USER MOD reduce.3.24.130724 H: found=0, std=0, add=907, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 903 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 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 112 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 11 CYS SG : rot 136:sc= 0.405 USER MOD Set 2.2: A 14 CYS SG : rot -56:sc= -0.118 USER MOD Set 2.3: A 30 HIS :FLIP no HE2:sc= -0.188 F(o=-1.6,f=-0.25) USER MOD Set 2.4: A 34 CYS SG : rot 176:sc= -0.347 USER MOD Set 3.1: A 29 SER OG : rot 58:sc= 1.06 USER MOD Set 3.2: B 168 HIS : no HD1:sc= -1.04 K(o=0.015,f=-0.65) USER MOD Single : A 10 SER OG : rot 180:sc= -0.275 USER MOD Single : A 13 MET CE :methyl 174:sc= -2.41 (180deg=-2.55) USER MOD Single : A 15 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.4) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 24 GLN : amide:sc= -0.491 X(o=-0.49,f=-0.22) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0774 USER MOD Single : B 99 SER OG : rot 30:sc= 0.00407 USER MOD Single : B 100 HIS :FLIP no HD1:sc= -0.309 F(o=-0.99,f=-0.31) USER MOD Single : B 101 MET CE :methyl -175:sc= -0.447 (180deg=-0.562) USER MOD Single : B 102 GLN : amide:sc= -0.163 K(o=-0.16,f=-1.5!) USER MOD Single : B 107 THR OG1 : rot -59:sc= -0.356 USER MOD Single : B 109 THR OG1 : rot -18:sc= 0.843! USER MOD Single : B 111 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.119) USER MOD Single : B 114 THR OG1 : rot -87:sc= 1.98 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -160:sc= -0.373 USER MOD Single : B 125 ASN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD Single : B 127 LYS NZ :NH3+ -154:sc= -2.68 (180deg=-5.44!) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 GLN : amide:sc= -1.05 X(o=-1.1,f=-1.2) USER MOD Single : B 133 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.575) USER MOD Single : B 140 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.14) USER MOD Single : B 141 GLN : amide:sc= -3.12! C(o=-3.1!,f=-6.4!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 GLN : amide:sc= -2.02 K(o=-2,f=-5.1!) USER MOD Single : B 155 THR OG1 : rot 180:sc= 0 USER MOD Single : B 157 SER OG : rot -15:sc= 0.25 USER MOD Single : B 159 TYR OH : rot 165:sc=-0.00937 USER MOD Single : B 160 ASN : amide:sc= -0.0342 X(o=-0.034,f=-0.032) USER MOD Single : B 162 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot 84:sc= 1.08 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 73 N ALA A 7 -11.187 -5.272 3.943 1.00 0.00 N ATOM 74 CA ALA A 7 -11.446 -4.783 5.290 1.00 0.00 C ATOM 75 C ALA A 7 -12.579 -3.762 5.296 1.00 0.00 C ATOM 76 O ALA A 7 -13.206 -3.521 6.328 1.00 0.00 O ATOM 77 CB ALA A 7 -10.183 -4.175 5.883 1.00 0.00 C ATOM 0 HA ALA A 7 -11.752 -5.630 5.904 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.391 -3.814 6.890 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.399 -4.932 5.924 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.852 -3.344 5.260 1.00 0.00 H new ATOM 83 N LEU A 8 -12.836 -3.164 4.138 1.00 0.00 N ATOM 84 CA LEU A 8 -13.894 -2.169 4.009 1.00 0.00 C ATOM 85 C LEU A 8 -14.769 -2.459 2.794 1.00 0.00 C ATOM 86 O LEU A 8 -14.267 -2.668 1.691 1.00 0.00 O ATOM 87 CB LEU A 8 -13.291 -0.767 3.894 1.00 0.00 C ATOM 88 CG LEU A 8 -11.857 -0.695 3.367 1.00 0.00 C ATOM 89 CD1 LEU A 8 -11.610 0.638 2.676 1.00 0.00 C ATOM 90 CD2 LEU A 8 -10.861 -0.903 4.499 1.00 0.00 C ATOM 0 H LEU A 8 -12.326 -3.351 3.275 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.517 -2.219 4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -13.928 -0.172 3.240 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.319 -0.299 4.878 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.718 -1.492 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.585 0.672 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.300 0.748 1.840 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -11.768 1.450 3.386 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -9.846 -0.848 4.105 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.000 -0.128 5.253 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.023 -1.882 4.951 1.00 0.00 H new ATOM 102 N ARG A 9 -16.082 -2.465 3.005 1.00 0.00 N ATOM 103 CA ARG A 9 -17.028 -2.729 1.928 1.00 0.00 C ATOM 104 C ARG A 9 -17.486 -1.428 1.277 1.00 0.00 C ATOM 105 O ARG A 9 -18.255 -1.439 0.316 1.00 0.00 O ATOM 106 CB ARG A 9 -18.238 -3.500 2.460 1.00 0.00 C ATOM 107 CG ARG A 9 -18.938 -4.338 1.403 1.00 0.00 C ATOM 108 CD ARG A 9 -18.233 -5.668 1.189 1.00 0.00 C ATOM 109 NE ARG A 9 -19.119 -6.670 0.603 1.00 0.00 N ATOM 110 CZ ARG A 9 -20.061 -7.308 1.289 1.00 0.00 C ATOM 111 NH1 ARG A 9 -20.239 -7.048 2.576 1.00 0.00 N ATOM 112 NH2 ARG A 9 -20.829 -8.207 0.685 1.00 0.00 N ATOM 0 H ARG A 9 -16.514 -2.290 3.912 1.00 0.00 H new ATOM 0 HA ARG A 9 -16.523 -3.334 1.175 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -17.915 -4.151 3.273 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -18.952 -2.793 2.883 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -19.970 -4.517 1.704 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -18.971 -3.787 0.463 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -17.372 -5.521 0.538 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -17.853 -6.034 2.143 1.00 0.00 H new ATOM 0 HE ARG A 9 -19.009 -6.892 -0.386 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -19.652 -6.356 3.043 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -20.963 -7.539 3.100 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -20.696 -8.408 -0.306 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -21.552 -8.697 1.212 1.00 0.00 H new ATOM 126 N SER A 10 -17.009 -0.306 1.809 1.00 0.00 N ATOM 127 CA SER A 10 -17.374 1.004 1.283 1.00 0.00 C ATOM 128 C SER A 10 -16.290 2.034 1.591 1.00 0.00 C ATOM 129 O SER A 10 -15.878 2.194 2.740 1.00 0.00 O ATOM 130 CB SER A 10 -18.709 1.461 1.874 1.00 0.00 C ATOM 131 OG SER A 10 -19.461 0.357 2.347 1.00 0.00 O ATOM 0 H SER A 10 -16.370 -0.279 2.603 1.00 0.00 H new ATOM 0 HA SER A 10 -17.474 0.919 0.201 1.00 0.00 H new ATOM 0 HB2 SER A 10 -18.529 2.159 2.691 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.281 1.997 1.117 1.00 0.00 H new ATOM 0 HG SER A 10 -20.309 0.675 2.721 1.00 0.00 H new ATOM 137 N CYS A 11 -15.832 2.729 0.555 1.00 0.00 N ATOM 138 CA CYS A 11 -14.797 3.743 0.713 1.00 0.00 C ATOM 139 C CYS A 11 -15.169 4.736 1.809 1.00 0.00 C ATOM 140 O CYS A 11 -16.057 5.573 1.647 1.00 0.00 O ATOM 141 CB CYS A 11 -14.575 4.484 -0.608 1.00 0.00 C ATOM 142 SG CYS A 11 -13.120 5.580 -0.610 1.00 0.00 S ATOM 0 H CYS A 11 -16.162 2.608 -0.403 1.00 0.00 H new ATOM 0 HA CYS A 11 -13.873 3.241 1.001 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -14.467 3.753 -1.409 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -15.462 5.075 -0.834 1.00 0.00 H new ATOM 0 HG CYS A 11 -12.462 5.426 -1.721 1.00 0.00 H new ATOM 147 N PRO A 12 -14.475 4.642 2.953 1.00 0.00 N ATOM 148 CA PRO A 12 -14.714 5.524 4.099 1.00 0.00 C ATOM 149 C PRO A 12 -14.267 6.958 3.830 1.00 0.00 C ATOM 150 O PRO A 12 -14.441 7.840 4.671 1.00 0.00 O ATOM 151 CB PRO A 12 -13.867 4.900 5.210 1.00 0.00 C ATOM 152 CG PRO A 12 -12.787 4.163 4.495 1.00 0.00 C ATOM 153 CD PRO A 12 -13.402 3.668 3.215 1.00 0.00 C ATOM 0 HA PRO A 12 -15.774 5.597 4.343 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.455 5.664 5.870 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -14.461 4.229 5.831 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -11.937 4.815 4.293 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -12.416 3.333 5.097 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.675 3.643 2.403 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -13.795 2.657 3.323 1.00 0.00 H new ATOM 161 N MET A 13 -13.692 7.183 2.654 1.00 0.00 N ATOM 162 CA MET A 13 -13.221 8.510 2.275 1.00 0.00 C ATOM 163 C MET A 13 -14.307 9.279 1.530 1.00 0.00 C ATOM 164 O MET A 13 -14.669 10.392 1.914 1.00 0.00 O ATOM 165 CB MET A 13 -11.968 8.401 1.404 1.00 0.00 C ATOM 166 CG MET A 13 -10.906 9.437 1.734 1.00 0.00 C ATOM 167 SD MET A 13 -9.393 8.699 2.379 1.00 0.00 S ATOM 168 CE MET A 13 -8.912 7.656 1.006 1.00 0.00 C ATOM 0 H MET A 13 -13.541 6.464 1.947 1.00 0.00 H new ATOM 0 HA MET A 13 -12.974 9.055 3.186 1.00 0.00 H new ATOM 0 HB2 MET A 13 -11.541 7.405 1.520 1.00 0.00 H new ATOM 0 HB3 MET A 13 -12.253 8.506 0.357 1.00 0.00 H new ATOM 0 HG2 MET A 13 -10.672 10.010 0.837 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.304 10.139 2.466 1.00 0.00 H new ATOM 0 HE1 MET A 13 -7.937 7.214 1.209 1.00 0.00 H new ATOM 0 HE2 MET A 13 -9.649 6.864 0.875 1.00 0.00 H new ATOM 0 HE3 MET A 13 -8.857 8.254 0.097 1.00 0.00 H new ATOM 178 N CYS A 14 -14.824 8.680 0.463 1.00 0.00 N ATOM 179 CA CYS A 14 -15.869 9.308 -0.337 1.00 0.00 C ATOM 180 C CYS A 14 -17.176 8.526 -0.236 1.00 0.00 C ATOM 181 O CYS A 14 -18.047 8.641 -1.098 1.00 0.00 O ATOM 182 CB CYS A 14 -15.432 9.405 -1.800 1.00 0.00 C ATOM 183 SG CYS A 14 -15.409 7.809 -2.677 1.00 0.00 S ATOM 0 H CYS A 14 -14.536 7.759 0.132 1.00 0.00 H new ATOM 0 HA CYS A 14 -16.036 10.312 0.053 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -16.103 10.086 -2.324 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -14.436 9.845 -1.842 1.00 0.00 H new ATOM 0 HG CYS A 14 -14.643 6.974 -2.039 1.00 0.00 H new ATOM 188 N GLN A 15 -17.304 7.733 0.822 1.00 0.00 N ATOM 189 CA GLN A 15 -18.504 6.932 1.036 1.00 0.00 C ATOM 190 C GLN A 15 -18.959 6.277 -0.264 1.00 0.00 C ATOM 191 O GLN A 15 -20.025 6.595 -0.792 1.00 0.00 O ATOM 192 CB GLN A 15 -19.628 7.801 1.604 1.00 0.00 C ATOM 193 CG GLN A 15 -19.570 7.960 3.114 1.00 0.00 C ATOM 194 CD GLN A 15 -19.599 6.630 3.843 1.00 0.00 C ATOM 195 OE1 GLN A 15 -18.664 6.284 4.565 1.00 0.00 O ATOM 196 NE2 GLN A 15 -20.676 5.876 3.656 1.00 0.00 N ATOM 0 H GLN A 15 -16.592 7.628 1.545 1.00 0.00 H new ATOM 0 HA GLN A 15 -18.264 6.147 1.753 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -19.583 8.787 1.141 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -20.588 7.364 1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -18.661 8.498 3.384 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -20.411 8.569 3.444 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -21.428 6.202 3.049 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -20.752 4.971 4.120 1.00 0.00 H new ATOM 205 N LYS A 16 -18.144 5.361 -0.776 1.00 0.00 N ATOM 206 CA LYS A 16 -18.462 4.659 -2.014 1.00 0.00 C ATOM 207 C LYS A 16 -18.490 3.150 -1.792 1.00 0.00 C ATOM 208 O LYS A 16 -17.447 2.518 -1.633 1.00 0.00 O ATOM 209 CB LYS A 16 -17.440 5.006 -3.098 1.00 0.00 C ATOM 210 CG LYS A 16 -17.644 4.242 -4.395 1.00 0.00 C ATOM 211 CD LYS A 16 -17.898 5.182 -5.562 1.00 0.00 C ATOM 212 CE LYS A 16 -16.635 5.926 -5.963 1.00 0.00 C ATOM 213 NZ LYS A 16 -16.903 6.950 -7.010 1.00 0.00 N ATOM 0 H LYS A 16 -17.257 5.087 -0.352 1.00 0.00 H new ATOM 0 HA LYS A 16 -19.452 4.979 -2.340 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -17.491 6.075 -3.304 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -16.438 4.802 -2.720 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -16.764 3.633 -4.602 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -18.486 3.559 -4.287 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -18.273 4.614 -6.413 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -18.673 5.899 -5.291 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -16.204 6.408 -5.086 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -15.896 5.215 -6.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -16.017 7.435 -7.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -17.291 6.487 -7.