 S ATOM 924 CE MET B 57 -14.542 1.050 8.133 1.00 0.00 C ATOM 0 H MET B 57 -10.109 1.078 5.895 1.00 0.00 H new ATOM 0 HA MET B 57 -9.906 2.218 8.568 1.00 0.00 H new ATOM 0 HB2 MET B 57 -12.027 1.353 7.310 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.466 -0.241 7.775 1.00 0.00 H new ATOM 0 HG2 MET B 57 -11.433 0.525 10.172 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.120 2.053 9.658 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.622 0.941 8.234 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.286 2.109 8.098 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.213 0.567 7.213 1.00 0.00 H new ATOM 934 N GLY B 58 -8.111 -0.219 7.748 1.00 0.00 N ATOM 935 CA GLY B 58 -7.112 -1.164 8.215 1.00 0.00 C ATOM 936 C GLY B 58 -7.627 -2.588 8.260 1.00 0.00 C ATOM 937 O GLY B 58 -6.885 -3.514 8.582 1.00 0.00 O ATOM 0 H GLY B 58 -8.030 0.035 6.763 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -6.241 -1.118 7.561 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -6.779 -0.871 9.211 1.00 0.00 H new ATOM 941 N LEU B 59 -8.897 -2.768 7.931 1.00 0.00 N ATOM 942 CA LEU B 59 -9.504 -4.093 7.945 1.00 0.00 C ATOM 943 C LEU B 59 -9.206 -4.825 6.642 1.00 0.00 C ATOM 944 O LEU B 59 -9.344 -6.045 6.548 1.00 0.00 O ATOM 945 CB LEU B 59 -11.011 -3.985 8.202 1.00 0.00 C ATOM 946 CG LEU B 59 -11.781 -3.059 7.261 1.00 0.00 C ATOM 947 CD1 LEU B 59 -12.135 -3.769 5.971 1.00 0.00 C ATOM 948 CD2 LEU B 59 -13.030 -2.533 7.938 1.00 0.00 C ATOM 0 H LEU B 59 -9.527 -2.016 7.651 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.071 -4.675 8.758 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.444 -4.983 8.135 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -11.162 -3.640 9.225 1.00 0.00 H new ATOM 0 HG LEU B 59 -11.137 -2.214 7.016 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -12.682 -3.088 5.319 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.222 -4.094 5.472 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -12.756 -4.637 6.192 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -13.566 -1.875 7.253 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -13.673 -3.368 8.216 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -12.752 -1.976 8.833 1.00 0.00 H new ATOM 960 N ALA B 60 -8.807 -4.056 5.641 1.00 0.00 N ATOM 961 CA ALA B 60 -8.370 -4.606 4.367 1.00 0.00 C ATOM 962 C ALA B 60 -7.069 -3.938 3.946 1.00 0.00 C ATOM 963 O ALA B 60 -6.778 -2.824 4.381 1.00 0.00 O ATOM 964 CB ALA B 60 -9.440 -4.412 3.305 1.00 0.00 C ATOM 0 H ALA B 60 -8.777 -3.038 5.688 1.00 0.00 H new ATOM 0 HA ALA B 60 -8.201 -5.677 4.480 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -9.094 -4.830 2.360 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -10.354 -4.919 3.613 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -9.640 -3.348 3.180 1.00 0.00 H new ATOM 970 N ASP B 61 -6.285 -4.616 3.114 1.00 0.00 N ATOM 971 CA ASP B 61 -5.000 -4.076 2.689 1.00 0.00 C ATOM 972 C ASP B 61 -5.156 -3.157 1.487 1.00 0.00 C ATOM 973 O ASP B 61 -4.860 -1.966 1.571 1.00 0.00 O ATOM 974 CB ASP B 61 -3.995 -5.188 2.356 1.00 0.00 C ATOM 975 CG ASP B 61 -3.424 -5.870 3.583 1.00 0.00 C ATOM 976 OD1 ASP B 61 -2.859 -5.171 4.451 1.00 0.00 O ATOM 977 OD2 ASP B 61 -3.511 -7.112 3.672 1.00 0.00 O ATOM 0 H ASP B 61 -6.514 -5.531 2.725 1.00 0.00 H new ATOM 0 HA ASP B 61 -4.613 -3.500 3.529 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -4.484 -5.934 1.729 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -3.178 -4.766 1.771 1.00 0.00 H new ATOM 982 N SER B 62 -5.622 -3.700 0.373 1.00 0.00 N ATOM 983 CA SER B 62 -5.686 -2.936 -0.863 1.00 0.00 C ATOM 984 C SER B 62 -6.828 -3.419 -1.756 1.00 0.00 C ATOM 985 O SER B 62 -7.533 -4.372 -1.425 1.00 0.00 O ATOM 986 CB SER B 62 -4.346 -3.037 -1.606 1.00 0.00 C ATOM 987 OG SER B 62 -4.335 -2.244 -2.781 1.00 0.00 O ATOM 0 H SER B 62 -5.959 -4.660 0.299 1.00 0.00 H new ATOM 0 HA SER B 62 -5.881 -1.893 -0.612 1.00 0.00 H new ATOM 0 HB2 SER B 62 -3.539 -2.719 -0.945 1.00 0.00 H new ATOM 0 HB3 SER B 62 -4.153 -4.077 -1.868 1.00 0.00 H new ATOM 0 HG SER B 62 -3.467 -2.332 -3.227 1.00 0.00 H new ATOM 993 N VAL B 63 -6.995 -2.737 -2.887 1.00 0.00 N ATOM 994 CA VAL B 63 -7.995 -3.078 -3.896 1.00 0.00 C ATOM 995 C VAL B 63 -7.825 -4.526 -4.356 1.00 0.00 C ATOM 996 O VAL B 63 -8.781 -5.182 -4.781 1.00 0.00 O ATOM 997 CB VAL B 63 -7.862 -2.132 -5.115 1.00 0.00 C ATOM 998 CG1 VAL B 63 -8.811 -2.529 -6.236 1.00 0.00 C ATOM 999 CG2 VAL B 63 -8.095 -0.679 -4.708 1.00 0.00 C ATOM 0 H VAL B 63 -6.433 -1.922 -3.131 1.00 0.00 H new ATOM 0 HA VAL B 63 -8.983 -2.963 -3.451 1.00 0.00 H new ATOM 0 HB VAL B 63 -6.843 -2.226 -5.490 1.00 0.00 H new ATOM 0 HG11 VAL B 63 -8.690 -1.843 -7.075 1.00 0.00 H new ATOM 0 HG12 VAL B 63 -8.585 -3.544 -6.562 1.00 0.00 H new ATOM 0 HG13 VAL B 63 -9.839 -2.484 -5.876 1.00 0.00 H new ATOM 0 HG21 VAL B 63 -7.996 -0.036 -5.582 1.00 0.00 H new ATOM 0 HG22 VAL B 63 -9.097 -0.574 -4.292 1.00 0.00 H new ATOM 0 HG23 VAL B 63 -7.359 -0.389 -3.959 1.00 0.00 H new ATOM 1009 N LYS B 64 -6.595 -5.014 -4.247 1.00 0.00 N ATOM 1010 CA LYS B 64 -6.251 -6.384 -4.615 1.00 0.00 C ATOM 1011 C LYS B 64 -7.131 -7.380 -3.871 1.00 0.00 C ATOM 1012 O LYS B 64 -7.547 -8.399 -4.414 1.00 0.00 O ATOM 1013 CB LYS B 64 -4.776 -6.632 -4.282 1.00 0.00 C ATOM 1014 CG LYS B 64 -4.524 -7.165 -2.875 1.00 0.00 C ATOM 1015 CD LYS B 64 -3.050 -7.428 -2.618 1.00 0.00 C ATOM 1016 CE LYS B 64 -2.826 -8.137 -1.289 1.00 0.00 C ATOM 1017 NZ LYS B 64 -3.251 -7.313 -0.125 1.00 0.00 N ATOM 0 H LYS B 64 -5.805 -4.470 -3.900 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.417 -6.521 -5.683 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -4.368 -7.340 -5.003 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -4.227 -5.699 -4.407 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -4.896 -6.447 -2.144 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -5.087 -8.087 -2.731 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -2.642 -8.034 -3.427 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -2.506 -6.483 -2.622 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -3.377 -9.077 -1.285 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -1.770 -8.386 -1.187 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -3.402 -7.929 0.699 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -2.512 -6.615 0.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -4.137 -6.819 -0.355 1.00 0.00 H new ATOM 1031 N ASP B 65 -7.418 -7.052 -2.626 1.00 0.00 N ATOM 1032 CA ASP B 65 -8.183 -7.929 -1.750 1.00 0.00 C ATOM 1033 C ASP B 65 -9.675 -7.813 -2.022 1.00 0.00 C ATOM 1034 O ASP B 65 -10.472 -8.577 -1.478 1.00 0.00 O ATOM 1035 CB ASP B 65 -7.905 -7.592 -0.282 1.00 0.00 C ATOM 1036 CG ASP B 65 -6.427 -7.604 0.049 1.00 0.00 C ATOM 1037 OD1 ASP B 65 -5.821 -6.512 0.129 1.00 0.00 O ATOM 1038 OD2 ASP B 65 -5.855 -8.700 0.217 1.00 0.00 O ATOM 0 H ASP B 65 -7.131 -6.175 -2.191 1.00 0.00 H new ATOM 0 HA ASP B 65 -7.870 -8.953 -1.953 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -8.316 -6.609 -0.055 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -8.422 -8.309 0.356 1.00 0.00 H new ATOM 1043 N PHE B 66 -10.050 -6.858 -2.860 1.00 0.00 N ATOM 1044 CA PHE B 66 -11.455 -6.556 -3.075 1.00 0.00 C ATOM 1045 C PHE B 66 -11.980 -7.065 -4.399 1.00 0.00 C ATOM 1046 O PHE B 66 -13.016 -7.728 -4.452 1.00 0.00 O ATOM 1047 CB PHE B 66 -11.668 -5.048 -3.024 1.00 0.00 C ATOM 1048 CG PHE B 66 -12.093 -4.568 -1.686 1.00 0.00 C ATOM 1049 CD1 PHE B 66 -11.194 -4.524 -0.640 1.00 0.00 C ATOM 1050 CD2 PHE B 66 -13.399 -4.175 -1.470 1.00 0.00 C ATOM 1051 CE1 PHE B 66 -11.593 -4.097 0.602 1.00 0.00 C ATOM 1052 CE2 PHE B 66 -13.800 -3.746 -0.241 1.00 0.00 C ATOM 1053 CZ PHE B 66 -12.897 -3.708 0.804 1.00 0.00 C ATOM 0 H PHE B 66 -9.404 -6.282 -3.399 1.00 0.00 H new ATOM 0 HA PHE B 66 -12.003 -7.065 -2.282 1.00 0.00 H new ATOM 0 HB2 PHE B 66 -10.743 -4.546 -3.307 1.00 0.00 H new ATOM 0 HB3 PHE B 66 -12.421 -4.768 -3.761 1.00 0.00 H new ATOM 0 HD1 