USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 HIS : no HE2:sc= -1.67 K(o=-2.9,f=-9.7!) USER MOD Set 1.2: B 69 ASN : amide:sc= -1.19 K(o=-2.9,f=-14!) USER MOD Set 2.1: B 9 HIS : no HD1:sc= -0.134 X(o=0.52,f=0.19) USER MOD Set 2.2: B 37 HIS : no HD1:sc= 0.0746 K(o=0.52,f=-1.1) USER MOD Set 2.3: B 40 THR OG1 : rot 0:sc= 0.585 USER MOD Set 3.1: B 12 CYS SG : rot 180:sc= 0.942 USER MOD Set 3.2: B 15 CYS SG : rot 63:sc= -4.38! USER MOD Set 4.1: A 69 ASN : amide:sc= -0.985 K(o=0.15,f=-7.7!) USER MOD Set 4.2: B 67 HIS : no HE2:sc= 1.14 K(o=0.15,f=-10!) USER MOD Set 5.1: A 37 HIS : no HD1:sc= 0.938 K(o=2.3,f=-7.2!) USER MOD Set 5.2: A 40 THR OG1 : rot 67:sc= 1.32 USER MOD Single : A 1 VAL N :NH3+ -164:sc= -0.0723 (180deg=-0.469) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 162:sc= 0.459 (180deg=0.301) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= 0.713 K(o=0.71,f=-3.9!) USER MOD Single : A 12 CYS SG : rot -150:sc= -0.0121 USER MOD Single : A 15 CYS SG : rot -110:sc= -1.98 USER MOD Single : A 17 SER OG : rot 72:sc= 0.324 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 24 ASN : amide:sc= -0.17 X(o=-0.17,f=-0.16!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 174:sc= 1.15 (180deg=1.05) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 71:sc= 0.291 USER MOD Single : A 42 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0292) USER MOD Single : A 50 LYS NZ :NH3+ -171:sc= -0.0169 (180deg=-0.151) USER MOD Single : A 54 LYS NZ :NH3+ -162:sc= -0.0686 (180deg=-0.507) USER MOD Single : A 55 SER OG : rot -142:sc= 0.872 USER MOD Single : A 78 LYS NZ :NH3+ -173:sc= 0.606 (180deg=0.429) USER MOD Single : A 80 SER OG : rot 78:sc= 0.255 USER MOD Single : B 1 VAL N :NH3+ -164:sc= -0.023 (180deg=-0.332) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 TYR OH : rot 180:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 20 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : B 24 ASN : amide:sc= 0.397 X(o=0.4,f=0) USER MOD Single : B 29 SER OG : rot 81:sc= 1.07 USER MOD Single : B 30 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.14) USER MOD Single : B 31 TYR OH : rot -166:sc= 0.041 USER MOD Single : B 32 THR OG1 : rot 91:sc= 0.0881 USER MOD Single : B 42 LYS NZ :NH3+ 168:sc= -0.0204 (180deg=-0.161) USER MOD Single : B 50 LYS NZ :NH3+ -168:sc=-0.00615 (180deg=-0.131) USER MOD Single : B 54 LYS NZ :NH3+ -159:sc= -0.0786 (180deg=-0.46) USER MOD Single : B 55 SER OG : rot 180:sc= -0.0964 USER MOD Single : B 78 LYS NZ :NH3+ -158:sc= 0.748 (180deg=0.38) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 28.299 15.341 -15.782 1.00 0.00 N ATOM 2 CA VAL A 1 27.602 16.121 -14.735 1.00 0.00 C ATOM 3 C VAL A 1 27.336 15.250 -13.516 1.00 0.00 C ATOM 4 O VAL A 1 26.520 14.324 -13.565 1.00 0.00 O ATOM 5 CB VAL A 1 26.267 16.702 -15.250 1.00 0.00 C ATOM 6 CG1 VAL A 1 25.596 17.549 -14.178 1.00 0.00 C ATOM 7 CG2 VAL A 1 26.488 17.520 -16.512 1.00 0.00 C ATOM 0 H1 VAL A 1 28.712 15.990 -16.481 1.00 0.00 H new ATOM 0 H2 VAL A 1 29.055 14.774 -15.347 1.00 0.00 H new ATOM 0 H3 VAL A 1 27.621 14.710 -16.254 1.00 0.00 H new ATOM 0 HA VAL A 1 28.254 16.950 -14.460 1.00 0.00 H new ATOM 0 HB VAL A 1 25.607 15.869 -15.491 1.00 0.00 H new ATOM 0 HG11 VAL A 1 24.658 17.948 -14.564 1.00 0.00 H new ATOM 0 HG12 VAL A 1 25.396 16.934 -13.301 1.00 0.00 H new ATOM 0 HG13 VAL A 1 26.254 18.373 -13.901 1.00 0.00 H new ATOM 0 HG21 VAL A 1 25.535 17.920 -16.858 1.00 0.00 H new ATOM 0 HG22 VAL A 1 27.170 18.343 -16.298 1.00 0.00 H new ATOM 0 HG23 VAL A 1 26.917 16.885 -17.287 1.00 0.00 H new ATOM 19 N ALA A 2 28.035 15.544 -12.432 1.00 0.00 N ATOM 20 CA ALA A 2 27.890 14.796 -11.199 1.00 0.00 C ATOM 21 C ALA A 2 27.794 15.737 -10.009 1.00 0.00 C ATOM 22 O ALA A 2 28.788 16.341 -9.596 1.00 0.00 O ATOM 23 CB ALA A 2 29.052 13.830 -11.025 1.00 0.00 C ATOM 0 H ALA A 2 28.714 16.303 -12.384 1.00 0.00 H new ATOM 0 HA ALA A 2 26.967 14.219 -11.253 1.00 0.00 H new ATOM 0 HB1 ALA A 2 28.928 13.276 -10.095 1.00 0.00 H new ATOM 0 HB2 ALA A 2 29.074 13.133 -11.862 1.00 0.00 H new ATOM 0 HB3 ALA A 2 29.988 14.388 -10.993 1.00 0.00 H new ATOM 29 N SER A 3 26.592 15.871 -9.472 1.00 0.00 N ATOM 30 CA SER A 3 26.365 16.700 -8.302 1.00 0.00 C ATOM 31 C SER A 3 26.813 15.955 -7.045 1.00 0.00 C ATOM 32 O SER A 3 27.428 14.890 -7.133 1.00 0.00 O ATOM 33 CB SER A 3 24.882 17.064 -8.209 1.00 0.00 C ATOM 34 OG SER A 3 24.411 17.602 -9.434 1.00 0.00 O ATOM 0 H SER A 3 25.755 15.413 -9.831 1.00 0.00 H new ATOM 0 HA SER A 3 26.947 17.618 -8.389 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.302 16.178 -7.951 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.731 17.788 -7.408 1.00 0.00 H new ATOM 0 HG SER A 3 23.460 17.825 -9.349 1.00 0.00 H new ATOM 40 N LYS A 4 26.517 16.502 -5.880 1.00 0.00 N ATOM 41 CA LYS A 4 26.887 15.849 -4.637 1.00 0.00 C ATOM 42 C LYS A 4 25.641 15.440 -3.861 1.00 0.00 C ATOM 43 O LYS A 4 24.598 16.074 -3.979 1.00 0.00 O ATOM 44 CB LYS A 4 27.765 16.768 -3.790 1.00 0.00 C ATOM 45 CG LYS A 4 28.503 16.028 -2.692 1.00 0.00 C ATOM 46 CD LYS A 4 29.438 16.938 -1.923 1.00 0.00 C ATOM 47 CE LYS A 4 30.346 16.128 -1.021 1.00 0.00 C ATOM 48 NZ LYS A 4 31.242 16.986 -0.207 1.00 0.00 N ATOM 0 H LYS A 4 26.026 17.389 -5.768 1.00 0.00 H new ATOM 0 HA LYS A 4 27.458 14.951 -4.875 1.00 0.00 H new ATOM 0 HB2 LYS A 4 28.488 17.267 -4.435 1.00 0.00 H new ATOM 0 HB3 LYS A 4 27.145 17.546 -3.344 1.00 0.00 H new ATOM 0 HG2 LYS A 4 27.782 15.586 -2.005 1.00 0.00 H new ATOM 0 HG3 LYS A 4 29.073 15.207 -3.128 1.00 0.00 H new ATOM 0 HD2 LYS A 4 30.037 17.525 -2.619 1.00 0.00 H new ATOM 0 HD3 LYS A 4 28.859 17.644 -1.327 1.00 0.00 H new ATOM 0 HE2 LYS A 4 29.739 15.509 -0.360 1.00 0.00 H new ATOM 0 HE3 LYS A 4 30.947 15.451 -1.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 31.616 16.437 0.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 32.031 17.321 -0.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 30.708 17.802 0.153 1.00 0.00 H new ATOM 62 N ALA A 5 25.750 14.372 -3.084 1.00 0.00 N ATOM 63 CA ALA A 5 24.636 13.888 -2.286 1.00 0.00 C ATOM 64 C ALA A 5 25.117 13.453 -0.907 1.00 0.00 C ATOM 65 O ALA A 5 25.842 12.468 -0.773 1.00 0.00 O ATOM 66 CB ALA A 5 23.939 12.735 -2.994 1.00 0.00 C ATOM 0 H ALA A 5 26.604 13.822 -2.990 1.00 0.00 H new ATOM 0 HA ALA A 5 23.921 14.701 -2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 5 23.107 12.383 -2.384 1.00 0.00 H new ATOM 0 HB2 ALA A 5 23.563 13.075 -3.959 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.647 11.920 -3.146 1.00 0.00 H new ATOM 72 N ILE A 6 24.729 14.201 0.112 1.00 0.00 N ATOM 73 CA ILE A 6 25.120 13.885 1.478 1.00 0.00 C ATOM 74 C ILE A 6 24.010 13.109 2.174 1.00 0.00 C ATOM 75 O ILE A 6 22.879 13.583 2.272 1.00 0.00 O ATOM 76 CB ILE A 6 25.436 15.158 2.294 1.00 0.00 C ATOM 77 CG1 ILE A 6 26.486 16.015 1.580 1.00 0.00 C ATOM 78 CG2 ILE A 6 25.919 14.784 3.689 1.00 0.00 C ATOM 79 CD1 ILE A 6 27.824 15.328 1.411 1.00 0.00 C ATOM 0 H ILE A 6 24.144 15.031 0.021 1.00 0.00 H new ATOM 0 HA ILE A 6 26.024 13.279 1.425 1.00 0.00 H new ATOM 0 HB ILE A 6 24.521 15.743 2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 6 26.106 16.295 0.598 1.00 0.00 H new ATOM 0 HG13 ILE A 6 26.631 16.938 2.141 1.00 0.00 H new ATOM 0 HG21 ILE A 6 26.138 15.690 4.253 1.00 0.00 H new ATOM 0 HG22 ILE A 6 25.143 14.216 4.202 1.00 0.00 H new ATOM 0 HG23 ILE A 6 26.822 14.178 3.611 1.00 0.00 H new ATOM 0 HD11 ILE A 6 28.514 15.997 0.897 1.00 0.00 H new ATOM 0 HD12 ILE A 6 28.228 15.072 2.391 1.00 0.00 H new ATOM 0 HD13 ILE A 6 27.695 14.419 0.823 1.00 0.00 H new ATOM 91 N PHE A 7 24.334 11.922 2.654 1.00 0.00 N ATOM 92 CA PHE A 7 23.346 11.057 3.277 1.00 0.00 C ATOM 93 C PHE A 7 23.554 11.013 4.788 1.00 0.00 C ATOM 94 O PHE A 7 24.459 10.344 5.279 1.00 0.00 O ATOM 95 CB PHE A 7 23.440 9.650 2.676 1.00 0.00 C ATOM 96 CG PHE A 7 22.321 8.727 3.070 1.00 0.00 C ATOM 97 CD1 PHE A 7 21.111 8.761 2.395 1.00 0.00 C ATOM 98 CD2 PHE A 7 22.483 7.815 4.101 1.00 0.00 C ATOM 99 CE1 PHE A 7 20.084 7.907 2.743 1.00 0.00 C ATOM 100 CE2 PHE A 7 21.458 6.960 4.455 1.00 0.00 C ATOM 101 CZ PHE A 7 20.258 7.005 3.774 1.00 0.00 C ATOM 0 H PHE A 7 25.277 11.533 2.625 1.00 0.00 H new ATOM 0 HA PHE A 7 22.350 11.456 3.085 1.00 0.00 H new ATOM 0 HB2 PHE A 7 23.459 9.734 1.589 1.00 0.00 H new ATOM 0 HB3 PHE A 7 24.387 9.202 2.978 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.970 9.464 1.587 1.00 0.00 H new ATOM 0 HD2 PHE A 7 23.422 7.773 4.634 1.00 0.00 H new ATOM 0 HE1 PHE A 7 19.146 7.944 2.210 1.00 0.00 H new ATOM 0 HE2 PHE A 7 21.595 6.257 5.263 1.00 0.00 H new ATOM 0 HZ PHE A 7 19.456 6.335 4.047 1.00 0.00 H new ATOM 111 N TYR A 8 22.728 11.748 5.516 1.00 0.00 N ATOM 112 CA TYR A 8 22.806 11.777 6.973 1.00 0.00 C ATOM 113 C TYR A 8 21.882 10.728 7.573 1.00 0.00 C ATOM 114 O TYR A 8 20.719 10.638 7.191 1.00 0.00 O ATOM 115 CB TYR A 8 22.404 13.152 7.520 1.00 0.00 C ATOM 116 CG TYR A 8 23.418 14.252 7.297 1.00 0.00 C