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -17.589 7.644 -6.650 1.00 0.00 H new ATOM 227 N GLU A 17 -19.692 2.580 -1.784 1.00 0.00 N ATOM 228 CA GLU A 17 -19.855 1.145 -1.584 1.00 0.00 C ATOM 229 C GLU A 17 -19.118 0.357 -2.663 1.00 0.00 C ATOM 230 O GLU A 17 -19.395 0.506 -3.853 1.00 0.00 O ATOM 231 CB GLU A 17 -21.339 0.772 -1.586 1.00 0.00 C ATOM 232 CG GLU A 17 -22.084 1.230 -0.344 1.00 0.00 C ATOM 233 CD GLU A 17 -23.527 1.597 -0.632 1.00 0.00 C ATOM 234 OE1 GLU A 17 -24.282 0.718 -1.097 1.00 0.00 O ATOM 235 OE2 GLU A 17 -23.901 2.765 -0.392 1.00 0.00 O ATOM 0 H GLU A 17 -20.566 3.090 -1.914 1.00 0.00 H new ATOM 0 HA GLU A 17 -19.425 0.888 -0.616 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -21.813 1.208 -2.465 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -21.433 -0.310 -1.677 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -22.057 0.438 0.404 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -21.572 2.092 0.085 1.00 0.00 H new ATOM 242 N PHE A 18 -18.179 -0.481 -2.238 1.00 0.00 N ATOM 243 CA PHE A 18 -17.401 -1.292 -3.167 1.00 0.00 C ATOM 244 C PHE A 18 -18.219 -2.478 -3.671 1.00 0.00 C ATOM 245 O PHE A 18 -19.130 -2.950 -2.991 1.00 0.00 O ATOM 246 CB PHE A 18 -16.120 -1.791 -2.494 1.00 0.00 C ATOM 247 CG PHE A 18 -15.235 -0.684 -1.995 1.00 0.00 C ATOM 248 CD1 PHE A 18 -14.788 0.305 -2.857 1.00 0.00 C ATOM 249 CD2 PHE A 18 -14.852 -0.633 -0.666 1.00 0.00 C ATOM 250 CE1 PHE A 18 -13.974 1.325 -2.402 1.00 0.00 C ATOM 251 CE2 PHE A 18 -14.038 0.385 -0.204 1.00 0.00 C ATOM 252 CZ PHE A 18 -13.598 1.364 -1.074 1.00 0.00 C ATOM 0 H PHE A 18 -17.938 -0.616 -1.256 1.00 0.00 H new ATOM 0 HA PHE A 18 -17.135 -0.667 -4.020 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -16.386 -2.437 -1.658 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -15.560 -2.401 -3.203 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -15.079 0.278 -3.897 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -15.193 -1.397 0.018 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -13.633 2.090 -3.084 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.747 0.415 0.836 1.00 0.00 H new ATOM 0 HZ PHE A 18 -12.961 2.159 -0.716 1.00 0.00 H new ATOM 262 N ALA A 19 -17.886 -2.954 -4.866 1.00 0.00 N ATOM 263 CA ALA A 19 -18.588 -4.084 -5.461 1.00 0.00 C ATOM 264 C ALA A 19 -18.440 -5.335 -4.602 1.00 0.00 C ATOM 265 O ALA A 19 -17.475 -5.493 -3.854 1.00 0.00 O ATOM 266 CB ALA A 19 -18.073 -4.344 -6.869 1.00 0.00 C ATOM 0 H ALA A 19 -17.134 -2.574 -5.441 1.00 0.00 H new ATOM 0 HA ALA A 19 -19.648 -3.835 -5.515 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -18.606 -5.191 -7.301 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -18.236 -3.460 -7.485 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -17.007 -4.568 -6.831 1.00 0.00 H new ATOM 272 N PRO A 20 -19.417 -6.248 -4.711 1.00 0.00 N ATOM 273 CA PRO A 20 -19.418 -7.502 -3.950 1.00 0.00 C ATOM 274 C PRO A 20 -18.334 -8.464 -4.420 1.00 0.00 C ATOM 275 O PRO A 20 -17.726 -8.264 -5.473 1.00 0.00 O ATOM 276 CB PRO A 20 -20.806 -8.084 -4.226 1.00 0.00 C ATOM 277 CG PRO A 20 -21.208 -7.499 -5.537 1.00 0.00 C ATOM 278 CD PRO A 20 -20.598 -6.125 -5.583 1.00 0.00 C ATOM 0 HA PRO A 20 -19.213 -7.337 -2.892 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -20.777 -9.173 -4.270 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -21.511 -7.816 -3.440 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -20.850 -8.112 -6.364 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -22.293 -7.447 -5.625 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.320 -5.842 -6.598 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.290 -5.366 -5.218 1.00 0.00 H new ATOM 286 N ARG A 21 -18.096 -9.509 -3.635 1.00 0.00 N ATOM 287 CA ARG A 21 -17.084 -10.504 -3.972 1.00 0.00 C ATOM 288 C ARG A 21 -15.841 -9.838 -4.556 1.00 0.00 C ATOM 289 O ARG A 21 -15.242 -10.343 -5.506 1.00 0.00 O ATOM 290 CB ARG A 21 -17.647 -11.520 -4.966 1.00 0.00 C ATOM 291 CG ARG A 21 -18.002 -10.918 -6.316 1.00 0.00 C ATOM 292 CD ARG A 21 -18.098 -11.986 -7.394 1.00 0.00 C ATOM 293 NE ARG A 21 -18.926 -11.557 -8.518 1.00 0.00 N ATOM 294 CZ ARG A 21 -19.182 -12.318 -9.575 1.00 0.00 C ATOM 295 NH1 ARG A 21 -18.676 -13.542 -9.653 1.00 0.00 N ATOM 296 NH2 ARG A 21 -19.946 -11.858 -10.558 1.00 0.00 N ATOM 0 H ARG A 21 -18.590 -9.689 -2.761 1.00 0.00 H new ATOM 0 HA ARG A 21 -16.801 -11.023 -3.056 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -16.916 -12.315 -5.113 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -18.537 -11.980 -4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -18.952 -10.389 -6.241 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -17.248 -10.182 -6.597 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -17.098 -12.230 -7.753 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -18.514 -12.898 -6.965 1.00 0.00 H new ATOM 0 HE ARG A 21 -19.330 -10.621 -8.489 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.089 -13.900 -8.900 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -18.874 -14.125 -10.466 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -20.338 -10.918 -10.502 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -20.141 -12.445 -11.369 1.00 0.00 H new ATOM 310 N LEU A 22 -15.460 -8.702 -3.983 1.00 0.00 N ATOM 311 CA LEU A 22 -14.289 -7.967 -4.446 1.00 0.00 C ATOM 312 C LEU A 22 -13.007 -8.569 -3.880 1.00 0.00 C ATOM 313 O LEU A 22 -13.041 -9.577 -3.174 1.00 0.00 O ATOM 314 CB LEU A 22 -14.395 -6.495 -4.045 1.00 0.00 C ATOM 315 CG LEU A 22 -14.904 -6.220 -2.629 1.00 0.00 C ATOM 316 CD1 LEU A 22 -14.049 -6.949 -1.604 1.00 0.00 C ATOM 317 CD2 LEU A 22 -14.917 -4.725 -2.348 1.00 0.00 C ATOM 0 H LEU A 22 -15.945 -8.270 -3.197 1.00 0.00 H new ATOM 0 HA LEU A 22 -14.253 -8.040 -5.533 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -13.411 -6.039 -4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -15.057 -5.993 -4.751 1.00 0.00 H new ATOM 0 HG LEU A 22 -15.925 -6.593 -2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -14.426 -6.742 -0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -14.090 -8.022 -1.793 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -13.017 -6.607 -1.681 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -15.282 -4.548 -1.336 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.906 -4.328 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.572 -4.226 -3.062 1.00 0.00 H new ATOM 329 N THR A 23 -11.877 -7.944 -4.192 1.00 0.00 N ATOM 330 CA THR A 23 -10.584 -8.417 -3.713 1.00 0.00 C ATOM 331 C THR A 23 -9.794 -7.290 -3.059 1.00 0.00 C ATOM 332 O THR A 23 -10.107 -6.114 -3.240 1.00 0.00 O ATOM 333 CB THR A 23 -9.746 -9.017 -4.859 1.00 0.00 C ATOM 334 OG1 THR A 23 -9.623 -8.069 -5.925 1.00 0.00 O ATOM 335 CG2 THR A 23 -10.382 -10.296 -5.382 1.00 0.00 C ATOM 0 H THR A 23 -11.831 -7.108 -4.775 1.00 0.00 H new ATOM 0 HA THR A 23 -10.785 -9.193 -2.974 1.00 0.00 H new ATOM 0 HB THR A 23 -8.756 -9.255 -4.469 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.088 -8.458 -6.648 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.773 -10.701 -6.190 1.00 0.00 H new ATOM 0 HG22 THR A 23 -10.447 -11.026 -4.575 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.382 -10.078 -5.756 1.00 0.00 H new ATOM 343 N GLN A 24 -8.768 -7.658 -2.296 1.00 0.00 N ATOM 344 CA GLN A 24 -7.934 -6.675 -1.614 1.00 0.00 C ATOM 345 C GLN A 24 -7.427 -5.619 -2.591 1.00 0.00 C ATOM 346 O GLN A 24 -7.319 -4.442 -2.247 1.00 0.00 O ATOM 347 CB GLN A 24 -6.752 -7.366 -0.932 1.00 0.00 C ATOM 348 CG GLN A 24 -6.290 -6.669 0.337 1.00 0.00 C ATOM 349 CD GLN A 24 -6.850 -7.309 1.592 1.00 0.00 C ATOM 350 OE1 GLN A 24 -6.116 -7.597 2.537 1.00 0.00 O ATOM 351 NE2 GLN A 24 -8.159 -7.534 1.607 1.00 0.00 N ATOM 0 H GLN A 24 -8.495 -8.628 -2.135 1.00 0.00 H new ATOM 0 HA GLN A 24 -8.543 -6.180 -0.858 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -7.031 -8.392 -0.692 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.918 -7.418 -1.632 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.201 -6.686 0.380 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.591 -5.622 0.302 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.730 -7.279 0.801 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.594 -7.962 2.425 1.00 0.00 H new ATOM 360 N LEU A 25 -7.118 -6.047 -3.810 1.00 0.00 N ATOM 361 CA LEU A 25 -6.622 -5.138 -4.837 1.00 0.00 C ATOM 362 C LEU A 25 -7.734 -4.221 -5.336 1.00 0.00 C ATOM 363 O LEU A 25 -7.486 -3.073 -5.704 1.00 0.00 O ATOM 364 CB LEU A 25 -6.036 -5.930 -6.007 1.00 0.00 C ATOM 365 CG LEU A 25 -5.566 -5.107 -7.207 1.00 0.00 C ATOM 366 CD1 LEU A 25 -4.086 -4.780 -7.082 1.00 0.00 C ATOM 367 CD2 LEU A 25 -5.842 -5.851 -8.505 1.00 0.00 C ATOM 0 H LEU A 25 -7.202 -7.018 -4.111 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.839 -4.522 -4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.192 -6.513 -5.638 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.788 -6.641 -6.351 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.124 -4.171 -7.223 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.769 -4.194 -7.945 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.916 -4.206 -6.171 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.511 -5.705 -7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.501 -5.250 -9.348 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.311 -6.803 -8.499 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.912 -6.034 -8.599 1.00 0.00 H new ATOM 379 N ASP A 26 -8.959 -4.735 -5.341 1.00 0.00 N ATOM 380 CA ASP A 26 -10.111 -3.961 -5.792 1.00 0.00 C ATOM 381 C ASP A 26 -10.329 -2.743 -4.899 1.00 0.00 C ATOM 382 O ASP A 26 -10.498 -1.626 -5.387 1.00 0.00 O ATOM 383 CB ASP A 26 -11.366 -4.834 -5.801 1.00 0.00 C ATOM 384 CG ASP A 26 -11.275 -5.969 -6.801 1.00 0.00 C ATOM 385 OD1 ASP A 26 -10.248 -6.057 -7.507 1.00 0.00 O ATOM 386 OD2 ASP A 26 -12.228 -6.771 -6.877 1.00 0.00 O ATOM 0 H ASP A 26 -9.180 -5.684 -5.038 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.912 -3.615 -6.806 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -11.527 -5.244 -4.804 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -12.233 -4.216 -6.035 1.00 0.00 H new ATOM 391 N VAL A 27 -10.324 -2.968 -3.589 1.00 0.00 N ATOM 392 CA VAL A 27 -10.522 -1.889 -2.628 1.00 0.00 C ATOM 393 C VAL A 27 -9.273 -1.023 -2.509 1.00 0.00 C ATOM 394 O VAL A 27 -9.362 0.199 -2.389 1.00 0.00 O ATOM 395 CB VAL A 27 -10.886 -2.438 -1.235 1.00 0.00 C ATOM 396 CG1 VAL A 27 -11.286 -1.305 -0.303 1.00 0.00 C ATOM 397 CG2 VAL A 27 -12.000 -3.469 -1.344 1.00 0.00 C ATOM 0 H VAL A 27 -10.185 -3.887 -3.169 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.348 -1.282 -2.999 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.008 -2.929 -0.815 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.540 -1.712 0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.455 -0.607 -0.202 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -12.150 -0.783 -0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.245 -3.847 -0.351 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.883 -3.005 -1.784 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -11.671 -4.295 -1.975 1.00 0.00 H new ATOM 407 N ASP A 28 -8.109 -1.663 -2.546 1.00 0.00 N ATOM 408 CA ASP A 28 -6.841 -0.951 -2.445 1.00 0.00 C ATOM 409 C ASP A 28 -6.635 -0.036 -3.648 1.00 0.00 C ATOM 410 O ASP A 28 -6.173 1.097 -3.506 1.00 0.00 O ATOM 411 CB ASP A 28 -5.683 -1.943 -2.339 1.00 0.00 C ATOM 412 CG ASP A 28 -5.535 -2.513 -0.942 1.00 0.00 C ATOM 413 OD1 ASP A 28 -5.889 -1.809 0.027 1.00 0.00 O ATOM 414 OD2 ASP A 28 -5.067 -3.664 -0.818 1.00 0.00 O ATOM 0 H ASP A 28 -8.018 -2.674 -2.645 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.867 -0.337 -1.545 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.840 -2.758 -3.046 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.756 -1.447 -2.626 1.00 0.00 H new ATOM 419 N SER A 29 -6.980 -0.534 -4.831 1.00 0.00 N ATOM 420 CA SER A 29 -6.827 0.237 -6.059 1.00 0.00 C ATOM 421 C SER A 29 -7.477 1.611 -5.922 1.00 0.00 C ATOM 422 O SER A 29 -6.838 2.638 -6.155 1.00 0.00 O ATOM 423 CB SER A 29 -7.444 -0.516 -7.239 1.00 0.00 C ATOM 424 OG SER A 29 -6.617 -1.592 -7.646 1.00 0.00 O ATOM 0 H SER A 29 -7.367 -1.468 -4.965 1.00 0.00 H new ATOM 0 HA SER A 29 -5.761 0.375 -6.242 1.00 0.00 H new ATOM 0 HB2 SER A 29 -8.427 -0.895 -6.959 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.592 0.169 -8.074 1.00 0.00 H new ATOM 0 HG SER A 29 -6.470 -2.196 -6.889 1.00 0.00 H new ATOM 430 N HIS A 30 -8.750 1.622 -5.542 1.00 0.00 N ATOM 431 CA HIS A 30 -9.488 2.868 -5.373 1.00 0.00 C ATOM 432 C HIS A 30 -8.990 3.632 -4.150 1.00 0.00 C ATOM 433 O HIS A 30 -8.832 4.852 -4.190 1.00 0.00 O ATOM 434 CB HIS A 30 -10.984 2.586 -5.239 1.00 0.00 C ATOM 435 CG HIS A 30 -11.813 3.820 -5.058 1.00 0.00 C ATOM 436 ND1 HIS A 30 -11.873 4.704 -4.035 1.00 0.00 N flip ATOM 437 CD2 HIS A 30 -12.715 4.266 -6.000 1.00 0.00 C flip ATOM 438 CE1 HIS A 30 -12.801 5.659 -4.375 1.00 0.00 C flip ATOM 439 NE2 HIS A 30 -13.293 5.371 -5.566 1.00 0.00 N flip ATOM 0 H HIS A 30 -9.293 0.781 -5.345 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.321 3.483 -6.257 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -11.326 2.056 -6.128 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -11.145 1.922 -4.390 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -11.330 4.668 -3.172 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -12.918 3.786 -6.946 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -13.082 6.507 -3.767 1.00 0.00 H new ATOM 447 N LEU A 31 -8.745 2.906 -3.065 1.00 0.00 N ATOM 448 CA LEU A 31 -8.266 3.515 -1.829 1.00 0.00 C ATOM 449 C LEU A 31 -7.021 4.359 -2.085 1.00 0.00 C ATOM 450 O LEU A 31 -6.808 5.383 -1.436 1.00 0.00 O ATOM 451 CB LEU A 31 -7.959 2.436 -0.790 1.00 0.00 C ATOM 452 CG LEU A 31 -9.031 2.207 0.276 1.00 0.00 C ATOM 453 CD1 LEU A 31 -8.943 3.273 1.359 1.00 0.00 C ATOM 454 CD2 LEU A 31 -10.416 2.197 -0.353 1.00 0.00 C ATOM 0 H LEU A 31 -8.870 1.895 -3.016 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.052 4.166 -1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.788 1.495 -1.313 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.027 2.697 -0.289 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.856 1.234 0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.713 3.094 2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -7.961 3.232 1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -9.091 4.257 0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -11.166 2.033 0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -10.601 3.154 -0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -10.475 1.397 -1.091 1.00 0.00 H new ATOM 466 N ALA A 32 -6.202 3.922 -3.037 1.00 0.00 N ATOM 467 CA ALA A 32 -4.981 4.639 -3.381 1.00 0.00 C ATOM 468 C ALA A 32 -5.294 5.924 -4.138 1.00 0.00 C ATOM 469 O ALA A 32 -4.652 6.953 -3.924 1.00 0.00 O ATOM 470 CB ALA A 32 -4.062 3.749 -4.206 1.00 0.00 