PHE B 66 -10.170 -4.827 -0.800 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -14.109 -4.208 -2.283 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -10.886 -4.067 1.418 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -14.822 -3.436 -0.084 1.00 0.00 H new ATOM 0 HZ PHE B 66 -13.215 -3.373 1.780 1.00 0.00 H new ATOM 1184 N VAL B 74 6.467 -5.185 -9.241 1.00 0.00 N ATOM 1185 CA VAL B 74 7.793 -4.851 -9.699 1.00 0.00 C ATOM 1186 C VAL B 74 7.981 -5.460 -11.080 1.00 0.00 C ATOM 1187 O VAL B 74 7.372 -6.481 -11.372 1.00 0.00 O ATOM 1188 CB VAL B 74 8.862 -5.377 -8.708 1.00 0.00 C ATOM 1189 CG1 VAL B 74 8.537 -4.904 -7.294 1.00 0.00 C ATOM 1190 CG2 VAL B 74 8.958 -6.901 -8.746 1.00 0.00 C ATOM 0 HA VAL B 74 7.911 -3.769 -9.754 1.00 0.00 H new ATOM 0 HB VAL B 74 9.829 -4.976 -9.010 1.00 0.00 H new ATOM 0 HG11 VAL B 74 9.293 -5.277 -6.603 1.00 0.00 H new ATOM 0 HG12 VAL B 74 8.528 -3.814 -7.268 1.00 0.00 H new ATOM 0 HG13 VAL B 74 7.558 -5.282 -7.000 1.00 0.00 H new ATOM 0 HG21 VAL B 74 9.717 -7.235 -8.039 1.00 0.00 H new ATOM 0 HG22 VAL B 74 7.995 -7.333 -8.475 1.00 0.00 H new ATOM 0 HG23 VAL B 74 9.231 -7.223 -9.751 1.00 0.00 H new ATOM 1200 N LEU B 75 8.777 -4.826 -11.927 1.00 0.00 N ATOM 1201 CA LEU B 75 8.945 -5.272 -13.311 1.00 0.00 C ATOM 1202 C LEU B 75 9.311 -6.760 -13.393 1.00 0.00 C ATOM 1203 O LEU B 75 10.467 -7.138 -13.271 1.00 0.00 O ATOM 1204 CB LEU B 75 10.008 -4.421 -14.012 1.00 0.00 C ATOM 1205 CG LEU B 75 11.366 -4.370 -13.309 1.00 0.00 C ATOM 1206 CD1 LEU B 75 12.455 -4.912 -14.222 1.00 0.00 C ATOM 1207 CD2 LEU B 75 11.689 -2.951 -12.867 1.00 0.00 C ATOM 0 H LEU B 75 9.321 -3.998 -11.684 1.00 0.00 H new ATOM 0 HA LEU B 75 7.989 -5.144 -13.819 1.00 0.00 H new ATOM 0 HB2 LEU B 75 10.153 -4.807 -15.021 1.00 0.00 H new ATOM 0 HB3 LEU B 75 9.629 -3.404 -14.111 1.00 0.00 H new ATOM 0 HG LEU B 75 11.319 -4.998 -12.420 1.00 0.00 H new ATOM 0 HD11 LEU B 75 13.415 -4.869 -13.708 1.00 0.00 H new ATOM 0 HD12 LEU B 75 12.229 -5.946 -14.484 1.00 0.00 H new ATOM 0 HD13 LEU B 75 12.502 -4.310 -15.129 1.00 0.00 H new ATOM 0 HD21 LEU B 75 12.659 -2.937 -12.369 1.00 0.00 H new ATOM 0 HD22 LEU B 75 11.719 -2.296 -13.738 1.00 0.00 H new ATOM 0 HD23 LEU B 75 10.922 -2.601 -12.176 1.00 0.00 H new ATOM 1219 N TRP B 76 8.308 -7.603 -13.581 1.00 0.00 N ATOM 1220 CA TRP B 76 8.531 -9.035 -13.680 1.00 0.00 C ATOM 1221 C TRP B 76 8.664 -9.449 -15.132 1.00 0.00 C ATOM 1222 O TRP B 76 7.695 -9.433 -15.891 1.00 0.00 O ATOM 1223 CB TRP B 76 7.396 -9.821 -13.014 1.00 0.00 C ATOM 1224 CG TRP B 76 7.496 -9.893 -11.521 1.00 0.00 C ATOM 1225 CD1 TRP B 76 6.705 -9.260 -10.616 1.00 0.00 C ATOM 1226 CD2 TRP B 76 8.439 -10.652 -10.763 1.00 0.00 C ATOM 1227 NE1 TRP B 76 7.099 -9.571 -9.339 1.00 0.00 N ATOM 1228 CE2 TRP B 76 8.163 -10.423 -9.403 1.00 0.00 C ATOM 1229 CE3 TRP B 76 9.491 -11.501 -11.102 1.00 0.00 C ATOM 1230 CZ2 TRP B 76 8.901 -11.010 -8.385 1.00 0.00 C ATOM 1231 CZ3 TRP B 76 10.224 -12.082 -10.087 1.00 0.00 C ATOM 1232 CH2 TRP B 76 9.925 -11.835 -8.747 1.00 0.00 C ATOM 0 H TRP B 76 7.332 -7.320 -13.668 1.00 0.00 H new ATOM 0 HA TRP B 76 9.459 -9.265 -13.156 1.00 0.00 H new ATOM 0 HB2 TRP B 76 6.444 -9.362 -13.282 1.00 0.00 H new ATOM 0 HB3 TRP B 76 7.385 -10.834 -13.416 1.00 0.00 H new ATOM 0 HD1 TRP B 76 5.883 -8.605 -10.866 1.00 0.00 H new ATOM 0 HE1 TRP B 76 6.668 -9.223 -8.483 1.00 0.00 H new ATOM 0 HE3 TRP B 76 9.728 -11.700 -12.137 1.00 0.00 H new ATOM 0 HZ2 TRP B 76 8.673 -10.821 -7.346 1.00 0.00 H new ATOM 0 HZ3 TRP B 76 11.044 -12.740 -10.335 1.00 0.00 H new ATOM 0 HH2 TRP B 76 10.518 -12.308 -7.978 1.00 0.00 H new ATOM 1243 N THR B 77 9.873 -9.799 -15.513 1.00 0.00 N ATOM 1244 CA THR B 77 10.142 -10.321 -16.836 1.00 0.00 C ATOM 1245 C THR B 77 10.328 -11.829 -16.757 1.00 0.00 C ATOM 1246 O THR B 77 10.291 -12.403 -15.663 1.00 0.00 O ATOM 1247 CB THR B 77 11.409 -9.673 -17.428 1.00 0.00 C ATOM 1248 OG1 THR B 77 12.512 -9.861 -16.528 1.00 0.00 O ATOM 1249 CG2 THR B 77 11.197 -8.183 -17.674 1.00 0.00 C ATOM 0 H THR B 77 10.697 -9.730 -14.916 1.00 0.00 H new ATOM 0 HA THR B 77 9.297 -10.087 -17.484 1.00 0.00 H new ATOM 0 HB THR B 77 11.626 -10.152 -18.383 1.00 0.00 H new ATOM 0 HG1 THR B 77 13.317 -9.450 -16.907 1.00 0.00 H new ATOM 0 HG21 THR B 77 12.106 -7.750 -18.092 1.00 0.00 H new ATOM 0 HG22 THR B 77 10.374 -8.043 -18.374 1.00 0.00 H new ATOM 0 HG23 THR B 77 10.960 -7.689 -16.732 1.00 0.00 H new ATOM 1257 N GLY B 78 10.503 -12.476 -17.902 1.00 0.00 N ATOM 1258 CA GLY B 78 10.847 -13.884 -17.900 1.00 0.00 C ATOM 1259 C GLY B 78 12.155 -14.117 -17.175 1.00 0.00 C ATOM 1260 O GLY B 78 12.296 -15.072 -16.410 1.00 0.00 O ATOM 0 H GLY B 78 10.414 -12.054 -18.826 1.00 0.00 H new ATOM 0 HA2 GLY B 78 10.053 -14.456 -17.420 1.00 0.00 H new ATOM 0 HA3 GLY B 78 10.925 -14.245 -18.925 1.00 0.00 H new ATOM 1264 N ASP B 79 13.097 -13.211 -17.409 1.00 0.00 N ATOM 1265 CA ASP B 79 14.395 -13.228 -16.742 1.00 0.00 C ATOM 1266 C ASP B 79 14.231 -13.141 -15.233 1.00 0.00 C ATOM 1267 O ASP B 79 14.645 -14.038 -14.506 1.00 0.00 O ATOM 1268 CB ASP B 79 15.227 -12.041 -17.224 1.00 0.00 C ATOM 1269 CG ASP B 79 16.630 -12.007 -16.648 1.00 0.00 C ATOM 1270 OD1 ASP B 79 16.825 -11.424 -15.561 1.00 0.00 O ATOM 1271 OD2 ASP B 79 17.553 -12.537 -17.302 1.00 0.00 O ATOM 0 H ASP B 79 12.983 -12.441 -18.068 1.00 0.00 H new ATOM 0 HA ASP B 79 14.896 -14.165 -16.986 1.00 0.00 H new ATOM 0 HB2 ASP B 79 15.291 -12.071 -18.312 1.00 0.00 H new ATOM 0 HB3 ASP B 79 14.713 -11.117 -16.960 1.00 0.00 H new ATOM 1276 N GLN B 80 13.604 -12.059 -14.776 1.00 0.00 N ATOM 1277 CA GLN B 80 13.447 -11.793 -13.350 1.00 0.00 C ATOM 1278 C GLN B 80 12.719 -12.930 -12.644 1.00 0.00 C ATOM 1279 O GLN B 80 13.115 -13.348 -11.552 1.00 0.00 O ATOM 1280 CB GLN B 80 12.699 -10.474 -13.131 1.00 0.00 C ATOM 1281 CG GLN B 80 12.423 -10.168 -11.671 1.00 0.00 C ATOM 1282 CD GLN B 80 12.191 -8.701 -11.411 1.00 0.00 C ATOM 1283 OE1 GLN B 80 12.826 -7.842 -12.010 1.00 0.00 O ATOM 1284 NE2 GLN B 80 11.256 -8.405 -10.525 1.00 0.00 N ATOM 0 H GLN B 80 13.193 -11.347 -15.380 1.00 0.00 H new ATOM 0 HA GLN B 80 14.445 -11.714 -12.919 1.00 0.00 H new ATOM 0 HB2 GLN B 80 13.282 -9.659 -13.560 1.00 0.00 H new ATOM 0 HB3 GLN B 80 11.753 -10.508 -13.672 1.00 0.00 H new ATOM 0 HG2 GLN B 80 11.549 -10.732 -11.346 1.00 0.00 H new ATOM 0 HG3 GLN B 80 13.264 -10.510 -11.068 1.00 0.00 H new ATOM 0 HE21 GLN B 80 10.750 -9.152 -10.048 1.00 0.00 H new ATOM 0 HE22 GLN B 80 11.040 -7.430 -10.318 1.00 0.00 H new ATOM 1293 N GLU B 81 11.666 -13.432 -13.270 1.00 0.00 N ATOM 1294 CA GLU B 81 10.857 -14.476 -12.667 1.00 0.00 C ATOM 1295 C GLU B 81 11.645 -15.778 -12.561 1.00 0.00 C ATOM 1296 O GLU B 81 11.615 -16.449 -11.530 1.00 0.00 O ATOM 1297 CB GLU B 81 9.572 -14.675 -13.467 1.00 0.00 C ATOM 1298 CG GLU B 81 8.582 -15.614 -12.802 1.00 0.00 C ATOM 1299 CD GLU B 81 7.192 -15.497 -13.383 1.00 0.00 C ATOM 1300 OE1 GLU B 81 6.458 -14.558 -12.998 1.00 0.00 O ATOM 1301 OE2 GLU B 81 6.827 -16.340 -14.230 1.00 0.00 O ATOM 0 H GLU B 81 11.353 -13.133 -14.194 1.00 0.00 H new ATOM 0 HA GLU B 81 10.587 -14.168 -11.657 1.00 0.00 H new ATOM 0 HB2 GLU B 81 9.095 -13.707 -13.620 1.00 0.00 H new ATOM 0 HB3 GLU B 81 9.824 -15.065 -14.453 1.00 0.00 H new ATOM 0 HG2 GLU B 81 8.932 -16.641 -12.910 1.00 0.00 H new ATOM 0 HG3 GLU B 81 8.545 -15.400 -11.734 1.00 0.00 H new ATOM 1308 N LEU B 82 12.369 -16.115 -13.619 1.00 0.00 N ATOM 1309 CA LEU B 82 13.206 -17.307 -13.617 1.00 0.00 C ATOM 1310 C LEU B 82 14.379 -17.146 -12.659 1.00 0.00 C ATOM 1311 O LEU B 82 14.780 -18.098 -11.986 1.00 0.00 O ATOM 1312 CB LEU B 82 13.750 -17.592 -15.014 1.00 0.00 C ATOM 1313 CG LEU B 82 14.733 -18.761 -15.078 1.00 0.00 C ATOM 1314 CD1 LEU B 82 13.999 -20.091 -14.981 1.00 0.00 C ATOM 1315 CD2 LEU B 82 15.573 -18.683 -16.338 1.00 0.00 C ATOM 0 H LEU B 82 12.394 -15.581 -14.488 1.00 0.00 H new ATOM 0 HA LEU B 82 12.582 -18.140 -13.292 1.00 0.00 H new ATOM 0 HB2 LEU B 82 12.914 -17.798 -15.682 1.00 0.00 H new ATOM 0 HB3 LEU B 82 14.244 -16.696 -15.389 1.00 0.00 H new ATOM 0 HG LEU B 82 15.406 -18.693 -14.223 1.00 0.00 H new ATOM 0 HD11 LEU B 82 14.719 -20.908 -15.029 1.00 0.00 H new ATOM 0 HD12 LEU B 82 13.457 -20.139 -14.036 1.00 0.00 H new ATOM 0 HD13 LEU B 82 13.295 -20.179 -15.808 1.00 0.00 H new ATOM 0 HD21 LEU B 82 16.267 -19.523 -16.366 1.00 0.00 H new ATOM 0 HD22 LEU B 82 14.923 -18.720 -17.212 1.00 0.00 H new ATOM 0 HD23 LEU B 82 16.135 -17.749 -16.344 1.00 0.00 H new ATOM 1327 N GLU B 83 14.930 -15.940 -12.614 1.00 0.00 N ATOM 1328 CA GLU B 83 16.093 -15.663 -11.792 1.00 0.00 C ATOM 1329 C GLU B 83 15.771 -15.897 -10.321 1.00 0.00 C ATOM 1330 O GLU B 83 16.533 -16.553 -9.609 1.00 0.00 O ATOM 1331 CB GLU B 83 16.578 -14.228 -12.012 1.00 0.00 C ATOM 1332 CG GLU B 83 18.025 -14.018 -11.600 1.00 0.00 C ATOM 1333 CD GLU B 83 18.976 -14.901 -12.384 1.00 0.00 C ATOM 1334 OE1 GLU B 83 19.551 -14.425 -13.386 1.00 0.00 O ATOM 1335 OE2 GLU B 83 19.152 -16.079 -12.009 1.00 0.00 O ATOM 0 H GLU B 83 14.586 -15.137 -13.141 1.00 0.00 H new ATOM 0 HA GLU B 83 16.892 -16.344 -12.085 1.00 0.00 H new ATOM 0 HB2 GLU B 83 16.465 -13.970 -13.065 1.00 0.00 H new ATOM 0 HB3 GLU B 83 15.943 -13.546 -11.447 1.00 0.00 H new ATOM 0 HG2 GLU B 83 18.296 -12.973 -11.749 1.00 0.00 H new ATOM 0 HG3 GLU B 83 18.132 -14.226 -10.535 1.00 0.00 H new ATOM 1342 N LEU B 84 14.629 -15.382 -9.870 1.00 0.00 N ATOM 1343 CA LEU B 84 14.208 -15.602 -8.496 1.00 0.00 C ATOM 1344 C LEU B 84 13.875 -17.070 -8.287 1.00 0.00 C ATOM 1345 O LEU B 84 14.146 -17.620 -7.228 1.00 0.00 O ATOM 1346 CB LEU B 84 13.007 -14.718 -8.121 1.00 0.00 C ATOM 1347 CG LEU B 84 12.546 -14.826 -6.653 1.00 0.00 C ATOM 1348 CD1 LEU B 84 11.933 -13.523 -6.177 1.00 0.00 C ATOM 1349 CD2 LEU B 84 11.529 -15.946 -6.486 1.00 0.00 C ATOM 0 H LEU B 84 13.989 -14.818 -10.430 1.00 0.00 H new ATOM 0 HA LEU B 84 15.034 -15.323 -7.841 1.00 0.00 H new ATOM 0 HB2 LEU B 84 13.262 -13.679 -8.330 1.00 0.00 H new ATOM 0 HB3 LEU B 84 12.169 -14.977 -8.768 1.00 0.00 H new ATOM 0 HG LEU B 84 13.428 -15.046 -6.051 1.00 0.00 H new ATOM 0 HD11 LEU B 84 11.617 -13.627 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU B 84 12.671 -12.725 -6.253 1.00 0.00 H new ATOM 0 HD13 LEU B 84 11.070 -13.279 -6.796 1.00 0.00 H new ATOM 0 HD21 LEU B 84 11.219 -16.003 -5.443 1.00 0.00 H new ATOM 0 HD22 LEU B 84 10.660 -15.745 -7.113 1.00 0.00 H new ATOM 0 HD23 LEU B 84 11.979 -16.893 -6.783 1.00 0.00 H new ATOM 1361 N GLN B 85 13.302 -17.697 -9.311 1.00 0.00 N ATOM 1362 CA GLN B 85 12.960 -19.115 -9.257 1.00 0.00 C ATOM 1363 C GLN B 85 14.196 -19.943 -8.908 1.00 0.00 C ATOM 1364 O GLN B 85 14.185 -20.728 -7.958 1.00 0.00 O ATOM 1365 CB GLN B 85 12.363 -19.553 -10.605 1.00 0.00 C ATOM 1366 CG GLN B 85 11.694 -20.928 -10.599 1.00 0.00 C ATOM 1367 CD GLN B 85 12.649 -22.112 -10.697 1.00 0.00 C ATOM 1368 OE1 GLN B 85 12.381 -23.177 -10.139 1.00 0.00 O ATOM 1369 NE2 GLN B 85 13.734 -21.962 -11.441 1.00 0.00 N ATOM 0 H GLN B 85 13.064 -17.242 -10.192 1.00 0.00 H new ATOM 0 HA GLN B 85 12.215 -19.280 -8.478 1.00 0.00 H new ATOM 0 HB2 GLN B 85 11.630 -18.810 -10.919 1.00 0.00 H new ATOM 0 HB3 GLN B 85 13.156 -19.555 -11.353 1.00 0.00 H new ATOM 0 HG2 GLN B 85 11.110 -21.027 -9.684 1.00 0.00 H new ATOM 0 HG3 GLN B 85 10.992 -20.977 -11.432 1.00 0.00 H new ATOM 0 HE21 GLN B 85 13.925 -21.066 -11.889 1.00 0.00 H new ATOM 0 HE22 GLN B 85 14.378 -22.743 -11.566 1.00 0.00 H new ATOM 1378 N ARG B 86 15.269 -19.733 -9.664 1.00 0.00 N ATOM 1379 CA ARG B 86 16.510 -20.465 -9.442 1.00 0.00 C ATOM 1380 C ARG B 86 17.149 -20.091 -8.105 1.00 0.00 C ATOM 1381 O ARG B 86 17.723 -20.944 -7.423 1.00 0.00 O ATOM 1382 CB ARG B 86 17.499 -20.199 -10.579 1.00 0.00 C ATOM 1383 CG ARG B 86 16.966 -20.581 -11.949 1.00 0.00 C ATOM 1384 CD ARG B 86 18.047 -20.494 -13.016 1.00 0.00 C ATOM 1385 NE ARG B 86 18.665 -19.170 -13.085 1.00 0.00 N ATOM 1386 CZ ARG B 86 19.633 -18.848 -13.943 1.00 0.00 C ATOM 1387 NH1 ARG B 86 20.082 -19.745 -14.814 1.00 0.00 N ATOM 1388 NH2 ARG B 86 20.151 -17.628 -13.922 1.00 0.00 N ATOM 0 H ARG B 86 15.304 -19.064 -10.433 1.00 0.00 H new ATOM 0 HA ARG B 86 16.264 -21.527 -9.418 1.00 0.00 H new ATOM 0 HB2 ARG B 86 17.760 -19.141 -10.582 1.00 0.00 H new ATOM 0 HB3 ARG B 86 18.418 -20.754 -10.388 1.00 0.00 H new ATOM 0 HG2 ARG B 86 16.568 -21.595 -11.915 1.00 0.00 H new ATOM 0 HG3 ARG B 86 16.139 -19.923 -12.214 1.00 0.00 H new ATOM 0 HD2 ARG B 86 18.816 -21.239 -12.811 1.00 0.00 H new ATOM 0 HD3 ARG B 86 17.615 -20.740 -13.986 1.00 0.00 H new ATOM 0 HE ARG B 86 18.336 -18.452 -12.439 1.00 0.00 H new ATOM 0 HH11 ARG B 86 19.686 -20.685 -14.828 1.00 0.00 H new ATOM 0 HH12 ARG B 86 20.823 -19.494 -15.469 1.00 0.00 H new ATOM 0 HH21 ARG B 86 19.809 -16.940 -13.251 1.00 0.00 H new ATOM 0 HH22 ARG B 86 20.892 -17.377 -14.577 1.00 0.00 H new ATOM 1402 N LEU B 87 17.045 -18.818 -7.733 1.00 0.00 N ATOM 1403 CA LEU B 87 17.656 -18.324 -6.503 1.00 0.00 C ATOM 1404 C LEU B 87 16.921 -18.867 -5.277 1.00 0.00 C ATOM 1405 O LEU B 87 17.550 -19.298 -4.304 1.00 0.00 O ATOM 1406 CB LEU B 87 17.641 -16.795 -6.485 1.00 0.00 C ATOM 1407 CG LEU B 87 18.520 -16.147 -5.416 1.00 0.00 C ATOM 1408 CD1 LEU B 87 19.989 -16.382 -5.724 1.00 0.00 C ATOM 1409 CD2 LEU B 87 18.231 -14.661 -5.320 1.00 0.00 C ATOM 0 H LEU B 87 16.542 -18.109 -8.267 1.00 0.00 H new ATOM 0 HA LEU B 87 18.688 -18.672 -6.470 1.00 0.00 H new ATOM 0 HB2 LEU B 87 17.960 -16.433 -7.463 1.00 0.00 H new ATOM 0 HB3 LEU B 87 16.614 -16.460 -6.340 1.00 0.00 H new ATOM 0 HG LEU B 87 18.289 -16.606 -4.455 1.00 0.00 H new ATOM 0 HD11 LEU B 87 20.602 -15.914 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU B 87 20.189 -17.453 -5.746 1.00 0.00 H new ATOM 0 HD13 LEU B 87 20.231 -15.947 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU B 87 18.866 -14.216 -4.554 1.00 0.00 H new ATOM 0 HD22 LEU B 87 18.435 -14.188 -6.281 1.00 0.00 H new ATOM 0 HD23 LEU B 87 17.184 -14.510 -5.056 1.00 0.00 H new ATOM 1421 N PHE B 88 15.592 -18.822 -5.339 1.00 0.00 N ATOM 1422 CA PHE B 88 14.718 -19.383 -4.317 1.00 0.00 C ATOM 1423 C PHE B 88 15.160 -20.781 -3.901 1.00 0.00 C ATOM 1424 O PHE B 88 15.250 -21.079 -2.718 1.00 0.00 O ATOM 1425 CB PHE B 88 13.283 -19.398 -4.862 1.00 0.00 C ATOM 1426 CG PHE B 88 12.359 -20.381 -4.207 1.00 0.00 C ATOM 1427 CD1 PHE B 88 12.172 -21.638 -4.760 1.00 0.00 C ATOM 1428 CD2 PHE B 88 11.665 -20.049 -3.057 1.00 0.00 C ATOM 1429 CE1 PHE B 88 11.313 -22.543 -4.179 1.00 0.00 C ATOM 1430 CE2 PHE B 88 10.804 -20.956 -2.470 1.00 0.00 C ATOM 1431 CZ PHE B 88 10.629 -22.202 -3.034 1.00 0.00 C ATOM 0 H PHE B 88 15.087 -18.388 -6.112 1.00 0.00 H new ATOM 0 HA PHE B 88 14.769 -18.764 -3.422 1.00 0.00 H new ATOM 0 HB2 PHE B 88 12.860 -18.399 -4.754 1.00 0.00 H new ATOM 0 HB3 PHE B 88 13.320 -19.615 -5.930 1.00 0.00 H new ATOM 0 HD1 PHE B 88 12.707 -21.911 -5.658 1.00 0.00 H new ATOM 0 HD2 PHE B 88 11.797 -19.073 -2.615 1.00 0.00 H new ATOM 0 HE1 PHE B 88 11.176 -23.519 -4.621 1.00 0.00 H new ATOM 0 HE2 PHE B 88 10.269 -20.689 -1.571 1.00 0.00 H new ATOM 0 HZ PHE B 88 9.955 -22.911 -2.577 1.00 0.00 H new ATOM 1441 N GLU B 89 15.442 -21.627 -4.877 1.00 0.00 N ATOM 1442 CA GLU B 89 15.867 -22.997 -4.605 1.00 0.00 C ATOM 1443 C GLU B 89 17.205 -23.026 -3.888 1.00 0.00 C ATOM 1444 O GLU B 89 17.403 -23.770 -2.928 1.00 0.00 O ATOM 1445 CB GLU B 89 16.024 -23.758 -5.907 1.00 0.00 C ATOM 1446 CG GLU B 89 14.772 -23.804 -6.751 1.00 0.00 C ATOM 1447 CD GLU B 89 15.051 -24.370 -8.126 1.00 0.00 C ATOM 1448 OE1 GLU B 89 15.461 -23.607 -9.021 1.00 0.00 O ATOM 1449 OE2 GLU B 89 14.891 -25.595 -8.312 1.00 0.00 O ATOM 0 H GLU B 89 15.385 -21.392 -5.868 1.00 0.00 H new ATOM 0 HA GLU B 89 15.105 -23.456 -3.975 1.00 0.00 H new ATOM 0 HB2 GLU B 89 16.824 -23.300 -6.488 1.00 0.00 H new ATOM 0 HB3 GLU B 89 16.336 -24.778 -5.683 1.00 0.00 H new ATOM 0 HG2 GLU B 89 14.018 -24.412 -6.252 1.00 0.00 H new ATOM 0 HG3 GLU B 89 14.359 -22.800 -6.847 1.00 0.00 H new ATOM 1456 N GLU B 90 18.116 -22.210 -4.372 1.00 0.00 N ATOM 1457 CA GLU B 90 19.504 -22.274 -3.964 1.00 0.00 C ATOM 1458 C GLU B 90 19.716 -21.747 -2.548 1.00 0.00 C ATOM 1459 O GLU B 90 20.443 -22.347 -1.760 1.00 0.00 O ATOM 1460 CB GLU B 90 20.350 -21.505 -4.966 1.00 0.00 C ATOM 1461 CG GLU B 90 20.521 -22.238 -6.283 1.00 0.00 C ATOM 1462 CD GLU B 90 21.211 -23.578 -6.116 1.00 0.00 C ATOM 1463 OE1 GLU B 90 22.457 -23.615 -6.162 1.00 0.00 O ATOM 1464 OE2 GLU B 90 20.517 -24.602 -5.941 1.00 0.00 O ATOM 0 H GLU B 90 17.916 -21.483 -5.059 1.00 0.00 H new ATOM 0 HA GLU B 90 19.811 -23.320 -3.949 1.00 0.00 H new ATOM 0 HB2 GLU B 90 19.889 -20.535 -5.153 1.00 0.00 H new ATOM 0 HB3 GLU B 90 21.332 -21.313 -4.533 1.00 0.00 H new ATOM 0 HG2 GLU B 90 19.543 -22.391 -6.740 1.00 0.00 H new ATOM 0 HG3 GLU B 90 21.099 -21.618 -6.968 1.00 0.00 H new ATOM 1471 N PHE B 91 19.068 -20.643 -2.218 1.00 0.00 N ATOM 1472 CA PHE B 91 19.220 -20.049 -0.894 1.00 0.00 C ATOM 1473 C PHE B 91 18.070 -20.443 0.025 1.00 0.00 C ATOM 1474 O PHE B 91 17.863 -19.833 1.074 1.00 0.00 O ATOM 1475 CB PHE B 91 19.337 -18.525 -0.990 1.00 0.00 C ATOM 1476 CG PHE B 91 20.689 -18.067 -1.455 1.00 0.00 C ATOM 1477 CD1 PHE B 91 20.977 -17.960 -2.805 1.00 0.00 C ATOM 1478 CD2 PHE B 91 21.677 -17.750 -0.536 1.00 0.00 C ATOM 1479 CE1 PHE B 91 22.223 -17.543 -3.231 1.00 0.00 C ATOM 1480 CE2 PHE B 91 22.925 -17.331 -0.956 1.00 0.00 C ATOM 1481 CZ PHE B 91 23.198 -17.228 -2.306 1.00 0.00 C ATOM 0 H PHE B 91 18.435 -20.140 -2.841 1.00 0.00 H new ATOM 0 HA PHE B 91 20.142 -20.437 -0.461 1.00 0.00 H new ATOM 0 HB2 PHE B 91 18.577 -18.151 -1.676 1.00 0.00 H new ATOM 0 HB3 PHE B 91 19.128 -18.088 -0.014 1.00 0.00 H new ATOM 0 HD1 PHE B 91 20.218 -18.205 -3.534 1.00 0.00 H new ATOM 0 HD2 PHE B 91 21.469 -17.831 0.521 1.00 0.00 H new ATOM 0 HE1 PHE B 91 22.434 -17.463 -4.287 1.00 0.00 H new ATOM 0 HE2 PHE B 91 23.686 -17.085 -0.230 1.00 0.00 H new ATOM 0 HZ PHE B 91 24.173 -16.902 -2.637 1.00 0.00 H new ATOM 1491 N ARG B 92 17.355 -21.495 -0.355 1.00 0.00 N ATOM 1492 CA ARG B 92 16.214 -21.973 0.419 1.00 0.00 C ATOM 1493 C ARG B 92 16.683 -22.714 1.667 1.00 0.00 C ATOM 1494 O ARG B 92 15.898 -23.005 2.567 1.00 0.00 O ATOM 1495 CB ARG B 92 15.332 -22.878 -0.439 1.00 0.00 C ATOM 1496 CG ARG B 92 13.922 -23.036 0.099 1.00 0.00 C ATOM 1497 CD ARG B 92 13.040 -23.809 -0.866 1.00 0.00 C ATOM 1498 NE ARG B 92 11.713 -24.051 -0.302 1.00 0.00 N ATOM 1499 CZ ARG B 92 10.940 -25.083 -0.637 1.00 0.00 C ATOM 1500 NH1 ARG B 92 11.319 -25.914 -1.599 1.00 0.00 N ATOM 1501 NH2 ARG B 92 9.779 -25.273 -0.021 1.00 0.00 N ATOM 0 H ARG B 92 17.546 -22.036 -1.198 1.00 0.00 H new ATOM 0 HA ARG B 92 15.626 -21.111 0.734 1.00 0.00 H new ATOM 0 HB2 ARG B 92 15.283 -22.472 -1.450 1.00 0.00 H new ATOM 0 HB3 ARG B 92 15.797 -23.861 -0.512 1.00 0.00 H new ATOM 0 HG2 ARG B 92 13.953 -23.553 1.058 1.00 0.00 H new ATOM 0 HG3 ARG B 92 13.489 -22.052 0.281 1.00 0.00 H new ATOM 0 HD2 ARG B 92 12.944 -23.253 -1.798 1.00 0.00 H new ATOM 0 HD3 ARG B 92 13.512 -24.761 -1.110 1.00 0.00 H new ATOM 0 HE ARG B 92 11.358 -23.390 0.389 1.00 0.00 H new ATOM 0 HH11 ARG B 92 12.204 -25.763 -2.084 1.00 0.00 H new ATOM 0 HH12 ARG B 92 10.726 -26.704 -1.854 1.00 0.00 H new ATOM 0 HH21 ARG B 92 9.478 -24.628 0.710 1.00 0.00 H new ATOM 0 HH22 ARG B 92 9.188 -26.064 -0.279 1.00 0.00 H new ATOM 1515 N ASP B 93 17.977 -23.005 1.709 1.00 0.00 N ATOM 1516 CA ASP B 93 18.596 -23.660 2.859 1.00 0.00 C ATOM 1517 C ASP B 93 18.724 -22.680 4.031 1.00 0.00 C ATOM 1518 O ASP B 93 19.287 -22.994 5.081 1.00 0.00 O ATOM 1519 CB ASP B 93 19.968 -24.217 2.452 1.00 0.00 C ATOM 1520 CG ASP B 93 20.660 -24.985 3.562 1.00 0.00 C ATOM 1521 OD1 ASP B 93 20.212 -26.102 3.894 1.00 0.00 O ATOM 1522 OD2 ASP B 93 21.680 -24.487 4.090 1.00 0.00 O ATOM 0 H ASP B 93 18.627 -22.795 0.951 1.00 0.00 H new ATOM 0 HA ASP B 93 17.965 -24.486 3.187 1.00 0.00 H new ATOM 0 HB2 ASP B 93 19.845 -24.872 1.589 1.00 0.00 H new ATOM 0 HB3 ASP B 93 20.608 -23.393 2.137 1.00 0.00 H new ATOM 1527 N SER B 94 18.156 -21.499 3.858 1.00 0.00 N ATOM 1528 CA SER B 94 18.173 -20.483 4.887 1.00 0.00 C ATOM 1529 C SER B 94 16.811 -20.433 5.565 1.00 0.00 C ATOM 1530 O SER B 94 15.824 -20.922 5.016 1.00 0.00 O ATOM 1531 CB SER B 94 18.497 -19.122 4.269 1.00 0.00 C ATOM 1532 OG SER B 94 19.576 -19.221 3.355 1.00 0.00 O ATOM 0 H SER B 94 17.673 -21.222 3.003 1.00 0.00 H new ATOM 0 HA SER B 94 18.938 -20.725 5.625 1.00 0.00 H new ATOM 0 HB2 SER B 94 17.617 -18.733 3.757 1.00 0.00 H new ATOM 0 HB3 SER B 94 18.748 -18.412 5.057 1.00 0.00 H new ATOM 0 HG SER B 94 19.231 -19.435 2.463 1.00 0.00 H new ATOM 1538 N ASP B 95 16.755 -19.857 6.757 1.00 0.00 N ATOM 1539 CA ASP B 95 15.503 -19.777 7.498 1.00 0.00 C ATOM 1540 C ASP B 95 14.520 -18.878 6.757 1.00 0.00 C ATOM 1541 O ASP B 95 13.366 -19.241 6.538 1.00 0.00 O ATOM 1542 CB ASP B 95 15.764 -19.256 8.909 1.00 0.00 C ATOM 1543 CG ASP B 95 14.712 -19.702 9.902 1.00 0.00 C ATOM 1544 OD1 ASP B 95 13.977 -18.843 10.428 1.00 0.00 O ATOM 1545 OD2 ASP B 95 14.648 -20.920 10.186 1.00 0.00 O ATOM 0 H ASP B 95 17.557 -19.440 7.230 1.00 0.00 H new ATOM 0 HA ASP B 95 15.065 -20.772 7.578 1.00 0.00 H new ATOM 0 HB2 ASP B 95 16.742 -19.601 9.244 1.00 0.00 H new ATOM 0 HB3 ASP B 95 15.800 -18.167 8.889 1.00 0.00 H new ATOM 1550 N ASP B 96 15.001 -17.707 6.358 1.00 0.00 N ATOM 1551 CA ASP B 96 14.253 -16.832 5.465 1.00 0.00 C ATOM 1552 C ASP B 96 14.858 -16.894 4.073 1.00 0.00 C ATOM 1553 O ASP B 96 15.879 -16.250 3.813 1.00 0.00 O ATOM 1554 CB ASP B 96 14.279 -15.374 5.941 1.00 0.00 C ATOM 1555 CG ASP B 96 13.447 -15.117 7.176 1.00 0.00 C ATOM 1556 OD1 ASP B 96 14.014 -15.118 8.285 1.00 0.00 O ATOM 1557 OD2 ASP B 96 12.234 -14.870 7.037 1.00 0.00 O ATOM 0 H ASP B 96 15.910 -17.340 6.641 1.00 0.00 H new ATOM 0 HA ASP B 96 13.219 -17.176 5.457 1.00 0.00 H new ATOM 0 HB2 ASP B 96 15.311 -15.087 6.144 1.00 0.00 H new ATOM 0 HB3 ASP B 96 13.922 -14.733 5.135 1.00 0.00 H new ATOM 1562 N VAL B 97 14.259 -17.672 3.178 1.00 0.00 N ATOM 1563 CA VAL B 97 14.771 -17.756 1.815 1.00 0.00 C ATOM 1564 C VAL B 97 14.638 -16.403 1.121 1.00 0.00 C ATOM 1565 O VAL B 97 15.552 -15.966 0.421 1.00 0.00 O ATOM 1566 CB VAL B 97 14.088 -18.866 0.972 1.00 0.00 C ATOM 1567 CG1 VAL B 97 12.592 -18.642 0.823 1.00 0.00 C ATOM 1568 CG2 VAL B 97 14.742 -18.961 -0.399 1.00 0.00 C ATOM 0 H VAL B 97 13.435 -18.243 3.366 1.00 0.00 H new ATOM 0 HA VAL B 97 15.823 -18.030 1.891 1.00 0.00 H new ATOM 0 HB VAL B 97 14.222 -19.806 1.507 1.00 0.00 H new ATOM 0 HG11 VAL B 97 12.162 -19.445 0.225 1.00 0.00 H new ATOM 0 HG12 VAL B 97 12.126 -18.633 1.808 1.00 0.00 H new ATOM 0 HG13 VAL B 97 12.415 -17.687 0.329 1.00 0.00 H new ATOM 0 HG21 VAL B 97 14.255 -19.743 -0.981 1.00 0.00 H new ATOM 0 HG22 VAL B 97 14.642 -18.007 -0.917 1.00 0.00 H new ATOM 0 HG23 VAL B 97 15.799 -19.201 -0.282 1.00 0.00 H new ATOM 1578 N LEU B 98 13.518 -15.720 1.366 1.00 0.00 N ATOM 1579 CA LEU B 98 13.277 -14.416 0.769 1.00 0.00 C ATOM 1580 C LEU B 98 14.376 -13.445 1.164 1.00 0.00 C ATOM 1581 O LEU B 98 14.853 -12.684 0.338 1.00 0.00 O ATOM 1582 CB LEU B 98 11.925 -13.838 1.195 1.00 0.00 C ATOM 1583 CG LEU B 98 10.704 -14.709 0.906 1.00 0.00 C ATOM 1584 CD1 LEU B 98 10.252 -15.416 2.166 1.00 0.00 C ATOM 1585 CD2 LEU B 98 9.575 -13.873 0.335 1.00 0.00 C ATOM 0 H LEU B 98 12.768 -16.052 1.973 1.00 0.00 H new ATOM 0 HA LEU B 98 13.270 -14.553 -0.312 1.00 0.00 H new ATOM 0 HB2 LEU B 98 11.959 -13.638 2.266 1.00 0.00 H new ATOM 0 HB3 LEU B 98 11.789 -12.879 0.696 1.00 0.00 H new ATOM 0 HG LEU B 98 10.983 -15.459 0.166 1.00 0.00 H new ATOM 0 HD11 LEU B 98 9.381 -16.033 1.945 1.00 0.00 H new ATOM 0 HD12 LEU B 98 11.059 -16.047 2.538 1.00 0.00 H new ATOM 0 HD13 LEU B 98 9.990 -14.677 2.924 1.00 0.00 H new ATOM 0 HD21 LEU B 98 8.714 -14.511 0.136 1.00 0.00 H new ATOM 0 HD22 LEU B 98 9.296 -13.101 1.052 1.00 0.00 H new ATOM 0 HD23 LEU B 98 9.902 -13.405 -0.593 1.00 0.00 H new ATOM 1597 N GLY B 99 14.785 -13.503 2.426 1.00 0.00 N ATOM 1598 CA GLY B 99 15.813 -12.609 2.925 1.00 0.00 C ATOM 1599 C GLY B 99 17.077 -12.632 2.090 