ATOM 117 CD1 TYR A 8 24.598 14.292 8.028 1.00 0.00 C ATOM 118 CD2 TYR A 8 23.182 15.266 6.377 1.00 0.00 C ATOM 119 CE1 TYR A 8 25.517 15.308 7.847 1.00 0.00 C ATOM 120 CE2 TYR A 8 24.098 16.284 6.188 1.00 0.00 C ATOM 121 CZ TYR A 8 25.263 16.301 6.926 1.00 0.00 C ATOM 122 OH TYR A 8 26.176 17.314 6.744 1.00 0.00 O ATOM 0 H TYR A 8 21.993 12.335 5.123 1.00 0.00 H new ATOM 0 HA TYR A 8 23.839 11.567 7.250 1.00 0.00 H new ATOM 0 HB2 TYR A 8 21.462 13.448 7.059 1.00 0.00 H new ATOM 0 HB3 TYR A 8 22.220 13.060 8.590 1.00 0.00 H new ATOM 0 HD1 TYR A 8 24.801 13.515 8.751 1.00 0.00 H new ATOM 0 HD2 TYR A 8 22.269 15.259 5.801 1.00 0.00 H new ATOM 0 HE1 TYR A 8 26.430 15.324 8.424 1.00 0.00 H new ATOM 0 HE2 TYR A 8 23.902 17.063 5.466 1.00 0.00 H new ATOM 0 HH TYR A 8 25.847 17.932 6.058 1.00 0.00 H new ATOM 132 N HIS A 9 22.389 9.937 8.508 1.00 0.00 N ATOM 133 CA HIS A 9 21.547 8.986 9.222 1.00 0.00 C ATOM 134 C HIS A 9 22.170 8.617 10.563 1.00 0.00 C ATOM 135 O HIS A 9 23.333 8.922 10.815 1.00 0.00 O ATOM 136 CB HIS A 9 21.289 7.730 8.379 1.00 0.00 C ATOM 137 CG HIS A 9 22.449 6.786 8.280 1.00 0.00 C ATOM 138 ND1 HIS A 9 22.436 5.583 8.937 1.00 0.00 N ATOM 139 CD2 HIS A 9 23.601 6.895 7.579 1.00 0.00 C ATOM 140 CE1 HIS A 9 23.572 4.987 8.623 1.00 0.00 C ATOM 141 NE2 HIS A 9 24.312 5.741 7.801 1.00 0.00 N ATOM 0 H HIS A 9 23.370 9.934 8.789 1.00 0.00 H new ATOM 0 HA HIS A 9 20.586 9.465 9.409 1.00 0.00 H new ATOM 0 HB2 HIS A 9 20.439 7.195 8.802 1.00 0.00 H new ATOM 0 HB3 HIS A 9 21.003 8.038 7.373 1.00 0.00 H new ATOM 0 HD2 HIS A 9 23.903 7.729 6.963 1.00 0.00 H new ATOM 0 HE1 HIS A 9 23.867 4.013 8.984 1.00 0.00 H new ATOM 0 HE2 HIS A 9 25.226 5.505 7.415 1.00 0.00 H new ATOM 149 N ALA A 10 21.395 7.959 11.418 1.00 0.00 N ATOM 150 CA ALA A 10 21.851 7.628 12.763 1.00 0.00 C ATOM 151 C ALA A 10 22.072 6.126 12.932 1.00 0.00 C ATOM 152 O ALA A 10 22.245 5.638 14.048 1.00 0.00 O ATOM 153 CB ALA A 10 20.852 8.133 13.794 1.00 0.00 C ATOM 0 H ALA A 10 20.449 7.644 11.204 1.00 0.00 H new ATOM 0 HA ALA A 10 22.810 8.122 12.919 1.00 0.00 H new ATOM 0 HB1 ALA A 10 21.203 7.880 14.795 1.00 0.00 H new ATOM 0 HB2 ALA A 10 20.754 9.215 13.706 1.00 0.00 H new ATOM 0 HB3 ALA A 10 19.883 7.666 13.621 1.00 0.00 H new ATOM 159 N GLY A 11 22.069 5.397 11.823 1.00 0.00 N ATOM 160 CA GLY A 11 22.313 3.965 11.876 1.00 0.00 C ATOM 161 C GLY A 11 21.062 3.160 12.168 1.00 0.00 C ATOM 162 O GLY A 11 21.131 1.948 12.360 1.00 0.00 O ATOM 0 H GLY A 11 21.902 5.769 10.888 1.00 0.00 H new ATOM 0 HA2 GLY A 11 22.734 3.639 10.925 1.00 0.00 H new ATOM 0 HA3 GLY A 11 23.059 3.758 12.643 1.00 0.00 H new ATOM 166 N CYS A 12 19.918 3.831 12.201 1.00 0.00 N ATOM 167 CA CYS A 12 18.647 3.173 12.478 1.00 0.00 C ATOM 168 C CYS A 12 18.215 2.315 11.286 1.00 0.00 C ATOM 169 O CYS A 12 18.561 2.624 10.146 1.00 0.00 O ATOM 170 CB CYS A 12 17.582 4.226 12.790 1.00 0.00 C ATOM 171 SG CYS A 12 18.073 5.401 14.072 1.00 0.00 S ATOM 0 H CYS A 12 19.844 4.835 12.039 1.00 0.00 H new ATOM 0 HA CYS A 12 18.767 2.519 13.342 1.00 0.00 H new ATOM 0 HB2 CYS A 12 17.348 4.775 11.878 1.00 0.00 H new ATOM 0 HB3 CYS A 12 16.667 3.723 13.103 1.00 0.00 H new ATOM 0 HG CYS A 12 17.018 5.811 14.712 1.00 0.00 H new ATOM 177 N PRO A 13 17.456 1.230 11.533 1.00 0.00 N ATOM 178 CA PRO A 13 17.009 0.306 10.477 1.00 0.00 C ATOM 179 C PRO A 13 16.300 1.023 9.331 1.00 0.00 C ATOM 180 O PRO A 13 16.523 0.714 8.160 1.00 0.00 O ATOM 181 CB PRO A 13 16.042 -0.628 11.207 1.00 0.00 C ATOM 182 CG PRO A 13 16.493 -0.597 12.624 1.00 0.00 C ATOM 183 CD PRO A 13 16.985 0.803 12.866 1.00 0.00 C ATOM 0 HA PRO A 13 17.848 -0.209 10.008 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.011 -0.286 11.111 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.082 -1.638 10.800 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.675 -0.847 13.300 1.00 0.00 H new ATOM 0 HG3 PRO A 13 17.285 -1.326 12.799 1.00 0.00 H new ATOM 0 HD2 PRO A 13 16.191 1.450 13.239 1.00 0.00 H new ATOM 0 HD3 PRO A 13 17.788 0.826 13.603 1.00 0.00 H new ATOM 191 N VAL A 14 15.459 1.996 9.679 1.00 0.00 N ATOM 192 CA VAL A 14 14.738 2.792 8.687 1.00 0.00 C ATOM 193 C VAL A 14 15.719 3.503 7.754 1.00 0.00 C ATOM 194 O VAL A 14 15.479 3.630 6.552 1.00 0.00 O ATOM 195 CB VAL A 14 13.833 3.846 9.364 1.00 0.00 C ATOM 196 CG1 VAL A 14 12.955 4.547 8.337 1.00 0.00 C ATOM 197 CG2 VAL A 14 12.982 3.210 10.454 1.00 0.00 C ATOM 0 H VAL A 14 15.260 2.253 10.646 1.00 0.00 H new ATOM 0 HA VAL A 14 14.114 2.108 8.112 1.00 0.00 H new ATOM 0 HB VAL A 14 14.476 4.594 9.828 1.00 0.00 H new ATOM 0 HG11 VAL A 14 12.327 5.284 8.838 1.00 0.00 H new ATOM 0 HG12 VAL A 14 13.584 5.047 7.601 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.324 3.813 7.836 1.00 0.00 H new ATOM 0 HG21 VAL A 14 12.354 3.972 10.916 1.00 0.00 H new ATOM 0 HG22 VAL A 14 12.352 2.435 10.018 1.00 0.00 H new ATOM 0 HG23 VAL A 14 13.630 2.767 11.210 1.00 0.00 H new ATOM 207 N CYS A 15 16.836 3.943 8.320 1.00 0.00 N ATOM 208 CA CYS A 15 17.864 4.637 7.559 1.00 0.00 C ATOM 209 C CYS A 15 18.574 3.672 6.616 1.00 0.00 C ATOM 210 O CYS A 15 18.838 3.999 5.460 1.00 0.00 O ATOM 211 CB CYS A 15 18.880 5.274 8.507 1.00 0.00 C ATOM 212 SG CYS A 15 18.153 6.360 9.760 1.00 0.00 S ATOM 0 H CYS A 15 17.053 3.830 9.310 1.00 0.00 H new ATOM 0 HA CYS A 15 17.386 5.418 6.968 1.00 0.00 H new ATOM 0 HB2 CYS A 15 19.437 4.483 9.008 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.598 5.846 7.920 1.00 0.00 H new ATOM 0 HG CYS A 15 18.468 7.594 9.500 1.00 0.00 H new ATOM 218 N VAL A 16 18.865 2.477 7.119 1.00 0.00 N ATOM 219 CA VAL A 16 19.566 1.463 6.342 1.00 0.00 C ATOM 220 C VAL A 16 18.748 1.060 5.118 1.00 0.00 C ATOM 221 O VAL A 16 19.300 0.827 4.041 1.00 0.00 O ATOM 222 CB VAL A 16 19.878 0.215 7.198 1.00 0.00 C ATOM 223 CG1 VAL A 16 20.691 -0.800 6.407 1.00 0.00 C ATOM 224 CG2 VAL A 16 20.612 0.610 8.471 1.00 0.00 C ATOM 0 H VAL A 16 18.624 2.187 8.067 1.00 0.00 H new ATOM 0 HA VAL A 16 20.509 1.898 6.012 1.00 0.00 H new ATOM 0 HB VAL A 16 18.932 -0.250 7.473 1.00 0.00 H new ATOM 0 HG11 VAL A 16 20.897 -1.668 7.033 1.00 0.00 H new ATOM 0 HG12 VAL A 16 20.127 -1.112 5.528 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.632 -0.348 6.093 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.823 -0.282 9.061 1.00 0.00 H new ATOM 0 HG22 VAL A 16 21.548 1.104 8.213 1.00 0.00 H new ATOM 0 HG23 VAL A 16 19.991 1.291 9.053 1.00 0.00 H new ATOM 234 N SER A 17 17.431 1.000 5.282 1.00 0.00 N ATOM 235 CA SER A 17 16.537 0.688 4.176 1.00 0.00 C ATOM 236 C SER A 17 16.664 1.735 3.070 1.00 0.00 C ATOM 237 O SER A 17 16.796 1.401 1.891 1.00 0.00 O ATOM 238 CB SER A 17 15.094 0.618 4.675 1.00 0.00 C ATOM 239 OG SER A 17 14.974 -0.308 5.742 1.00 0.00 O ATOM 0 H SER A 17 16.960 1.164 6.172 1.00 0.00 H new ATOM 0 HA SER A 17 16.818 -0.282 3.764 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.771 1.605 5.006 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.436 0.325 3.857 1.00 0.00 H new ATOM 0 HG SER A 17 15.392 0.064 6.547 1.00 0.00 H new ATOM 245 N ALA A 18 16.647 3.006 3.459 1.00 0.00 N ATOM 246 CA ALA A 18 16.765 4.096 2.502 1.00 0.00 C ATOM 247 C ALA A 18 18.138 4.083 1.839 1.00 0.00 C ATOM 248 O ALA A 18 18.271 4.402 0.660 1.00 0.00 O ATOM 249 CB ALA A 18 16.516 5.432 3.183 1.00 0.00 C ATOM 0 H ALA A 18 16.553 3.304 4.430 1.00 0.00 H new ATOM 0 HA ALA A 18 16.009 3.956 1.729 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.608 6.236 2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.513 5.442 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 18 17.248 5.578 3.977 1.00 0.00 H new ATOM 255 N GLU A 19 19.149 3.701 2.605 1.00 0.00 N ATOM 256 CA GLU A 19 20.509 3.607 2.096 1.00 0.00 C ATOM 257 C GLU A 19 20.608 2.523 1.023 1.00 0.00 C ATOM 258 O GLU A 19 21.011 2.786 -0.109 1.00 0.00 O ATOM 259 CB GLU A 19 21.476 3.290 3.240 1.00 0.00 C ATOM 260 CG GLU A 19 22.934 3.269 2.817 1.00 0.00 C ATOM 261 CD GLU A 19 23.843 2.683 3.877 1.00 0.00 C ATOM 262 OE1 GLU A 19 23.940 3.261 4.974 1.00 0.00 O ATOM 263 OE2 GLU A 19 24.470 1.633 3.616 1.00 0.00 O ATOM 0 H GLU A 19 19.052 3.449 3.589 1.00 0.00 H new ATOM 0 HA GLU A 19 20.777 4.565 1.652 1.00 0.00 H new ATOM 0 HB2 GLU A 19 21.346 4.030 4.030 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.216 2.321 3.666 1.00 0.00 H new ATOM 0 HG2 GLU A 19 23.033 2.690 1.899 1.00 0.00 H new ATOM 0 HG3 GLU A 19 23.256 4.285 2.589 1.00 0.00 H new ATOM 270 N GLN A 20 20.198 1.314 1.376 1.00 0.00 N ATOM 271 CA GLN A 20 20.376 0.160 0.505 1.00 0.00 C ATOM 272 C GLN A 20 19.382 0.150 -0.653 1.00 0.00 C ATOM 273 O GLN A 20 19.488 -0.677 -1.561 1.00 0.00 O ATOM 274 CB GLN A 20 20.264 -1.131 1.315 1.00 0.00 C ATOM 275 CG GLN A 20 21.301 -1.227 2.422 1.00 0.00 C ATOM 276 CD GLN A 20 21.217 -2.520 3.204 1.00 0.00 C ATOM 277 OE1 GLN A 20 20.147 -3.113 3.349 1.00 0.00 O ATOM 278 NE2 GLN A 20 22.348 -2.961 3.724 1.00 0.00 N ATOM 0 H GLN A 20 19.738 1.105 2.262 1.00 0.00 H new ATOM 0 HA