C ATOM 0 H ALA A 32 -6.362 3.075 -3.583 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.474 4.908 -2.455 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.154 4.297 -4.456 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -3.803 2.860 -3.630 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.571 3.452 -5.123 1.00 0.00 H new ATOM 476 N GLN A 33 -6.282 5.859 -5.023 1.00 0.00 N ATOM 477 CA GLN A 33 -6.679 7.019 -5.814 1.00 0.00 C ATOM 478 C GLN A 33 -7.408 8.043 -4.949 1.00 0.00 C ATOM 479 O GLN A 33 -7.068 9.224 -5.000 1.00 0.00 O ATOM 480 CB GLN A 33 -7.572 6.589 -6.979 1.00 0.00 C ATOM 481 CG GLN A 33 -7.000 5.438 -7.791 1.00 0.00 C ATOM 482 CD GLN A 33 -7.387 5.509 -9.255 1.00 0.00 C ATOM 483 OE1 GLN A 33 -8.216 4.730 -9.728 1.00 0.00 O ATOM 484 NE2 GLN A 33 -6.789 6.446 -9.981 1.00 0.00 N ATOM 0 H GLN A 33 -6.823 5.015 -5.211 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.776 7.482 -6.211 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.548 6.299 -6.590 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.732 7.443 -7.637 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.913 5.443 -7.706 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -7.349 4.494 -7.372 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.108 7.070 -9.548 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -7.010 6.542 -10.972 1.00 0.00 H new ATOM 493 N CYS A 34 -8.383 7.574 -4.184 1.00 0.00 N ATOM 494 CA CYS A 34 -9.146 8.457 -3.319 1.00 0.00 C ATOM 495 C CYS A 34 -8.166 9.227 -2.433 1.00 0.00 C ATOM 496 O CYS A 34 -8.192 10.455 -2.343 1.00 0.00 O ATOM 497 CB CYS A 34 -10.179 7.687 -2.494 1.00 0.00 C ATOM 498 SG CYS A 34 -11.722 8.660 -2.356 1.00 0.00 S ATOM 0 H CYS A 34 -8.662 6.594 -4.145 1.00 0.00 H new ATOM 0 HA CYS A 34 -9.715 9.161 -3.926 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -10.387 6.725 -2.963 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -9.781 7.478 -1.501 1.00 0.00 H new ATOM 0 HG CYS A 34 -12.623 7.959 -1.734 1.00 0.00 H new ATOM 503 N LEU A 35 -7.293 8.473 -1.774 1.00 0.00 N ATOM 504 CA LEU A 35 -6.293 9.057 -0.888 1.00 0.00 C ATOM 505 C LEU A 35 -5.448 10.090 -1.627 1.00 0.00 C ATOM 506 O LEU A 35 -5.206 11.186 -1.121 1.00 0.00 O ATOM 507 CB LEU A 35 -5.392 7.963 -0.312 1.00 0.00 C ATOM 508 CG LEU A 35 -4.446 8.394 0.810 1.00 0.00 C ATOM 509 CD1 LEU A 35 -5.224 9.052 1.939 1.00 0.00 C ATOM 510 CD2 LEU A 35 -3.656 7.202 1.328 1.00 0.00 C ATOM 0 H LEU A 35 -7.258 7.456 -1.837 1.00 0.00 H new ATOM 0 HA LEU A 35 -6.814 9.557 -0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -6.025 7.159 0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.795 7.547 -1.124 1.00 0.00 H new ATOM 0 HG LEU A 35 -3.743 9.123 0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -4.535 9.352 2.729 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.745 9.931 1.558 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.950 8.345 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.988 7.527 2.126 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.344 6.450 1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.069 6.774 0.515 1.00 0.00 H new ATOM 522 N ALA A 36 -5.002 9.734 -2.828 1.00 0.00 N ATOM 523 CA ALA A 36 -4.189 10.632 -3.637 1.00 0.00 C ATOM 524 C ALA A 36 -4.929 11.933 -3.927 1.00 0.00 C ATOM 525 O ALA A 36 -4.309 12.965 -4.182 1.00 0.00 O ATOM 526 CB ALA A 36 -3.787 9.951 -4.939 1.00 0.00 C ATOM 0 H ALA A 36 -5.191 8.830 -3.261 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.289 10.875 -3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.180 10.633 -5.534 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.211 9.052 -4.717 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.682 9.679 -5.499 1.00 0.00 H new ATOM 532 N GLU A 37 -6.255 11.877 -3.884 1.00 0.00 N ATOM 533 CA GLU A 37 -7.079 13.052 -4.143 1.00 0.00 C ATOM 534 C GLU A 37 -7.348 13.823 -2.854 1.00 0.00 C ATOM 535 O GLU A 37 -7.431 15.051 -2.857 1.00 0.00 O ATOM 536 CB GLU A 37 -8.404 12.642 -4.790 1.00 0.00 C ATOM 537 CG GLU A 37 -8.312 12.450 -6.294 1.00 0.00 C ATOM 538 CD GLU A 37 -9.634 12.695 -6.996 1.00 0.00 C ATOM 539 OE1 GLU A 37 -10.682 12.319 -6.431 1.00 0.00 O ATOM 540 OE2 GLU A 37 -9.620 13.261 -8.108 1.00 0.00 O ATOM 0 H GLU A 37 -6.783 11.030 -3.672 1.00 0.00 H new ATOM 0 HA GLU A 37 -6.534 13.701 -4.828 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.750 11.714 -4.334 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.155 13.402 -4.574 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.560 13.128 -6.698 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.974 11.436 -6.507 1.00 0.00 H new ATOM 547 N SER A 38 -7.484 13.091 -1.751 1.00 0.00 N ATOM 548 CA SER A 38 -7.747 13.705 -0.455 1.00 0.00 C ATOM 549 C SER A 38 -6.457 13.875 0.339 1.00 0.00 C ATOM 550 O SER A 38 -5.831 12.896 0.749 1.00 0.00 O ATOM 551 CB SER A 38 -8.742 12.857 0.342 1.00 0.00 C ATOM 552 OG SER A 38 -9.510 13.661 1.219 1.00 0.00 O ATOM 0 H SER A 38 -7.416 12.073 -1.730 1.00 0.00 H new ATOM 0 HA SER A 38 -8.177 14.691 -0.629 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.403 12.327 -0.343 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.204 12.101 0.914 1.00 0.00 H new ATOM 0 HG SER A 38 -10.139 13.096 1.715 1.00 0.00 H new ATOM 558 N THR A 39 -6.060 15.126 0.553 1.00 0.00 N ATOM 559 CA THR A 39 -4.843 15.426 1.296 1.00 0.00 C ATOM 560 C THR A 39 -4.947 14.946 2.738 1.00 0.00 C ATOM 561 O THR A 39 -3.938 14.640 3.373 1.00 0.00 O ATOM 562 CB THR A 39 -4.540 16.937 1.290 1.00 0.00 C ATOM 563 OG1 THR A 39 -3.262 17.182 1.890 1.00 0.00 O ATOM 564 CG2 THR A 39 -5.615 17.708 2.040 1.00 0.00 C ATOM 0 H THR A 39 -6.565 15.948 0.222 1.00 0.00 H new ATOM 0 HA THR A 39 -4.030 14.898 0.798 1.00 0.00 H new ATOM 0 HB THR A 39 -4.527 17.279 0.255 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.076 18.144 1.881 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.379 18.772 2.022 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.581 17.542 1.563 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.656 17.363 3.073 1.00 0.00 H new ATOM 572 N GLU A 40 -6.173 14.881 3.249 1.00 0.00 N ATOM 573 CA GLU A 40 -6.406 14.438 4.618 1.00 0.00 C ATOM 574 C GLU A 40 -5.935 12.999 4.811 1.00 0.00 C ATOM 575 O GLU A 40 -6.213 12.128 3.987 1.00 0.00 O ATOM 576 CB GLU A 40 -7.891 14.551 4.968 1.00 0.00 C ATOM 577 CG GLU A 40 -8.411 15.978 4.959 1.00 0.00 C ATOM 578 CD GLU A 40 -7.471 16.947 5.651 1.00 0.00 C ATOM 579 OE1 GLU A 40 -7.223 16.771 6.862 1.00 0.00 O ATOM 580 OE2 GLU A 40 -6.984 17.881 4.980 1.00 0.00 O ATOM 0 H GLU A 40 -7.019 15.129 2.736 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.833 15.083 5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.469 13.958 4.259 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.057 14.119 5.955 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.563 16.299 3.928 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.384 16.009 5.449 1.00 0.00 H new ATOM 587 N ASP A 41 -5.221 12.758 5.905 1.00 0.00 N ATOM 588 CA ASP A 41 -4.712 11.426 6.208 1.00 0.00 C ATOM 589 C ASP A 41 -5.386 10.856 7.451 1.00 0.00 C ATOM 590 O ASP A 41 -4.723 10.522 8.434 1.00 0.00 O ATOM 591 CB ASP A 41 -3.196 11.470 6.411 1.00 0.00 C ATOM 592 CG ASP A 41 -2.485 12.217 5.300 1.00 0.00 C ATOM 593 OD1 ASP A 41 -3.064 12.336 4.199 1.00 0.00 O ATOM 594 OD2 ASP A 41 -1.349 12.683 5.529 1.00 0.00 O ATOM 0 H ASP A 41 -4.982 13.468 6.597 1.00 0.00 H new ATOM 0 HA ASP A 41 -4.940 10.777 5.363 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.974 11.947 7.366 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.810 10.452 6.466 1.00 0.00 H new ATOM 599 N VAL A 42 -6.710 10.747 7.404 1.00 0.00 N ATOM 600 CA VAL A 42 -7.476 10.218 8.526 1.00 0.00 C ATOM 601 C VAL A 42 -7.479 8.694 8.518 1.00 0.00 C ATOM 602 O VAL A 42 -7.945 8.067 7.566 1.00 0.00 O ATOM 603 CB VAL A 42 -8.930 10.723 8.501 1.00 0.00 C ATOM 604 CG1 VAL A 42 -8.982 12.214 8.800 1.00 0.00 C ATOM 605 CG2 VAL A 42 -9.578 10.418 7.160 1.00 0.00 C ATOM 0 H VAL A 42 -7.275 11.019 6.599 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.992 10.573 9.436 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.491 10.200 9.276 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.018 12.554 8.778 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.559 12.402 9.787 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.407 12.756 8.049 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.605 10.782 7.161 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.019 10.912 6.365 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.575 9.341 6.991 1.00 0.00 H new ATOM 615 N THR A 43 -6.955 8.100 9.586 1.00 0.00 N ATOM 616 CA THR A 43 -6.897 6.648 9.703 1.00 0.00 C ATOM 617 C THR A 43 -8.227 6.082 10.186 1.00 0.00 C ATOM 618 O THR A 43 -8.796 6.559 11.168 1.00 0.00 O ATOM 619 CB THR A 43 -5.782 6.206 10.669 1.00 0.00 C ATOM 620 OG1 THR A 43 -5.283 7.338 11.391 1.00 0.00 O ATOM 621 CG2 THR A 43 -4.644 5.539 9.913 1.00 0.00 C ATOM 0 H THR A 43 -6.564 8.603 10.383 1.00 0.00 H new ATOM 0 HA THR A 43 -6.680 6.259 8.708 1.00 0.00 H new ATOM 0 HB THR A 43 -6.203 5.485 11.370 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.576 7.049 12.004 1.00 0.00 H new ATOM 0 HG21 THR A 43 -3.869 5.236 10.616 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.021 4.661 9.388 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.225 6.241 9.192 1.00 0.00 H new ATOM 629 N TRP A 44 -8.717 5.062 9.492 1.00 0.00 N ATOM 630 CA TRP A 44 -9.982 4.430 9.852 1.00 0.00 C ATOM 631 C TRP A 44 -9.746 3.056 10.473 1.00 0.00 C ATOM 632 O TRP A 44 -9.141 2.202 9.828 1.00 0.00 O ATOM 633 CB TRP A 44 -10.879 4.299 8.621 1.00 0.00 C ATOM 634 CG TRP A 44 -10.174 3.725 7.429 1.00 0.00 C ATOM 635 CD1 TRP A 44 -10.087 2.406 7.086 1.00 0.00 C ATOM 636 CD2 TRP A 44 -9.456 4.451 6.426 1.00 0.00 C ATOM 637 NE1 TRP A 44 -9.357 2.268 5.930 1.00 0.00 N ATOM 638 CE2 TRP A 44 -8.960 3.507 5.504 1.00 0.00 C ATOM 639 CE3 TRP A 44 -9.186 5.806 6.214 1.00 0.00 C ATOM 640 CZ2 TRP A 44 -8.209 3.879 4.392 1.00 0.00 C ATOM 641 CZ3 TRP A 44 -8.441 6.172 5.111 1.00 0.00 C ATOM 642 CH2 TRP A 44 -7.960 5.212 4.210 1.00 0.00 C ATOM 0 H TRP A 44 -8.259 4.654 8.677 1.00 0.00 H new ATOM 0 HA TRP A 44 -10.479 5.061 10.589 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -11.732 3.667 8.868 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -11.274 5.281 8.362 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -10.527 1.591 7.642 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -9.145 1.385 5.465 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -9.554 6.554 6.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -7.836 3.141 3.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -8.225 7.216 4.939 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -7.382 5.531 3.355 1.00 0.00 H new ATOM 654 N SER B 99 16.451 -14.602 3.267 1.00 0.00 N ATOM 655 CA SER B 99 16.299 -14.497 4.713 1.00 0.00 C ATOM 656 C SER B 99 14.977 -13.827 5.073 1.00 0.00 C ATOM 657 O SER B 99 14.435 -14.038 6.159 1.00 0.00 O ATOM 658 CB SER B 99 17.464 -13.709 5.315 1.00 0.00 C ATOM 659 OG SER B 99 18.677 -14.434 5.214 1.00 0.00 O ATOM 0 HA SER B 99 16.300 -15.505 5.127 1.00 0.00 H new ATOM 0 HB2 SER B 99 17.564 -12.753 4.801 1.00 0.00 H new ATOM 0 HB3 SER B 99 17.255 -13.488 6.362 1.00 0.00 H new ATOM 0 HG SER B 99 18.652 -15.004 4.417 1.00 0.00 H new ATOM 665 N HIS B 100 14.460 -13.018 4.153 1.00 0.00 N ATOM 666 CA HIS B 100 13.201 -12.317 4.372 1.00 0.00 C ATOM 667 C HIS B 100 12.203 -12.631 3.260 1.00 0.00 C ATOM 668 O HIS B 100 12.469 -13.463 2.393 1.00 0.00 O ATOM 669 CB HIS B 100 13.439 -10.808 4.447 1.00 0.00 C ATOM 670 CG HIS B 100 14.412 -10.303 3.427 1.00 0.00 C ATOM 671 ND1 HIS B 100 14.246 -10.003 2.118 1.00 0.00 N flip ATOM 672 CD2 HIS B 100 15.738 -10.055 3.711 1.00 0.00 C flip ATOM 673 CE1 HIS B 100 15.463 -9.582 1.639 1.00 0.00 C flip ATOM 674 NE2 HIS B 100 16.347 -9.622 2.620 1.00 0.00 N flip ATOM 0 H HIS B 100 14.894 -12.832 3.249 1.00 0.00 H new ATOM 0 HA HIS B 100 12.784 -12.659 5.319 1.00 0.00 H new ATOM 0 HB2 HIS B 100 12.488 -10.292 4.316 1.00 0.00 H new ATOM 0 HB3 HIS B 100 13.805 -10.555 5.442 1.00 0.00 H new ATOM 0 HD2 HIS B 100 16.206 -10.193 4.674 1.00 0.00 H new ATOM 0 HE1 HIS B 100 15.664 -9.269 0.625 1.00 0.00 H new ATOM 0 HE2 HIS B 100 17.331 -9.363 2.548 1.00 0.00 H new ATOM 682 N MET B 101 11.057 -11.961 3.294 1.00 0.00 N ATOM 683 CA MET B 101 10.021 -12.169 2.289 1.00 0.00 C ATOM 684 C MET B 101 10.058 -11.069 1.233 1.00 0.00 C ATOM 685 O MET B 101 10.812 -10.104 1.357 1.00 0.00 O ATOM 686 CB MET B 101 8.641 -12.211 2.949 1.00 0.00 C ATOM 687 CG MET B 101 8.113 -10.841 3.341 1.00 0.00 C ATOM 688 SD MET B 101 6.993 -10.905 4.752 1.00 0.00 S ATOM 689 CE MET B 101 6.577 -9.173 4.935 1.00 0.00 C ATOM 0 H MET B 101 10.822 -11.270 4.006 1.00 0.00 H new ATOM 0 HA MET B 101 10.212 -13.124 1.800 1.00 0.00 H new ATOM 0 HB2 MET B 101 7.934 -12.682 2.265 1.00 0.00 H new ATOM 0 HB3 MET B 101 8.691 -12.840 3.838 1.00 0.00 H new ATOM 0 HG2 MET B 101 8.952 -10.187 3.578 1.00 0.00 H new ATOM 0 HG3 MET B 101 7.594 -10.399 2.490 1.00 0.00 H new ATOM 0 HE1 MET B 101 5.960 -9.039 5.824 1.00 0.00 H new ATOM 0 HE2 MET B 101 7.491 -8.588 5.036 1.00 0.00 H new ATOM 0 HE3 MET B 101 6.026 -8.836 4.057 1.00 0.00 H new ATOM 