1.00 0.00 C ATOM 1600 O GLY B 99 17.628 -11.582 1.764 1.00 0.00 O ATOM 0 H GLY B 99 14.420 -14.158 3.117 1.00 0.00 H new ATOM 0 HA2 GLY B 99 15.421 -11.592 2.951 1.00 0.00 H new ATOM 0 HA3 GLY B 99 16.058 -12.883 3.951 1.00 0.00 H new ATOM 1604 N HIS B 100 17.527 -13.826 1.723 1.00 0.00 N ATOM 1605 CA HIS B 100 18.740 -13.956 0.926 1.00 0.00 C ATOM 1606 C HIS B 100 18.439 -13.713 -0.542 1.00 0.00 C ATOM 1607 O HIS B 100 19.316 -13.317 -1.309 1.00 0.00 O ATOM 1608 CB HIS B 100 19.392 -15.324 1.132 1.00 0.00 C ATOM 1609 CG HIS B 100 20.087 -15.437 2.451 1.00 0.00 C ATOM 1610 ND1 HIS B 100 21.438 -15.229 2.607 1.00 0.00 N ATOM 1611 CD2 HIS B 100 19.606 -15.702 3.687 1.00 0.00 C ATOM 1612 CE1 HIS B 100 21.753 -15.358 3.879 1.00 0.00 C ATOM 1613 NE2 HIS B 100 20.661 -15.644 4.560 1.00 0.00 N ATOM 0 H HIS B 100 17.076 -14.709 1.962 1.00 0.00 H new ATOM 0 HA HIS B 100 19.449 -13.199 1.261 1.00 0.00 H new ATOM 0 HB2 HIS B 100 18.630 -16.100 1.059 1.00 0.00 H new ATOM 0 HB3 HIS B 100 20.109 -15.505 0.331 1.00 0.00 H new ATOM 0 HD2 HIS B 100 18.579 -15.919 3.940 1.00 0.00 H new ATOM 0 HE1 HIS B 100 22.743 -15.248 4.296 1.00 0.00 H new ATOM 0 HE2 HIS B 100 20.610 -15.796 5.567 1.00 0.00 H new ATOM 1622 N ILE B 101 17.190 -13.944 -0.924 1.00 0.00 N ATOM 1623 CA ILE B 101 16.727 -13.590 -2.254 1.00 0.00 C ATOM 1624 C ILE B 101 16.848 -12.087 -2.464 1.00 0.00 C ATOM 1625 O ILE B 101 17.540 -11.639 -3.370 1.00 0.00 O ATOM 1626 CB ILE B 101 15.258 -14.020 -2.492 1.00 0.00 C ATOM 1627 CG1 ILE B 101 15.150 -15.545 -2.577 1.00 0.00 C ATOM 1628 CG2 ILE B 101 14.704 -13.374 -3.759 1.00 0.00 C ATOM 1629 CD1 ILE B 101 13.734 -16.041 -2.785 1.00 0.00 C ATOM 0 H ILE B 101 16.481 -14.375 -0.330 1.00 0.00 H new ATOM 0 HA ILE B 101 17.356 -14.123 -2.968 1.00 0.00 H new ATOM 0 HB ILE B 101 14.662 -13.679 -1.645 1.00 0.00 H new ATOM 0 HG12 ILE B 101 15.775 -15.900 -3.397 1.00 0.00 H new ATOM 0 HG13 ILE B 101 15.548 -15.981 -1.661 1.00 0.00 H new ATOM 0 HG21 ILE B 101 13.671 -13.690 -3.907 1.00 0.00 H new ATOM 0 HG22 ILE B 101 14.741 -12.289 -3.660 1.00 0.00 H new ATOM 0 HG23 ILE B 101 15.303 -13.681 -4.616 1.00 0.00 H new ATOM 0 HD11 ILE B 101 13.734 -17.130 -2.836 1.00 0.00 H new ATOM 0 HD12 ILE B 101 13.109 -15.716 -1.953 1.00 0.00 H new ATOM 0 HD13 ILE B 101 13.339 -15.634 -3.716 1.00 0.00 H new ATOM 1641 N MET B 102 16.209 -11.319 -1.585 1.00 0.00 N ATOM 1642 CA MET B 102 16.148 -9.863 -1.718 1.00 0.00 C ATOM 1643 C MET B 102 17.544 -9.261 -1.593 1.00 0.00 C ATOM 1644 O MET B 102 17.830 -8.199 -2.141 1.00 0.00 O ATOM 1645 CB MET B 102 15.247 -9.250 -0.633 1.00 0.00 C ATOM 1646 CG MET B 102 13.986 -10.048 -0.329 1.00 0.00 C ATOM 1647 SD MET B 102 13.199 -9.556 1.213 1.00 0.00 S ATOM 1648 CE MET B 102 12.551 -7.959 0.751 1.00 0.00 C ATOM 0 H MET B 102 15.722 -11.683 -0.766 1.00 0.00 H new ATOM 0 HA MET B 102 15.733 -9.637 -2.700 1.00 0.00 H new ATOM 0 HB2 MET B 102 15.826 -9.147 0.285 1.00 0.00 H new ATOM 0 HB3 MET B 102 14.959 -8.246 -0.943 1.00 0.00 H new ATOM 0 HG2 MET B 102 13.278 -9.924 -1.148 1.00 0.00 H new ATOM 0 HG3 MET B 102 14.236 -11.108 -0.281 1.00 0.00 H new ATOM 0 HE1 MET B 102 12.109 -7.479 1.624 1.00 0.00 H new ATOM 0 HE2 MET B 102 13.358 -7.337 0.365 1.00 0.00 H new ATOM 0 HE3 MET B 102 11.790 -8.084 -0.019 1.00 0.00 H new ATOM 1658 N LYS B 103 18.401 -9.961 -0.861 1.00 0.00 N ATOM 1659 CA LYS B 103 19.750 -9.494 -0.574 1.00 0.00 C ATOM 1660 C LYS B 103 20.666 -9.643 -1.791 1.00 0.00 C ATOM 1661 O LYS B 103 21.430 -8.732 -2.125 1.00 0.00 O ATOM 1662 CB LYS B 103 20.327 -10.295 0.599 1.00 0.00 C ATOM 1663 CG LYS B 103 21.657 -9.770 1.125 1.00 0.00 C ATOM 1664 CD LYS B 103 21.491 -8.482 1.915 1.00 0.00 C ATOM 1665 CE LYS B 103 20.669 -8.700 3.177 1.00 0.00 C ATOM 1666 NZ LYS B 103 20.684 -7.505 4.055 1.00 0.00 N ATOM 0 H LYS B 103 18.180 -10.868 -0.450 1.00 0.00 H new ATOM 0 HA LYS B 103 19.696 -8.436 -0.318 1.00 0.00 H new ATOM 0 HB2 LYS B 103 19.603 -10.296 1.414 1.00 0.00 H new ATOM 0 HB3 LYS B 103 20.457 -11.331 0.287 1.00 0.00 H new ATOM 0 HG2 LYS B 103 22.120 -10.526 1.759 1.00 0.00 H new ATOM 0 HG3 LYS B 103 22.334 -9.597 0.289 1.00 0.00 H new ATOM 0 HD2 LYS B 103 22.472 -8.090 2.183 1.00 0.00 H new ATOM 0 HD3 LYS B 103 21.007 -7.731 1.290 1.00 0.00 H new ATOM 0 HE2 LYS B 103 19.641 -8.939 2.905 1.00 0.00 H new ATOM 0 HE3 LYS B 103 21.061 -9.558 3.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 20.114 -7.691 4.904 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 21.663 -7.292 4.335 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 20.286 -6.692 3.542 1.00 0.00 H new ATOM 1680 N ASN B 104 20.580 -10.793 -2.454 1.00 0.00 N ATOM 1681 CA ASN B 104 21.549 -11.152 -3.493 1.00 0.00 C ATOM 1682 C ASN B 104 20.977 -11.013 -4.899 1.00 0.00 C ATOM 1683 O ASN B 104 21.669 -11.285 -5.882 1.00 0.00 O ATOM 1684 CB ASN B 104 22.042 -12.592 -3.292 1.00 0.00 C ATOM 1685 CG ASN B 104 22.927 -12.762 -2.067 1.00 0.00 C ATOM 1686 OD1 ASN B 104 22.792 -12.049 -1.071 1.00 0.00 O ATOM 1687 ND2 ASN B 104 23.846 -13.714 -2.132 1.00 0.00 N ATOM 0 H ASN B 104 19.854 -11.491 -2.294 1.00 0.00 H new ATOM 0 HA ASN B 104 22.380 -10.453 -3.397 1.00 0.00 H new ATOM 0 HB2 ASN B 104 21.181 -13.254 -3.203 1.00 0.00 H new ATOM 0 HB3 ASN B 104 22.595 -12.906 -4.177 1.00 0.00 H new ATOM 0 HD21 ASN B 104 24.470 -13.875 -1.341 1.00 0.00 H new ATOM 0 HD22 ASN B 104 23.930 -14.286 -2.973 1.00 0.00 H new ATOM 1694 N ILE B 105 19.726 -10.592 -5.013 1.00 0.00 N ATOM 1695 CA ILE B 105 19.097 -10.482 -6.321 1.00 0.00 C ATOM 1696 C ILE B 105 19.293 -9.086 -6.903 1.00 0.00 C ATOM 1697 O ILE B 105 19.555 -8.125 -6.182 1.00 0.00 O ATOM 1698 CB ILE B 105 17.590 -10.827 -6.271 1.00 0.00 C ATOM 1699 CG1 ILE B 105 17.014 -11.035 -7.675 1.00 0.00 C ATOM 1700 CG2 ILE B 105 16.810 -9.746 -5.542 1.00 0.00 C ATOM 1701 CD1 ILE B 105 17.583 -12.240 -8.393 1.00 0.00 C ATOM 0 H ILE B 105 19.133 -10.324 -4.227 1.00 0.00 H new ATOM 0 HA ILE B 105 19.585 -11.210 -6.969 1.00 0.00 H new ATOM 0 HB ILE B 105 17.491 -11.763 -5.721 1.00 0.00 H new ATOM 0 HG12 ILE B 105 15.932 -11.144 -7.602 1.00 0.00 H new ATOM 0 HG13 ILE B 105 17.205 -10.143 -8.272 1.00 0.00 H new ATOM 0 HG21 ILE B 105 15.753 -10.012 -5.520 1.00 0.00 H new ATOM 0 HG22 ILE B 105 17.182 -9.654 -4.522 1.00 0.00 H new ATOM 0 HG23 ILE B 105 16.934 -8.795 -6.060 1.00 0.00 H new ATOM 0 HD11 ILE B 105 17.129 -12.323 -9.380 1.00 0.00 H new ATOM 0 HD12 ILE B 105 18.662 -12.125 -8.499 1.00 0.00 H new ATOM 0 HD13 ILE B 105 17.369 -13.141 -7.818 1.00 0.00 H new ATOM 1713 N THR B 106 19.162 -8.999 -8.214 1.00 0.00 N ATOM 1714 CA THR B 106 19.395 -7.770 -8.940 1.00 0.00 C ATOM 1715 C THR B 106 18.285 -6.736 -8.685 1.00 0.00 C ATOM 1716 O THR B 106 18.558 -5.538 -8.587 1.00 0.00 O ATOM 1717 CB THR B 106 19.513 -8.086 -10.444 1.00 0.00 C ATOM 1718 OG1 THR B 106 20.078 -6.982 -11.162 1.00 0.00 O ATOM 1719 CG2 THR B 106 18.159 -8.437 -11.038 1.00 0.00 C ATOM 0 H THR B 106 18.890 -9.784 -8.805 1.00 0.00 H new ATOM 0 HA THR B 106 20.326 -7.328 -8.584 1.00 0.00 H new ATOM 0 HB THR B 106 20.175 -8.946 -10.541 1.00 0.00 H new ATOM 0 HG1 THR B 106 20.143 -7.209 -12.113 1.00 0.00 H new ATOM 0 HG21 THR B 106 18.273 -8.655 -12.100 1.00 0.00 H new ATOM 0 HG22 THR B 106 17.754 -9.312 -10.529 1.00 0.00 H new ATOM 0 HG23 THR B 106 17.477 -7.596 -10.912 1.00 0.00 H new ATOM 1727 N ALA B 107 17.044 -7.199 -8.559 1.00 0.00 N ATOM 1728 CA ALA B 107 15.919 -6.300 -8.347 1.00 0.00 C ATOM 1729 C ALA B 107 15.560 -6.241 -6.882 1.00 0.00 C ATOM 1730 O ALA B 107 15.317 -7.267 -6.252 1.00 0.00 O ATOM 1731 CB ALA B 107 14.709 -6.751 -9.143 1.00 0.00 C ATOM 0 H ALA B 107 16.795 -8.187 -8.600 1.00 0.00 H new ATOM 0 HA ALA B 107 16.216 -5.308 -8.687 1.00 0.00 H new ATOM 0 HB1 ALA B 107 13.881 -6.063 -8.968 1.00 0.00 H new ATOM 0 HB2 ALA B 107 14.955 -6.760 -10.205 1.00 0.00 H new ATOM 0 HB3 ALA B 107 14.420 -7.754 -8.829 1.00 0.00 H new ATOM 1737 N LYS B 108 15.485 -5.041 -6.350 1.00 0.00 N ATOM 1738 CA LYS B 108 15.178 -4.872 -4.950 1.00 0.00 C ATOM 1739 C