GLN A 20 21.373 0.230 0.070 1.00 0.00 H new ATOM 0 HB2 GLN A 20 19.267 -1.195 1.751 1.00 0.00 H new ATOM 0 HB3 GLN A 20 20.374 -1.984 0.646 1.00 0.00 H new ATOM 0 HG2 GLN A 20 22.297 -1.136 1.988 1.00 0.00 H new ATOM 0 HG3 GLN A 20 21.173 -0.387 3.105 1.00 0.00 H new ATOM 0 HE21 GLN A 20 23.213 -2.440 3.580 1.00 0.00 H new ATOM 0 HE22 GLN A 20 22.357 -3.823 4.269 1.00 0.00 H new ATOM 287 N ALA A 21 18.415 1.056 -0.628 1.00 0.00 N ATOM 288 CA ALA A 21 17.467 1.167 -1.727 1.00 0.00 C ATOM 289 C ALA A 21 17.667 2.461 -2.513 1.00 0.00 C ATOM 290 O ALA A 21 18.011 2.429 -3.692 1.00 0.00 O ATOM 291 CB ALA A 21 16.041 1.071 -1.219 1.00 0.00 C ATOM 0 H ALA A 21 18.267 1.719 0.133 1.00 0.00 H new ATOM 0 HA ALA A 21 17.653 0.334 -2.404 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.350 1.156 -2.057 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.895 0.111 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 21 15.852 1.877 -0.510 1.00 0.00 H new ATOM 297 N VAL A 22 17.472 3.598 -1.857 1.00 0.00 N ATOM 298 CA VAL A 22 17.527 4.889 -2.537 1.00 0.00 C ATOM 299 C VAL A 22 18.963 5.260 -2.899 1.00 0.00 C ATOM 300 O VAL A 22 19.235 5.693 -4.017 1.00 0.00 O ATOM 301 CB VAL A 22 16.905 6.015 -1.684 1.00 0.00 C ATOM 302 CG1 VAL A 22 16.825 7.312 -2.479 1.00 0.00 C ATOM 303 CG2 VAL A 22 15.527 5.608 -1.181 1.00 0.00 C ATOM 0 H VAL A 22 17.275 3.654 -0.858 1.00 0.00 H new ATOM 0 HA VAL A 22 16.942 4.786 -3.451 1.00 0.00 H new ATOM 0 HB VAL A 22 17.549 6.184 -0.821 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.384 8.092 -1.859 1.00 0.00 H new ATOM 0 HG12 VAL A 22 17.827 7.614 -2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 22 16.207 7.159 -3.364 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.105 6.415 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 22 14.874 5.408 -2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.613 4.710 -0.570 1.00 0.00 H new ATOM 313 N ALA A 23 19.887 5.061 -1.963 1.00 0.00 N ATOM 314 CA ALA A 23 21.297 5.362 -2.212 1.00 0.00 C ATOM 315 C ALA A 23 21.947 4.256 -3.042 1.00 0.00 C ATOM 316 O ALA A 23 23.137 4.300 -3.346 1.00 0.00 O ATOM 317 CB ALA A 23 22.045 5.570 -0.902 1.00 0.00 C ATOM 0 H ALA A 23 19.689 4.696 -1.032 1.00 0.00 H new ATOM 0 HA ALA A 23 21.352 6.290 -2.782 1.00 0.00 H new ATOM 0 HB1 ALA A 23 23.091 5.792 -1.112 1.00 0.00 H new ATOM 0 HB2 ALA A 23 21.599 6.402 -0.357 1.00 0.00 H new ATOM 0 HB3 ALA A 23 21.981 4.665 -0.299 1.00 0.00 H new ATOM 323 N ASN A 24 21.149 3.254 -3.384 1.00 0.00 N ATOM 324 CA ASN A 24 21.564 2.207 -4.307 1.00 0.00 C ATOM 325 C ASN A 24 21.025 2.545 -5.695 1.00 0.00 C ATOM 326 O ASN A 24 21.592 2.167 -6.721 1.00 0.00 O ATOM 327 CB ASN A 24 21.026 0.853 -3.825 1.00 0.00 C ATOM 328 CG ASN A 24 21.620 -0.354 -4.541 1.00 0.00 C ATOM 329 OD1 ASN A 24 21.972 -0.305 -5.719 1.00 0.00 O ATOM 330 ND2 ASN A 24 21.732 -1.458 -3.819 1.00 0.00 N ATOM 0 H ASN A 24 20.198 3.144 -3.031 1.00 0.00 H new ATOM 0 HA ASN A 24 22.651 2.143 -4.350 1.00 0.00 H new ATOM 0 HB2 ASN A 24 21.221 0.758 -2.757 1.00 0.00 H new ATOM 0 HB3 ASN A 24 19.944 0.840 -3.954 1.00 0.00 H new ATOM 0 HD21 ASN A 24 22.120 -2.304 -4.237 1.00 0.00 H new ATOM 0 HD22 ASN A 24 21.430 -1.463 -2.845 1.00 0.00 H new ATOM 337 N ALA A 25 19.921 3.282 -5.709 1.00 0.00 N ATOM 338 CA ALA A 25 19.317 3.742 -6.948 1.00 0.00 C ATOM 339 C ALA A 25 20.100 4.917 -7.520 1.00 0.00 C ATOM 340 O ALA A 25 20.184 5.094 -8.735 1.00 0.00 O ATOM 341 CB ALA A 25 17.864 4.124 -6.717 1.00 0.00 C ATOM 0 H ALA A 25 19.424 3.574 -4.867 1.00 0.00 H new ATOM 0 HA ALA A 25 19.347 2.929 -7.673 1.00 0.00 H new ATOM 0 HB1 ALA A 25 17.425 4.467 -7.654 1.00 0.00 H new ATOM 0 HB2 ALA A 25 17.313 3.257 -6.354 1.00 0.00 H new ATOM 0 HB3 ALA A 25 17.811 4.923 -5.978 1.00 0.00 H new ATOM 347 N ILE A 26 20.670 5.719 -6.635 1.00 0.00 N ATOM 348 CA ILE A 26 21.518 6.825 -7.049 1.00 0.00 C ATOM 349 C ILE A 26 22.853 6.292 -7.561 1.00 0.00 C ATOM 350 O ILE A 26 23.506 5.485 -6.900 1.00 0.00 O ATOM 351 CB ILE A 26 21.757 7.822 -5.894 1.00 0.00 C ATOM 352 CG1 ILE A 26 20.420 8.387 -5.402 1.00 0.00 C ATOM 353 CG2 ILE A 26 22.679 8.950 -6.340 1.00 0.00 C ATOM 354 CD1 ILE A 26 20.549 9.321 -4.216 1.00 0.00 C ATOM 0 H ILE A 26 20.561 5.625 -5.625 1.00 0.00 H new ATOM 0 HA ILE A 26 21.005 7.358 -7.850 1.00 0.00 H new ATOM 0 HB ILE A 26 22.239 7.293 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 26 19.938 8.920 -6.222 1.00 0.00 H new ATOM 0 HG13 ILE A 26 19.764 7.559 -5.131 1.00 0.00 H new ATOM 0 HG21 ILE A 26 22.835 9.642 -5.512 1.00 0.00 H new ATOM 0 HG22 ILE A 26 23.638 8.535 -6.651 1.00 0.00 H new ATOM 0 HG23 ILE A 26 22.225 9.482 -7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 26 19.561 9.679 -3.926 1.00 0.00 H new ATOM 0 HD12 ILE A 26 21.001 8.787 -3.380 1.00 0.00 H new ATOM 0 HD13 ILE A 26 21.178 10.169 -4.487 1.00 0.00 H new ATOM 366 N ASP A 27 23.242 6.732 -8.748 1.00 0.00 N ATOM 367 CA ASP A 27 24.461 6.243 -9.377 1.00 0.00 C ATOM 368 C ASP A 27 25.668 7.040 -8.892 1.00 0.00 C ATOM 369 O ASP A 27 25.637 8.273 -8.871 1.00 0.00 O ATOM 370 CB ASP A 27 24.341 6.333 -10.900 1.00 0.00 C ATOM 371 CG ASP A 27 25.477 5.635 -11.618 1.00 0.00 C ATOM 372 OD1 ASP A 27 26.530 6.267 -11.833 1.00 0.00 O ATOM 373 OD2 ASP A 27 25.319 4.447 -11.974 1.00 0.00 O ATOM 0 H ASP A 27 22.733 7.426 -9.295 1.00 0.00 H new ATOM 0 HA ASP A 27 24.603 5.199 -9.098 1.00 0.00 H new ATOM 0 HB2 ASP A 27 23.394 5.893 -11.212 1.00 0.00 H new ATOM 0 HB3 ASP A 27 24.318 7.381 -11.197 1.00 0.00 H new ATOM 378 N PRO A 28 26.750 6.344 -8.498 1.00 0.00 N ATOM 379 CA PRO A 28 27.967 6.984 -7.978 1.00 0.00 C ATOM 380 C PRO A 28 28.652 7.891 -9.002 1.00 0.00 C ATOM 381 O PRO A 28 29.446 8.757 -8.642 1.00 0.00 O ATOM 382 CB PRO A 28 28.877 5.803 -7.621 1.00 0.00 C ATOM 383 CG PRO A 28 28.348 4.654 -8.408 1.00 0.00 C ATOM 384 CD PRO A 28 26.868 4.876 -8.511 1.00 0.00 C ATOM 0 HA PRO A 28 27.739 7.637 -7.136 1.00 0.00 H new ATOM 0 HB2 PRO A 28 29.915 6.013 -7.879 1.00 0.00 H new ATOM 0 HB3 PRO A 28 28.850 5.594 -6.552 1.00 0.00 H new ATOM 0 HG2 PRO A 28 28.807 4.612 -9.396 1.00 0.00 H new ATOM 0 HG3 PRO A 28 28.568 3.707 -7.914 1.00 0.00 H new ATOM 0 HD2 PRO A 28 26.458 4.447 -9.425 1.00 0.00 H new ATOM 0 HD3 PRO A 28 26.333 4.421 -7.678 1.00 0.00 H new ATOM 392 N SER A 29 28.343 7.690 -10.277 1.00 0.00 N ATOM 393 CA SER A 29 28.906 8.515 -11.334 1.00 0.00 C ATOM 394 C SER A 29 27.917 9.599 -11.746 1.00 0.00 C ATOM 395 O SER A 29 28.128 10.316 -12.725 1.00 0.00 O ATOM 396 CB SER A 29 29.269 7.648 -12.537 1.00 0.00 C ATOM 397 OG SER A 29 30.143 6.597 -12.162 1.00 0.00 O ATOM 0 H SER A 29 27.706 6.963 -10.602 1.00 0.00 H new ATOM 0 HA SER A 29 29.810 8.995 -10.959 1.00 0.00 H new ATOM 0 HB2 SER A 29 28.362 7.232 -12.977 1.00 0.00 H new ATOM 0 HB3 SER A 29 29.742 8.263 -13.303 1.00 0.00 H new ATOM 0 HG SER A 29 30.359 6.055 -12.949 1.00 0.00 H new ATOM 403 N LYS A 30 26.828 9.701 -11.000 1.00 0.00 N ATOM 404 CA LYS A 30 25.832 10.730 -11.240 1.00 0.00 C ATOM 405 C LYS A 30 25.806 11.700 -10.064 1.00 0.00 C ATOM 406 O LYS A 30 25.645 12.908 -10.238 1.00 0.00 O ATOM 407 CB LYS A 30 24.450 10.102 -11.445 1.00 0.00 C ATOM 408 CG LYS A 30 23.387 11.098 -11.874 1.00 0.00 C ATOM 409 CD LYS A 30 22.024 10.443 -12.004 1.00 0.00 C ATOM 410 CE LYS A 30 20.984 11.426 -12.517 1.00 0.00 C ATOM 411 NZ LYS A 30 21.258 11.850 -13.918 1.00 0.00 N ATOM 0 H LYS A 30 26.612 9.080 -10.220 1.00 0.00 H new ATOM 0 HA LYS A 30 26.096 11.275 -12.147 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.525 9.317 -12.197 1.00 0.00 H new ATOM 0 HB3 LYS A 30 24.136 9.625 -10.517 1.00 0.00 H new ATOM 0 HG2 LYS A 30 23.333 11.909 -11.147 1.00 0.00 H new ATOM 0 HG3 LYS A 30 23.669 11.543 -12.828 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.090 9.593 -12.683 1.00 0.00 H new ATOM 0 HD3 LYS A 30 21.712 10.053 -11.035 1.00 0.00 H new ATOM 0 HE2 LYS A 30 19.996 10.969 -12.464 1.00 0.00 H new ATOM 0 HE3 LYS A 30 20.965 12.303 -11.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 20.473 12.439 -14.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 22.141 12.399 -13.