699 N GLN B 102 9.242 -11.223 0.195 1.00 0.00 N ATOM 700 CA GLN B 102 9.185 -10.242 -0.882 1.00 0.00 C ATOM 701 C GLN B 102 7.795 -9.621 -0.980 1.00 0.00 C ATOM 702 O GLN B 102 6.809 -10.210 -0.534 1.00 0.00 O ATOM 703 CB GLN B 102 9.558 -10.895 -2.215 1.00 0.00 C ATOM 704 CG GLN B 102 9.955 -9.897 -3.290 1.00 0.00 C ATOM 705 CD GLN B 102 10.672 -10.549 -4.456 1.00 0.00 C ATOM 706 OE1 GLN B 102 11.875 -10.805 -4.396 1.00 0.00 O ATOM 707 NE2 GLN B 102 9.935 -10.823 -5.526 1.00 0.00 N ATOM 0 H GLN B 102 8.612 -12.017 0.077 1.00 0.00 H new ATOM 0 HA GLN B 102 9.902 -9.452 -0.658 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.383 -11.589 -2.052 1.00 0.00 H new ATOM 0 HB3 GLN B 102 8.712 -11.483 -2.571 1.00 0.00 H new ATOM 0 HG2 GLN B 102 9.063 -9.389 -3.656 1.00 0.00 H new ATOM 0 HG3 GLN B 102 10.600 -9.135 -2.852 1.00 0.00 H new ATOM 0 HE21 GLN B 102 8.941 -10.594 -5.533 1.00 0.00 H new ATOM 0 HE22 GLN B 102 10.363 -11.263 -6.341 1.00 0.00 H new ATOM 716 N ILE B 103 7.725 -8.430 -1.564 1.00 0.00 N ATOM 717 CA ILE B 103 6.455 -7.730 -1.719 1.00 0.00 C ATOM 718 C ILE B 103 6.418 -6.944 -3.025 1.00 0.00 C ATOM 719 O ILE B 103 7.446 -6.745 -3.673 1.00 0.00 O ATOM 720 CB ILE B 103 6.196 -6.766 -0.546 1.00 0.00 C ATOM 721 CG1 ILE B 103 7.329 -5.744 -0.438 1.00 0.00 C ATOM 722 CG2 ILE B 103 6.050 -7.543 0.755 1.00 0.00 C ATOM 723 CD1 ILE B 103 6.931 -4.477 0.288 1.00 0.00 C ATOM 0 H ILE B 103 8.531 -7.929 -1.937 1.00 0.00 H new ATOM 0 HA ILE B 103 5.675 -8.491 -1.732 1.00 0.00 H new ATOM 0 HB ILE B 103 5.265 -6.230 -0.733 1.00 0.00 H new ATOM 0 HG12 ILE B 103 8.172 -6.201 0.080 1.00 0.00 H new ATOM 0 HG13 ILE B 103 7.673 -5.487 -1.440 1.00 0.00 H new ATOM 0 HG21 ILE B 103 5.867 -6.849 1.575 1.00 0.00 H new ATOM 0 HG22 ILE B 103 5.213 -8.236 0.673 1.00 0.00 H new ATOM 0 HG23 ILE B 103 6.965 -8.102 0.950 1.00 0.00 H new ATOM 0 HD11 ILE B 103 7.782 -3.798 0.328 1.00 0.00 H new ATOM 0 HD12 ILE B 103 6.108 -3.997 -0.242 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.615 -4.723 1.302 1.00 0.00 H new ATOM 735 N PHE B 104 5.225 -6.498 -3.407 1.00 0.00 N ATOM 736 CA PHE B 104 5.053 -5.733 -4.636 1.00 0.00 C ATOM 737 C PHE B 104 4.380 -4.393 -4.353 1.00 0.00 C ATOM 738 O PHE B 104 3.631 -4.254 -3.385 1.00 0.00 O ATOM 739 CB PHE B 104 4.225 -6.529 -5.646 1.00 0.00 C ATOM 740 CG PHE B 104 4.870 -7.818 -6.067 1.00 0.00 C ATOM 741 CD1 PHE B 104 4.904 -8.904 -5.206 1.00 0.00 C ATOM 742 CD2 PHE B 104 5.441 -7.945 -7.322 1.00 0.00 C ATOM 743 CE1 PHE B 104 5.498 -10.092 -5.591 1.00 0.00 C ATOM 744 CE2 PHE B 104 6.036 -9.130 -7.713 1.00 0.00 C ATOM 745 CZ PHE B 104 6.064 -10.205 -6.847 1.00 0.00 C ATOM 0 H PHE B 104 4.364 -6.653 -2.883 1.00 0.00 H new ATOM 0 HA PHE B 104 6.040 -5.542 -5.056 1.00 0.00 H new ATOM 0 HB2 PHE B 104 3.248 -6.745 -5.213 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.053 -5.913 -6.529 1.00 0.00 H new ATOM 0 HD1 PHE B 104 4.462 -8.821 -4.224 1.00 0.00 H new ATOM 0 HD2 PHE B 104 5.421 -7.108 -8.004 1.00 0.00 H new ATOM 0 HE1 PHE B 104 5.520 -10.931 -4.911 1.00 0.00 H new ATOM 0 HE2 PHE B 104 6.478 -9.215 -8.695 1.00 0.00 H new ATOM 0 HZ PHE B 104 6.527 -11.132 -7.150 1.00 0.00 H new ATOM 755 N VAL B 105 4.652 -3.409 -5.204 1.00 0.00 N ATOM 756 CA VAL B 105 4.072 -2.080 -5.046 1.00 0.00 C ATOM 757 C VAL B 105 3.552 -1.546 -6.376 1.00 0.00 C ATOM 758 O VAL B 105 4.243 -1.601 -7.394 1.00 0.00 O ATOM 759 CB VAL B 105 5.099 -1.085 -4.472 1.00 0.00 C ATOM 760 CG1 VAL B 105 4.465 0.285 -4.280 1.00 0.00 C ATOM 761 CG2 VAL B 105 5.671 -1.606 -3.163 1.00 0.00 C ATOM 0 H VAL B 105 5.270 -3.507 -6.010 1.00 0.00 H new ATOM 0 HA VAL B 105 3.241 -2.178 -4.347 1.00 0.00 H new ATOM 0 HB VAL B 105 5.918 -0.983 -5.184 1.00 0.00 H new ATOM 0 HG11 VAL B 105 5.205 0.975 -3.874 1.00 0.00 H new ATOM 0 HG12 VAL B 105 4.109 0.659 -5.240 1.00 0.00 H new ATOM 0 HG13 VAL B 105 3.626 0.204 -3.588 1.00 0.00 H new ATOM 0 HG21 VAL B 105 6.395 -0.891 -2.772 1.00 0.00 H new ATOM 0 HG22 VAL B 105 4.865 -1.739 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL B 105 6.164 -2.563 -3.336 1.00 0.00 H new ATOM 771 N LYS B 106 2.328 -1.029 -6.361 1.00 0.00 N ATOM 772 CA LYS B 106 1.714 -0.482 -7.565 1.00 0.00 C ATOM 773 C LYS B 106 1.625 1.038 -7.489 1.00 0.00 C ATOM 774 O LYS B 106 1.260 1.599 -6.455 1.00 0.00 O ATOM 775 CB LYS B 106 0.316 -1.075 -7.764 1.00 0.00 C ATOM 776 CG LYS B 106 -0.361 -0.622 -9.044 1.00 0.00 C ATOM 777 CD LYS B 106 -0.159 -1.624 -10.168 1.00 0.00 C ATOM 778 CE LYS B 106 -1.323 -2.599 -10.261 1.00 0.00 C ATOM 779 NZ LYS B 106 -0.949 -3.840 -10.994 1.00 0.00 N ATOM 0 H LYS B 106 1.742 -0.977 -5.528 1.00 0.00 H new ATOM 0 HA LYS B 106 2.341 -0.750 -8.415 1.00 0.00 H new ATOM 0 HB2 LYS B 106 0.389 -2.163 -7.767 1.00 0.00 H new ATOM 0 HB3 LYS B 106 -0.310 -0.800 -6.915 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -1.427 -0.486 -8.864 1.00 0.00 H new ATOM 0 HG3 LYS B 106 0.037 0.347 -9.344 1.00 0.00 H new ATOM 0 HD2 LYS B 106 -0.050 -1.094 -11.114 1.00 0.00 H new ATOM 0 HD3 LYS B 106 0.767 -2.175 -10.003 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -1.661 -2.858 -9.258 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -2.161 -2.118 -10.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -1.769 -4.479 -11.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 -0.650 -3.596 -11.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -0.166 -4.313 -10.499 1.00 0.00 H new ATOM 793 N THR B 107 1.961 1.702 -8.591 1.00 0.00 N ATOM 794 CA THR B 107 1.919 3.158 -8.649 1.00 0.00 C ATOM 795 C THR B 107 0.645 3.645 -9.328 1.00 0.00 C ATOM 796 O THR B 107 -0.046 2.877 -9.998 1.00 0.00 O ATOM 797 CB THR B 107 3.138 3.726 -9.401 1.00 0.00 C ATOM 798 OG1 THR B 107 3.456 2.888 -10.519 1.00 0.00 O ATOM 799 CG2 THR B 107 4.343 3.829 -8.479 1.00 0.00 C ATOM 0 H THR B 107 2.265 1.254 -9.455 1.00 0.00 H new ATOM 0 HA THR B 107 1.938 3.516 -7.619 1.00 0.00 H new ATOM 0 HB THR B 107 2.886 4.726 -9.755 1.00 0.00 H new ATOM 0 HG1 THR B 107 3.654 1.982 -10.203 1.00 0.00 H new ATOM 0 HG21 THR B 107 5.191 4.232 -9.032 1.00 0.00 H new ATOM 0 HG22 THR B 107 4.107 4.489 -7.644 1.00 0.00 H new ATOM 0 HG23 THR B 107 4.596 2.839 -8.099 1.00 0.00 H new ATOM 807 N LEU B 108 0.338 4.925 -9.152 1.00 0.00 N ATOM 808 CA LEU B 108 -0.855 5.516 -9.749 1.00 0.00 C ATOM 809 C LEU B 108 -0.741 5.553 -11.270 1.00 0.00 C ATOM 810 O LEU B 108 -1.727 5.774 -11.972 1.00 0.00 O ATOM 811 CB LEU B 108 -1.074 6.930 -9.208 1.00 0.00 C ATOM 812 CG LEU B 108 -2.180 7.085 -8.164 1.00 0.00 C ATOM 813 CD1 LEU B 108 -1.944 6.142 -6.993 1.00 0.00 C ATOM 814 CD2 LEU B 108 -2.260 8.526 -7.681 1.00 0.00 C ATOM 0 H LEU B 108 0.899 5.574 -8.600 1.00 0.00 H new ATOM 0 HA LEU B 108 -1.710 4.895 -9.482 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -0.138 7.279 -8.772 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -1.299 7.588 -10.047 1.00 0.00 H new ATOM 0 HG LEU B 108 -3.131 6.825 -8.629 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -2.741 6.266 -6.260 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -1.937 5.112 -7.351 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -0.985 6.371 -6.529 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -3.053 8.617 -6.938 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -1.309 8.813 -7.233 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -2.476 9.181 -8.525 1.00 0.00 H new ATOM 826 N THR B 109 0.470 5.335 -11.773 1.00 0.00 N ATOM 827 CA THR B 109 0.715 5.342 -13.210 1.00 0.00 C ATOM 828 C THR B 109 0.539 3.949 -13.804 1.00 0.00 C ATOM 829 O THR B 109 0.640 3.764 -15.017 1.00 0.00 O ATOM 830 CB THR B 109 2.130 5.853 -13.537 1.00 0.00 C ATOM 831 OG1 THR B 109 2.370 5.762 -14.945 1.00 0.00 O ATOM 832 CG2 THR B 109 3.182 5.051 -12.785 1.00 0.00 C ATOM 0 H THR B 109 1.297 5.151 -11.206 1.00 0.00 H new ATOM 0 HA THR B 109 -0.017 6.018 -13.652 1.00 0.00 H new ATOM 0 HB THR B 109 2.198 6.895 -13.224 1.00 0.00 H new ATOM 0 HG1 THR B 109 1.726 5.142 -15.347 1.00 0.00 H new ATOM 0 HG21 THR B 109 4.174 5.430 -13.032 1.00 0.00 H new ATOM 0 HG22 THR B 109 3.014 5.146 -11.712 1.00 0.00 H new ATOM 0 HG23 THR B 109 3.113 4.002 -13.072 1.00 0.00 H new ATOM 840 N GLY B 110 0.276 2.971 -12.942 1.00 0.00 N ATOM 841 CA GLY B 110 0.090 1.607 -13.402 1.00 0.00 C ATOM 842 C GLY B 110 1.350 0.774 -13.270 1.00 0.00 C ATOM 843 O GLY B 110 1.283 -0.446 -13.120 1.00 0.00 O ATOM 0 H GLY B 110 0.188 3.099 -11.934 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -0.712 1.140 -12.830 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -0.227 1.618 -14.445 1.00 0.00 H new ATOM 847 N LYS B 111 2.502 1.434 -13.326 1.00 0.00 N ATOM 848 CA LYS B 111 3.783 0.748 -13.212 1.00 0.00 C ATOM 849 C LYS B 111 3.822 -0.127 -11.963 1.00 0.00 C ATOM 850 O LYS B 111 3.331 0.264 -10.903 1.00 0.00 O ATOM 851 CB LYS B 111 4.927 1.763 -13.173 1.00 0.00 C ATOM 852 CG LYS B 111 6.291 1.135 -12.946 1.00 0.00 C ATOM 853 CD LYS B 111 7.399 2.173 -12.990 1.00 0.00 C ATOM 854 CE LYS B 111 7.274 3.170 -11.849 1.00 0.00 C ATOM 855 NZ LYS B 111 8.431 4.107 -11.802 1.00 0.00 N ATOM 0 H LYS B 111 2.574 2.444 -13.450 1.00 0.00 H new ATOM 0 HA LYS B 111 3.903 0.108 -14.086 1.00 0.00 H new ATOM 0 HB2 LYS B 111 4.943 2.316 -14.112 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.733 2.486 -12.381 1.00 0.00 H new ATOM 0 HG2 LYS B 111 6.303 0.630 -11.980 1.00 0.00 H new ATOM 0 HG3 LYS B 111 6.473 0.375 -13.706 1.00 0.00 H new ATOM 0 HD2 LYS B 111 8.367 1.676 -12.935 1.00 0.00 H new ATOM 0 HD3 LYS B 111 7.366 2.702 -13.942 1.00 0.00 H new ATOM 0 HE2 LYS B 111 6.351 3.738 -11.963 1.00 0.00 H new ATOM 0 HE3 LYS B 111 7.203 2.633 -10.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 8.246 4.852 -11.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 9.290 3.585 -11.534 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 8.566 4.539 -12.738 1.00 0.00 H new ATOM 869 N THR B 112 4.412 -1.311 -12.093 1.00 0.00 N ATOM 870 CA THR B 112 4.515 -2.241 -10.975 1.00 0.00 C ATOM 871 C THR B 112 5.958 -2.364 -10.496 1.00 0.00 C ATOM 872 O THR B 112 6.891 -2.369 -11.299 1.00 0.00 O ATOM 873 CB THR B 112 3.991 -3.638 -11.356 1.00 0.00 C ATOM 874 OG1 THR B 112 2.636 -3.546 -11.806 1.00 0.00 O ATOM 875 CG2 THR B 112 4.074 -4.588 -10.171 1.00 0.00 C ATOM 0 H THR B 112 4.826 -1.649 -12.962 1.00 0.00 H new ATOM 0 HA THR B 112 3.900 -1.839 -10.170 1.00 0.00 H new ATOM 0 HB THR B 112 4.614 -4.030 -12.160 1.00 0.00 H new ATOM 0 HG1 THR B 112 2.310 -4.438 -12.048 1.00 0.00 H new ATOM 0 HG21 THR B 112 3.698 -5.569 -10.464 1.00 0.00 H new ATOM 0 HG22 THR B 112 5.111 -4.678 -9.849 1.00 0.00 H new ATOM 0 HG23 THR B 112 3.472 -4.199 -9.350 1.00 0.00 H new ATOM 883 N ILE B 113 6.132 -2.465 -9.183 1.00 0.00 N ATOM 884 CA ILE B 113 7.461 -2.591 -8.597 1.00 0.00 C ATOM 885 C ILE B 113 7.554 -3.823 -7.703 1.00 0.00 C ATOM 886 O ILE B 113 6.607 -4.161 -6.991 1.00 0.00 O ATOM 887 CB ILE B 113 7.834 -1.345 -7.774 1.00 0.00 C ATOM 888 CG1 ILE B 113 7.787 -0.093 -8.652 1.00 0.00 C ATOM 889 CG2 ILE B 113 9.215 -1.512 -7.155 1.00 0.00 C ATOM 890 CD1 ILE B 113 8.112 1.182 -7.907 1.00 0.00 C ATOM 0 H ILE B 113 5.370 -2.462 -8.505 1.00 0.00 H new ATOM 0 HA ILE B 113 8.162 -2.693 -9.426 1.00 0.00 H new ATOM 0 HB ILE B 113 7.108 -1.229 -6.970 1.00 0.00 H new ATOM 0 HG12 ILE B 113 8.490 -0.211 -9.477 1.00 0.00 H new ATOM 0 HG13 ILE B 113 6.793 -0.004 -9.091 1.00 0.00 H new ATOM 0 HG21 ILE B 113 9.464 -0.623 -6.576 1.00 0.00 H new ATOM 0 HG22 ILE B 113 9.217 -2.383 -6.500 1.00 0.00 H new ATOM 0 HG23 ILE B 113 9.953 -1.650 -7.945 1.00 0.00 H new ATOM 0 HD11 ILE B 113 8.059 2.028 -8.593 1.00 0.00 H new ATOM 0 HD12 ILE B 113 7.394 1.324 -7.099 1.00 0.00 H new ATOM 0 HD13 ILE B 113 9.117 1.114 -7.491 1.00 0.00 H new ATOM 902 N THR B 114 8.702 -4.492 -7.743 1.00 0.00 N ATOM 903 CA THR B 114 8.920 -5.687 -6.937 1.00 0.00 C ATOM 904 C THR B 114 10.178 -5.555 -6.087 1.00 0.00 C ATOM 905 O THR B 114 11.294 -5.563 -6.608 1.00 0.00 O ATOM 906 CB THR B 114 9.037 -6.946 -7.817 1.00 0.00 C ATOM 907 OG1 THR B 114 7.969 -6.978 -8.771 1.00 0.00 O ATOM 908 CG2 THR B 114 9.003 -8.206 -6.967 1.00 0.00 C ATOM 0 H THR B 114 9.496 -4.226 -8.326 1.00 0.00 H new ATOM 0 HA THR B 114 8.053 -5.790 -6.284 1.00 0.00 H new ATOM 0 HB THR B 114 9.991 -6.908 -8.342 1.00 0.00 H new ATOM 0 HG1 THR B 114 7.189 -7.419 -8.374 1.00 0.00 H new ATOM 0 HG21 THR B 114 9.087 -9.082 -7.611 1.00 0.00 H new ATOM 0 HG22 THR B 114 9.835 -8.192 -6.263 1.00 0.00 H new ATOM 0 HG23 THR B 114 8.063 -8.249 -6.417 1.00 0.00 H new ATOM 916 N LEU B 115 9.992 -5.435 -4.778 1.00 0.00 N ATOM 917 CA LEU B 115 11.114 -5.302 -3.854 1.00 0.00 C ATOM 918 C LEU B 115 11.001 -6.307 -2.712 1.00 0.00 C ATOM 919 O LEU B 115 9.965 -6.947 -2.537 1.00 0.00 O ATOM 920 CB LEU B 115 11.173 -3.880 -3.294 1.00 0.00 C ATOM 921 CG LEU B 115 12.006 -2.878 -4.095 1.00 0.00 C ATOM 922 CD1 LEU B 115 11.729 -1.459 -3.624 1.00 0.00 C ATOM 923 CD2 LEU B 115 13.488 -3.201 -3.977 1.00 0.00 C ATOM 0 H LEU B 115 9.075 -5.427 -4.331 1.00 0.00 H new ATOM 0 HA LEU B 115 12.032 -5.507 -4.404 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.155 -3.498 -3.219 1.00 0.00 H new ATOM 0 HB3 LEU B 115 11.572 -3.926 -2.281 1.00 0.00 H new ATOM 0 HG LEU B 115 11.721 -2.954 -5.144 1.00 0.00 H new ATOM 0 HD11 LEU B 115 12.330 -0.759 -4.205 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.672 -1.230 