LYS B 108 13.673 -4.763 -4.789 1.00 0.00 C ATOM 1740 O LYS B 108 13.061 -3.768 -5.181 1.00 0.00 O ATOM 1741 CB LYS B 108 15.894 -3.645 -4.378 1.00 0.00 C ATOM 1742 CG LYS B 108 17.342 -3.495 -4.849 1.00 0.00 C ATOM 1743 CD LYS B 108 18.121 -4.809 -4.808 1.00 0.00 C ATOM 1744 CE LYS B 108 18.227 -5.388 -3.407 1.00 0.00 C ATOM 1745 NZ LYS B 108 19.081 -4.558 -2.519 1.00 0.00 N ATOM 0 H LYS B 108 15.632 -4.172 -6.864 1.00 0.00 H new ATOM 0 HA LYS B 108 15.534 -5.736 -4.389 1.00 0.00 H new ATOM 0 HB2 LYS B 108 15.338 -2.750 -4.656 1.00 0.00 H new ATOM 0 HB3 LYS B 108 15.881 -3.704 -3.290 1.00 0.00 H new ATOM 0 HG2 LYS B 108 17.349 -3.106 -5.867 1.00 0.00 H new ATOM 0 HG3 LYS B 108 17.848 -2.759 -4.224 1.00 0.00 H new ATOM 0 HD2 LYS B 108 17.635 -5.535 -5.460 1.00 0.00 H new ATOM 0 HD3 LYS B 108 19.123 -4.645 -5.205 1.00 0.00 H new ATOM 0 HE2 LYS B 108 17.230 -5.472 -2.974 1.00 0.00 H new ATOM 0 HE3 LYS B 108 18.636 -6.397 -3.463 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 19.152 -5.009 -1.585 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 20.031 -4.470 -2.934 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 18.659 -3.613 -2.416 1.00 0.00 H new ATOM 1759 N ARG B 109 13.080 -5.815 -4.250 1.00 0.00 N ATOM 1760 CA ARG B 109 11.634 -5.925 -4.156 1.00 0.00 C ATOM 1761 C ARG B 109 11.236 -6.360 -2.752 1.00 0.00 C ATOM 1762 O ARG B 109 12.087 -6.761 -1.964 1.00 0.00 O ATOM 1763 CB ARG B 109 11.127 -6.930 -5.197 1.00 0.00 C ATOM 1764 CG ARG B 109 11.656 -8.337 -4.976 1.00 0.00 C ATOM 1765 CD ARG B 109 11.279 -9.277 -6.110 1.00 0.00 C ATOM 1766 NE ARG B 109 12.114 -9.091 -7.302 1.00 0.00 N ATOM 1767 CZ ARG B 109 13.130 -9.895 -7.631 1.00 0.00 C ATOM 1768 NH1 ARG B 109 13.530 -10.844 -6.792 1.00 0.00 N ATOM 1769 NH2 ARG B 109 13.759 -9.735 -8.788 1.00 0.00 N ATOM 0 H ARG B 109 13.585 -6.614 -3.867 1.00 0.00 H new ATOM 0 HA ARG B 109 11.182 -4.954 -4.356 1.00 0.00 H new ATOM 0 HB2 ARG B 109 10.037 -6.950 -5.173 1.00 0.00 H new ATOM 0 HB3 ARG B 109 11.418 -6.591 -6.191 1.00 0.00 H new ATOM 0 HG2 ARG B 109 12.741 -8.304 -4.879 1.00 0.00 H new ATOM 0 HG3 ARG B 109 11.264 -8.728 -4.037 1.00 0.00 H new ATOM 0 HD2 ARG B 109 11.368 -10.308 -5.767 1.00 0.00 H new ATOM 0 HD3 ARG B 109 10.234 -9.118 -6.375 1.00 0.00 H new ATOM 0 HE ARG B 109 11.907 -8.303 -7.915 1.00 0.00 H new ATOM 0 HH11 ARG B 109 13.062 -10.961 -5.894 1.00 0.00 H new ATOM 0 HH12 ARG B 109 14.306 -11.456 -7.046 1.00 0.00 H new ATOM 0 HH21 ARG B 109 13.468 -8.997 -9.429 1.00 0.00 H new ATOM 0 HH22 ARG B 109 14.534 -10.350 -9.036 1.00 0.00 H new ATOM 1783 N SER B 110 9.949 -6.290 -2.450 1.00 0.00 N ATOM 1784 CA SER B 110 9.460 -6.608 -1.115 1.00 0.00 C ATOM 1785 C SER B 110 9.018 -8.064 -1.025 1.00 0.00 C ATOM 1786 O SER B 110 8.747 -8.703 -2.046 1.00 0.00 O ATOM 1787 CB SER B 110 8.292 -5.694 -0.766 1.00 0.00 C ATOM 1788 OG SER B 110 8.530 -4.374 -1.221 1.00 0.00 O ATOM 0 H SER B 110 9.222 -6.016 -3.111 1.00 0.00 H new ATOM 0 HA SER B 110 10.273 -6.453 -0.406 1.00 0.00 H new ATOM 0 HB2 SER B 110 7.377 -6.079 -1.216 1.00 0.00 H new ATOM 0 HB3 SER B 110 8.139 -5.689 0.313 1.00 0.00 H new ATOM 0 HG SER B 110 7.767 -3.805 -0.988 1.00 0.00 H new ATOM 1794 N ARG B 111 8.917 -8.569 0.199 1.00 0.00 N ATOM 1795 CA ARG B 111 8.600 -9.972 0.432 1.00 0.00 C ATOM 1796 C ARG B 111 7.182 -10.318 0.035 1.00 0.00 C ATOM 1797 O ARG B 111 6.959 -11.345 -0.588 1.00 0.00 O ATOM 1798 CB ARG B 111 8.820 -10.346 1.887 1.00 0.00 C ATOM 1799 CG ARG B 111 10.281 -10.476 2.247 1.00 0.00 C ATOM 1800 CD ARG B 111 10.457 -11.133 3.594 1.00 0.00 C ATOM 1801 NE ARG B 111 11.862 -11.375 3.896 1.00 0.00 N ATOM 1802 CZ ARG B 111 12.271 -12.123 4.922 1.00 0.00 C ATOM 1803 NH1 ARG B 111 11.381 -12.780 5.656 1.00 0.00 N ATOM 1804 NH2 ARG B 111 13.562 -12.218 5.212 1.00 0.00 N ATOM 0 H ARG B 111 9.051 -8.023 1.050 1.00 0.00 H new ATOM 0 HA ARG B 111 9.277 -10.547 -0.199 1.00 0.00 H new ATOM 0 HB2 ARG B 111 8.360 -9.591 2.524 1.00 0.00 H new ATOM 0 HB3 ARG B 111 8.315 -11.289 2.095 1.00 0.00 H new ATOM 0 HG2 ARG B 111 10.795 -11.061 1.485 1.00 0.00 H new ATOM 0 HG3 ARG B 111 10.744 -9.489 2.258 1.00 0.00 H new ATOM 0 HD2 ARG B 111 10.022 -10.500 4.367 1.00 0.00 H new ATOM 0 HD3 ARG B 111 9.913 -12.077 3.612 1.00 0.00 H new ATOM 0 HE ARG B 111 12.567 -10.952 3.293 1.00 0.00 H new ATOM 0 HH11 ARG B 111 10.388 -12.712 5.435 1.00 0.00 H new ATOM 0 HH12 ARG B 111 11.691 -13.353 6.441 1.00 0.00 H new ATOM 0 HH21 ARG B 111 14.249 -11.717 4.649 1.00 0.00 H new ATOM 0 HH22 ARG B 111 13.867 -12.792 5.998 1.00 0.00 H new ATOM 1818 N ALA B 112 6.230 -9.466 0.390 1.00 0.00 N ATOM 1819 CA ALA B 112 4.830 -9.714 0.066 1.00 0.00 C ATOM 1820 C ALA B 112 4.658 -9.898 -1.438 1.00 0.00 C ATOM 1821 O ALA B 112 3.792 -10.642 -1.904 1.00 0.00 O ATOM 1822 CB ALA B 112 3.958 -8.568 0.560 1.00 0.00 C ATOM 0 H ALA B 112 6.400 -8.600 0.901 1.00 0.00 H new ATOM 0 HA ALA B 112 4.517 -10.630 0.568 1.00 0.00 H new ATOM 0 HB1 ALA B 112 2.916 -8.769 0.310 1.00 0.00 H new ATOM 0 HB2 ALA B 112 4.060 -8.473 1.641 1.00 0.00 H new ATOM 0 HB3 ALA B 112 4.273 -7.640 0.083 1.00 0.00 H new ATOM 1828 N ARG B 113 5.520 -9.229 -2.191 1.00 0.00 N ATOM 1829 CA ARG B 113 5.493 -9.305 -3.639 1.00 0.00 C ATOM 1830 C ARG B 113 6.173 -10.595 -4.110 1.00 0.00 C ATOM 1831 O ARG B 113 5.765 -11.207 -5.100 1.00 0.00 O ATOM 1832 CB ARG B 113 6.190 -8.074 -4.228 1.00 0.00 C ATOM 1833 CG ARG B 113 5.442 -7.415 -5.375 1.00 0.00 C ATOM 1834 CD ARG B 113 5.358 -8.309 -6.600 1.00 0.00 C ATOM 1835 NE ARG B 113 4.390 -9.396 -6.452 1.00 0.00 N ATOM 1836 CZ ARG B 113 3.074 -9.259 -6.626 1.00 0.00 C ATOM 1837 NH1 ARG B 113 2.541 -8.059 -6.776 1.00 0.00 N ATOM 1838 NH2 ARG B 113 2.283 -10.320 -6.620 1.00 0.00 N ATOM 0 H ARG B 113 6.251 -8.624 -1.816 1.00 0.00 H new ATOM 0 HA ARG B 113 4.459 -9.321 -3.985 1.00 0.00 H new ATOM 0 HB2 ARG B 113 6.334 -7.340 -3.435 1.00 0.00 H new ATOM 0 HB3 ARG B 113 7.181 -8.365 -4.577 1.00 0.00 H new ATOM 0 HG2 ARG B 113 4.435 -7.156 -5.048 1.00 0.00 H new ATOM 0 HG3 ARG B 113 5.940 -6.483 -5.642 1.00 0.00 H new ATOM 0 HD2 ARG B 113 5.087 -7.705 -7.466 1.00 0.00 H new ATOM 0 HD3 ARG B 113 6.342 -8.732 -6.802 1.00 0.00 H new ATOM 0 HE ARG B 113 4.744 -10.319 -6.199 1.00 0.00 H new ATOM 0 HH11 ARG B 113 3.136 -7.231 -6.759 1.00 0.00 H new ATOM 0 HH12 ARG B 113 1.534 -7.961 -6.909 1.00 0.00 H new ATOM 0 HH21 ARG B 113 2.678 -11.250 -6.482 1.00 0.00 H new ATOM 0 HH22 ARG B 113 1.278 -10.208 -6.754 1.00 0.00 H new ATOM 1852 N ILE B 114 7.203 -11.004 -3.385 1.00 0.00 N ATOM 1853 CA ILE B 114 7.928 -12.232 -3.690 1.00 0.00 C ATOM 1854 C ILE B 114 7.082 -13.453 -3.346 1.00 0.00 C ATOM 1855 O ILE B 114 7.017 -14.419 -4.106 1.00 0.00 O ATOM 1856 CB ILE B 114 9.244 -12.304 -2.890 1.00 0.00 C ATOM 1857 CG1 ILE B 114 10.176 -11.166 -3.287 1.00 0.00 C ATOM 1858 CG2 ILE B 114 9.930 -13.649 -3.088 1.00 0.00 C ATOM 1859 CD1 ILE B 114 11.416 -11.069 -2.415 1.00 0.00 C ATOM 0 H ILE B 114 7.560 -10.499 -2.574 1.00 0.00 H new ATOM 0 HA ILE B 114 8.150 -12.226 -4.757 1.00 0.00 H new ATOM 0 HB ILE B 114 9.001 -12.200 -1.832 1.00 0.00 H new ATOM 0 HG12 ILE B 114 10.481 -11.301 -4.325 1.00 0.00 H new ATOM 0 HG13 ILE B 114 9.630 -10.224 -3.235 1.00 0.00 H new ATOM 0 HG21 ILE B 114 10.856 -13.673 -2.513 1.00 0.00 H new ATOM 0 HG22 ILE B 114 9.270 -14.447 -2.748 1.00 0.00 H new ATOM 0 HG23 ILE B 114 10.156 -13.790 -4.145 1.00 0.00 H new ATOM 0 HD11 ILE B 114 12.035 -10.238 -2.753 1.00 0.00 H new ATOM 0 HD12 ILE B 114 11.120 -10.903 -1.379 1.00 0.00 H new ATOM 0 HD13 ILE B 114 11.984 -11.997 -2.486 1.00 0.00 H new ATOM 1871 N VAL B 115 6.445 -13.385 -2.187 1.00 0.00 N ATOM 1872 CA VAL B 115 5.598 -14.454 -1.686 1.00 0.00 C ATOM 1873 C VAL B 115 4.545 -14.863 -2.713 1.00 0.00 C ATOM 1874 O VAL B 115 4.447 -16.035 -3.078 1.00 0.00 O ATOM 1875 CB VAL B 115 4.914 -14.014 -0.376 1.00 0.00 C ATOM 1876 CG1 VAL B 115 3.752 -14.924 -0.028 1.00 0.00 C ATOM 1877 CG2 VAL B 115 5.918 -13.974 0.768 1.00 0.00 C ATOM 0 H VAL B 115 6.502 -12.580 -1.564 1.00 0.00 H new ATOM 0 