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 21.352 11.009 -14.523 1.00 0.00 H new ATOM 425 N TYR A 31 25.970 11.156 -8.865 1.00 0.00 N ATOM 426 CA TYR A 31 26.027 11.958 -7.653 1.00 0.00 C ATOM 427 C TYR A 31 27.167 11.496 -6.760 1.00 0.00 C ATOM 428 O TYR A 31 27.447 10.303 -6.660 1.00 0.00 O ATOM 429 CB TYR A 31 24.708 11.884 -6.880 1.00 0.00 C ATOM 430 CG TYR A 31 23.600 12.723 -7.476 1.00 0.00 C ATOM 431 CD1 TYR A 31 22.801 12.234 -8.501 1.00 0.00 C ATOM 432 CD2 TYR A 31 23.357 14.010 -7.013 1.00 0.00 C ATOM 433 CE1 TYR A 31 21.792 13.004 -9.048 1.00 0.00 C ATOM 434 CE2 TYR A 31 22.349 14.785 -7.554 1.00 0.00 C ATOM 435 CZ TYR A 31 21.571 14.279 -8.571 1.00 0.00 C ATOM 436 OH TYR A 31 20.569 15.050 -9.113 1.00 0.00 O ATOM 0 H TYR A 31 26.067 10.153 -8.707 1.00 0.00 H new ATOM 0 HA TYR A 31 26.200 12.993 -7.950 1.00 0.00 H new ATOM 0 HB2 TYR A 31 24.381 10.845 -6.838 1.00 0.00 H new ATOM 0 HB3 TYR A 31 24.882 12.206 -5.853 1.00 0.00 H new ATOM 0 HD1 TYR A 31 22.971 11.236 -8.877 1.00 0.00 H new ATOM 0 HD2 TYR A 31 23.966 14.412 -6.217 1.00 0.00 H new ATOM 0 HE1 TYR A 31 21.180 12.609 -9.845 1.00 0.00 H new ATOM 0 HE2 TYR A 31 22.172 15.783 -7.181 1.00 0.00 H new ATOM 0 HH TYR A 31 20.546 15.920 -8.663 1.00 0.00 H new ATOM 446 N THR A 32 27.825 12.452 -6.129 1.00 0.00 N ATOM 447 CA THR A 32 28.885 12.160 -5.184 1.00 0.00 C ATOM 448 C THR A 32 28.280 11.882 -3.813 1.00 0.00 C ATOM 449 O THR A 32 27.983 12.808 -3.057 1.00 0.00 O ATOM 450 CB THR A 32 29.872 13.340 -5.092 1.00 0.00 C ATOM 451 OG1 THR A 32 30.185 13.811 -6.414 1.00 0.00 O ATOM 452 CG2 THR A 32 31.151 12.929 -4.379 1.00 0.00 C ATOM 0 H THR A 32 27.640 13.447 -6.257 1.00 0.00 H new ATOM 0 HA THR A 32 29.431 11.282 -5.528 1.00 0.00 H new ATOM 0 HB THR A 32 29.401 14.138 -4.517 1.00 0.00 H new ATOM 0 HG1 THR A 32 29.403 14.262 -6.794 1.00 0.00 H new ATOM 0 HG21 THR A 32 31.829 13.781 -4.328 1.00 0.00 H new ATOM 0 HG22 THR A 32 30.913 12.594 -3.369 1.00 0.00 H new ATOM 0 HG23 THR A 32 31.629 12.117 -4.928 1.00 0.00 H new ATOM 460 N VAL A 33 28.072 10.612 -3.512 1.00 0.00 N ATOM 461 CA VAL A 33 27.354 10.222 -2.308 1.00 0.00 C ATOM 462 C VAL A 33 28.298 10.068 -1.122 1.00 0.00 C ATOM 463 O VAL A 33 29.191 9.218 -1.129 1.00 0.00 O ATOM 464 CB VAL A 33 26.578 8.903 -2.515 1.00 0.00 C ATOM 465 CG1 VAL A 33 25.779 8.542 -1.270 1.00 0.00 C ATOM 466 CG2 VAL A 33 25.663 9.004 -3.726 1.00 0.00 C ATOM 0 H VAL A 33 28.390 9.831 -4.085 1.00 0.00 H new ATOM 0 HA VAL A 33 26.644 11.021 -2.095 1.00 0.00 H new ATOM 0 HB VAL A 33 27.303 8.109 -2.696 1.00 0.00 H new ATOM 0 HG11 VAL A 33 25.241 7.609 -1.441 1.00 0.00 H new ATOM 0 HG12 VAL A 33 26.457 8.421 -0.425 1.00 0.00 H new ATOM 0 HG13 VAL A 33 25.066 9.337 -1.052 1.00 0.00 H new ATOM 0 HG21 VAL A 33 25.125 8.065 -3.855 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.949 9.814 -3.576 1.00 0.00 H new ATOM 0 HG23 VAL A 33 26.259 9.206 -4.616 1.00 0.00 H new ATOM 476 N GLU A 34 28.106 10.905 -0.114 1.00 0.00 N ATOM 477 CA GLU A 34 28.852 10.792 1.130 1.00 0.00 C ATOM 478 C GLU A 34 27.894 10.516 2.277 1.00 0.00 C ATOM 479 O GLU A 34 27.057 11.355 2.614 1.00 0.00 O ATOM 480 CB GLU A 34 29.656 12.061 1.424 1.00 0.00 C ATOM 481 CG GLU A 34 30.660 12.423 0.344 1.00 0.00 C ATOM 482 CD GLU A 34 31.739 13.360 0.850 1.00 0.00 C ATOM 483 OE1 GLU A 34 31.424 14.513 1.204 1.00 0.00 O ATOM 484 OE2 GLU A 34 32.914 12.942 0.890 1.00 0.00 O ATOM 0 H GLU A 34 27.436 11.674 -0.134 1.00 0.00 H new ATOM 0 HA GLU A 34 29.556 9.966 1.025 1.00 0.00 H new ATOM 0 HB2 GLU A 34 28.965 12.893 1.556 1.00 0.00 H new ATOM 0 HB3 GLU A 34 30.185 11.932 2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.123 11.513 -0.038 1.00 0.00 H new ATOM 0 HG3 GLU A 34 30.139 12.891 -0.491 1.00 0.00 H new ATOM 491 N ILE A 35 28.001 9.337 2.858 1.00 0.00 N ATOM 492 CA ILE A 35 27.142 8.960 3.962 1.00 0.00 C ATOM 493 C ILE A 35 27.773 9.378 5.285 1.00 0.00 C ATOM 494 O ILE A 35 28.939 9.085 5.549 1.00 0.00 O ATOM 495 CB ILE A 35 26.864 7.444 3.954 1.00 0.00 C ATOM 496 CG1 ILE A 35 26.183 7.046 2.639 1.00 0.00 C ATOM 497 CG2 ILE A 35 26.001 7.056 5.142 1.00 0.00 C ATOM 498 CD1 ILE A 35 25.916 5.561 2.509 1.00 0.00 C ATOM 0 H ILE A 35 28.676 8.623 2.583 1.00 0.00 H new ATOM 0 HA ILE A 35 26.190 9.477 3.846 1.00 0.00 H new ATOM 0 HB ILE A 35 27.811 6.911 4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 35 25.239 7.583 2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 35 26.809 7.367 1.806 1.00 0.00 H new ATOM 0 HG21 ILE A 35 25.814 5.982 5.121 1.00 0.00 H new ATOM 0 HG22 ILE A 35 26.516 7.317 6.067 1.00 0.00 H new ATOM 0 HG23 ILE A 35 25.052 7.590 5.092 1.00 0.00 H new ATOM 0 HD11 ILE A 35 25.433 5.361 1.553 1.00 0.00 H new ATOM 0 HD12 ILE A 35 26.859 5.016 2.561 1.00 0.00 H new ATOM 0 HD13 ILE A 35 25.264 5.236 3.320 1.00 0.00 H new ATOM 510 N VAL A 36 27.003 10.082 6.099 1.00 0.00 N ATOM 511 CA VAL A 36 27.488 10.601 7.366 1.00 0.00 C ATOM 512 C VAL A 36 26.710 9.992 8.527 1.00 0.00 C ATOM 513 O VAL A 36 25.497 10.185 8.647 1.00 0.00 O ATOM 514 CB VAL A 36 27.373 12.139 7.423 1.00 0.00 C ATOM 515 CG1 VAL A 36 27.926 12.673 8.733 1.00 0.00 C ATOM 516 CG2 VAL A 36 28.089 12.775 6.240 1.00 0.00 C ATOM 0 H VAL A 36 26.028 10.309 5.901 1.00 0.00 H new ATOM 0 HA VAL A 36 28.540 10.327 7.450 1.00 0.00 H new ATOM 0 HB VAL A 36 26.317 12.403 7.367 1.00 0.00 H new ATOM 0 HG11 VAL A 36 27.835 13.759 8.751 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.365 12.248 9.565 1.00 0.00 H new ATOM 0 HG13 VAL A 36 28.976 12.396 8.825 1.00 0.00 H new ATOM 0 HG21 VAL A 36 27.996 13.859 6.299 1.00 0.00 H new ATOM 0 HG22 VAL A 36 29.143 12.499 6.262 1.00 0.00 H new ATOM 0 HG23 VAL A 36 27.641 12.422 5.311 1.00 0.00 H new ATOM 526 N HIS A 37 27.412 9.251 9.370 1.00 0.00 N ATOM 527 CA HIS A 37 26.794 8.595 10.511 1.00 0.00 C ATOM 528 C HIS A 37 26.713 9.555 11.700 1.00 0.00 C ATOM 529 O HIS A 37 27.728 9.904 12.301 1.00 0.00 O ATOM 530 CB HIS A 37 27.593 7.347 10.891 1.00 0.00 C ATOM 531 CG HIS A 37 26.830 6.365 11.725 1.00 0.00 C ATOM 532 ND1 HIS A 37 26.790 6.456 13.095 1.00 0.00 N ATOM 533 CD2 HIS A 37 26.113 5.286 11.333 1.00 0.00 C ATOM 534 CE1 HIS A 37 26.056 5.431 13.502 1.00 0.00 C ATOM 535 NE2 HIS A 37 25.624 4.696 12.470 1.00 0.00 N ATOM 0 H HIS A 37 28.415 9.089 9.284 1.00 0.00 H new ATOM 0 HA HIS A 37 25.781 8.298 10.239 1.00 0.00 H new ATOM 0 HB2 HIS A 37 27.928 6.851 9.980 1.00 0.00 H new ATOM 0 HB3 HIS A 37 28.487 7.652 11.435 1.00 0.00 H new ATOM 0 HD2 HIS A 37 25.956 4.953 10.318 1.00 0.00 H new ATOM 0 HE1 HIS A 37 25.834 5.215 14.537 1.00 0.00 H new ATOM 0 HE2 HIS A 37 25.043 3.859 12.520 1.00 0.00 H new ATOM 543 N LEU A 38 25.498 9.971 12.034 1.00 0.00 N ATOM 544 CA LEU A 38 25.274 10.924 13.119 1.00 0.00 C ATOM 545 C LEU A 38 25.182 10.212 14.467 1.00 0.00 C ATOM 546 O LEU A 38 25.012 10.848 15.508 1.00 0.00 O ATOM 547 CB LEU A 38 23.987 11.716 12.869 1.00 0.00 C ATOM 548 CG LEU A 38 23.956 12.524 11.569 1.00 0.00 C ATOM 549 CD1 LEU A 38 22.613 13.213 11.405 1.00 0.00 C ATOM 550 CD2 LEU A 38 25.079 13.546 11.547 1.00 0.00 C ATOM 0 H LEU A 38 24.646 9.662 11.567 1.00 0.00 H new ATOM 0 HA LEU A 38 26.123 11.607 13.145 1.00 0.00 H new ATOM 0 HB2 LEU A 38 23.148 11.021 12.865 1.00 0.00 H new ATOM 0 HB3 LEU A 38 23.832 12.398 13.705 1.00 0.00 H new ATOM 0 HG LEU A 38 24.099 11.837 10.735 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.608 13.783 10.476 1.00 0.00 H new ATOM 0 HD12 LEU A 38 21.821 12.464 11.376 1.00 0.00 H new ATOM 0 HD13 LEU A 38 22.445 13.887 12.245 1.00 0.00 H new ATOM 0 HD21 LEU A 38 25.040 14.110 10.615 1.00 0.00 H new ATOM 0 HD22 LEU A 38 24.966 14.229 12.389 1.00 0.00 H new ATOM 0 HD23 LEU A 38 26.038 13.034 11.621 1.00 0.00 H new ATOM 562 N GLY A 39 25.288 8.892 14.439 1.00 0.00 N ATOM 563 CA GLY A 39 25.209 8.119 15.662 1.00 0.00 C ATOM 564 C GLY A 39 26.564 7.959 16.323 1.00 0.00 C ATOM 565 O GLY A 39 26.659 7.838 17.545 1.00 0.00 O ATOM 0 H GLY A 39 25.427 8.342 13.591 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.523 8.606 16.355 1.00 0.00 H new ATOM 0 HA3 GLY A 39 24.795 7.135 15.443 1.00 0.00 H new ATOM 569 N THR A 40 27.610 7.969 15.509 1.00 0.00 N ATOM 570 CA THR A 40 28.966 7.801 16.007 1.00 0.00 C ATOM 571 C THR A 40 29.453 9.076 16.696 1.00 0.00 C ATOM 572 O THR A 40 29.844 9.050 17.865 1.00 0.00 O ATOM 573 CB THR A 40 29.934 7.419 14.865 1.00 0.00 C ATOM 574 OG1 THR A 40 29.428 6.280 14.153 1.00 0.00 O ATOM 575 CG2 THR A 40 31.321 7.098 15.409 1.00 0.00 C ATOM 0 H THR A 40 27.544 8.092 14.499 1.00 0.00 H new ATOM 0 HA THR A 40 28.951 6.990 16.735 1.00 0.00 H new ATOM 0 HB THR A 40 30.012 8.271 14.190 1.00 0.00 H new ATOM 0 HG1 THR A 40 28.604 6.527 13.683 1.00 0.00 H new ATOM 0 HG21 THR A 40 31.983 6.832 14.585 1.00 0.00 H new ATOM 0 HG22 THR A 40 31.719 7.970 15.927 1.00 0.00 H new ATOM 0 HG23 THR A 40 31.254 6.262 16.105 1.00 0.00 H new ATOM 583 N ASP A 41 29.403 10.193 15.980 1.00 0.00 N ATOM 584 CA ASP A 41 29.860 11.467 16.524 1.00 0.00 C ATOM 585 C ASP A 41 28.700 12.448 16.639 1.00 0.00 C ATOM 586 O ASP A 41 27.865 12.542 15.739 1.00 0.00 O ATOM 587 CB ASP A 41 30.967 12.059 15.649 1.00 0.00 C ATOM 588 CG ASP A 41 31.375 13.448 16.095 1.00 0.00 C ATOM 589 OD1 ASP A 41 31.976 13.581 17.184 1.00 0.00 O ATOM 590 OD2 ASP A 41 31.102 14.411 15.358 1.00 0.00 O ATOM 0 H ASP A 41 29.052 10.243 15.024 1.00 0.00 H new ATOM 0 HA ASP A 41 30.263 11.287 17.521 1.00 0.00 H new ATOM 0 HB2 ASP A 41 31.837 11.402 15.674 1.00 0.00 H new ATOM 0 HB3 ASP A 41 30.627 12.098 14.614 1.00 0.00 H new ATOM 595 N LYS A 42 28.656 13.176 17.748 1.00 0.00 N ATOM 596 CA LYS A 42 27.550 14.083 18.025 1.00 0.00 C ATOM 597 C LYS A 42 27.810 15.475 17.458 1.00 0.00 C ATOM 598 O LYS A 42 26.877 16.251 17.272 1.00 0.00 O ATOM 599 CB LYS A 42 27.300 14.191 19.529 1.00 0.00 C ATOM 600 CG LYS A 42 26.868 12.886 20.174 1.00 0.00 C ATOM 601 CD LYS A 42 26.542 13.090 21.644 1.00 0.00 C ATOM 602 CE LYS A 42 26.052 11.808 22.294 1.00 0.00 C ATOM 603 NZ LYS A 42 27.111 10.770 22.372 1.00 0.00 N ATOM 0 H LYS A 42 29.375 13.156 18.471 1.00 0.00 H new ATOM 0 HA LYS A 42 26.667 13.667 17.539 1.00 0.00 H new ATOM 0 HB2 LYS A 42 28.211 14.542 20.015 1.00 0.00 H new ATOM 0 HB3 LYS A 42 26.533 14.945 19.707 1.00 0.00 H new ATOM 0 HG2 LYS A 42 25.995 12.491 19.655 1.00 0.00 H new ATOM 0 HG3 LYS A 42 27.661 12.145 20.073 1.00 0.00 H new ATOM 0 HD2 LYS A 42 27.429 13.447 22.167 1.00 0.00 H new ATOM 0 HD3 LYS A 42 25.780 13.863 21.744 1.00 0.00 H new ATOM 0 HE2 LYS A 42 25.689 12.029 23.298 1.00 0.00 H new ATOM 0 HE3 LYS A 42 25.206 11.418 21.