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU B 115 11.986 -1.369 -2.569 1.00 0.00 H new ATOM 0 HD21 LEU B 115 14.065 -2.478 -4.553 1.00 0.00 H new ATOM 0 HD22 LEU B 115 13.788 -3.154 -2.930 1.00 0.00 H new ATOM 0 HD23 LEU B 115 13.674 -4.203 -4.363 1.00 0.00 H new ATOM 935 N GLU B 116 12.073 -6.437 -1.937 1.00 0.00 N ATOM 936 CA GLU B 116 12.093 -7.363 -0.811 1.00 0.00 C ATOM 937 C GLU B 116 11.942 -6.615 0.511 1.00 0.00 C ATOM 938 O GLU B 116 12.415 -5.489 0.657 1.00 0.00 O ATOM 939 CB GLU B 116 13.394 -8.170 -0.808 1.00 0.00 C ATOM 940 CG GLU B 116 13.693 -8.847 -2.133 1.00 0.00 C ATOM 941 CD GLU B 116 14.348 -7.912 -3.133 1.00 0.00 C ATOM 942 OE1 GLU B 116 15.552 -7.626 -2.976 1.00 0.00 O ATOM 943 OE2 GLU B 116 13.653 -7.467 -4.070 1.00 0.00 O ATOM 0 H GLU B 116 12.938 -5.913 -2.068 1.00 0.00 H new ATOM 0 HA GLU B 116 11.251 -8.046 -0.920 1.00 0.00 H new ATOM 0 HB2 GLU B 116 14.222 -7.508 -0.553 1.00 0.00 H new ATOM 0 HB3 GLU B 116 13.340 -8.928 -0.027 1.00 0.00 H new ATOM 0 HG2 GLU B 116 14.346 -9.703 -1.960 1.00 0.00 H new ATOM 0 HG3 GLU B 116 12.766 -9.234 -2.556 1.00 0.00 H new ATOM 950 N VAL B 117 11.278 -7.251 1.471 1.00 0.00 N ATOM 951 CA VAL B 117 11.064 -6.649 2.781 1.00 0.00 C ATOM 952 C VAL B 117 11.060 -7.705 3.879 1.00 0.00 C ATOM 953 O VAL B 117 10.816 -8.883 3.618 1.00 0.00 O ATOM 954 CB VAL B 117 9.736 -5.868 2.829 1.00 0.00 C ATOM 955 CG1 VAL B 117 9.747 -4.734 1.816 1.00 0.00 C ATOM 956 CG2 VAL B 117 8.561 -6.802 2.584 1.00 0.00 C ATOM 0 H VAL B 117 10.879 -8.184 1.366 1.00 0.00 H new ATOM 0 HA VAL B 117 11.890 -5.958 2.950 1.00 0.00 H new ATOM 0 HB VAL B 117 9.625 -5.434 3.823 1.00 0.00 H new ATOM 0 HG11 VAL B 117 8.801 -4.194 1.864 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.567 -4.052 2.042 1.00 0.00 H new ATOM 0 HG13 VAL B 117 9.881 -5.142 0.814 1.00 0.00 H new ATOM 0 HG21 VAL B 117 7.631 -6.234 2.621 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.664 -7.266 1.603 1.00 0.00 H new ATOM 0 HG23 VAL B 117 8.545 -7.576 3.352 1.00 0.00 H new ATOM 966 N GLU B 118 11.330 -7.276 5.108 1.00 0.00 N ATOM 967 CA GLU B 118 11.358 -8.188 6.246 1.00 0.00 C ATOM 968 C GLU B 118 10.065 -8.092 7.051 1.00 0.00 C ATOM 969 O GLU B 118 9.366 -7.079 7.031 1.00 0.00 O ATOM 970 CB GLU B 118 12.556 -7.878 7.146 1.00 0.00 C ATOM 971 CG GLU B 118 13.896 -8.013 6.443 1.00 0.00 C ATOM 972 CD GLU B 118 14.932 -7.041 6.972 1.00 0.00 C ATOM 973 OE1 GLU B 118 15.578 -7.358 7.993 1.00 0.00 O ATOM 974 OE2 GLU B 118 15.098 -5.963 6.364 1.00 0.00 O ATOM 0 H GLU B 118 11.532 -6.304 5.341 1.00 0.00 H new ATOM 0 HA GLU B 118 11.453 -9.204 5.863 1.00 0.00 H new ATOM 0 HB2 GLU B 118 12.458 -6.863 7.531 1.00 0.00 H new ATOM 0 HB3 GLU B 118 12.537 -8.548 8.006 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.264 -9.032 6.563 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.760 -7.847 5.374 1.00 0.00 H new ATOM 981 N PRO B 119 9.739 -9.171 7.776 1.00 0.00 N ATOM 982 CA PRO B 119 8.529 -9.235 8.601 1.00 0.00 C ATOM 983 C PRO B 119 8.609 -8.320 9.819 1.00 0.00 C ATOM 984 O PRO B 119 7.625 -8.135 10.535 1.00 0.00 O ATOM 985 CB PRO B 119 8.473 -10.701 9.038 1.00 0.00 C ATOM 986 CG PRO B 119 9.887 -11.167 8.980 1.00 0.00 C ATOM 987 CD PRO B 119 10.526 -10.414 7.847 1.00 0.00 C ATOM 0 HA PRO B 119 7.646 -8.905 8.054 1.00 0.00 H new ATOM 0 HB2 PRO B 119 8.065 -10.799 10.044 1.00 0.00 H new ATOM 0 HB3 PRO B 119 7.835 -11.287 8.376 1.00 0.00 H new ATOM 0 HG2 PRO B 119 10.402 -10.968 9.920 1.00 0.00 H new ATOM 0 HG3 PRO B 119 9.937 -12.243 8.811 1.00 0.00 H new ATOM 0 HD2 PRO B 119 11.579 -10.212 8.042 1.00 0.00 H new ATOM 0 HD3 PRO B 119 10.477 -10.975 6.914 1.00 0.00 H new ATOM 995 N SER B 120 9.788 -7.750 10.048 1.00 0.00 N ATOM 996 CA SER B 120 9.997 -6.858 11.182 1.00 0.00 C ATOM 997 C SER B 120 10.170 -5.415 10.713 1.00 0.00 C ATOM 998 O SER B 120 10.168 -4.484 11.519 1.00 0.00 O ATOM 999 CB SER B 120 11.225 -7.295 11.984 1.00 0.00 C ATOM 1000 OG SER B 120 11.251 -8.702 12.148 1.00 0.00 O ATOM 0 H SER B 120 10.612 -7.890 9.464 1.00 0.00 H new ATOM 0 HA SER B 120 9.116 -6.912 11.822 1.00 0.00 H new ATOM 0 HB2 SER B 120 12.131 -6.968 11.475 1.00 0.00 H new ATOM 0 HB3 SER B 120 11.216 -6.812 12.961 1.00 0.00 H new ATOM 0 HG SER B 120 12.046 -8.957 12.662 1.00 0.00 H new ATOM 1006 N ASP B 121 10.320 -5.240 9.405 1.00 0.00 N ATOM 1007 CA ASP B 121 10.493 -3.912 8.827 1.00 0.00 C ATOM 1008 C ASP B 121 9.246 -3.060 9.041 1.00 0.00 C ATOM 1009 O ASP B 121 8.309 -3.470 9.727 1.00 0.00 O ATOM 1010 CB ASP B 121 10.802 -4.020 7.333 1.00 0.00 C ATOM 1011 CG ASP B 121 12.238 -4.424 7.066 1.00 0.00 C ATOM 1012 OD1 ASP B 121 12.971 -4.687 8.042 1.00 0.00 O ATOM 1013 OD2 ASP B 121 12.628 -4.480 5.882 1.00 0.00 O ATOM 0 H ASP B 121 10.325 -6.000 8.725 1.00 0.00 H new ATOM 0 HA ASP B 121 11.331 -3.430 9.330 1.00 0.00 H new ATOM 0 HB2 ASP B 121 10.132 -4.750 6.878 1.00 0.00 H new ATOM 0 HB3 ASP B 121 10.602 -3.062 6.854 1.00 0.00 H new ATOM 1018 N THR B 122 9.240 -1.869 8.449 1.00 0.00 N ATOM 1019 CA THR B 122 8.110 -0.957 8.577 1.00 0.00 C ATOM 1020 C THR B 122 7.668 -0.436 7.214 1.00 0.00 C ATOM 1021 O THR B 122 8.285 -0.741 6.193 1.00 0.00 O ATOM 1022 CB THR B 122 8.453 0.239 9.485 1.00 0.00 C ATOM 1023 OG1 THR B 122 9.351 1.126 8.808 1.00 0.00 O ATOM 1024 CG2 THR B 122 9.084 -0.233 10.786 1.00 0.00 C ATOM 0 H THR B 122 10.006 -1.514 7.876 1.00 0.00 H new ATOM 0 HA THR B 122 7.296 -1.524 9.028 1.00 0.00 H new ATOM 0 HB THR B 122 7.528 0.767 9.718 1.00 0.00 H new ATOM 0 HG1 THR B 122 9.809 1.692 9.464 1.00 0.00 H new ATOM 0 HG21 THR B 122 9.318 0.629 11.411 1.00 0.00 H new ATOM 0 HG22 THR B 122 8.387 -0.885 11.313 1.00 0.00 H new ATOM 0 HG23 THR B 122 10.000 -0.782 10.568 1.00 0.00 H new ATOM 1032 N ILE B 123 6.596 0.350 7.207 1.00 0.00 N ATOM 1033 CA ILE B 123 6.073 0.914 5.969 1.00 0.00 C ATOM 1034 C ILE B 123 7.065 1.891 5.347 1.00 0.00 C ATOM 1035 O ILE B 123 7.392 1.790 4.165 1.00 0.00 O ATOM 1036 CB ILE B 123 4.734 1.638 6.202 1.00 0.00 C ATOM 1037 CG1 ILE B 123 3.739 0.707 6.897 1.00 0.00 C ATOM 1038 CG2 ILE B 123 4.167 2.141 4.883 1.00 0.00 C ATOM 1039 CD1 ILE B 123 3.524 -0.601 6.166 1.00 0.00 C ATOM 0 H ILE B 123 6.074 0.610 8.044 1.00 0.00 H new ATOM 0 HA ILE B 123 5.912 0.080 5.286 1.00 0.00 H new ATOM 0 HB ILE B 123 4.910 2.497 6.849 1.00 0.00 H new ATOM 0 HG12 ILE B 123 4.094 0.496 7.906 1.00 0.00 H new ATOM 0 HG13 ILE B 123 2.782 1.220 6.997 1.00 0.00 H new ATOM 0 HG21 ILE B 123 3.221 2.650 5.064 1.00 0.00 H new ATOM 0 HG22 ILE B 123 4.871 2.836 4.426 1.00 0.00 H new ATOM 0 HG23 ILE B 123 4.002 1.298 4.213 1.00 0.00 H new ATOM 0 HD11 ILE B 123 2.807 -1.211 6.715 1.00 0.00 H new ATOM 0 HD12 ILE B 123 3.139 -0.400 5.166 1.00 0.00 H new ATOM 0 HD13 ILE B 123 4.471 -1.135 6.089 1.00 0.00 H new ATOM 1051 N GLU B 124 7.542 2.835 6.153 1.00 0.00 N ATOM 1052 CA GLU B 124 8.498 3.829 5.682 1.00 0.00 C ATOM 1053 C GLU B 124 9.749 3.157 5.121 1.00 0.00 C ATOM 1054 O GLU B 124 10.500 3.761 4.355 1.00 0.00 O ATOM 1055 CB GLU B 124 8.882 4.779 6.817 1.00 0.00 C ATOM 1056 CG GLU B 124 9.622 4.100 7.956 1.00 0.00 C ATOM 1057 CD GLU B 124 10.216 5.089 8.940 1.00 0.00 C ATOM 1058 OE1 GLU B 124 9.722 6.234 9.002 1.00 0.00 O ATOM 1059 OE2 GLU B 124 11.176 4.718 9.648 1.00 0.00 O ATOM 0 H GLU B 124 7.282 2.932 7.134 1.00 0.00 H new ATOM 0 HA GLU B 124 8.024 4.401 4.884 1.00 0.00 H new ATOM 0 HB2 GLU B 124 9.505 5.578 6.415 1.00 0.00 H new ATOM 0 HB3 GLU B 124 7.979 5.246 7.209 1.00 0.00 H new ATOM 0 HG2 GLU B 124 8.938 3.436 8.483 1.00 0.00 H new ATOM 0 HG3 GLU B 124 10.418 3.478 7.547 1.00 0.00 H new ATOM 1066 N ASN B 125 9.967 1.906 5.511 1.00 0.00 N ATOM 1067 CA ASN B 125 11.127 1.152 5.049 1.00 0.00 C ATOM 1068 C ASN B 125 10.977 0.766 3.581 1.00 0.00 C ATOM 1069 O ASN B 125 11.869 1.008 2.769 1.00 0.00 O ATOM 1070 CB ASN B 125 11.317 -0.104 5.901 1.00 0.00 C ATOM 1071 CG ASN B 125 12.768 -0.539 5.975 1.00 0.00 C ATOM 1072 OD1 ASN B 125 13.379 -0.520 7.044 1.00 0.00 O ATOM 1073 ND2 ASN B 125 13.328 -0.931 4.836 1.00 0.00 N ATOM 0 H ASN B 125 9.356 1.392 6.146 1.00 0.00 H new ATOM 0 HA ASN B 125 12.006 1.789 5.150 1.00 0.00 H new ATOM 0 HB2 ASN B 125 10.945 0.084 6.908 1.00 0.00 H new ATOM 0 HB3 ASN B 125 10.718 -0.915 5.486 1.00 0.00 H new ATOM 0 HD21 ASN B 125 14.302 -1.232 4.824 1.00 0.00 H new ATOM 0 HD22 ASN B 125 12.784 -0.931 3.973 1.00 0.00 H new ATOM 1080 N VAL B 126 9.839 0.165 3.246 1.00 0.00 N ATOM 1081 CA VAL B 126 9.569 -0.253 1.876 1.00 0.00 C ATOM 1082 C VAL B 126 9.677 0.923 0.912 1.00 0.00 C ATOM 1083 O VAL B 126 9.934 0.742 -0.279 1.00 0.00 O ATOM 1084 CB VAL B 126 8.169 -0.883 1.747 1.00 0.00 C ATOM 1085 CG1 VAL B 126 7.927 -1.882 2.867 1.00 0.00 C ATOM 1086 CG2 VAL B 126 7.097 0.197 1.742 1.00 0.00 C ATOM 0 H VAL B 126 9.089 -0.043 3.906 1.00 0.00 H new ATOM 0 HA VAL B 126 10.320 -1.000 1.618 1.00 0.00 H new ATOM 0 HB VAL B 126 8.117 -1.418 0.799 1.00 0.00 H new ATOM 0 HG11 VAL B 126 6.933 -2.316 2.759 1.00 0.00 H new ATOM 0 HG12 VAL B 126 8.676 -2.673 2.817 1.00 0.00 H new ATOM 0 HG13 VAL B 126 7.998 -1.374 3.829 1.00 0.00 H new ATOM 0 HG21 VAL B 126 6.114 -0.266 1.650 1.00 0.00 H new ATOM 0 HG22 VAL B 126 7.146 0.763 2.672 1.00 0.00 H new ATOM 0 HG23 VAL B 126 7.262 0.869 0.900 1.00 0.00 H new ATOM 1096 N LYS B 127 9.478 2.128 1.433 1.00 0.00 N ATOM 1097 CA LYS B 127 9.554 3.336 0.619 1.00 0.00 C ATOM 1098 C LYS B 127 11.004 3.751 0.396 1.00 0.00 C ATOM 1099 O LYS B 127 11.345 4.313 -0.645 1.00 0.00 O ATOM 1100 CB LYS B 127 8.783 4.477 1.290 1.00 0.00 C ATOM 1101 CG LYS B 127 7.391 4.082 1.750 1.00 0.00 C ATOM 1102 CD LYS B 127 6.754 5.172 2.596 1.00 0.00 C ATOM 1103 CE LYS B 127 5.516 4.664 3.319 1.00 0.00 C ATOM 1104 NZ LYS B 127 4.578 3.969 2.393 1.00 0.00 N ATOM 0 H LYS B 127 9.263 2.295 2.416 1.00 0.00 H new ATOM 0 HA LYS B 127 9.103 3.121 -0.350 1.00 0.00 H new ATOM 0 HB2 LYS B 127 9.353 4.834 2.148 1.00 0.00 H new ATOM 0 HB3 LYS B 127 8.703 5.310 0.592 1.00 0.00 H new ATOM 0 HG2 LYS B 127 6.763 3.880 0.882 1.00 0.00 H new ATOM 0 HG3 LYS B 127 7.445 3.158 2.326 1.00 0.00 H new ATOM 0 HD2 LYS B 127 7.477 5.538 3.324 1.00 0.00 H new ATOM 0 HD3 LYS B 127 6.485 6.016 1.961 1.00 0.00 H new ATOM 0 HE2 LYS B 127 5.815 3.980 4.114 1.00 0.00 H new ATOM 0 HE3 LYS B 127 5.004 5.501 3.794 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 3.611 4.028 2.770 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 4.613 4.423 1.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 4.854 2.970 2.304 1.00 0.00 H new ATOM 1118 N ALA B 128 11.854 3.470 1.378 1.00 0.00 N ATOM 1119 CA ALA B 128 13.268 3.810 1.285 1.00 0.00 C ATOM 1120 C ALA B 128 13.909 3.169 0.059 1.00 0.00 C ATOM 1121 O ALA B 128 14.563 3.844 -0.736 1.00 0.00 O ATOM 1122 CB ALA B 128 13.998 3.381 2.550 1.00 0.00 C ATOM 0 H ALA B 128 11.588 3.008 2.247 1.00 0.00 H new ATOM 0 HA ALA B 128 13.349 4.892 1.180 1.00 0.00 H new ATOM 0 HB1 ALA B 128 15.053 3.641 2.467 1.00 0.00 H new ATOM 0 HB2 ALA B 128 13.565 3.891 3.411 1.00 0.00 H new ATOM 0 HB3 ALA B 128 13.899 2.303 2.679 1.00 0.00 H new ATOM 1128 N LYS B 129 13.716 1.863 -0.089 1.00 0.00 N ATOM 1129 CA LYS B 129 14.275 1.130 -1.219 1.00 0.00 C ATOM 1130 C LYS B 129 13.535 1.474 -2.508 1.00 0.00 C ATOM 1131 O LYS B 129 14.150 1.620 -3.566 1.00 0.00 O ATOM 1132 CB LYS B 129 14.200 -0.377 -0.962 1.00 0.00 C ATOM 1133 CG LYS B 129 12.897 -0.821 -0.322 1.00 0.00 C ATOM 1134 CD LYS B 129 13.105 -1.272 1.114 1.00 0.00 C ATOM 1135 CE LYS B 129 13.281 -2.781 1.205 1.00 0.00 C ATOM 1136 NZ LYS B 129 14.353 -3.157 2.168 1.00 0.00 N ATOM 0 H LYS B 129 13.176 1.290 0.560 1.00 0.00 H new ATOM 0 HA LYS B 129 15.319 1.422 -1.330 1.00 0.00 H new ATOM 0 HB2 LYS B 129 14.329 -0.905 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS B 129 15.029 -0.669 -0.318 1.00 0.00 H new ATOM 0 HG2 LYS B 129 12.181 0.000 -0.346 1.00 0.00 H new ATOM 0 HG3 LYS B 129 12.466 -1.637 -0.902 1.00 0.00 H new ATOM 0 HD2 LYS B 129 13.983 -0.777 1.528 1.00 0.00 H new ATOM 0 HD3 LYS B 129 12.251 -0.967 1.719 1.00 0.00 H new ATOM 0 HE2 LYS B 129 12.340 -3.239 1.512 1.00 0.00 H new ATOM 0 HE3 LYS B 129 13.522 -3.179 0.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 14.442 -4.193 2.