HA VAL B 115 6.231 -15.320 -1.493 1.00 0.00 H new ATOM 0 HB VAL B 115 4.520 -13.009 -0.529 1.00 0.00 H new ATOM 0 HG11 VAL B 115 3.291 -14.587 0.901 1.00 0.00 H new ATOM 0 HG12 VAL B 115 3.015 -14.895 -0.830 1.00 0.00 H new ATOM 0 HG13 VAL B 115 4.114 -15.945 0.096 1.00 0.00 H new ATOM 0 HG21 VAL B 115 5.415 -13.661 1.683 1.00 0.00 H new ATOM 0 HG22 VAL B 115 6.347 -14.966 0.911 1.00 0.00 H new ATOM 0 HG23 VAL B 115 6.712 -13.266 0.531 1.00 0.00 H new ATOM 1887 N ASP B 116 3.766 -13.895 -3.186 1.00 0.00 N ATOM 1888 CA ASP B 116 2.739 -14.165 -4.191 1.00 0.00 C ATOM 1889 C ASP B 116 3.362 -14.756 -5.450 1.00 0.00 C ATOM 1890 O ASP B 116 2.786 -15.631 -6.093 1.00 0.00 O ATOM 1891 CB ASP B 116 1.982 -12.883 -4.541 1.00 0.00 C ATOM 1892 CG ASP B 116 0.929 -13.096 -5.613 1.00 0.00 C ATOM 1893 OD1 ASP B 116 -0.212 -13.482 -5.274 1.00 0.00 O ATOM 1894 OD2 ASP B 116 1.234 -12.859 -6.799 1.00 0.00 O ATOM 0 H ASP B 116 3.824 -12.920 -2.892 1.00 0.00 H new ATOM 0 HA ASP B 116 2.038 -14.887 -3.773 1.00 0.00 H new ATOM 0 HB2 ASP B 116 1.505 -12.491 -3.643 1.00 0.00 H new ATOM 0 HB3 ASP B 116 2.692 -12.128 -4.880 1.00 0.00 H new ATOM 1899 N LYS B 117 4.560 -14.286 -5.777 1.00 0.00 N ATOM 1900 CA LYS B 117 5.273 -14.752 -6.954 1.00 0.00 C ATOM 1901 C LYS B 117 5.613 -16.243 -6.834 1.00 0.00 C ATOM 1902 O LYS B 117 5.550 -16.978 -7.817 1.00 0.00 O ATOM 1903 CB LYS B 117 6.533 -13.894 -7.162 1.00 0.00 C ATOM 1904 CG LYS B 117 7.383 -14.274 -8.367 1.00 0.00 C ATOM 1905 CD LYS B 117 6.594 -14.292 -9.672 1.00 0.00 C ATOM 1906 CE LYS B 117 5.815 -13.014 -9.925 1.00 0.00 C ATOM 1907 NZ LYS B 117 5.031 -13.101 -11.187 1.00 0.00 N ATOM 0 H LYS B 117 5.058 -13.578 -5.238 1.00 0.00 H new ATOM 0 HA LYS B 117 4.633 -14.643 -7.830 1.00 0.00 H new ATOM 0 HB2 LYS B 117 6.231 -12.852 -7.265 1.00 0.00 H new ATOM 0 HB3 LYS B 117 7.150 -13.960 -6.266 1.00 0.00 H new ATOM 0 HG2 LYS B 117 8.209 -13.569 -8.458 1.00 0.00 H new ATOM 0 HG3 LYS B 117 7.821 -15.258 -8.200 1.00 0.00 H new ATOM 0 HD2 LYS B 117 7.282 -14.459 -10.501 1.00 0.00 H new ATOM 0 HD3 LYS B 117 5.902 -15.134 -9.657 1.00 0.00 H new ATOM 0 HE2 LYS B 117 5.142 -12.824 -9.089 1.00 0.00 H new ATOM 0 HE3 LYS B 117 6.503 -12.170 -9.979 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 4.563 -12.190 -11.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 5.669 -13.326 -11.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 4.312 -13.848 -11.099 1.00 0.00 H new ATOM 1921 N LEU B 118 5.938 -16.700 -5.627 1.00 0.00 N ATOM 1922 CA LEU B 118 6.202 -18.120 -5.407 1.00 0.00 C ATOM 1923 C LEU B 118 4.946 -18.937 -5.654 1.00 0.00 C ATOM 1924 O LEU B 118 4.985 -19.983 -6.303 1.00 0.00 O ATOM 1925 CB LEU B 118 6.665 -18.400 -3.983 1.00 0.00 C ATOM 1926 CG LEU B 118 7.975 -17.760 -3.543 1.00 0.00 C ATOM 1927 CD1 LEU B 118 8.430 -18.409 -2.252 1.00 0.00 C ATOM 1928 CD2 LEU B 118 9.042 -17.894 -4.616 1.00 0.00 C ATOM 0 H LEU B 118 6.024 -16.116 -4.795 1.00 0.00 H new ATOM 0 HA LEU B 118 6.992 -18.401 -6.104 1.00 0.00 H new ATOM 0 HB2 LEU B 118 5.881 -18.070 -3.301 1.00 0.00 H new ATOM 0 HB3 LEU B 118 6.758 -19.479 -3.863 1.00 0.00 H new ATOM 0 HG LEU B 118 7.813 -16.694 -3.380 1.00 0.00 H new ATOM 0 HD11 LEU B 118 9.368 -17.957 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU B 118 7.672 -18.261 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU B 118 8.578 -19.477 -2.414 1.00 0.00 H new ATOM 0 HD21 LEU B 118 9.965 -17.427 -4.272 1.00 0.00 H new ATOM 0 HD22 LEU B 118 9.223 -18.949 -4.819 1.00 0.00 H new ATOM 0 HD23 LEU B 118 8.705 -17.401 -5.528 1.00 0.00 H new ATOM 1940 N LEU B 119 3.836 -18.452 -5.109 1.00 0.00 N ATOM 1941 CA LEU B 119 2.545 -19.120 -5.232 1.00 0.00 C ATOM 1942 C LEU B 119 2.113 -19.184 -6.687 1.00 0.00 C ATOM 1943 O LEU B 119 1.443 -20.125 -7.114 1.00 0.00 O ATOM 1944 CB LEU B 119 1.484 -18.377 -4.414 1.00 0.00 C ATOM 1945 CG LEU B 119 1.429 -18.708 -2.910 1.00 0.00 C ATOM 1946 CD1 LEU B 119 0.984 -20.144 -2.706 1.00 0.00 C ATOM 1947 CD2 LEU B 119 2.770 -18.477 -2.224 1.00 0.00 C ATOM 0 H LEU B 119 3.805 -17.586 -4.570 1.00 0.00 H new ATOM 0 HA LEU B 119 2.649 -20.135 -4.849 1.00 0.00 H new ATOM 0 HB2 LEU B 119 1.655 -17.306 -4.523 1.00 0.00 H new ATOM 0 HB3 LEU B 119 0.507 -18.589 -4.847 1.00 0.00 H new ATOM 0 HG LEU B 119 0.705 -18.033 -2.454 1.00 0.00 H new ATOM 0 HD11 LEU B 119 0.949 -20.366 -1.639 1.00 0.00 H new ATOM 0 HD12 LEU B 119 -0.007 -20.283 -3.138 1.00 0.00 H new ATOM 0 HD13 LEU B 119 1.690 -20.816 -3.194 1.00 0.00 H new ATOM 0 HD21 LEU B 119 2.684 -18.723 -1.166 1.00 0.00 H new ATOM 0 HD22 LEU B 119 3.528 -19.111 -2.684 1.00 0.00 H new ATOM 0 HD23 LEU B 119 3.058 -17.431 -2.331 1.00 0.00 H new ATOM 1959 N ALA B 120 2.518 -18.180 -7.439 1.00 0.00 N ATOM 1960 CA ALA B 120 2.163 -18.075 -8.841 1.00 0.00 C ATOM 1961 C ALA B 120 2.953 -19.073 -9.683 1.00 0.00 C ATOM 1962 O ALA B 120 2.421 -19.677 -10.613 1.00 0.00 O ATOM 1963 CB ALA B 120 2.397 -16.653 -9.315 1.00 0.00 C ATOM 0 H ALA B 120 3.101 -17.416 -7.097 1.00 0.00 H new ATOM 0 HA ALA B 120 1.107 -18.318 -8.959 1.00 0.00 H new ATOM 0 HB1 ALA B 120 2.131 -16.572 -10.369 1.00 0.00 H new ATOM 0 HB2 ALA B 120 1.781 -15.969 -8.732 1.00 0.00 H new ATOM 0 HB3 ALA B 120 3.448 -16.395 -9.186 1.00 0.00 H new ATOM 1969 N LEU B 121 4.227 -19.244 -9.352 1.00 0.00 N ATOM 1970 CA LEU B 121 5.069 -20.233 -10.020 1.00 0.00 C ATOM 1971 C LEU B 121 4.736 -21.639 -9.545 1.00 0.00 C ATOM 1972 O LEU B 121 4.929 -22.615 -10.266 1.00 0.00 O ATOM 1973 CB LEU B 121 6.543 -19.955 -9.723 1.00 0.00 C ATOM 1974 CG LEU B 121 7.238 -18.935 -10.624 1.00 0.00 C ATOM 1975 CD1 LEU B 121 6.497 -17.609 -10.641 1.00 0.00 C ATOM 1976 CD2 LEU B 121 8.674 -18.741 -10.162 1.00 0.00 C ATOM 0 H LEU B 121 4.702 -18.710 -8.624 1.00 0.00 H new ATOM 0 HA LEU B 121 4.882 -20.160 -11.091 1.00 0.00 H new ATOM 0 HB2 LEU B 121 6.625 -19.611 -8.692 1.00 0.00 H new ATOM 0 HB3 LEU B 121 7.088 -20.897 -9.789 1.00 0.00 H new ATOM 0 HG LEU B 121 7.236 -19.320 -11.644 1.00 0.00 H new ATOM 0 HD11 LEU B 121 7.020 -16.908 -11.292 1.00 0.00 H new ATOM 0 HD12 LEU B 121 5.484 -17.763 -11.013 1.00 0.00 H new ATOM 0 HD13 LEU B 121 6.455 -17.203 -9.630 1.00 0.00 H new ATOM 0 HD21 LEU B 121 9.168 -18.013 -10.806 1.00 0.00 H new ATOM 0 HD22 LEU B 121 8.680 -18.379 -9.134 1.00 0.00 H new ATOM 0 HD23 LEU B 121 9.205 -19.692 -10.215 1.00 0.00 H new ATOM 1988 N GLY B 122 4.212 -21.728 -8.336 1.00 0.00 N ATOM 1989 CA GLY B 122 3.995 -23.015 -7.719 1.00 0.00 C ATOM 1990 C GLY B 122 5.267 -23.556 -7.106 1.00 0.00 C ATOM 1991 O GLY B 122 5.483 -24.765 -7.059 1.00 0.00 O ATOM 0 H GLY B 122 3.932 -20.928 -7.769 1.00 0.00 H new ATOM 0 HA2 GLY B 122 3.228 -22.926 -6.950 1.00 0.00 H new ATOM 0 HA3 GLY B 122 3.620 -23.718 -8.463 1.00 0.00 H new ATOM 1995 N LEU B 123 6.115 -22.646 -6.635 1.00 0.00 N ATOM 1996 CA LEU B 123 7.347 -23.025 -5.961 1.00 0.00 C ATOM 1997 C LEU B 123 7.020 -23.494 -4.561 1.00 0.00 C ATOM 1998 O LEU B 123 7.756 -24.263 -3.946 1.00 0.00 O ATOM 1999 CB LEU B 123 8.315 -21.843 -5.924 1.00 0.00 C ATOM 2000 CG LEU B 123 8.934 -21.478 -7.273 1.00 0.00 C ATOM 2001 CD1 LEU B 123 9.838 -20.266 -7.134 1.00 0.00 C ATOM 2002 CD2 LEU B 123 9.709 -22.661 -7.834 1.00 0.00 C ATOM 0 H LEU B 123 5.968 -21.639 -6.709 1.00 0.00 H new ATOM 0 HA LEU B 123 7.829 -23.836 -6.506 1.00 0.00 H new ATOM 0 HB2 LEU B 123 7.788 -20.972 -5.535 1.00 0.00 H new ATOM 0 HB3 LEU B 123 9.117 -22.070 -5.222 1.00 0.00 H new ATOM 0 HG LEU B 123 8.132 -21.228 -7.967 1.00 0.00 H new ATOM 0 HD11 LEU B 123 10.270 -20.021 -8.104 1.00 0.00 H new ATOM 0 HD12 LEU B 123 9.257 -19.418 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU B 123 10.637 -20.487 -6.427 1.00 0.00 H new ATOM 0 HD21 LEU B 123 10.145 -22.388 -8.795 1.00 0.00 H new ATOM 0 HD22 LEU B 123 10.503 -22.937 -7.141 1.00 0.00 H new ATOM 0 HD23 LEU B 123 9.035 -23.507 -7.969 1.00 0.00 H new ATOM 2014 N VAL B 124 5.890 -23.016 -4.081 1.00 0.00 N ATOM 2015 CA VAL B 124 5.357 -23.413 -2.795 1.00 0.00 C ATOM 2016 C VAL B 124 3.858 -23.629 -2.915 1.00 0.00 