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 26.759 9.954 22.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 27.369 10.464 21.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 27.949 11.164 22.846 1.00 0.00 H new ATOM 617 N ALA A 43 29.068 15.781 17.179 1.00 0.00 N ATOM 618 CA ALA A 43 29.433 17.099 16.667 1.00 0.00 C ATOM 619 C ALA A 43 28.927 17.277 15.240 1.00 0.00 C ATOM 620 O ALA A 43 28.771 18.399 14.756 1.00 0.00 O ATOM 621 CB ALA A 43 30.939 17.301 16.732 1.00 0.00 C ATOM 0 H ALA A 43 29.852 15.140 17.297 1.00 0.00 H new ATOM 0 HA ALA A 43 28.961 17.854 17.295 1.00 0.00 H new ATOM 0 HB1 ALA A 43 31.191 18.289 16.346 1.00 0.00 H new ATOM 0 HB2 ALA A 43 31.273 17.220 17.766 1.00 0.00 H new ATOM 0 HB3 ALA A 43 31.435 16.539 16.130 1.00 0.00 H new ATOM 627 N ARG A 44 28.670 16.159 14.576 1.00 0.00 N ATOM 628 CA ARG A 44 28.130 16.175 13.221 1.00 0.00 C ATOM 629 C ARG A 44 26.699 16.714 13.215 1.00 0.00 C ATOM 630 O ARG A 44 26.209 17.192 12.191 1.00 0.00 O ATOM 631 CB ARG A 44 28.147 14.769 12.625 1.00 0.00 C ATOM 632 CG ARG A 44 29.522 14.124 12.578 1.00 0.00 C ATOM 633 CD ARG A 44 29.449 12.754 11.929 1.00 0.00 C ATOM 634 NE ARG A 44 30.744 12.077 11.881 1.00 0.00 N ATOM 635 CZ ARG A 44 31.520 12.035 10.801 1.00 0.00 C ATOM 636 NH1 ARG A 44 31.226 12.773 9.737 1.00 0.00 N ATOM 637 NH2 ARG A 44 32.616 11.292 10.806 1.00 0.00 N ATOM 0 H ARG A 44 28.827 15.225 14.954 1.00 0.00 H new ATOM 0 HA ARG A 44 28.757 16.830 12.616 1.00 0.00 H new ATOM 0 HB2 ARG A 44 27.480 14.133 13.207 1.00 0.00 H new ATOM 0 HB3 ARG A 44 27.744 14.812 11.613 1.00 0.00 H new ATOM 0 HG2 ARG A 44 30.209 14.760 12.020 1.00 0.00 H new ATOM 0 HG3 ARG A 44 29.921 14.033 13.588 1.00 0.00 H new ATOM 0 HD2 ARG A 44 28.741 12.134 12.479 1.00 0.00 H new ATOM 0 HD3 ARG A 44 29.061 12.858 10.916 1.00 0.00 H new ATOM 0 HE ARG A 44 31.072 11.609 12.726 1.00 0.00 H new ATOM 0 HH11 ARG A 44 30.403 13.375 9.746 1.00 0.00 H new ATOM 0 HH12 ARG A 44 31.824 12.738 8.911 1.00 0.00 H new ATOM 0 HH21 ARG A 44 32.863 10.754 11.636 1.00 0.00 H new ATOM 0 HH22 ARG A 44 33.213 11.258 9.979 1.00 0.00 H new ATOM 651 N ILE A 45 26.039 16.641 14.366 1.00 0.00 N ATOM 652 CA ILE A 45 24.659 17.093 14.498 1.00 0.00 C ATOM 653 C ILE A 45 24.569 18.607 14.310 1.00 0.00 C ATOM 654 O ILE A 45 23.580 19.119 13.781 1.00 0.00 O ATOM 655 CB ILE A 45 24.069 16.689 15.870 1.00 0.00 C ATOM 656 CG1 ILE A 45 24.091 15.164 16.023 1.00 0.00 C ATOM 657 CG2 ILE A 45 22.650 17.218 16.030 1.00 0.00 C ATOM 658 CD1 ILE A 45 23.588 14.677 17.366 1.00 0.00 C ATOM 0 H ILE A 45 26.441 16.270 15.227 1.00 0.00 H new ATOM 0 HA ILE A 45 24.073 16.607 13.718 1.00 0.00 H new ATOM 0 HB ILE A 45 24.684 17.133 16.653 1.00 0.00 H new ATOM 0 HG12 ILE A 45 23.482 14.720 15.235 1.00 0.00 H new ATOM 0 HG13 ILE A 45 25.111 14.808 15.877 1.00 0.00 H new ATOM 0 HG21 ILE A 45 22.258 16.920 17.003 1.00 0.00 H new ATOM 0 HG22 ILE A 45 22.657 18.306 15.959 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.018 16.807 15.243 1.00 0.00 H new ATOM 0 HD11 ILE A 45 23.634 13.588 17.399 1.00 0.00 H new ATOM 0 HD12 ILE A 45 24.211 15.090 18.159 1.00 0.00 H new ATOM 0 HD13 ILE A 45 22.557 15.001 17.508 1.00 0.00 H new ATOM 670 N ALA A 46 25.615 19.317 14.725 1.00 0.00 N ATOM 671 CA ALA A 46 25.687 20.761 14.535 1.00 0.00 C ATOM 672 C ALA A 46 25.631 21.108 13.054 1.00 0.00 C ATOM 673 O ALA A 46 24.948 22.051 12.651 1.00 0.00 O ATOM 674 CB ALA A 46 26.958 21.319 15.158 1.00 0.00 C ATOM 0 H ALA A 46 26.425 18.914 15.196 1.00 0.00 H new ATOM 0 HA ALA A 46 24.829 21.214 15.031 1.00 0.00 H new ATOM 0 HB1 ALA A 46 26.994 22.398 15.006 1.00 0.00 H new ATOM 0 HB2 ALA A 46 26.965 21.102 16.226 1.00 0.00 H new ATOM 0 HB3 ALA A 46 27.826 20.857 14.688 1.00 0.00 H new ATOM 680 N GLU A 47 26.342 20.326 12.248 1.00 0.00 N ATOM 681 CA GLU A 47 26.349 20.514 10.804 1.00 0.00 C ATOM 682 C GLU A 47 24.948 20.323 10.242 1.00 0.00 C ATOM 683 O GLU A 47 24.470 21.133 9.451 1.00 0.00 O ATOM 684 CB GLU A 47 27.309 19.524 10.138 1.00 0.00 C ATOM 685 CG GLU A 47 28.758 19.687 10.564 1.00 0.00 C ATOM 686 CD GLU A 47 29.662 18.626 9.965 1.00 0.00 C ATOM 687 OE1 GLU A 47 30.083 18.780 8.799 1.00 0.00 O ATOM 688 OE2 GLU A 47 29.954 17.630 10.657 1.00 0.00 O ATOM 0 H GLU A 47 26.923 19.553 12.574 1.00 0.00 H new ATOM 0 HA GLU A 47 26.685 21.529 10.593 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.985 18.509 10.368 1.00 0.00 H new ATOM 0 HB3 GLU A 47 27.244 19.642 9.056 1.00 0.00 H new ATOM 0 HG2 GLU A 47 29.113 20.673 10.265 1.00 0.00 H new ATOM 0 HG3 GLU A 47 28.821 19.642 11.651 1.00 0.00 H new ATOM 695 N ALA A 48 24.289 19.258 10.683 1.00 0.00 N ATOM 696 CA ALA A 48 22.950 18.931 10.219 1.00 0.00 C ATOM 697 C ALA A 48 21.959 20.039 10.568 1.00 0.00 C ATOM 698 O ALA A 48 21.179 20.475 9.720 1.00 0.00 O ATOM 699 CB ALA A 48 22.498 17.605 10.814 1.00 0.00 C ATOM 0 H ALA A 48 24.666 18.602 11.367 1.00 0.00 H new ATOM 0 HA ALA A 48 22.979 18.839 9.133 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.494 17.371 10.460 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.185 16.816 10.508 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.491 17.678 11.902 1.00 0.00 H new ATOM 705 N GLU A 49 22.007 20.503 11.812 1.00 0.00 N ATOM 706 CA GLU A 49 21.087 21.534 12.282 1.00 0.00 C ATOM 707 C GLU A 49 21.253 22.825 11.487 1.00 0.00 C ATOM 708 O GLU A 49 20.271 23.422 11.045 1.00 0.00 O ATOM 709 CB GLU A 49 21.305 21.810 13.770 1.00 0.00 C ATOM 710 CG GLU A 49 20.351 22.846 14.340 1.00 0.00 C ATOM 711 CD GLU A 49 20.625 23.141 15.795 1.00 0.00 C ATOM 712 OE1 GLU A 49 21.632 23.811 16.087 1.00 0.00 O ATOM 713 OE2 GLU A 49 19.846 22.688 16.661 1.00 0.00 O ATOM 0 H GLU A 49 22.674 20.182 12.514 1.00 0.00 H new ATOM 0 HA GLU A 49 20.072 21.165 12.132 1.00 0.00 H new ATOM 0 HB2 GLU A 49 21.191 20.879 14.325 1.00 0.00 H new ATOM 0 HB3 GLU A 49 22.330 22.149 13.922 1.00 0.00 H new ATOM 0 HG2 GLU A 49 20.433 23.767 13.764 1.00 0.00 H new ATOM 0 HG3 GLU A 49 19.326 22.491 14.231 1.00 0.00 H new ATOM 720 N LYS A 50 22.498 23.238 11.289 1.00 0.00 N ATOM 721 CA LYS A 50 22.784 24.490 10.600 1.00 0.00 C ATOM 722 C LYS A 50 22.581 24.350 9.094 1.00 0.00 C ATOM 723 O LYS A 50 22.559 25.344 8.368 1.00 0.00 O ATOM 724 CB LYS A 50 24.210 24.957 10.904 1.00 0.00 C ATOM 725 CG LYS A 50 24.465 25.196 12.385 1.00 0.00 C ATOM 726 CD LYS A 50 25.875 25.702 12.643 1.00 0.00 C ATOM 727 CE LYS A 50 26.161 25.824 14.133 1.00 0.00 C ATOM 728 NZ LYS A 50 25.216 26.751 14.810 1.00 0.00 N ATOM 0 H LYS A 50 23.325 22.725 11.595 1.00 0.00 H new ATOM 0 HA LYS A 50 22.084 25.241 10.967 1.00 0.00 H new ATOM 0 HB2 LYS A 50 24.915 24.211 10.537 1.00 0.00 H new ATOM 0 HB3 LYS A 50 24.407 25.878 10.356 1.00 0.00 H new ATOM 0 HG2 LYS A 50 23.744 25.920 12.765 1.00 0.00 H new ATOM 0 HG3 LYS A 50 24.306 24.269 12.935 1.00 0.00 H new ATOM 0 HD2 LYS A 50 26.595 25.022 12.188 1.00 0.00 H new ATOM 0 HD3 LYS A 50 26.007 26.673 12.166 1.00 0.00 H new ATOM 0 HE2 LYS A 50 26.096 24.839 14.596 1.00 0.00 H new ATOM 0 HE3 LYS A 50 27.182 26.178 14.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 25.537 26.923 15.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 25.183 27.652 14.