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 15.256 -2.742 1.862 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 14.111 -2.800 3.114 1.00 0.00 H new ATOM 1150 N ILE B 130 12.217 1.603 -2.413 1.00 0.00 N ATOM 1151 CA ILE B 130 11.396 1.931 -3.571 1.00 0.00 C ATOM 1152 C ILE B 130 11.836 3.250 -4.200 1.00 0.00 C ATOM 1153 O ILE B 130 11.704 3.447 -5.407 1.00 0.00 O ATOM 1154 CB ILE B 130 9.905 2.026 -3.197 1.00 0.00 C ATOM 1155 CG1 ILE B 130 9.303 0.627 -3.057 1.00 0.00 C ATOM 1156 CG2 ILE B 130 9.147 2.834 -4.241 1.00 0.00 C ATOM 1157 CD1 ILE B 130 7.934 0.621 -2.413 1.00 0.00 C ATOM 0 H ILE B 130 11.694 1.485 -1.545 1.00 0.00 H new ATOM 0 HA ILE B 130 11.530 1.124 -4.291 1.00 0.00 H new ATOM 0 HB ILE B 130 9.817 2.537 -2.238 1.00 0.00 H new ATOM 0 HG12 ILE B 130 9.234 0.170 -4.044 1.00 0.00 H new ATOM 0 HG13 ILE B 130 9.977 0.008 -2.465 1.00 0.00 H new ATOM 0 HG21 ILE B 130 8.095 2.892 -3.963 1.00 0.00 H new ATOM 0 HG22 ILE B 130 9.564 3.840 -4.296 1.00 0.00 H new ATOM 0 HG23 ILE B 130 9.239 2.350 -5.213 1.00 0.00 H new ATOM 0 HD11 ILE B 130 7.568 -0.404 -2.346 1.00 0.00 H new ATOM 0 HD12 ILE B 130 8.001 1.049 -1.413 1.00 0.00 H new ATOM 0 HD13 ILE B 130 7.246 1.213 -3.016 1.00 0.00 H new ATOM 1169 N GLN B 131 12.359 4.148 -3.372 1.00 0.00 N ATOM 1170 CA GLN B 131 12.819 5.448 -3.847 1.00 0.00 C ATOM 1171 C GLN B 131 13.876 5.287 -4.935 1.00 0.00 C ATOM 1172 O GLN B 131 13.830 5.962 -5.963 1.00 0.00 O ATOM 1173 CB GLN B 131 13.385 6.267 -2.686 1.00 0.00 C ATOM 1174 CG GLN B 131 14.315 7.386 -3.128 1.00 0.00 C ATOM 1175 CD GLN B 131 14.240 8.599 -2.221 1.00 0.00 C ATOM 1176 OE1 GLN B 131 14.456 8.500 -1.013 1.00 0.00 O ATOM 1177 NE2 GLN B 131 13.932 9.754 -2.802 1.00 0.00 N ATOM 0 H GLN B 131 12.475 4.000 -2.370 1.00 0.00 H new ATOM 0 HA GLN B 131 11.965 5.975 -4.272 1.00 0.00 H new ATOM 0 HB2 GLN B 131 12.559 6.695 -2.118 1.00 0.00 H new ATOM 0 HB3 GLN B 131 13.925 5.602 -2.012 1.00 0.00 H new ATOM 0 HG2 GLN B 131 15.340 7.015 -3.148 1.00 0.00 H new ATOM 0 HG3 GLN B 131 14.063 7.682 -4.146 1.00 0.00 H new ATOM 0 HE21 GLN B 131 13.761 9.790 -3.807 1.00 0.00 H new ATOM 0 HE22 GLN B 131 13.867 10.605 -2.243 1.00 0.00 H new ATOM 1186 N ASP B 132 14.827 4.389 -4.700 1.00 0.00 N ATOM 1187 CA ASP B 132 15.895 4.138 -5.660 1.00 0.00 C ATOM 1188 C ASP B 132 15.366 3.392 -6.880 1.00 0.00 C ATOM 1189 O ASP B 132 16.055 3.266 -7.893 1.00 0.00 O ATOM 1190 CB ASP B 132 17.021 3.337 -5.005 1.00 0.00 C ATOM 1191 CG ASP B 132 18.327 3.445 -5.766 1.00 0.00 C ATOM 1192 OD1 ASP B 132 18.712 4.576 -6.127 1.00 0.00 O ATOM 1193 OD2 ASP B 132 18.966 2.397 -6.003 1.00 0.00 O ATOM 0 H ASP B 132 14.880 3.823 -3.853 1.00 0.00 H new ATOM 0 HA ASP B 132 16.288 5.100 -5.988 1.00 0.00 H new ATOM 0 HB2 ASP B 132 17.168 3.691 -3.985 1.00 0.00 H new ATOM 0 HB3 ASP B 132 16.727 2.289 -4.940 1.00 0.00 H new ATOM 1198 N LYS B 133 14.137 2.897 -6.777 1.00 0.00 N ATOM 1199 CA LYS B 133 13.513 2.162 -7.871 1.00 0.00 C ATOM 1200 C LYS B 133 12.841 3.116 -8.854 1.00 0.00 C ATOM 1201 O LYS B 133 13.264 3.235 -10.003 1.00 0.00 O ATOM 1202 CB LYS B 133 12.485 1.169 -7.325 1.00 0.00 C ATOM 1203 CG LYS B 133 12.942 -0.277 -7.391 1.00 0.00 C ATOM 1204 CD LYS B 133 13.997 -0.576 -6.339 1.00 0.00 C ATOM 1205 CE LYS B 133 14.928 -1.693 -6.786 1.00 0.00 C ATOM 1206 NZ LYS B 133 14.175 -2.896 -7.238 1.00 0.00 N ATOM 0 H LYS B 133 13.553 2.992 -5.946 1.00 0.00 H new ATOM 0 HA LYS B 133 14.294 1.614 -8.399 1.00 0.00 H new ATOM 0 HB2 LYS B 133 12.261 1.424 -6.289 1.00 0.00 H new ATOM 0 HB3 LYS B 133 11.557 1.274 -7.887 1.00 0.00 H new ATOM 0 HG2 LYS B 133 12.086 -0.937 -7.248 1.00 0.00 H new ATOM 0 HG3 LYS B 133 13.345 -0.488 -8.382 1.00 0.00 H new ATOM 0 HD2 LYS B 133 14.577 0.324 -6.138 1.00 0.00 H new ATOM 0 HD3 LYS B 133 13.511 -0.858 -5.405 1.00 0.00 H new ATOM 0 HE2 LYS B 133 15.561 -1.335 -7.598 1.00 0.00 H new ATOM 0 HE3 LYS B 133 15.589 -1.966 -5.963 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 14.772 -3.740 -7.130 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 13.315 -3.004 -6.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 13.911 -2.785 -8.238 1.00 0.00 H new ATOM 1220 N GLU B 134 11.796 3.795 -8.393 1.00 0.00 N ATOM 1221 CA GLU B 134 11.068 4.739 -9.233 1.00 0.00 C ATOM 1222 C GLU B 134 11.737 6.110 -9.216 1.00 0.00 C ATOM 1223 O GLU B 134 11.865 6.762 -10.252 1.00 0.00 O ATOM 1224 CB GLU B 134 9.617 4.862 -8.760 1.00 0.00 C ATOM 1225 CG GLU B 134 9.482 5.112 -7.268 1.00 0.00 C ATOM 1226 CD GLU B 134 8.050 5.382 -6.849 1.00 0.00 C ATOM 1227 OE1 GLU B 134 7.173 5.441 -7.736 1.00 0.00 O ATOM 1228 OE2 GLU B 134 7.807 5.534 -5.634 1.00 0.00 O ATOM 0 H GLU B 134 11.434 3.709 -7.443 1.00 0.00 H new ATOM 0 HA GLU B 134 11.079 4.361 -10.255 1.00 0.00 H new ATOM 0 HB2 GLU B 134 9.135 5.676 -9.301 1.00 0.00 H new ATOM 0 HB3 GLU B 134 9.081 3.948 -9.017 1.00 0.00 H new ATOM 0 HG2 GLU B 134 9.859 4.247 -6.723 1.00 0.00 H new ATOM 0 HG3 GLU B 134 10.105 5.961 -6.988 1.00 0.00 H new ATOM 1235 N GLY B 135 12.164 6.541 -8.033 1.00 0.00 N ATOM 1236 CA GLY B 135 12.814 7.831 -7.903 1.00 0.00 C ATOM 1237 C GLY B 135 11.962 8.838 -7.155 1.00 0.00 C ATOM 1238 O GLY B 135 11.880 10.002 -7.546 1.00 0.00 O ATOM 0 H GLY B 135 12.071 6.019 -7.162 1.00 0.00 H new ATOM 0 HA2 GLY B 135 13.763 7.705 -7.382 1.00 0.00 H new ATOM 0 HA3 GLY B 135 13.044 8.220 -8.895 1.00 0.00 H new ATOM 1242 N ILE B 136 11.326 8.387 -6.079 1.00 0.00 N ATOM 1243 CA ILE B 136 10.475 9.257 -5.276 1.00 0.00 C ATOM 1244 C ILE B 136 10.791 9.115 -3.791 1.00 0.00 C ATOM 1245 O ILE B 136 11.073 8.026 -3.293 1.00 0.00 O ATOM 1246 CB ILE B 136 8.983 8.952 -5.504 1.00 0.00 C ATOM 1247 CG1 ILE B 136 8.386 9.940 -6.508 1.00 0.00 C ATOM 1248 CG2 ILE B 136 8.225 9.005 -4.186 1.00 0.00 C ATOM 1249 CD1 ILE B 136 7.167 9.407 -7.228 1.00 0.00 C ATOM 0 H ILE B 136 11.384 7.426 -5.743 1.00 0.00 H new ATOM 0 HA ILE B 136 10.680 10.280 -5.593 1.00 0.00 H new ATOM 0 HB ILE B 136 8.891 7.946 -5.914 1.00 0.00 H new ATOM 0 HG12 ILE B 136 8.117 10.858 -5.986 1.00 0.00 H new ATOM 0 HG13 ILE B 136 9.147 10.202 -7.243 1.00 0.00 H new ATOM 0 HG21 ILE B 136 7.172 8.787 -4.363 1.00 0.00 H new ATOM 0 HG22 ILE B 136 8.638 8.266 -3.499 1.00 0.00 H new ATOM 0 HG23 ILE B 136 8.322 9.999 -3.750 1.00 0.00 H new ATOM 0 HD11 ILE B 136 6.797 10.160 -7.924 1.00 0.00 H new ATOM 0 HD12 ILE B 136 7.435 8.505 -7.778 1.00 0.00 H new ATOM 0 HD13 ILE B 136 6.389 9.171 -6.501 1.00 0.00 H new ATOM 1261 N PRO B 137 10.741 10.242 -3.065 1.00 0.00 N ATOM 1262 CA PRO B 137 11.016 10.269 -1.626 1.00 0.00 C ATOM 1263 C PRO B 137 9.923 9.581 -0.813 1.00 0.00 C ATOM 1264 O PRO B 137 8.738 9.655 -1.136 1.00 0.00 O ATOM 1265 CB PRO B 137 11.062 11.764 -1.301 1.00 0.00 C ATOM 1266 CG PRO B 137 10.226 12.406 -2.353 1.00 0.00 C ATOM 1267 CD PRO B 137 10.411 11.577 -3.594 1.00 0.00 C ATOM 0 HA PRO B 137 11.934 9.736 -1.377 1.00 0.00 H new ATOM 0 HB2 PRO B 137 10.668 11.965 -0.305 1.00 0.00 H new ATOM 0 HB3 PRO B 137 12.084 12.142 -1.322 1.00 0.00 H new ATOM 0 HG2 PRO B 137 9.178 12.434 -2.055 1.00 0.00 H new ATOM 0 HG3 PRO B 137 10.537 13.437 -2.523 1.00 0.00 H new ATOM 0 HD2 PRO B 137 9.507 11.556 -4.202 1.00 0.00 H new ATOM 0 HD3 PRO B 137 11.210 11.969 -4.224 1.00 0.00 H new ATOM 1275 N PRO B 138 10.330 8.897 0.266 1.00 0.00 N ATOM 1276 CA PRO B 138 9.400 8.184 1.147 1.00 0.00 C ATOM 1277 C PRO B 138 8.525 9.134 1.957 1.00 0.00 C ATOM 1278 O PRO B 138 7.540 8.717 2.567 1.00 0.00 O ATOM 1279 CB PRO B 138 10.327 7.391 2.072 1.00 0.00 C ATOM 1280 CG PRO B 138 11.603 8.158 2.080 1.00 0.00 C ATOM 1281 CD PRO B 138 11.728 8.767 0.711 1.00 0.00 C ATOM 0 HA PRO B 138 8.701 7.563 0.586 1.00 0.00 H new ATOM 0 HB2 PRO B 138 9.909 7.309 3.075 1.00 0.00 H new ATOM 0 HB3 PRO B 138 10.478 6.376 1.705 1.00 0.00 H new ATOM 0 HG2 PRO B 138 11.590 8.929 2.850 1.00 0.00 H new ATOM 0 HG3 PRO B 138 12.449 7.506 2.296 1.00 0.00 H new ATOM 0 HD2 PRO B 138 12.230 9.734 0.746 1.00 0.00 H new ATOM 0 HD3 PRO B 138 12.306 8.132 0.040 1.00 0.00 H new ATOM 1289 N ASP B 139 8.889 10.411 1.959 1.00 0.00 N ATOM 1290 CA ASP B 139 8.136 11.421 2.692 1.00 0.00 C ATOM 1291 C ASP B 139 6.944 11.910 1.876 1.00 0.00 C ATOM 1292 O ASP B 139 6.173 12.754 2.332 1.00 0.00 O ATOM 1293 CB ASP B 139 9.041 12.600 3.054 1.00 0.00 C ATOM 1294 CG ASP B 139 8.503 13.406 4.220 1.00 0.00 C ATOM 1295 OD1 ASP B 139 7.699 14.330 3.982 1.00 0.00 O ATOM 1296 OD2 ASP B 139 8.889 13.113 5.372 1.00 0.00 O ATOM 0 H ASP B 139 9.702 10.772 1.460 1.00 0.00 H new ATOM 0 HA ASP B 139 7.762 10.965 3.609 1.00 0.00 H new ATOM 0 HB2 ASP B 139 10.035 12.228 3.301 1.00 0.00 H new ATOM 0 HB3 ASP B 139 9.150 13.250 2.186 1.00 0.00 H new ATOM 1301 N GLN B 140 6.802 11.375 0.667 1.00 0.00 N ATOM 1302 CA GLN B 140 5.704 11.758 -0.212 1.00 0.00 C ATOM 1303 C GLN B 140 4.863 10.545 -0.595 1.00 0.00 C ATOM 1304 O GLN B 140 3.640 10.633 -0.695 1.00 0.00 O ATOM 1305 CB GLN B 140 6.247 12.436 -1.472 1.00 0.00 C ATOM 1306 CG GLN B 140 6.224 13.954 -1.404 1.00 0.00 C ATOM 1307 CD GLN B 140 7.459 14.584 -2.017 1.00 0.00 C ATOM 1308 OE1 GLN B 140 8.246 15.234 -1.328 1.00 0.00 O ATOM 1309 NE2 GLN B 140 7.637 14.396 -3.319 1.00 0.00 N ATOM 0 H GLN B 140 7.433 10.676 0.275 1.00 0.00 H new ATOM 0 HA GLN B 140 5.068 12.461 0.327 1.00 0.00 H new ATOM 0 HB2 GLN B 140 7.271 12.104 -1.641 1.00 0.00 H new ATOM 0 HB3 GLN B 140 5.661 12.110 -2.331 1.00 0.00 H new ATOM 0 HG2 GLN B 140 5.338 14.324 -1.920 1.00 0.00 H new ATOM 0 HG3 GLN B 140 6.140 14.266 -0.363 1.00 0.00 H new ATOM 0 HE21 GLN B 140 6.960 13.851 -3.853 1.00 0.00 H new ATOM 0 HE22 GLN B 140 8.451 14.797 -3.786 1.00 0.00 H new ATOM 1318 N GLN B 141 5.529 9.414 -0.808 1.00 0.00 N ATOM 1319 CA GLN B 141 4.841 8.184 -1.180 1.00 0.00 C ATOM 1320 C GLN B 141 4.318 7.457 0.054 1.00 0.00 C ATOM 1321 O GLN B 141 4.942 7.486 1.115 1.00 0.00 O ATOM 1322 CB GLN B 141 5.781 7.266 -1.966 1.00 0.00 C ATOM 1323 CG GLN B 141 6.991 6.809 -1.167 1.00 0.00 C ATOM 1324 CD GLN B 141 7.744 5.682 -1.846 1.00 0.00 C ATOM 1325 OE1 GLN B 141 7.238 4.566 -1.967 1.00 0.00 O ATOM 1326 NE2 GLN B 141 8.963 5.968 -2.292 1.00 0.00 N ATOM 0 H GLN B 141 6.542 9.325 -0.729 1.00 0.00 H new ATOM 0 HA GLN B 141 3.992 8.450 -1.810 1.00 0.00 H new ATOM 0 HB2 GLN B 141 5.225 6.390 -2.301 1.00 0.00 H new ATOM 0 HB3 GLN B 141 6.122 7.788 -2.860 1.00 0.00 H new ATOM 0 HG2 GLN B 141 7.664 7.653 -1.018 1.00 0.00 H new ATOM 0 HG3 GLN B 141 6.667 6.482 -0.179 1.00 0.00 H new ATOM 0 HE21 GLN B 141 9.343 6.907 -2.170 1.00 0.00 H new ATOM 0 HE22 GLN B 141 9.518 5.249 -2.756 1.00 0.00 H new ATOM 1335 N ARG B 142 3.168 6.806 -0.091 1.00 0.00 N ATOM 1336 CA ARG B 142 2.560 6.074 1.014 1.00 0.00 C ATOM 1337 C ARG B 142 2.193 4.655 0.588 1.00 0.00 C ATOM 1338 O ARG B 142 2.393 4.270 -0.565 1.00 0.00 O ATOM 1339 CB ARG B 142 1.313 6.805 1.514 1.00 0.00 C ATOM 1340 CG ARG B 142 1.557 8.269 1.842 1.00 0.00 C ATOM 1341 CD ARG B 142 2.417 8.426 3.086 1.00 0.00 C ATOM 1342 NE ARG B 142 2.566 9.825 3.476 1.00 0.00 N ATOM 1343 CZ ARG B 142 1.653 10.497 4.166 1.00 0.00 C ATOM 1344 NH1 ARG B 142 0.530 9.903 4.542 1.00 0.00 N ATOM 1345 NH2 ARG B 142 1.863 11.770 4.483 1.00 0.00 N ATOM 0 H ARG B 142 2.639 6.771 -0.962 1.00 0.00 H new ATOM 0 HA ARG B 142 3.288 6.017 1.823 1.00 0.00 H new ATOM 0 HB2 ARG B 142 0.533 6.736 0.756 1.00 0.00 H new ATOM 0 HB3 ARG B 142 0.938 6.299 2.404 1.00 0.00 H new ATOM 0 HG2 ARG B 142 2.045 8.756 0.997 1.00 0.00 H new ATOM 0 HG3 ARG B 142 0.602 8.773 1.992 1.00 0.00 H new ATOM 0 HD2 ARG B 142 1.971 7.866 3.908 1.00 0.00 H new ATOM 0 HD3 ARG B 142 3.401 7.994 2.903 1.00 0.00 H new ATOM 0 HE ARG B 142 3.419 10.313 3.203 1.00 0.00 H new ATOM 0 HH11 ARG B 142 0.365 8.926 4.301 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -0.169 10.423 5.072 1.00 0.00 H new ATOM 0 HH21 ARG B 142 2.726 12.231 4.196 1.00 0.00 H new ATOM 0 HH22 ARG B 142 1.161 12.286 5.013 1.00 0.00 H new ATOM 1359 N LEU B 143 1.659 3.880 1.526 1.00 0.00 N ATOM 1360 CA LEU B 143 1.265 2.504 1.249 1.00 0.00 C ATOM 1361 C LEU B 143 -0.219 2.294 1.534 1.00 0.00 C ATOM 1362 O LEU B 143 -0.800 2.972 2.381 1.00 0.00 O ATOM 1363 CB LEU B 143 2.099 1.536 2.090 1.00 0.00 C ATOM 1364 CG LEU B 143 2.513 0.234 1.402 1.00 0.00 C ATOM 1365 CD1 LEU B 143 3.309 0.528 0.140 1.00 0.00 C ATOM 1366 CD2 LEU B 143 3.318 -0.639 2.352 1.00 0.00 C ATOM 0 H LEU B 143 1.489 4.182 2.485 1.00 0.00 H new ATOM 0 HA LEU B 143 1.444 2.306 0.192 1.00 0.00 H new ATOM 0 HB2 LEU B 143 3.001 2.054 2.416 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.533 1.285 2.987 1.00 0.00 H new ATOM 0 HG LEU B 143 1.611 -0.309 1.120 1.00 0.00 H new ATOM 0 HD11 LEU B 143 3.595 -0.410 -0.336 1.00 0.00 H new ATOM 0 HD12 LEU B 143 2.698 1.113 -0.548 1.00 0.00 H new ATOM 0 HD13 LEU B 143 4.205 1.092 0.398 1.00 0.00 H new ATOM 0 HD21 LEU B 143 3.604 -1.561 1.845 1.00 0.00 H new ATOM 0 HD22 LEU B 143 4.215 -0.105 2.666 1.00 0.00 H new ATOM 0 HD23 LEU B 143 2.713 -0.878 3.227 1.00 0.00 H new ATOM 1378 N ILE B 144 -0.825 1.350 0.821 1.00 0.00 N ATOM 1379 CA ILE B 144 -2.240 1.050 1.000 1.00 0.00 C ATOM 1380 C ILE B 144 -2.494 -0.454 0.947 1.00 0.00 C ATOM 1381 O ILE B 144 -2.376 -1.077 -0.108 1.00 0.00 O ATOM 1382 CB ILE B 144 -3.102 1.742 -0.071 1.00 0.00 C ATOM 1383 CG1 ILE B 144 -2.868 3.254 -0.047 1.00 0.00 C ATOM 1384 CG2 ILE B 144 -4.575 1.426 0.148 1.00 0.00 C ATOM 1385 CD1 ILE B 144 -3.383 3.925 1.206 1.00 0.00 C ATOM 0 H ILE B 144 -0.359 0.781 0.115 1.00 0.00 H new ATOM 0 HA ILE B 144 -2.521 1.430 1.982 1.00 0.00 H new ATOM 0 HB ILE B 144 -2.810 1.363 -1.051 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.800 3.450 -0.141 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -3.352 3.702 -0.915 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -5.171 1.923 -0.617 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -4.729 0.349 0.086 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -4.881 1.780 1.133 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -3.183 4.995 1.154 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -4.457 3.760 1.292 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -2.881 3.504 2.077 1.00 0.00 H new ATOM 1397 N PHE B 145 -2.843 -1.029 2.093 1.00 0.00 N ATOM 1398 CA PHE B 145 -3.115 -2.460 2.177 1.00 0.00 C ATOM 1399 C PHE B 145 -4.337 -2.731 3.049 1.00 0.00 C ATOM 1400 O PHE B 145 -4.547 -2.068 4.064 1.00 0.00 O ATOM 1401 CB PHE B 145 -1.899 -3.200 2.739 1.00 0.00 C ATOM 1402 CG PHE B 145 -1.987 -4.692 2.600 1.00 0.00 C ATOM 1403 CD1 PHE B 145 -1.822 -5.297 1.364 1.00 0.00 C ATOM 1404 CD2 PHE B 145 -2.238 -5.490 3.705 1.00 0.00 