C ATOM 2017 O VAL B 124 3.270 -23.364 -3.964 1.00 0.00 O ATOM 2018 CB VAL B 124 5.635 -22.352 -1.717 1.00 0.00 C ATOM 2019 CG1 VAL B 124 7.134 -22.152 -1.539 1.00 0.00 C ATOM 2020 CG2 VAL B 124 4.942 -21.045 -2.079 1.00 0.00 C ATOM 0 H VAL B 124 5.312 -22.337 -4.576 1.00 0.00 H new ATOM 0 HA VAL B 124 5.850 -24.338 -2.495 1.00 0.00 H new ATOM 0 HB VAL B 124 5.231 -22.699 -0.766 1.00 0.00 H new ATOM 0 HG11 VAL B 124 7.312 -21.398 -0.772 1.00 0.00 H new ATOM 0 HG12 VAL B 124 7.593 -23.093 -1.236 1.00 0.00 H new ATOM 0 HG13 VAL B 124 7.571 -21.822 -2.481 1.00 0.00 H new ATOM 0 HG21 VAL B 124 5.145 -20.300 -1.309 1.00 0.00 H new ATOM 0 HG22 VAL B 124 5.317 -20.688 -3.038 1.00 0.00 H new ATOM 0 HG23 VAL B 124 3.867 -21.210 -2.149 1.00 0.00 H new ATOM 2030 N ALA B 125 3.247 -24.097 -1.846 1.00 0.00 N ATOM 2031 CA ALA B 125 1.812 -24.344 -1.838 1.00 0.00 C ATOM 2032 C ALA B 125 1.113 -23.407 -0.868 1.00 0.00 C ATOM 2033 O ALA B 125 -0.114 -23.351 -0.810 1.00 0.00 O ATOM 2034 CB ALA B 125 1.526 -25.793 -1.478 1.00 0.00 C ATOM 0 H ALA B 125 3.719 -24.316 -0.968 1.00 0.00 H new ATOM 0 HA ALA B 125 1.424 -24.152 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA B 125 0.449 -25.962 -1.476 1.00 0.00 H new ATOM 0 HB2 ALA B 125 1.995 -26.449 -2.211 1.00 0.00 H new ATOM 0 HB3 ALA B 125 1.929 -26.008 -0.488 1.00 0.00 H new ATOM 2040 N GLU B 126 1.916 -22.668 -0.112 1.00 0.00 N ATOM 2041 CA GLU B 126 1.416 -21.795 0.936 1.00 0.00 C ATOM 2042 C GLU B 126 2.553 -20.934 1.460 1.00 0.00 C ATOM 2043 O GLU B 126 3.700 -21.140 1.081 1.00 0.00 O ATOM 2044 CB GLU B 126 0.840 -22.633 2.071 1.00 0.00 C ATOM 2045 CG GLU B 126 1.855 -23.591 2.666 1.00 0.00 C ATOM 2046 CD GLU B 126 1.220 -24.583 3.614 1.00 0.00 C ATOM 2047 OE1 GLU B 126 1.223 -25.790 3.303 1.00 0.00 O ATOM 2048 OE2 GLU B 126 0.691 -24.156 4.661 1.00 0.00 O ATOM 0 H GLU B 126 2.931 -22.659 -0.210 1.00 0.00 H new ATOM 0 HA GLU B 126 0.632 -21.154 0.532 1.00 0.00 H new ATOM 0 HB2 GLU B 126 0.469 -21.971 2.854 1.00 0.00 H new ATOM 0 HB3 GLU B 126 -0.015 -23.199 1.701 1.00 0.00 H new ATOM 0 HG2 GLU B 126 2.357 -24.130 1.863 1.00 0.00 H new ATOM 0 HG3 GLU B 126 2.620 -23.023 3.196 1.00 0.00 H new ATOM 2055 N ARG B 127 2.239 -19.999 2.348 1.00 0.00 N ATOM 2056 CA ARG B 127 3.251 -19.109 2.912 1.00 0.00 C ATOM 2057 C ARG B 127 4.070 -19.807 3.994 1.00 0.00 C ATOM 2058 O ARG B 127 5.183 -19.393 4.305 1.00 0.00 O ATOM 2059 CB ARG B 127 2.615 -17.836 3.475 1.00 0.00 C ATOM 2060 CG ARG B 127 2.316 -16.781 2.422 1.00 0.00 C ATOM 2061 CD ARG B 127 1.198 -17.199 1.482 1.00 0.00 C ATOM 2062 NE ARG B 127 0.792 -16.106 0.596 1.00 0.00 N ATOM 2063 CZ ARG B 127 -0.146 -16.205 -0.349 1.00 0.00 C ATOM 2064 NH1 ARG B 127 -0.812 -17.342 -0.521 1.00 0.00 N ATOM 2065 NH2 ARG B 127 -0.434 -15.155 -1.106 1.00 0.00 N ATOM 0 H ARG B 127 1.293 -19.836 2.694 1.00 0.00 H new ATOM 0 HA ARG B 127 3.923 -18.833 2.100 1.00 0.00 H new ATOM 0 HB2 ARG B 127 1.688 -18.099 3.985 1.00 0.00 H new ATOM 0 HB3 ARG B 127 3.281 -17.409 4.224 1.00 0.00 H new ATOM 0 HG2 ARG B 127 2.043 -15.848 2.914 1.00 0.00 H new ATOM 0 HG3 ARG B 127 3.218 -16.584 1.843 1.00 0.00 H new ATOM 0 HD2 ARG B 127 1.526 -18.049 0.883 1.00 0.00 H new ATOM 0 HD3 ARG B 127 0.339 -17.532 2.065 1.00 0.00 H new ATOM 0 HE ARG B 127 1.259 -15.206 0.709 1.00 0.00 H new ATOM 0 HH11 ARG B 127 -0.608 -18.147 0.071 1.00 0.00 H new ATOM 0 HH12 ARG B 127 -1.527 -17.410 -1.245 1.00 0.00 H new ATOM 0 HH21 ARG B 127 0.061 -14.274 -0.966 1.00 0.00 H new ATOM 0 HH22 ARG B 127 -1.150 -15.228 -1.829 1.00 0.00 H new ATOM 2079 N ARG B 128 3.511 -20.868 4.551 1.00 0.00 N ATOM 2080 CA ARG B 128 4.167 -21.633 5.609 1.00 0.00 C ATOM 2081 C ARG B 128 5.517 -22.172 5.140 1.00 0.00 C ATOM 2082 O ARG B 128 6.479 -22.234 5.902 1.00 0.00 O ATOM 2083 CB ARG B 128 3.270 -22.805 6.012 1.00 0.00 C ATOM 2084 CG ARG B 128 3.767 -23.584 7.216 1.00 0.00 C ATOM 2085 CD ARG B 128 3.199 -24.997 7.245 1.00 0.00 C ATOM 2086 NE ARG B 128 1.765 -25.041 6.956 1.00 0.00 N ATOM 2087 CZ ARG B 128 0.911 -25.893 7.521 1.00 0.00 C ATOM 2088 NH1 ARG B 128 1.335 -26.776 8.420 1.00 0.00 N ATOM 2089 NH2 ARG B 128 -0.367 -25.872 7.164 1.00 0.00 N ATOM 0 H ARG B 128 2.593 -21.226 4.287 1.00 0.00 H new ATOM 0 HA ARG B 128 4.335 -20.973 6.460 1.00 0.00 H new ATOM 0 HB2 ARG B 128 2.271 -22.426 6.226 1.00 0.00 H new ATOM 0 HB3 ARG B 128 3.178 -23.486 5.166 1.00 0.00 H new ATOM 0 HG2 ARG B 128 4.856 -23.630 7.196 1.00 0.00 H new ATOM 0 HG3 ARG B 128 3.487 -23.060 8.130 1.00 0.00 H new ATOM 0 HD2 ARG B 128 3.730 -25.611 6.518 1.00 0.00 H new ATOM 0 HD3 ARG B 128 3.380 -25.436 8.226 1.00 0.00 H new ATOM 0 HE ARG B 128 1.395 -24.375 6.277 1.00 0.00 H new ATOM 0 HH11 ARG B 128 2.320 -26.804 8.682 1.00 0.00 H new ATOM 0 HH12 ARG B 128 0.675 -27.425 8.848 1.00 0.00 H new ATOM 0 HH21 ARG B 128 -0.689 -25.207 6.461 1.00 0.00 H new ATOM 0 HH22 ARG B 128 -1.027 -26.521 7.592 1.00 0.00 H new ATOM 2103 N GLU B 129 5.577 -22.520 3.865 1.00 0.00 N ATOM 2104 CA GLU B 129 6.707 -23.240 3.302 1.00 0.00 C ATOM 2105 C GLU B 129 7.844 -22.313 2.883 1.00 0.00 C ATOM 2106 O GLU B 129 8.909 -22.777 2.469 1.00 0.00 O ATOM 2107 CB GLU B 129 6.226 -24.052 2.105 1.00 0.00 C ATOM 2108 CG GLU B 129 5.134 -25.057 2.453 1.00 0.00 C ATOM 2109 CD GLU B 129 5.523 -26.006 3.576 1.00 0.00 C ATOM 2110 OE1 GLU B 129 5.315 -25.657 4.757 1.00 0.00 O ATOM 2111 OE2 GLU B 129 6.011 -27.116 3.284 1.00 0.00 O ATOM 0 H GLU B 129 4.842 -22.311 3.190 1.00 0.00 H new ATOM 0 HA GLU B 129 7.107 -23.896 4.075 1.00 0.00 H new ATOM 0 HB2 GLU B 129 5.852 -23.371 1.340 1.00 0.00 H new ATOM 0 HB3 GLU B 129 7.073 -24.583 1.672 1.00 0.00 H new ATOM 0 HG2 GLU B 129 4.231 -24.517 2.740 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.889 -25.639 1.564 1.00 0.00 H new ATOM 2118 N LEU B 130 7.619 -21.008 2.968 1.00 0.00 N ATOM 2119 CA LEU B 130 8.615 -20.038 2.518 1.00 0.00 C ATOM 2120 C LEU B 130 9.643 -19.820 3.612 1.00 0.00 C ATOM 2121 O LEU B 130 10.703 -19.233 3.393 1.00 0.00 O ATOM 2122 CB LEU B 130 7.969 -18.696 2.158 1.00 0.00 C ATOM 2123 CG LEU B 130 6.502 -18.754 1.738 1.00 0.00 C ATOM 2124 CD1 LEU B 130 6.038 -17.394 1.267 1.00 0.00 C ATOM 2125 CD2 LEU B 130 6.268 -19.791 0.659 1.00 0.00 C ATOM 0 H LEU B 130 6.763 -20.597 3.341 1.00 0.00 H new ATOM 0 HA LEU B 130 9.094 -20.438 1.624 1.00 0.00 H new ATOM 0 HB2 LEU B 130 8.055 -18.031 3.017 1.00 0.00 H new ATOM 0 HB3 LEU B 130 8.541 -18.245 1.348 1.00 0.00 H new ATOM 0 HG LEU B 130 5.920 -19.049 2.611 1.00 0.00 H new ATOM 0 HD11 LEU B 130 4.991 -17.449 0.971 1.00 0.00 H new ATOM 0 HD12 LEU B 130 6.148 -16.672 2.076 1.00 0.00 H new ATOM 0 HD13 LEU B 130 6.640 -17.079 0.415 1.00 0.00 H new ATOM 0 HD21 LEU B 130 5.212 -19.802 0.387 1.00 0.00 H new ATOM 0 HD22 LEU B 130 6.866 -19.544 -0.218 1.00 0.00 H new ATOM 0 HD23 LEU B 130 6.557 -20.774 1.030 1.00 0.00 H new ATOM 2137 N TYR B 131 9.309 -20.304 4.791 1.00 0.00 N ATOM 2138 CA TYR B 131 10.156 -20.174 5.954 1.00 0.00 C ATOM 2139 C TYR B 131 10.430 -21.572 6.476 1.00 0.00 C ATOM 2140 O TYR B 131 9.509 -22.243 6.948 1.00 0.00 O ATOM 2141 CB TYR B 131 9.450 -19.327 7.021 1.00 0.00 C ATOM 2142 CG TYR B 131 8.808 -18.065 6.475 1.00 0.00 C ATOM 2143 CD1 TYR B 131 9.483 -16.852 6.496 1.00 0.00 C ATOM 2144 CD2 TYR B 131 7.523 -18.089 5.935 1.00 0.00 C ATOM 2145 CE1 TYR B 131 8.901 -15.702 5.999 1.00 0.00 C ATOM 2146 CE2 TYR B 131 6.935 -16.943 5.433 1.00 0.00 C ATOM 2147 CZ TYR B 131 7.627 -15.753 5.469 1.00 0.00 C ATOM 2148 OH TYR B 131 7.051 -14.607 4.971 1.00 0.00 O ATOM 0 H TYR B 131 8.436 -20.801 4.968 1.00 0.00 H new ATOM 0 HA TYR B 131 11.092 -19.677 5.701 1.00 0.00 H new ATOM 0 HB2 TYR B 131 8.684 -19.933 7.505 1.00 0.00 H new ATOM 0 HB3 TYR B 131 10.172 -19.053 7.790 1.00 0.00 H new ATOM 0 HD1 TYR B 131 10.480 -16.807 6.908 1.00 0.00 H new ATOM 0 HD2 TYR B 131 6.977 -19.020 5.908 1.00 0.00 H new ATOM 0 HE1 TYR B 131 9.440 -14.767 6.025 1.00 0.00 H new ATOM 0 HE2 TYR B 131 5.940 -16.981 5.015 1.00 0.00 H new ATOM 0 HH TYR B 131 6.154 -14.812 4.634 1.00 0.00 H new