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 24.267 26.327 14.828 1.00 0.00 H new ATOM 742 N ALA A 51 22.439 23.115 8.629 1.00 0.00 N ATOM 743 CA ALA A 51 22.168 22.853 7.220 1.00 0.00 C ATOM 744 C ALA A 51 20.667 22.814 6.957 1.00 0.00 C ATOM 745 O ALA A 51 20.223 22.958 5.818 1.00 0.00 O ATOM 746 CB ALA A 51 22.814 21.546 6.785 1.00 0.00 C ATOM 0 H ALA A 51 22.507 22.278 9.208 1.00 0.00 H new ATOM 0 HA ALA A 51 22.599 23.665 6.635 1.00 0.00 H new ATOM 0 HB1 ALA A 51 22.601 21.368 5.731 1.00 0.00 H new ATOM 0 HB2 ALA A 51 23.892 21.607 6.932 1.00 0.00 H new ATOM 0 HB3 ALA A 51 22.412 20.726 7.380 1.00 0.00 H new ATOM 752 N GLY A 52 19.891 22.627 8.016 1.00 0.00 N ATOM 753 CA GLY A 52 18.448 22.579 7.879 1.00 0.00 C ATOM 754 C GLY A 52 17.910 21.161 7.897 1.00 0.00 C ATOM 755 O GLY A 52 16.816 20.897 7.399 1.00 0.00 O ATOM 0 H GLY A 52 20.235 22.508 8.969 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.990 23.148 8.688 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.159 23.062 6.946 1.00 0.00 H new ATOM 759 N VAL A 53 18.684 20.247 8.467 1.00 0.00 N ATOM 760 CA VAL A 53 18.274 18.853 8.565 1.00 0.00 C ATOM 761 C VAL A 53 17.362 18.653 9.771 1.00 0.00 C ATOM 762 O VAL A 53 17.705 19.026 10.895 1.00 0.00 O ATOM 763 CB VAL A 53 19.492 17.908 8.667 1.00 0.00 C ATOM 764 CG1 VAL A 53 19.052 16.459 8.817 1.00 0.00 C ATOM 765 CG2 VAL A 53 20.391 18.066 7.450 1.00 0.00 C ATOM 0 H VAL A 53 19.600 20.446 8.869 1.00 0.00 H new ATOM 0 HA VAL A 53 17.729 18.606 7.654 1.00 0.00 H new ATOM 0 HB VAL A 53 20.057 18.183 9.558 1.00 0.00 H new ATOM 0 HG11 VAL A 53 19.930 15.817 8.886 1.00 0.00 H new ATOM 0 HG12 VAL A 53 18.453 16.353 9.721 1.00 0.00 H new ATOM 0 HG13 VAL A 53 18.457 16.168 7.951 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.244 17.393 7.538 1.00 0.00 H new ATOM 0 HG22 VAL A 53 19.829 17.823 6.548 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.745 19.095 7.390 1.00 0.00 H new ATOM 775 N LYS A 54 16.194 18.080 9.524 1.00 0.00 N ATOM 776 CA LYS A 54 15.199 17.872 10.566 1.00 0.00 C ATOM 777 C LYS A 54 15.212 16.431 11.053 1.00 0.00 C ATOM 778 O LYS A 54 15.053 16.161 12.246 1.00 0.00 O ATOM 779 CB LYS A 54 13.803 18.196 10.037 1.00 0.00 C ATOM 780 CG LYS A 54 13.644 19.618 9.535 1.00 0.00 C ATOM 781 CD LYS A 54 12.280 19.822 8.900 1.00 0.00 C ATOM 782 CE LYS A 54 12.042 21.277 8.543 1.00 0.00 C ATOM 783 NZ LYS A 54 12.091 22.150 9.742 1.00 0.00 N ATOM 0 H LYS A 54 15.910 17.748 8.602 1.00 0.00 H new ATOM 0 HA LYS A 54 15.447 18.534 11.395 1.00 0.00 H new ATOM 0 HB2 LYS A 54 13.565 17.507 9.226 1.00 0.00 H new ATOM 0 HB3 LYS A 54 13.076 18.019 10.830 1.00 0.00 H new ATOM 0 HG2 LYS A 54 13.772 20.316 10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 54 14.425 19.840 8.807 1.00 0.00 H new ATOM 0 HD2 LYS A 54 12.201 19.209 8.002 1.00 0.00 H new ATOM 0 HD3 LYS A 54 11.504 19.484 9.587 1.00 0.00 H new ATOM 0 HE2 LYS A 54 12.794 21.603 7.824 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.071 21.379 8.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 11.635 23.060 9.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 11.590 21.688 10.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.082 22.314 10.011 1.00 0.00 H new ATOM 797 N SER A 55 15.380 15.503 10.129 1.00 0.00 N ATOM 798 CA SER A 55 15.267 14.093 10.452 1.00 0.00 C ATOM 799 C SER A 55 16.241 13.261 9.628 1.00 0.00 C ATOM 800 O SER A 55 16.861 13.763 8.693 1.00 0.00 O ATOM 801 CB SER A 55 13.835 13.630 10.191 1.00 0.00 C ATOM 802 OG SER A 55 12.907 14.493 10.829 1.00 0.00 O ATOM 0 H SER A 55 15.595 15.700 9.151 1.00 0.00 H new ATOM 0 HA SER A 55 15.515 13.955 11.504 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.643 13.610 9.118 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.704 12.612 10.557 1.00 0.00 H new ATOM 0 HG SER A 55 12.163 13.966 11.187 1.00 0.00 H new ATOM 808 N VAL A 56 16.376 11.995 9.989 1.00 0.00 N ATOM 809 CA VAL A 56 17.211 11.069 9.242 1.00 0.00 C ATOM 810 C VAL A 56 16.428 9.796 8.928 1.00 0.00 C ATOM 811 O VAL A 56 15.522 9.416 9.677 1.00 0.00 O ATOM 812 CB VAL A 56 18.512 10.713 10.000 1.00 0.00 C ATOM 813 CG1 VAL A 56 19.379 11.948 10.194 1.00 0.00 C ATOM 814 CG2 VAL A 56 18.205 10.061 11.338 1.00 0.00 C ATOM 0 H VAL A 56 15.915 11.583 10.800 1.00 0.00 H new ATOM 0 HA VAL A 56 17.497 11.565 8.314 1.00 0.00 H new ATOM 0 HB VAL A 56 19.065 9.996 9.394 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.288 11.674 10.729 1.00 0.00 H new ATOM 0 HG12 VAL A 56 19.642 12.364 9.222 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.829 12.692 10.771 1.00 0.00 H new ATOM 0 HG21 VAL A 56 19.138 9.822 11.849 1.00 0.00 H new ATOM 0 HG22 VAL A 56 17.621 10.747 11.952 1.00 0.00 H new ATOM 0 HG23 VAL A 56 17.636 9.146 11.175 1.00 0.00 H new ATOM 824 N PRO A 57 16.762 9.115 7.821 1.00 0.00 N ATOM 825 CA PRO A 57 17.869 9.506 6.946 1.00 0.00 C ATOM 826 C PRO A 57 17.546 10.725 6.081 1.00 0.00 C ATOM 827 O PRO A 57 16.432 10.875 5.571 1.00 0.00 O ATOM 828 CB PRO A 57 18.083 8.270 6.078 1.00 0.00 C ATOM 829 CG PRO A 57 16.753 7.606 6.023 1.00 0.00 C ATOM 830 CD PRO A 57 16.067 7.914 7.327 1.00 0.00 C ATOM 0 HA PRO A 57 18.748 9.804 7.517 1.00 0.00 H new ATOM 0 HB2 PRO A 57 18.430 8.542 5.081 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.836 7.610 6.509 1.00 0.00 H new ATOM 0 HG2 PRO A 57 16.169 7.977 5.181 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.862 6.530 5.887 1.00 0.00 H new ATOM 0 HD2 PRO A 57 15.003 8.100 7.184 1.00 0.00 H new ATOM 0 HD3 PRO A 57 16.154 7.085 8.029 1.00 0.00 H new ATOM 838 N ALA A 58 18.534 11.589 5.933 1.00 0.00 N ATOM 839 CA ALA A 58 18.393 12.795 5.140 1.00 0.00 C ATOM 840 C ALA A 58 19.276 12.716 3.905 1.00 0.00 C ATOM 841 O ALA A 58 20.369 12.148 3.947 1.00 0.00 O ATOM 842 CB ALA A 58 18.751 14.020 5.969 1.00 0.00 C ATOM 0 H ALA A 58 19.454 11.474 6.358 1.00 0.00 H new ATOM 0 HA ALA A 58 17.354 12.884 4.822 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.640 14.917 5.360 1.00 0.00 H new ATOM 0 HB2 ALA A 58 18.087 14.083 6.831 1.00 0.00 H new ATOM 0 HB3 ALA A 58 19.783 13.939 6.311 1.00 0.00 H new ATOM 848 N LEU A 59 18.801 13.289 2.816 1.00 0.00 N ATOM 849 CA LEU A 59 19.521 13.267 1.558 1.00 0.00 C ATOM 850 C LEU A 59 19.752 14.690 1.068 1.00 0.00 C ATOM 851 O LEU A 59 18.839 15.341 0.558 1.00 0.00 O ATOM 852 CB LEU A 59 18.736 12.463 0.517 1.00 0.00 C ATOM 853 CG LEU A 59 19.418 12.303 -0.844 1.00 0.00 C ATOM 854 CD1 LEU A 59 20.720 11.527 -0.709 1.00 0.00 C ATOM 855 CD2 LEU A 59 18.483 11.610 -1.823 1.00 0.00 C ATOM 0 H LEU A 59 17.908 13.781 2.778 1.00 0.00 H new ATOM 0 HA LEU A 59 20.488 12.788 1.709 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.538 11.471 0.923 1.00 0.00 H new ATOM 0 HB3 LEU A 59 17.770 12.944 0.365 1.00 0.00 H new ATOM 0 HG LEU A 59 19.654 13.295 -1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 59 21.187 11.426 -1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 59 21.394 12.061 -0.039 1.00 0.00 H new ATOM 0 HD13 LEU A 59 20.513 10.537 -0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 59 18.980 11.502 -2.787 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.219 10.625 -1.439 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.578 12.206 -1.946 1.00 0.00 H new ATOM 867 N VAL A 60 20.963 15.183 1.257 1.00 0.00 N ATOM 868 CA VAL A 60 21.317 16.518 0.811 1.00 0.00 C ATOM 869 C VAL A 60 21.743 16.479 -0.649 1.00 0.00 C ATOM 870 O VAL A 60 22.871 16.105 -0.971 1.00 0.00 O ATOM 871 CB VAL A 60 22.445 17.127 1.671 1.00 0.00 C ATOM 872 CG1 VAL A 60 22.758 18.550 1.230 1.00 0.00 C ATOM 873 CG2 VAL A 60 22.067 17.094 3.145 1.00 0.00 C ATOM 0 H VAL A 60 21.719 14.677 1.718 1.00 0.00 H new ATOM 0 HA VAL A 60 20.436 17.151 0.920 1.00 0.00 H new ATOM 0 HB VAL A 60 23.343 16.525 1.530 1.00 0.00 H new ATOM 0 HG11 VAL A 60 23.556 18.956 1.852 1.00 0.00 H new ATOM 0 HG12 VAL A 60 23.076 18.546 0.188 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.866 19.168 1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.873 17.527 3.737 1.00 0.00 H new ATOM 0 HG22 VAL A 60 21.154 17.669 3.299 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.903 16.062 3.455 1.00 0.00 H new ATOM 883 N ILE A 61 20.826 16.849 -1.527 1.00 0.00 N ATOM 884 CA ILE A 61 21.067 16.800 -2.957 1.00 0.00 C ATOM 885 C ILE A 61 21.639 18.124 -3.453 1.00 0.00 C ATOM 886 O ILE A 61 20.911 19.099 -3.638 1.00 0.00 O ATOM 887 CB ILE A 61 19.776 16.466 -3.739 1.00 0.00 C ATOM 888 CG1 ILE A 61 19.188 15.140 -3.246 1.00 0.00 C ATOM 889 CG2 ILE A 61 20.059 16.401 -5.235 1.00 0.00 C ATOM 890 CD1 ILE A 61 17.888 14.763 -3.923 1.00 0.00 C ATOM 0 H ILE A 61 19.900 17.190 -1.270 1.00 0.00 H new ATOM 0 HA ILE A 61 21.792 16.006 -3.136 1.00 0.00 H new ATOM 0 HB ILE A 61 19.048 17.257 -3.563 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.917 14.346 -3.410 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.022 15.203 -2.171 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.139 16.165 -5.769 1.00 0.00 H new ATOM 0 HG22 ILE A 61 20.439 17.364 -5.576 1.00 0.00 H new ATOM 0 HG23 ILE A 61 20.801 15.628 -5.432 1.00 0.00 H new ATOM 0 HD11 ILE A 61 17.532 13.814 -3.523 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.143 15.537 -3.738 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.051 14.666 -4.996 1.00 0.00 H new ATOM 902 N ASP A 62 22.959 18.147 -3.608 1.00 0.00 N ATOM 903 CA ASP A 62 23.685 19.281 -4.186 1.00 0.00 C ATOM 904 C ASP A 62 23.478 20.566 -3.378 1.00 0.00 C ATOM 905 O ASP A 62 23.719 21.669 -3.866 1.00 0.00 O ATOM 906 CB ASP A 62 23.259 19.482 -5.644 1.00 0.00 C ATOM 907 CG ASP A 62 24.249 20.312 -6.438 1.00 0.00 C ATOM 908 OD1 ASP A 62 25.416 19.884 -6.570 1.00 0.00 O ATOM 909 OD2 ASP A 62 23.856 21.373 -6.965 1.00 0.00 O ATOM 0 H ASP A 62 23.564 17.373 -3.334 1.00 0.00 H new ATOM 0 HA ASP A 62 24.750 19.051 -4.151 1.00 0.00 H new ATOM 0 HB2 ASP A 62 23.143 18.509 -6.121 1.00 0.00 H new ATOM 0 HB3 ASP A 62 22.283 19.967 -5.669 1.00 