C ATOM 1405 CE1 PHE B 145 -1.902 -6.670 1.233 1.00 0.00 C ATOM 1406 CE2 PHE B 145 -2.319 -6.865 3.579 1.00 0.00 C ATOM 1407 CZ PHE B 145 -2.153 -7.455 2.342 1.00 0.00 C ATOM 0 H PHE B 145 -2.944 -0.527 2.975 1.00 0.00 H new ATOM 0 HA PHE B 145 -3.320 -2.825 1.171 1.00 0.00 H new ATOM 0 HB2 PHE B 145 -1.002 -2.848 2.229 1.00 0.00 H new ATOM 0 HB3 PHE B 145 -1.786 -2.948 3.793 1.00 0.00 H new ATOM 0 HD1 PHE B 145 -1.629 -4.688 0.493 1.00 0.00 H new ATOM 0 HD2 PHE B 145 -2.372 -5.033 4.675 1.00 0.00 H new ATOM 0 HE1 PHE B 145 -1.768 -7.129 0.265 1.00 0.00 H new ATOM 0 HE2 PHE B 145 -2.512 -7.477 4.448 1.00 0.00 H new ATOM 0 HZ PHE B 145 -2.219 -8.528 2.241 1.00 0.00 H new ATOM 1417 N ALA B 146 -5.140 -3.710 2.645 1.00 0.00 N ATOM 1418 CA ALA B 146 -6.340 -4.070 3.389 1.00 0.00 C ATOM 1419 C ALA B 146 -7.340 -2.919 3.408 1.00 0.00 C ATOM 1420 O ALA B 146 -8.176 -2.825 4.305 1.00 0.00 O ATOM 1421 CB ALA B 146 -5.978 -4.480 4.809 1.00 0.00 C ATOM 0 H ALA B 146 -4.981 -4.268 1.806 1.00 0.00 H new ATOM 0 HA ALA B 146 -6.809 -4.916 2.886 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -6.884 -4.746 5.353 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -5.307 -5.338 4.780 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -5.483 -3.649 5.313 1.00 0.00 H new ATOM 1427 N GLY B 147 -7.248 -2.045 2.411 1.00 0.00 N ATOM 1428 CA GLY B 147 -8.152 -0.911 2.333 1.00 0.00 C ATOM 1429 C GLY B 147 -7.862 0.134 3.392 1.00 0.00 C ATOM 1430 O GLY B 147 -8.674 1.030 3.629 1.00 0.00 O ATOM 0 H GLY B 147 -6.564 -2.101 1.656 1.00 0.00 H new ATOM 0 HA2 GLY B 147 -8.074 -0.455 1.346 1.00 0.00 H new ATOM 0 HA3 GLY B 147 -9.179 -1.260 2.443 1.00 0.00 H new ATOM 1434 N LYS B 148 -6.705 0.019 4.034 1.00 0.00 N ATOM 1435 CA LYS B 148 -6.310 0.960 5.075 1.00 0.00 C ATOM 1436 C LYS B 148 -4.967 1.603 4.747 1.00 0.00 C ATOM 1437 O LYS B 148 -4.246 1.138 3.865 1.00 0.00 O ATOM 1438 CB LYS B 148 -6.232 0.252 6.429 1.00 0.00 C ATOM 1439 CG LYS B 148 -7.155 -0.949 6.542 1.00 0.00 C ATOM 1440 CD LYS B 148 -7.207 -1.481 7.964 1.00 0.00 C ATOM 1441 CE LYS B 148 -6.840 -2.956 8.022 1.00 0.00 C ATOM 1442 NZ LYS B 148 -7.288 -3.589 9.293 1.00 0.00 N ATOM 0 H LYS B 148 -6.023 -0.718 3.851 1.00 0.00 H new ATOM 0 HA LYS B 148 -7.065 1.744 5.126 1.00 0.00 H new ATOM 0 HB2 LYS B 148 -5.206 -0.072 6.602 1.00 0.00 H new ATOM 0 HB3 LYS B 148 -6.478 0.964 7.217 1.00 0.00 H new ATOM 0 HG2 LYS B 148 -8.158 -0.669 6.220 1.00 0.00 H new ATOM 0 HG3 LYS B 148 -6.813 -1.736 5.870 1.00 0.00 H new ATOM 0 HD2 LYS B 148 -6.523 -0.910 8.592 1.00 0.00 H new ATOM 0 HD3 LYS B 148 -8.208 -1.338 8.371 1.00 0.00 H new ATOM 0 HE2 LYS B 148 -7.293 -3.476 7.178 1.00 0.00 H new ATOM 0 HE3 LYS B 148 -5.760 -3.066 7.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 -7.019 -4.594 9.294 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 -6.837 -3.109 10.098 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 -8.321 -3.507 9.376 1.00 0.00 H new ATOM 1456 N GLN B 149 -4.637 2.673 5.464 1.00 0.00 N ATOM 1457 CA GLN B 149 -3.379 3.378 5.248 1.00 0.00 C ATOM 1458 C GLN B 149 -2.288 2.839 6.167 1.00 0.00 C ATOM 1459 O GLN B 149 -2.443 2.822 7.389 1.00 0.00 O ATOM 1460 CB GLN B 149 -3.564 4.878 5.482 1.00 0.00 C ATOM 1461 CG GLN B 149 -4.858 5.429 4.905 1.00 0.00 C ATOM 1462 CD GLN B 149 -4.973 6.933 5.060 1.00 0.00 C ATOM 1463 OE1 GLN B 149 -4.334 7.693 4.331 1.00 0.00 O ATOM 1464 NE2 GLN B 149 -5.790 7.370 6.009 1.00 0.00 N ATOM 0 H GLN B 149 -5.223 3.070 6.199 1.00 0.00 H new ATOM 0 HA GLN B 149 -3.072 3.214 4.215 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -3.541 5.076 6.554 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -2.723 5.413 5.041 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -4.919 5.171 3.848 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -5.704 4.951 5.399 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -6.300 6.704 6.590 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -5.909 8.372 6.158 1.00 0.00 H new ATOM 1473 N LEU B 150 -1.185 2.399 5.573 1.00 0.00 N ATOM 1474 CA LEU B 150 -0.067 1.858 6.340 1.00 0.00 C ATOM 1475 C LEU B 150 1.000 2.922 6.570 1.00 0.00 C ATOM 1476 O LEU B 150 1.421 3.606 5.638 1.00 0.00 O ATOM 1477 CB LEU B 150 0.543 0.659 5.612 1.00 0.00 C ATOM 1478 CG LEU B 150 -0.432 -0.208 4.814 1.00 0.00 C ATOM 1479 CD1 LEU B 150 0.271 -1.446 4.276 1.00 0.00 C ATOM 1480 CD2 LEU B 150 -1.623 -0.603 5.675 1.00 0.00 C ATOM 0 H LEU B 150 -1.040 2.406 4.563 1.00 0.00 H new ATOM 0 HA LEU B 150 -0.446 1.534 7.309 1.00 0.00 H new ATOM 0 HB2 LEU B 150 1.313 1.025 4.932 1.00 0.00 H new ATOM 0 HB3 LEU B 150 1.041 0.028 6.348 1.00 0.00 H new ATOM 0 HG LEU B 150 -0.797 0.375 3.968 1.00 0.00 H new ATOM 0 HD11 LEU B 150 -0.438 -2.051 3.711 1.00 0.00 H new ATOM 0 HD12 LEU B 150 1.091 -1.144 3.624 1.00 0.00 H new ATOM 0 HD13 LEU B 150 0.665 -2.031 5.107 1.00 0.00 H new ATOM 0 HD21 LEU B 150 -2.306 -1.219 5.091 1.00 0.00 H new ATOM 0 HD22 LEU B 150 -1.275 -1.167 6.540 1.00 0.00 H new ATOM 0 HD23 LEU B 150 -2.142 0.294 6.012 1.00 0.00 H new ATOM 1492 N GLU B 151 1.435 3.055 7.819 1.00 0.00 N ATOM 1493 CA GLU B 151 2.455 4.037 8.172 1.00 0.00 C ATOM 1494 C GLU B 151 3.596 3.381 8.945 1.00 0.00 C ATOM 1495 O GLU B 151 3.500 2.224 9.351 1.00 0.00 O ATOM 1496 CB GLU B 151 1.843 5.165 9.006 1.00 0.00 C ATOM 1497 CG GLU B 151 0.950 4.673 10.132 1.00 0.00 C ATOM 1498 CD GLU B 151 0.585 5.775 11.110 1.00 0.00 C ATOM 1499 OE1 GLU B 151 0.383 6.922 10.660 1.00 0.00 O ATOM 1500 OE2 GLU B 151 0.500 5.489 12.322 1.00 0.00 O ATOM 0 H GLU B 151 1.098 2.496 8.603 1.00 0.00 H new ATOM 0 HA GLU B 151 2.856 4.454 7.248 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.645 5.770 9.428 1.00 0.00 H new ATOM 0 HB3 GLU B 151 1.263 5.816 8.352 1.00 0.00 H new ATOM 0 HG2 GLU B 151 0.038 4.250 9.710 1.00 0.00 H new ATOM 0 HG3 GLU B 151 1.456 3.870 10.668 1.00 0.00 H new ATOM 1507 N ASP B 152 4.675 4.131 9.143 1.00 0.00 N ATOM 1508 CA ASP B 152 5.836 3.624 9.866 1.00 0.00 C ATOM 1509 C ASP B 152 5.461 3.240 11.294 1.00 0.00 C ATOM 1510 O ASP B 152 6.173 2.484 11.952 1.00 0.00 O ATOM 1511 CB ASP B 152 6.950 4.672 9.883 1.00 0.00 C ATOM 1512 CG ASP B 152 6.762 5.699 10.982 1.00 0.00 C ATOM 1513 OD1 ASP B 152 5.618 6.164 11.172 1.00 0.00 O ATOM 1514 OD2 ASP B 152 7.760 6.039 11.653 1.00 0.00 O ATOM 0 H ASP B 152 4.770 5.092 8.813 1.00 0.00 H new ATOM 0 HA ASP B 152 6.194 2.733 9.351 1.00 0.00 H new ATOM 0 HB2 ASP B 152 7.911 4.175 10.015 1.00 0.00 H new ATOM 0 HB3 ASP B 152 6.983 5.178 8.918 1.00 0.00 H new ATOM 1519 N GLY B 153 4.335 3.768 11.768 1.00 0.00 N ATOM 1520 CA GLY B 153 3.886 3.469 13.115 1.00 0.00 C ATOM 1521 C GLY B 153 3.726 1.982 13.356 1.00 0.00 C ATOM 1522 O GLY B 153 3.754 1.525 14.500 1.00 0.00 O ATOM 0 H GLY B 153 3.727 4.397 11.243 1.00 0.00 H new ATOM 0 HA2 GLY B 153 4.600 3.875 13.831 1.00 0.00 H new ATOM 0 HA3 GLY B 153 2.934 3.968 13.296 1.00 0.00 H new ATOM 1526 N ARG B 154 3.556 1.223 12.279 1.00 0.00 N ATOM 1527 CA ARG B 154 3.389 -0.221 12.380 1.00 0.00 C ATOM 1528 C ARG B 154 4.363 -0.947 11.457 1.00 0.00 C ATOM 1529 O ARG B 154 4.980 -0.337 10.583 1.00 0.00 O ATOM 1530 CB ARG B 154 1.952 -0.615 12.032 1.00 0.00 C ATOM 1531 CG ARG B 154 0.904 0.294 12.654 1.00 0.00 C ATOM 1532 CD ARG B 154 -0.401 -0.447 12.899 1.00 0.00 C ATOM 1533 NE ARG B 154 -1.550 0.455 12.902 1.00 0.00 N ATOM 1534 CZ ARG B 154 -1.790 1.337 13.866 1.00 0.00 C ATOM 1535 NH1 ARG B 154 -0.965 1.435 14.900 1.00 0.00 N ATOM 1536 NH2 ARG B 154 -2.857 2.123 13.798 1.00 0.00 N ATOM 0 H ARG B 154 3.530 1.585 11.326 1.00 0.00 H new ATOM 0 HA ARG B 154 3.601 -0.515 13.408 1.00 0.00 H new ATOM 0 HB2 ARG B 154 1.833 -0.604 10.949 1.00 0.00 H new ATOM 0 HB3 ARG B 154 1.775 -1.639 12.362 1.00 0.00 H new ATOM 0 HG2 ARG B 154 1.280 0.693 13.596 1.00 0.00 H new ATOM 0 HG3 ARG B 154 0.723 1.145 11.997 1.00 0.00 H new ATOM 0 HD2 ARG B 154 -0.537 -1.205 12.128 1.00 0.00 H new ATOM 0 HD3 ARG B 154 -0.348 -0.969 13.854 1.00 0.00 H new ATOM 0 HE ARG B 154 -2.204 0.405 12.121 1.00 0.00 H new ATOM 0 HH11 ARG B 154 -0.144 0.832 14.956 1.00 0.00 H new ATOM 0 HH12 ARG B 154 -1.152 2.113 15.639 1.00 0.00 H new ATOM 0 HH21 ARG B 154 -3.494 2.050 13.005 1.00 0.00 H new ATOM 0 HH22 ARG B 154 -3.040 2.800 14.539 1.00 0.00 H new ATOM 1550 N THR B 155 4.499 -2.255 11.659 1.00 0.00 N ATOM 1551 CA THR B 155 5.400 -3.064 10.847 1.00 0.00 C ATOM 1552 C THR B 155 4.633 -3.840 9.783 1.00 0.00 C ATOM 1553 O THR B 155 3.410 -3.736 9.684 1.00 0.00 O ATOM 1554 CB THR B 155 6.198 -4.056 11.714 1.00 0.00 C ATOM 1555 OG1 THR B 155 5.303 -4.924 12.416 1.00 0.00 O ATOM 1556 CG2 THR B 155 7.081 -3.316 12.709 1.00 0.00 C ATOM 0 H THR B 155 3.997 -2.776 12.378 1.00 0.00 H new ATOM 0 HA THR B 155 6.093 -2.376 10.362 1.00 0.00 H new ATOM 0 HB THR B 155 6.835 -4.648 11.057 1.00 0.00 H new ATOM 0 HG1 THR B 155 5.819 -5.552 12.963 1.00 0.00 H new ATOM 0 HG21 THR B 155 7.635 -4.037 13.310 1.00 0.00 H new ATOM 0 HG22 THR B 155 7.782 -2.679 12.170 1.00 0.00 H new ATOM 0 HG23 THR B 155 6.459 -2.702 13.360 1.00 0.00 H new ATOM 1564 N LEU B 156 5.359 -4.618 8.987 1.00 0.00 N ATOM 1565 CA LEU B 156 4.745 -5.414 7.930 1.00 0.00 C ATOM 1566 C LEU B 156 3.826 -6.481 8.513 1.00 0.00 C ATOM 1567 O LEU B 156 2.688 -6.643 8.073 1.00 0.00 O ATOM 1568 CB LEU B 156 5.826 -6.071 7.068 1.00 0.00 C ATOM 1569 CG LEU B 156 6.540 -5.155 6.073 1.00 0.00 C ATOM 1570 CD1 LEU B 156 5.533 -4.459 5.171 1.00 0.00 C ATOM 1571 CD2 LEU B 156 7.395 -4.133 6.807 1.00 0.00 C ATOM 0 H LEU B 156 6.372 -4.714 9.053 1.00 0.00 H new ATOM 0 HA LEU B 156 4.147 -4.748 7.309 1.00 0.00 H new ATOM 0 HB2 LEU B 156 6.574 -6.509 7.729 1.00 0.00 H new ATOM 0 HB3 LEU B 156 5.371 -6.892 6.514 1.00 0.00 H new ATOM 0 HG LEU B 156 7.194 -5.766 5.451 1.00 0.00 H new ATOM 0 HD11 LEU B 156 6.059 -3.811 4.470 1.00 0.00 H new ATOM 0 HD12 LEU B 156 4.963 -5.206 4.618 1.00 0.00 H new ATOM 0 HD13 LEU B 156 4.854 -3.860 5.778 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.895 -3.490 6.083 1.00 0.00 H new ATOM 0 HD22 LEU B 156 6.762 -3.526 7.454 1.00 0.00 H new ATOM 0 HD23 LEU B 156 8.141 -4.649 7.411 1.00 0.00 H new ATOM 1583 N SER B 157 4.327 -7.206 9.509 1.00 0.00 N ATOM 1584 CA SER B 157 3.551 -8.260 10.153 1.00 0.00 C ATOM 1585 C SER B 157 2.356 -7.674 10.901 1.00 0.00 C ATOM 1586 O SER B 157 1.426 -8.393 11.265 1.00 0.00 O ATOM 1587 CB SER B 157 4.433 -9.053 11.119 1.00 0.00 C ATOM 1588 OG SER B 157 3.672 -10.014 11.831 1.00 0.00 O ATOM 0 H SER B 157 5.266 -7.083 9.887 1.00 0.00 H new ATOM 0 HA SER B 157 3.180 -8.930 9.378 1.00 0.00 H new ATOM 0 HB2 SER B 157 5.228 -9.552 10.565 1.00 0.00 H new ATOM 0 HB3 SER B 157 4.913 -8.372 11.821 1.00 0.00 H new ATOM 0 HG SER B 157 2.718 -9.814 11.733 1.00 0.00 H new ATOM 1594 N ASP B 158 2.391 -6.366 11.125 1.00 0.00 N ATOM 1595 CA ASP B 158 1.311 -5.681 11.829 1.00 0.00 C ATOM 1596 C ASP B 158 0.088 -5.529 10.930 1.00 0.00 C ATOM 1597 O ASP B 158 -1.049 -5.554 11.402 1.00 0.00 O ATOM 1598 CB ASP B 158 1.778 -4.308 12.313 1.00 0.00 C ATOM 1599 CG ASP B 158 1.959 -4.255 13.817 1.00 0.00 C ATOM 1600 OD1 ASP B 158 2.285 -5.303 14.413 1.00 0.00 O ATOM 1601 OD2 ASP B 158 1.774 -3.165 14.398 1.00 0.00 O ATOM 0 H ASP B 158 3.155 -5.758 10.830 1.00 0.00 H new ATOM 0 HA ASP B 158 1.033 -6.285 12.692 1.00 0.00 H new ATOM 0 HB2 ASP B 158 2.721 -4.056 11.827 1.00 0.00 H new ATOM 0 HB3 ASP B 158 1.052 -3.553 12.011 1.00 0.00 H new ATOM 1606 N TYR B 159 0.329 -5.370 9.634 1.00 0.00 N ATOM 1607 CA TYR B 159 -0.752 -5.209 8.669 1.00 0.00 C ATOM 1608 C TYR B 159 -1.025 -6.519 7.934 1.00 0.00 C ATOM 1609 O TYR B 159 -1.680 -6.533 6.892 1.00 0.00 O ATOM 1610 CB TYR B 159 -0.408 -4.109 7.663 1.00 0.00 C ATOM 1611 CG TYR B 159 -0.561 -2.712 8.219 1.00 0.00 C ATOM 1612 CD1 TYR B 159 -1.794 -2.250 8.664 1.00 0.00 C ATOM 1613 CD2 TYR B 159 0.528 -1.853 8.300 1.00 0.00 C ATOM 1614 CE1 TYR B 159 -1.938 -0.974 9.171 1.00 0.00 C ATOM 1615 CE2 TYR B 159 0.393 -0.574 8.808 1.00 0.00 C ATOM 1616 CZ TYR B 159 -0.842 -0.140 9.242 1.00 0.00 C ATOM 1617 OH TYR B 159 -0.981 1.133 9.748 1.00 0.00 O ATOM 0 H TYR B 159 1.264 -5.349 9.227 1.00 0.00 H new ATOM 0 HA TYR B 159 -1.652 -4.924 9.214 1.00 0.00 H new ATOM 0 HB2 TYR B 159 0.619 -4.246 7.324 1.00 0.00 H new ATOM 0 HB3 TYR B 159 -1.049 -4.215 6.788 1.00 0.00 H new ATOM 0 HD1 TYR B 159 -2.655 -2.901 8.612 1.00 0.00 H new ATOM 0 HD2 TYR B 159 1.496 -2.190 7.960 1.00 0.00 H new ATOM 0 HE1 TYR B 159 -2.904 -0.631 9.510 1.00 0.00 H new ATOM 0 HE2 TYR B 159 1.250 0.081 8.865 1.00 0.00 H new ATOM 0 HH TYR B 159 -0.097 1.502 9.953 1.00 0.00 H new ATOM 1627 N ASN B 160 -0.519 -7.616 8.485 1.00 0.00 N ATOM 1628 CA ASN B 160 -0.707 -8.931 7.883 1.00 0.00 C ATOM 1629 C ASN B 160 -0.134 -8.969 6.470 1.00 0.00 C ATOM 1630 O ASN B 160 -0.673 -9.641 5.590 1.00 0.00 O ATOM 1631 CB ASN B 160 -2.193 -9.293 7.854 1.00 0.00 C ATOM 1632 CG ASN B 160 -2.422 -10.790 7.775 1.00 0.00 C ATOM 1633 OD1 ASN B 160 -2.173 -11.519 8.735 1.00 0.00 O ATOM 1634 ND2 ASN B 160 -2.900 -11.255 6.627 1.00 0.00 N ATOM 0 H ASN B 160 0.025 -7.621 9.348 1.00 0.00 H new ATOM 0 HA ASN B 160 -0.174 -9.662 8.491 1.00 0.00 H new ATOM 0 HB2 ASN B 160 -2.677 -8.901 8.748 1.00 0.00 H new ATOM 0 HB3 ASN B 160 -2.665 -8.810 6.998 1.00 0.00 H new ATOM 0 HD21 ASN B 160 -3.075 -12.254 6.515 1.00 0.00 H new ATOM 0 HD22 ASN B 160 -3.092 -10.614 5.857 1.00 0.00 H new ATOM 1641 N ILE B 161 