0.00 H new ATOM 914 N GLY A 63 23.057 20.420 -2.129 1.00 0.00 N ATOM 915 CA GLY A 63 22.860 21.579 -1.278 1.00 0.00 C ATOM 916 C GLY A 63 21.441 21.689 -0.758 1.00 0.00 C ATOM 917 O GLY A 63 21.161 22.487 0.136 1.00 0.00 O ATOM 0 H GLY A 63 22.849 19.523 -1.690 1.00 0.00 H new ATOM 0 HA2 GLY A 63 23.548 21.526 -0.435 1.00 0.00 H new ATOM 0 HA3 GLY A 63 23.109 22.481 -1.837 1.00 0.00 H new ATOM 921 N ALA A 64 20.536 20.900 -1.321 1.00 0.00 N ATOM 922 CA ALA A 64 19.154 20.883 -0.859 1.00 0.00 C ATOM 923 C ALA A 64 18.938 19.729 0.117 1.00 0.00 C ATOM 924 O ALA A 64 19.230 18.579 -0.201 1.00 0.00 O ATOM 925 CB ALA A 64 18.201 20.780 -2.040 1.00 0.00 C ATOM 0 H ALA A 64 20.732 20.266 -2.095 1.00 0.00 H new ATOM 0 HA ALA A 64 18.947 21.817 -0.337 1.00 0.00 H new ATOM 0 HB1 ALA A 64 17.173 20.768 -1.678 1.00 0.00 H new ATOM 0 HB2 ALA A 64 18.344 21.636 -2.699 1.00 0.00 H new ATOM 0 HB3 ALA A 64 18.402 19.861 -2.591 1.00 0.00 H new ATOM 931 N ALA A 65 18.428 20.040 1.301 1.00 0.00 N ATOM 932 CA ALA A 65 18.295 19.044 2.359 1.00 0.00 C ATOM 933 C ALA A 65 16.945 18.338 2.296 1.00 0.00 C ATOM 934 O ALA A 65 15.914 18.903 2.670 1.00 0.00 O ATOM 935 CB ALA A 65 18.493 19.695 3.720 1.00 0.00 C ATOM 0 H ALA A 65 18.100 20.972 1.554 1.00 0.00 H new ATOM 0 HA ALA A 65 19.068 18.290 2.210 1.00 0.00 H new ATOM 0 HB1 ALA A 65 18.391 18.942 4.502 1.00 0.00 H new ATOM 0 HB2 ALA A 65 19.488 20.138 3.770 1.00 0.00 H new ATOM 0 HB3 ALA A 65 17.742 20.472 3.865 1.00 0.00 H new ATOM 941 N PHE A 66 16.956 17.104 1.812 1.00 0.00 N ATOM 942 CA PHE A 66 15.745 16.306 1.717 1.00 0.00 C ATOM 943 C PHE A 66 15.724 15.221 2.783 1.00 0.00 C ATOM 944 O PHE A 66 16.744 14.919 3.396 1.00 0.00 O ATOM 945 CB PHE A 66 15.617 15.685 0.324 1.00 0.00 C ATOM 946 CG PHE A 66 15.338 16.699 -0.743 1.00 0.00 C ATOM 947 CD1 PHE A 66 14.038 17.076 -1.030 1.00 0.00 C ATOM 948 CD2 PHE A 66 16.374 17.291 -1.442 1.00 0.00 C ATOM 949 CE1 PHE A 66 13.776 18.020 -1.999 1.00 0.00 C ATOM 950 CE2 PHE A 66 16.117 18.238 -2.410 1.00 0.00 C ATOM 951 CZ PHE A 66 14.817 18.604 -2.689 1.00 0.00 C ATOM 0 H PHE A 66 17.796 16.633 1.478 1.00 0.00 H new ATOM 0 HA PHE A 66 14.893 16.966 1.884 1.00 0.00 H new ATOM 0 HB2 PHE A 66 16.538 15.155 0.082 1.00 0.00 H new ATOM 0 HB3 PHE A 66 14.816 14.945 0.334 1.00 0.00 H new ATOM 0 HD1 PHE A 66 13.219 16.625 -0.488 1.00 0.00 H new ATOM 0 HD2 PHE A 66 17.394 17.009 -1.227 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.757 18.302 -2.218 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.934 18.693 -2.950 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.615 19.347 -3.447 1.00 0.00 H new ATOM 961 N HIS A 67 14.552 14.651 3.006 1.00 0.00 N ATOM 962 CA HIS A 67 14.369 13.621 4.021 1.00 0.00 C ATOM 963 C HIS A 67 13.672 12.417 3.410 1.00 0.00 C ATOM 964 O HIS A 67 12.795 12.579 2.557 1.00 0.00 O ATOM 965 CB HIS A 67 13.538 14.164 5.189 1.00 0.00 C ATOM 966 CG HIS A 67 14.138 15.362 5.856 1.00 0.00 C ATOM 967 ND1 HIS A 67 13.794 16.663 5.557 1.00 0.00 N ATOM 968 CD2 HIS A 67 15.079 15.439 6.828 1.00 0.00 C ATOM 969 CE1 HIS A 67 14.518 17.471 6.341 1.00 0.00 C ATOM 970 NE2 HIS A 67 15.314 16.777 7.134 1.00 0.00 N ATOM 0 H HIS A 67 13.703 14.886 2.493 1.00 0.00 H new ATOM 0 HA HIS A 67 15.347 13.321 4.397 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.544 14.423 4.825 1.00 0.00 H new ATOM 0 HB3 HIS A 67 13.411 13.374 5.929 1.00 0.00 H new ATOM 0 HD1 HIS A 67 13.109 16.958 4.861 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.569 14.596 7.292 1.00 0.00 H new ATOM 0 HE1 HIS A 67 14.459 18.549 6.327 1.00 0.00 H new ATOM 978 N ILE A 68 14.068 11.220 3.834 1.00 0.00 N ATOM 979 CA ILE A 68 13.476 9.988 3.326 1.00 0.00 C ATOM 980 C ILE A 68 13.101 9.050 4.477 1.00 0.00 C ATOM 981 O ILE A 68 13.957 8.361 5.025 1.00 0.00 O ATOM 982 CB ILE A 68 14.431 9.250 2.359 1.00 0.00 C ATOM 983 CG1 ILE A 68 14.851 10.172 1.209 1.00 0.00 C ATOM 984 CG2 ILE A 68 13.763 7.995 1.814 1.00 0.00 C ATOM 985 CD1 ILE A 68 15.878 9.561 0.284 1.00 0.00 C ATOM 0 H ILE A 68 14.799 11.078 4.531 1.00 0.00 H new ATOM 0 HA ILE A 68 12.577 10.271 2.778 1.00 0.00 H new ATOM 0 HB ILE A 68 15.325 8.959 2.911 1.00 0.00 H new ATOM 0 HG12 ILE A 68 13.968 10.441 0.630 1.00 0.00 H new ATOM 0 HG13 ILE A 68 15.253 11.096 1.624 1.00 0.00 H new ATOM 0 HG21 ILE A 68 14.446 7.485 1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 68 13.509 7.330 2.640 1.00 0.00 H new ATOM 0 HG23 ILE A 68 12.855 8.270 1.277 1.00 0.00 H new ATOM 0 HD11 ILE A 68 16.126 10.272 -0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 68 16.778 9.318 0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 68 15.472 8.652 -0.161 1.00 0.00 H new ATOM 997 N ASN A 69 11.813 9.041 4.819 1.00 0.00 N ATOM 998 CA ASN A 69 11.268 8.236 5.918 1.00 0.00 C ATOM 999 C ASN A 69 11.770 8.709 7.276 1.00 0.00 C ATOM 1000 O ASN A 69 12.969 8.740 7.540 1.00 0.00 O ATOM 1001 CB ASN A 69 11.567 6.742 5.738 1.00 0.00 C ATOM 1002 CG ASN A 69 10.588 6.052 4.804 1.00 0.00 C ATOM 1003 OD1 ASN A 69 9.432 6.461 4.678 1.00 0.00 O ATOM 1004 ND2 ASN A 69 11.036 4.988 4.154 1.00 0.00 N ATOM 0 H ASN A 69 11.108 9.598 4.336 1.00 0.00 H new ATOM 0 HA ASN A 69 10.187 8.374 5.888 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.578 6.623 5.349 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.540 6.251 6.711 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.417 4.478 3.524 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.999 4.679 4.284 1.00 0.00 H new ATOM 1011 N PHE A 70 10.835 9.072 8.142 1.00 0.00 N ATOM 1012 CA PHE A 70 11.176 9.527 9.478 1.00 0.00 C ATOM 1013 C PHE A 70 11.620 8.351 10.343 1.00 0.00 C ATOM 1014 O PHE A 70 10.795 7.622 10.896 1.00 0.00 O ATOM 1015 CB PHE A 70 9.983 10.248 10.122 1.00 0.00 C ATOM 1016 CG PHE A 70 10.285 10.847 11.470 1.00 0.00 C ATOM 1017 CD1 PHE A 70 10.962 12.050 11.569 1.00 0.00 C ATOM 1018 CD2 PHE A 70 9.890 10.209 12.633 1.00 0.00 C ATOM 1019 CE1 PHE A 70 11.240 12.606 12.804 1.00 0.00 C ATOM 1020 CE2 PHE A 70 10.166 10.759 13.871 1.00 0.00 C ATOM 1021 CZ PHE A 70 10.842 11.959 13.956 1.00 0.00 C ATOM 0 H PHE A 70 9.835 9.060 7.942 1.00 0.00 H new ATOM 0 HA PHE A 70 12.003 10.232 9.402 1.00 0.00 H new ATOM 0 HB2 PHE A 70 9.645 11.038 9.452 1.00 0.00 H new ATOM 0 HB3 PHE A 70 9.158 9.543 10.226 1.00 0.00 H new ATOM 0 HD1 PHE A 70 11.277 12.561 10.671 1.00 0.00 H new ATOM 0 HD2 PHE A 70 9.360 9.270 12.573 1.00 0.00 H new ATOM 0 HE1 PHE A 70 11.768 13.546 12.867 1.00 0.00 H new ATOM 0 HE2 PHE A 70 9.853 10.250 14.771 1.00 0.00 H new ATOM 0 HZ PHE A 70 11.059 12.391 14.922 1.00 0.00 H new ATOM 1031 N GLY A 71 12.925 8.142 10.411 1.00 0.00 N ATOM 1032 CA GLY A 71 13.464 7.128 11.289 1.00 0.00 C ATOM 1033 C GLY A 71 13.842 7.719 12.625 1.00 0.00 C ATOM 1034 O GLY A 71 13.434 7.226 13.675 1.00 0.00 O ATOM 0 H GLY A 71 13.621 8.658 9.873 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.728 6.336 11.432 1.00 0.00 H new ATOM 0 HA3 GLY A 71 14.339 6.670 10.828 1.00 0.00 H new ATOM 1038 N ALA A 72 14.615 8.789 12.571 1.00 0.00 N ATOM 1039 CA ALA A 72 15.023 9.511 13.764 1.00 0.00 C ATOM 1040 C ALA A 72 14.970 11.010 13.505 1.00 0.00 C ATOM 1041 O ALA A 72 15.078 11.447 12.359 1.00 0.00 O ATOM 1042 CB ALA A 72 16.420 9.086 14.194 1.00 0.00 C ATOM 0 H ALA A 72 14.977 9.181 11.702 1.00 0.00 H new ATOM 0 HA ALA A 72 14.334 9.272 14.575 1.00 0.00 H new ATOM 0 HB1 ALA A 72 16.709 9.637 15.089 1.00 0.00 H new ATOM 0 HB2 ALA A 72 16.425 8.017 14.409 1.00 0.00 H new ATOM 0 HB3 ALA A 72 17.128 9.299 13.393 1.00 0.00 H new ATOM 1048 N GLY A 73 14.806 11.791 14.558 1.00 0.00 N ATOM 1049 CA GLY A 73 14.715 13.230 14.400 1.00 0.00 C ATOM 1050 C GLY A 73 15.824 13.945 15.137 1.00 0.00 C ATOM 1051 O GLY A 73 16.216 13.522 16.223 1.00 0.00 O ATOM 0 H GLY A 73 14.734 11.458 15.519 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.760 13.483 13.341 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.750 13.576 14.770 1.00 0.00 H new ATOM 1055 N ILE A 74 16.323 15.036 14.564 1.00 0.00 N ATOM 1056 CA ILE A 74 17.433 15.774 15.162 1.00 0.00 C ATOM 1057 C ILE A 74 17.031 16.354 16.521 1.00 0.00 C ATOM 1058 O ILE A 74 17.865 16.519 17.414 1.00 0.00 O ATOM 1059 CB ILE A 74 17.938 16.901 14.228 1.00 0.00 C ATOM 1060 CG1 ILE A 74 19.243 17.492 14.763 1.00 0.00 C ATOM 1061 CG2 ILE A 74 16.885 17.992 14.067 1.00 0.00 C ATOM 1062 CD1 ILE A 74 19.876 18.505 13.835 1.00 0.00 C ATOM 0 H ILE A 74 15.978 15.429 13.688 1.00 0.00 H new ATOM 0 HA ILE A 74 18.250 15.068 15.309 1.00 0.00 H new ATOM 0 HB ILE A 74 18.127 16.467 13.246 1.00 0.00 H new ATOM 0 HG12 ILE A 74 19.050 17.965 15.726 1.00 0.00 H new ATOM 0 HG13 ILE A 74 19.952 16.683 14.942 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.266 18.771 13.406 1.00 0.00 H new ATOM 0 HG22 ILE A 74 15.979 17.563 13.638 1.00 0.00 H new ATOM 0 HG23 ILE A 74 16.656 18.423 15.042 1.00 0.00 H new ATOM 0 HD11 ILE A 74 20.797 18.881 14.280 1.00 0.00 H new ATOM 0 HD12 ILE A 74 20.102 18.032 