0.960 -8.246 6.261 1.00 0.00 N ATOM 1642 CA ILE B 161 1.607 -8.199 4.955 1.00 0.00 C ATOM 1643 C ILE B 161 2.491 -9.421 4.735 1.00 0.00 C ATOM 1644 O ILE B 161 3.646 -9.447 5.158 1.00 0.00 O ATOM 1645 CB ILE B 161 2.459 -6.926 4.795 1.00 0.00 C ATOM 1646 CG1 ILE B 161 1.583 -5.679 4.929 1.00 0.00 C ATOM 1647 CG2 ILE B 161 3.176 -6.935 3.453 1.00 0.00 C ATOM 1648 CD1 ILE B 161 2.364 -4.384 4.880 1.00 0.00 C ATOM 0 H ILE B 161 1.418 -7.684 6.979 1.00 0.00 H new ATOM 0 HA ILE B 161 0.812 -8.190 4.209 1.00 0.00 H new ATOM 0 HB ILE B 161 3.209 -6.906 5.586 1.00 0.00 H new ATOM 0 HG12 ILE B 161 0.842 -5.678 4.129 1.00 0.00 H new ATOM 0 HG13 ILE B 161 1.036 -5.729 5.870 1.00 0.00 H new ATOM 0 HG21 ILE B 161 3.774 -6.029 3.354 1.00 0.00 H new ATOM 0 HG22 ILE B 161 3.826 -7.808 3.394 1.00 0.00 H new ATOM 0 HG23 ILE B 161 2.442 -6.975 2.648 1.00 0.00 H new ATOM 0 HD11 ILE B 161 1.679 -3.542 4.981 1.00 0.00 H new ATOM 0 HD12 ILE B 161 3.087 -4.364 5.696 1.00 0.00 H new ATOM 0 HD13 ILE B 161 2.890 -4.312 3.928 1.00 0.00 H new ATOM 1660 N GLN B 162 1.940 -10.431 4.069 1.00 0.00 N ATOM 1661 CA GLN B 162 2.681 -11.656 3.791 1.00 0.00 C ATOM 1662 C GLN B 162 3.416 -11.559 2.459 1.00 0.00 C ATOM 1663 O GLN B 162 3.501 -10.485 1.862 1.00 0.00 O ATOM 1664 CB GLN B 162 1.733 -12.857 3.778 1.00 0.00 C ATOM 1665 CG GLN B 162 0.741 -12.863 4.930 1.00 0.00 C ATOM 1666 CD GLN B 162 1.413 -13.027 6.278 1.00 0.00 C ATOM 1667 OE1 GLN B 162 2.349 -13.814 6.427 1.00 0.00 O ATOM 1668 NE2 GLN B 162 0.939 -12.284 7.271 1.00 0.00 N ATOM 0 H GLN B 162 0.984 -10.425 3.712 1.00 0.00 H new ATOM 0 HA GLN B 162 3.419 -11.792 4.582 1.00 0.00 H new ATOM 0 HB2 GLN B 162 1.184 -12.865 2.837 1.00 0.00 H new ATOM 0 HB3 GLN B 162 2.321 -13.774 3.812 1.00 0.00 H new ATOM 0 HG2 GLN B 162 0.175 -11.932 4.922 1.00 0.00 H new ATOM 0 HG3 GLN B 162 0.026 -13.672 4.784 1.00 0.00 H new ATOM 0 HE21 GLN B 162 0.162 -11.645 7.104 1.00 0.00 H new ATOM 0 HE22 GLN B 162 1.352 -12.352 8.201 1.00 0.00 H new ATOM 1677 N LYS B 163 3.946 -12.685 1.998 1.00 0.00 N ATOM 1678 CA LYS B 163 4.674 -12.729 0.734 1.00 0.00 C ATOM 1679 C LYS B 163 3.762 -12.359 -0.432 1.00 0.00 C ATOM 1680 O LYS B 163 2.557 -12.602 -0.389 1.00 0.00 O ATOM 1681 CB LYS B 163 5.267 -14.122 0.512 1.00 0.00 C ATOM 1682 CG LYS B 163 6.651 -14.100 -0.114 1.00 0.00 C ATOM 1683 CD LYS B 163 6.588 -14.332 -1.614 1.00 0.00 C ATOM 1684 CE LYS B 163 7.941 -14.750 -2.170 1.00 0.00 C ATOM 1685 NZ LYS B 163 7.876 -15.038 -3.630 1.00 0.00 N ATOM 0 H LYS B 163 3.886 -13.582 2.481 1.00 0.00 H new ATOM 0 HA LYS B 163 5.484 -12.001 0.783 1.00 0.00 H new ATOM 0 HB2 LYS B 163 5.318 -14.643 1.468 1.00 0.00 H new ATOM 0 HB3 LYS B 163 4.597 -14.696 -0.128 1.00 0.00 H new ATOM 0 HG2 LYS B 163 7.127 -13.140 0.087 1.00 0.00 H new ATOM 0 HG3 LYS B 163 7.273 -14.867 0.348 1.00 0.00 H new ATOM 0 HD2 LYS B 163 5.849 -15.103 -1.833 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.255 -13.421 -2.111 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.668 -13.959 -1.988 1.00 0.00 H new ATOM 0 HE3 LYS B 163 8.293 -15.635 -1.641 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 8.818 -15.319 -3.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 7.201 -15.810 -3.802 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 7.564 -14.186 -4.138 1.00 0.00 H new ATOM 1699 N GLU B 164 4.347 -11.774 -1.471 1.00 0.00 N ATOM 1700 CA GLU B 164 3.586 -11.373 -2.649 1.00 0.00 C ATOM 1701 C GLU B 164 2.371 -10.539 -2.254 1.00 0.00 C ATOM 1702 O GLU B 164 1.236 -10.873 -2.598 1.00 0.00 O ATOM 1703 CB GLU B 164 3.138 -12.605 -3.438 1.00 0.00 C ATOM 1704 CG GLU B 164 4.262 -13.587 -3.723 1.00 0.00 C ATOM 1705 CD GLU B 164 4.044 -14.367 -5.005 1.00 0.00 C ATOM 1706 OE1 GLU B 164 3.940 -13.731 -6.075 1.00 0.00 O ATOM 1707 OE2 GLU B 164 3.975 -15.613 -4.939 1.00 0.00 O ATOM 0 H GLU B 164 5.344 -11.567 -1.522 1.00 0.00 H new ATOM 0 HA GLU B 164 4.234 -10.763 -3.278 1.00 0.00 H new ATOM 0 HB2 GLU B 164 2.352 -13.116 -2.882 1.00 0.00 H new ATOM 0 HB3 GLU B 164 2.701 -12.282 -4.383 1.00 0.00 H new ATOM 0 HG2 GLU B 164 5.205 -13.045 -3.788 1.00 0.00 H new ATOM 0 HG3 GLU B 164 4.351 -14.283 -2.889 1.00 0.00 H new ATOM 1714 N SER B 165 2.617 -9.454 -1.527 1.00 0.00 N ATOM 1715 CA SER B 165 1.543 -8.574 -1.080 1.00 0.00 C ATOM 1716 C SER B 165 1.274 -7.479 -2.108 1.00 0.00 C ATOM 1717 O SER B 165 2.199 -6.831 -2.599 1.00 0.00 O ATOM 1718 CB SER B 165 1.897 -7.946 0.270 1.00 0.00 C ATOM 1719 OG SER B 165 1.474 -8.770 1.342 1.00 0.00 O ATOM 0 H SER B 165 3.550 -9.163 -1.235 1.00 0.00 H new ATOM 0 HA SER B 165 0.639 -9.173 -0.968 1.00 0.00 H new ATOM 0 HB2 SER B 165 2.974 -7.789 0.331 1.00 0.00 H new ATOM 0 HB3 SER B 165 1.427 -6.966 0.353 1.00 0.00 H new ATOM 0 HG SER B 165 2.148 -9.461 1.509 1.00 0.00 H new ATOM 1725 N THR B 166 0.000 -7.277 -2.429 1.00 0.00 N ATOM 1726 CA THR B 166 -0.393 -6.263 -3.399 1.00 0.00 C ATOM 1727 C THR B 166 -0.712 -4.940 -2.711 1.00 0.00 C ATOM 1728 O THR B 166 -1.836 -4.720 -2.258 1.00 0.00 O ATOM 1729 CB THR B 166 -1.618 -6.712 -4.217 1.00 0.00 C ATOM 1730 OG1 THR B 166 -1.658 -8.141 -4.295 1.00 0.00 O ATOM 1731 CG2 THR B 166 -1.577 -6.122 -5.619 1.00 0.00 C ATOM 0 H THR B 166 -0.778 -7.803 -2.031 1.00 0.00 H new ATOM 0 HA THR B 166 0.453 -6.125 -4.073 1.00 0.00 H new ATOM 0 HB THR B 166 -2.516 -6.352 -3.715 1.00 0.00 H new ATOM 0 HG1 THR B 166 -2.441 -8.418 -4.815 1.00 0.00 H new ATOM 0 HG21 THR B 166 -2.452 -6.453 -6.179 1.00 0.00 H new ATOM 0 HG22 THR B 166 -1.576 -5.034 -5.556 1.00 0.00 H new ATOM 0 HG23 THR B 166 -0.673 -6.456 -6.128 1.00 0.00 H new ATOM 1739 N LEU B 167 0.282 -4.061 -2.639 1.00 0.00 N ATOM 1740 CA LEU B 167 0.107 -2.758 -2.008 1.00 0.00 C ATOM 1741 C LEU B 167 0.201 -1.637 -3.037 1.00 0.00 C ATOM 1742 O LEU B 167 1.008 -1.699 -3.966 1.00 0.00 O ATOM 1743 CB LEU B 167 1.157 -2.553 -0.914 1.00 0.00 C ATOM 1744 CG LEU B 167 1.295 -3.685 0.104 1.00 0.00 C ATOM 1745 CD1 LEU B 167 2.466 -4.588 -0.257 1.00 0.00 C ATOM 1746 CD2 LEU B 167 1.466 -3.122 1.507 1.00 0.00 C ATOM 0 H LEU B 167 1.217 -4.227 -3.010 1.00 0.00 H new ATOM 0 HA LEU B 167 -0.886 -2.730 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.125 -2.401 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU B 167 0.918 -1.635 -0.377 1.00 0.00 H new ATOM 0 HG LEU B 167 0.383 -4.281 0.082 1.00 0.00 H new ATOM 0 HD11 LEU B 167 2.549 -5.388 0.479 1.00 0.00 H new ATOM 0 HD12 LEU B 167 2.302 -5.019 -1.245 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.387 -4.005 -0.264 1.00 0.00 H new ATOM 0 HD21 LEU B 167 1.563 -3.942 2.219 1.00 0.00 H new ATOM 0 HD22 LEU B 167 2.362 -2.502 1.544 1.00 0.00 H new ATOM 0 HD23 LEU B 167 0.596 -2.518 1.765 1.00 0.00 H new ATOM 1758 N HIS B 168 -0.627 -0.611 -2.866 1.00 0.00 N ATOM 1759 CA HIS B 168 -0.634 0.527 -3.779 1.00 0.00 C ATOM 1760 C HIS B 168 0.194 1.679 -3.217 1.00 0.00 C ATOM 1761 O HIS B 168 0.608 1.652 -2.058 1.00 0.00 O ATOM 1762 CB HIS B 168 -2.068 0.992 -4.036 1.00 0.00 C ATOM 1763 CG HIS B 168 -2.701 0.347 -5.230 1.00 0.00 C ATOM 1764 ND1 HIS B 168 -3.229 -0.927 -5.206 1.00 0.00 N ATOM 1765 CD2 HIS B 168 -2.891 0.808 -6.489 1.00 0.00 C ATOM 1766 CE1 HIS B 168 -3.716 -1.222 -6.398 1.00 0.00 C ATOM 1767 NE2 HIS B 168 -3.523 -0.186 -7.195 1.00 0.00 N ATOM 0 H HIS B 168 -1.302 -0.544 -2.104 1.00 0.00 H new ATOM 0 HA HIS B 168 -0.189 0.209 -4.722 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -2.674 0.780 -3.155 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -2.072 2.073 -4.173 1.00 0.00 H new ATOM 0 HD2 HIS B 168 -2.600 1.777 -6.867 1.00 0.00 H new ATOM 0 HE1 HIS B 168 -4.191 -2.152 -6.674 1.00 0.00 H new ATOM 0 HE2 HIS B 168 -3.799 -0.133 -8.176 1.00 0.00 H new ATOM 1775 N LEU B 169 0.432 2.688 -4.047 1.00 0.00 N ATOM 1776 CA LEU B 169 1.213 3.850 -3.635 1.00 0.00 C ATOM 1777 C LEU B 169 0.394 5.130 -3.767 1.00 0.00 C ATOM 1778 O LEU B 169 -0.393 5.283 -4.702 1.00 0.00 O ATOM 1779 CB LEU B 169 2.487 3.958 -4.474 1.00 0.00 C ATOM 1780 CG LEU B 169 3.611 4.807 -3.881 1.00 0.00 C ATOM 1781 CD1 LEU B 169 4.500 3.964 -2.980 1.00 0.00 C ATOM 1782 CD2 LEU B 169 4.432 5.454 -4.988 1.00 0.00 C ATOM 0 H LEU B 169 0.096 2.726 -5.009 1.00 0.00 H new ATOM 0 HA LEU B 169 1.486 3.720 -2.588 1.00 0.00 H new ATOM 0 HB2 LEU B 169 2.871 2.952 -4.647 1.00 0.00 H new ATOM 0 HB3 LEU B 169 2.223 4.370 -5.448 1.00 0.00 H new ATOM 0 HG LEU B 169 3.163 5.597 -3.278 1.00 0.00 H new ATOM 0 HD11 LEU B 169 5.294 4.586 -2.567 1.00 0.00 H new ATOM 0 HD12 LEU B 169 3.905 3.549 -2.167 1.00 0.00 H new ATOM 0 HD13 LEU B 169 4.939 3.152 -3.559 1.00 0.00 H new ATOM 0 HD21 LEU B 169 5.228 6.055 -4.547 1.00 0.00 H new ATOM 0 HD22 LEU B 169 4.869 4.679 -5.618 1.00 0.00 H new ATOM 0 HD23 LEU B 169 3.788 6.092 -5.593 1.00 0.00 H new ATOM 1794 N VAL B 170 0.586 6.048 -2.825 1.00 0.00 N ATOM 1795 CA VAL B 170 -0.132 7.317 -2.838 1.00 0.00 C ATOM 1796 C VAL B 170 0.816 8.488 -2.601 1.00 0.00 C ATOM 1797 O VAL B 170 1.373 8.640 -1.513 1.00 0.00 O ATOM 1798 CB VAL B 170 -1.242 7.345 -1.770 1.00 0.00 C ATOM 1799 CG1 VAL B 170 -2.082 8.605 -1.905 1.00 0.00 C ATOM 1800 CG2 VAL B 170 -2.110 6.101 -1.872 1.00 0.00 C ATOM 0 H VAL B 170 1.232 5.937 -2.044 1.00 0.00 H new ATOM 0 HA VAL B 170 -0.585 7.414 -3.825 1.00 0.00 H new ATOM 0 HB VAL B 170 -0.775 7.354 -0.785 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -2.861 8.607 -1.142 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -1.447 9.481 -1.777 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -2.542 8.632 -2.893 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -2.889 6.137 -1.110 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -2.570 6.058 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -1.495 5.214 -1.720 1.00 0.00 H new ATOM 1810 N LEU B 171 0.994 9.314 -3.625 1.00 0.00 N ATOM 1811 CA LEU B 171 1.875 10.473 -3.529 1.00 0.00 C ATOM 1812 C LEU B 171 1.069 11.756 -3.352 1.00 0.00 C ATOM 1813 O LEU B 171 0.325 12.161 -4.245 1.00 0.00 O ATOM 1814 CB LEU B 171 2.752 10.576 -4.779 1.00 0.00 C ATOM 1815 CG LEU B 171 4.182 10.052 -4.640 1.00 0.00 C ATOM 1816 CD1 LEU B 171 4.296 8.652 -5.223 1.00 0.00 C ATOM 1817 CD2 LEU B 171 5.164 10.996 -5.317 1.00 0.00 C ATOM 0 H LEU B 171 0.540 9.203 -4.532 1.00 0.00 H new ATOM 0 HA LEU B 171 2.513 10.343 -2.655 1.00 0.00 H new ATOM 0 HB2 LEU B 171 2.264 10.031 -5.587 1.00 0.00 H new ATOM 0 HB3 LEU B 171 2.797 11.622 -5.082 1.00 0.00 H new ATOM 0 HG LEU B 171 4.429 10.003 -3.580 1.00 0.00 H new ATOM 0 HD11 LEU B 171 5.320 8.295 -5.115 1.00 0.00 H new ATOM 0 HD12 LEU B 171 3.620 7.981 -4.693 1.00 0.00 H new ATOM 0 HD13 LEU B 171 4.029 8.675 -6.280 1.00 0.00 H new ATOM 0 HD21 LEU B 171 6.176 10.607 -5.208 1.00 0.00 H new ATOM 0 HD22 LEU B 171 4.919 11.078 -6.376 1.00 0.00 H new ATOM 0 HD23 LEU B 171 5.101 11.980 -4.853 1.00 0.00 H new ATOM 1829 N ARG B 172 1.226 12.392 -2.196 1.00 0.00 N ATOM 1830 CA ARG B 172 0.514 13.630 -1.903 1.00 0.00 C ATOM 1831 C ARG B 172 1.477 14.811 -1.849 1.00 0.00 C ATOM 1832 O ARG B 172 1.847 15.277 -0.770 1.00 0.00 O ATOM 1833 CB ARG B 172 -0.236 13.509 -0.575 1.00 0.00 C ATOM 1834 CG ARG B 172 -1.700 13.131 -0.734 1.00 0.00 C ATOM 1835 CD ARG B 172 -1.880 11.625 -0.824 1.00 0.00 C ATOM 1836 NE ARG B 172 -1.516 10.955 0.422 1.00 0.00 N ATOM 1837 CZ ARG B 172 -2.270 10.973 1.514 1.00 0.00 C ATOM 1838 NH1 ARG B 172 -3.426 11.624 1.515 1.00 0.00 N ATOM 1839 NH2 ARG B 172 -1.871 10.339 2.610 1.00 0.00 N ATOM 0 H ARG B 172 1.840 12.071 -1.447 1.00 0.00 H new ATOM 0 HA ARG B 172 -0.204 13.805 -2.704 1.00 0.00 H new ATOM 0 HB2 ARG B 172 0.258 12.761 0.045 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -0.170 14.458 -0.043 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -2.270 13.517 0.111 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -2.103 13.601 -1.631 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -2.918 11.398 -1.068 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -1.268 11.235 -1.638 1.00 0.00 H new ATOM 0 HE ARG B 172 -0.633 10.445 0.455 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -3.737 12.112 0.675 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -4.004 11.636 2.356 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -0.983 9.837 2.614 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -2.452 10.354 3.448 1.00 0.00 H new ATOM 1853 N LEU B 173 1.882 15.292 -3.020 1.00 0.00 N ATOM 1854 CA LEU B 173 2.804 16.420 -3.107 1.00 0.00 C ATOM 1855 C LEU B 173 2.173 17.684 -2.533 1.00 0.00 C ATOM 1856 O LEU B 173 1.203 18.209 -3.079 1.00 0.00 O ATOM 1857 CB LEU B 173 3.214 16.656 -4.561 1.00 0.00 C ATOM 1858 CG LEU B 173 4.670 17.064 -4.788 1.00 0.00 C ATOM 1859 CD1 LEU B 173 5.222 16.401 -6.042 1.00 0.00 C ATOM 1860 CD2 LEU B 173 4.791 18.578 -4.887 1.00 0.00 C ATOM 0 H LEU B 173 1.587 14.919 -3.922 1.00 0.00 H new ATOM 0 HA LEU B 173 3.690 16.180 -2.520 1.00 0.00 H new ATOM 0 HB2 LEU B 173 3.021 15.744 -5.125 1.00 0.00 H new ATOM 0 HB3 LEU B 173 2.571 17.431 -4.978 1.00 0.00 H new ATOM 0 HG LEU B 173 5.258 16.727 -3.934 1.00 0.00 H new ATOM 0 HD11 LEU B 173 6.259 16.703 -6.187 1.00 0.00 H new ATOM 0 HD12 LEU B 173 5.172 15.318 -5.933 1.00 0.00 H new ATOM 0 HD13 LEU B 173 4.631 16.707 -6.905 1.00 0.00 H new ATOM 0 HD21 LEU B 173 5.834 18.850 -5.048 1.00 0.00 H new ATOM 0 HD22 LEU B 173 4.189 18.937 -5.722 1.00 0.00 H new ATOM 0 HD23 LEU B 173 4.437 19.033 -3.962 1.00 0.00 H new