12.879 1.00 0.00 H new ATOM 0 HD13 ILE A 74 19.186 19.333 13.676 1.00 0.00 H new ATOM 1074 N ASP A 75 15.738 16.629 16.671 1.00 0.00 N ATOM 1075 CA ASP A 75 15.189 17.126 17.930 1.00 0.00 C ATOM 1076 C ASP A 75 15.357 16.090 19.035 1.00 0.00 C ATOM 1077 O ASP A 75 15.597 16.429 20.194 1.00 0.00 O ATOM 1078 CB ASP A 75 13.707 17.466 17.756 1.00 0.00 C ATOM 1079 CG ASP A 75 13.060 17.932 19.044 1.00 0.00 C ATOM 1080 OD1 ASP A 75 13.208 19.119 19.392 1.00 0.00 O ATOM 1081 OD2 ASP A 75 12.385 17.118 19.707 1.00 0.00 O ATOM 0 H ASP A 75 15.046 16.515 15.930 1.00 0.00 H new ATOM 0 HA ASP A 75 15.734 18.027 18.213 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.603 18.244 17.000 1.00 0.00 H new ATOM 0 HB3 ASP A 75 13.178 16.588 17.385 1.00 0.00 H new ATOM 1086 N ASP A 76 15.239 14.825 18.661 1.00 0.00 N ATOM 1087 CA ASP A 76 15.396 13.725 19.600 1.00 0.00 C ATOM 1088 C ASP A 76 16.873 13.376 19.763 1.00 0.00 C ATOM 1089 O ASP A 76 17.316 13.007 20.850 1.00 0.00 O ATOM 1090 CB ASP A 76 14.602 12.507 19.119 1.00 0.00 C ATOM 1091 CG ASP A 76 14.821 11.279 19.980 1.00 0.00 C ATOM 1092 OD1 ASP A 76 14.086 11.097 20.973 1.00 0.00 O ATOM 1093 OD2 ASP A 76 15.722 10.478 19.658 1.00 0.00 O ATOM 0 H ASP A 76 15.033 14.533 17.705 1.00 0.00 H new ATOM 0 HA ASP A 76 15.007 14.030 20.572 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.540 12.753 19.110 1.00 0.00 H new ATOM 0 HB3 ASP A 76 14.885 12.279 18.091 1.00 0.00 H new ATOM 1098 N LEU A 77 17.629 13.515 18.672 1.00 0.00 N ATOM 1099 CA LEU A 77 19.069 13.261 18.689 1.00 0.00 C ATOM 1100 C LEU A 77 19.749 14.099 19.764 1.00 0.00 C ATOM 1101 O LEU A 77 20.529 13.582 20.565 1.00 0.00 O ATOM 1102 CB LEU A 77 19.691 13.562 17.321 1.00 0.00 C ATOM 1103 CG LEU A 77 19.219 12.664 16.176 1.00 0.00 C ATOM 1104 CD1 LEU A 77 19.904 13.054 14.874 1.00 0.00 C ATOM 1105 CD2 LEU A 77 19.485 11.202 16.498 1.00 0.00 C ATOM 0 H LEU A 77 17.265 13.803 17.764 1.00 0.00 H new ATOM 0 HA LEU A 77 19.221 12.206 18.917 1.00 0.00 H new ATOM 0 HB2 LEU A 77 19.473 14.598 17.061 1.00 0.00 H new ATOM 0 HB3 LEU A 77 20.774 13.475 17.406 1.00 0.00 H new ATOM 0 HG LEU A 77 18.144 12.800 16.055 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.556 12.404 14.071 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.664 14.090 14.633 1.00 0.00 H new ATOM 0 HD13 LEU A 77 20.983 12.948 14.985 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.142 10.579 15.672 1.00 0.00 H new ATOM 0 HD22 LEU A 77 20.554 11.051 16.647 1.00 0.00 H new ATOM 0 HD23 LEU A 77 18.949 10.926 17.406 1.00 0.00 H new ATOM 1117 N LYS A 78 19.449 15.392 19.788 1.00 0.00 N ATOM 1118 CA LYS A 78 19.947 16.251 20.850 1.00 0.00 C ATOM 1119 C LYS A 78 19.215 15.931 22.146 1.00 0.00 C ATOM 1120 O LYS A 78 18.014 16.179 22.279 1.00 0.00 O ATOM 1121 CB LYS A 78 19.806 17.732 20.489 1.00 0.00 C ATOM 1122 CG LYS A 78 20.783 18.181 19.413 1.00 0.00 C ATOM 1123 CD LYS A 78 20.758 19.689 19.214 1.00 0.00 C ATOM 1124 CE LYS A 78 21.850 20.137 18.254 1.00 0.00 C ATOM 1125 NZ LYS A 78 21.918 21.617 18.133 1.00 0.00 N ATOM 0 H LYS A 78 18.870 15.862 19.092 1.00 0.00 H new ATOM 0 HA LYS A 78 21.011 16.058 20.984 1.00 0.00 H new ATOM 0 HB2 LYS A 78 18.788 17.921 20.148 1.00 0.00 H new ATOM 0 HB3 LYS A 78 19.960 18.334 21.385 1.00 0.00 H new ATOM 0 HG2 LYS A 78 21.791 17.868 19.685 1.00 0.00 H new ATOM 0 HG3 LYS A 78 20.539 17.687 18.473 1.00 0.00 H new ATOM 0 HD2 LYS A 78 19.785 19.991 18.828 1.00 0.00 H new ATOM 0 HD3 LYS A 78 20.888 20.187 20.175 1.00 0.00 H new ATOM 0 HE2 LYS A 78 22.812 19.758 18.598 1.00 0.00 H new ATOM 0 HE3 LYS A 78 21.669 19.702 17.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 22.592 21.873 17.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 20.977 21.989 17.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 22.233 22.025 19.036 1.00 0.00 H new ATOM 1139 N GLY A 79 19.951 15.366 23.087 1.00 0.00 N ATOM 1140 CA GLY A 79 19.359 14.871 24.311 1.00 0.00 C ATOM 1141 C GLY A 79 19.643 13.395 24.500 1.00 0.00 C ATOM 1142 O GLY A 79 19.285 12.807 25.521 1.00 0.00 O ATOM 0 H GLY A 79 20.961 15.240 23.024 1.00 0.00 H new ATOM 0 HA2 GLY A 79 19.751 15.431 25.160 1.00 0.00 H new ATOM 0 HA3 GLY A 79 18.282 15.037 24.290 1.00 0.00 H new ATOM 1146 N SER A 80 20.289 12.799 23.506 1.00 0.00 N ATOM 1147 CA SER A 80 20.664 11.396 23.562 1.00 0.00 C ATOM 1148 C SER A 80 22.092 11.255 24.085 1.00 0.00 C ATOM 1149 O SER A 80 23.040 11.509 23.311 1.00 0.00 O ATOM 1150 CB SER A 80 20.545 10.766 22.174 1.00 0.00 C ATOM 1151 OG SER A 80 19.285 11.051 21.590 1.00 0.00 O ATOM 1152 OXT SER A 80 22.266 10.908 25.271 1.00 0.00 O ATOM 0 H SER A 80 20.565 13.272 22.645 1.00 0.00 H new ATOM 0 HA SER A 80 19.989 10.877 24.242 1.00 0.00 H new ATOM 0 HB2 SER A 80 21.341 11.142 21.531 1.00 0.00 H new ATOM 0 HB3 SER A 80 20.679 9.687 22.248 1.00 0.00 H new ATOM 0 HG SER A 80 19.285 11.968 21.243 1.00 0.00 H new TER 1158 SER A 80 ATOM 1159 N VAL B 1 16.954 -5.021 -13.561 1.00 0.00 N ATOM 1160 CA VAL B 1 17.953 -4.070 -14.109 1.00 0.00 C ATOM 1161 C VAL B 1 17.521 -2.635 -13.829 1.00 0.00 C ATOM 1162 O VAL B 1 18.159 -1.923 -13.053 1.00 0.00 O ATOM 1163 CB VAL B 1 18.143 -4.262 -15.631 1.00 0.00 C ATOM 1164 CG1 VAL B 1 19.118 -3.234 -16.191 1.00 0.00 C ATOM 1165 CG2 VAL B 1 18.625 -5.673 -15.933 1.00 0.00 C ATOM 0 H1 VAL B 1 17.372 -5.972 -13.510 1.00 0.00 H new ATOM 0 H2 VAL B 1 16.671 -4.716 -12.608 1.00 0.00 H new ATOM 0 H3 VAL B 1 16.119 -5.042 -14.180 1.00 0.00 H new ATOM 0 HA VAL B 1 18.904 -4.271 -13.616 1.00 0.00 H new ATOM 0 HB VAL B 1 17.178 -4.113 -16.115 1.00 0.00 H new ATOM 0 HG11 VAL B 1 19.235 -3.390 -17.263 1.00 0.00 H new ATOM 0 HG12 VAL B 1 18.733 -2.231 -16.010 1.00 0.00 H new ATOM 0 HG13 VAL B 1 20.085 -3.345 -15.701 1.00 0.00 H new ATOM 0 HG21 VAL B 1 18.754 -5.791 -17.009 1.00 0.00 H new ATOM 0 HG22 VAL B 1 19.577 -5.847 -15.432 1.00 0.00 H new ATOM 0 HG23 VAL B 1 17.890 -6.393 -15.574 1.00 0.00 H new ATOM 1177 N ALA B 2 16.430 -2.221 -14.455 1.00 0.00 N ATOM 1178 CA ALA B 2 15.870 -0.905 -14.217 1.00 0.00 C ATOM 1179 C ALA B 2 14.649 -1.029 -13.320 1.00 0.00 C ATOM 1180 O ALA B 2 13.515 -1.081 -13.800 1.00 0.00 O ATOM 1181 CB ALA B 2 15.511 -0.220 -15.529 1.00 0.00 C ATOM 0 H ALA B 2 15.915 -2.782 -15.134 1.00 0.00 H new ATOM 0 HA ALA B 2 16.617 -0.287 -13.718 1.00 0.00 H new ATOM 0 HB1 ALA B 2 15.093 0.765 -15.323 1.00 0.00 H new ATOM 0 HB2 ALA B 2 16.407 -0.113 -16.141 1.00 0.00 H new ATOM 0 HB3 ALA B 2 14.776 -0.821 -16.064 1.00 0.00 H new ATOM 1187 N SER B 3 14.900 -1.120 -12.019 1.00 0.00 N ATOM 1188 CA SER B 3 13.846 -1.337 -11.033 1.00 0.00 C ATOM 1189 C SER B 3 12.761 -0.266 -11.127 1.00 0.00 C ATOM 1190 O SER B 3 13.028 0.879 -11.498 1.00 0.00 O ATOM 1191 CB SER B 3 14.451 -1.365 -9.630 1.00 0.00 C ATOM 1192 OG SER B 3 15.485 -2.335 -9.546 1.00 0.00 O ATOM 0 H SER B 3 15.835 -1.046 -11.619 1.00 0.00 H new ATOM 0 HA SER B 3 13.375 -2.298 -11.242 1.00 0.00 H new ATOM 0 HB2 SER B 3 14.848 -0.381 -9.381 1.00 0.00 H new ATOM 0 HB3 SER B 3 13.675 -1.590 -8.899 1.00 0.00 H new ATOM 0 HG SER B 3 15.860 -2.336 -8.641 1.00 0.00 H new ATOM 1198 N LYS B 4 11.538 -0.652 -10.797 1.00 0.00 N ATOM 1199 CA LYS B 4 10.392 0.230 -10.931 1.00 0.00 C ATOM 1200 C LYS B 4 10.140 1.002 -9.640 1.00 0.00 C ATOM 1201 O LYS B 4 9.904 0.414 -8.583 1.00 0.00 O ATOM 1202 CB LYS B 4 9.155 -0.584 -11.320 1.00 0.00 C ATOM 1203 CG LYS B 4 7.893 0.245 -11.495 1.00 0.00 C ATOM 1204 CD LYS B 4 6.748 -0.607 -12.014 1.00 0.00 C ATOM 1205 CE LYS B 4 5.465 0.197 -12.147 1.00 0.00 C ATOM 1206 NZ LYS B 4 4.383 -0.594 -12.790 1.00 0.00 N ATOM 0 H LYS B 4 11.314 -1.578 -10.432 1.00 0.00 H new ATOM 0 HA LYS B 4 10.603 0.956 -11.716 1.00 0.00 H new ATOM 0 HB2 LYS B 4 9.360 -1.114 -12.250 1.00 0.00 H new ATOM 0 HB3 LYS B 4 8.976 -1.340 -10.556 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.614 0.694 -10.542 1.00 0.00 H new ATOM 0 HG3 LYS B 4 8.085 1.064 -12.189 1.00 0.00 H new ATOM 0 HD2 LYS B 4 7.017 -1.026 -12.983 1.00 0.00 H new ATOM 0 HD3 LYS B 4 6.583 -1.446 -11.338 1.00 0.00 H new ATOM 0 HE2 LYS B 4 5.138 0.526 -11.161 1.00 0.00 H new ATOM 0 HE3 LYS B 4 5.658 1.095 -12.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 3.524 -0.012 -12.863 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 4.685 -0.887 -13.741 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 4.182 -1.438 -12.216 1.00 0.00 H new ATOM 1220 N ALA B 5 10.205 2.319 -9.737 1.00 0.00 N ATOM 1221 CA ALA B 5 9.934 3.191 -8.609 1.00 0.00 C ATOM 1222 C ALA B 5 8.734 4.073 -8.917 1.00 0.00 C ATOM 1223 O ALA B 5 8.718 4.780 -9.924 1.00 0.00 O ATOM 1224 CB ALA B 5 11.155 4.040 -8.290 1.00 0.00 C ATOM 0 H ALA B 5 10.446 2.812 -10.597 1.00 0.00 H new ATOM 0 HA ALA B 5 9.706 2.581 -7.735 1.00 0.00 H new ATOM 0 HB1 ALA B 5 10.936 4.689 -7.442 1.00 0.00 H new ATOM 0 HB2 ALA B 5 11.995 3.391 -8.043 1.00 0.00 H new ATOM 0 HB3 ALA B 5 11.411 4.650 -9.156 1.00 0.00 H new ATOM 1230 N ILE B 6 7.727 4.018 -8.063 1.00 0.00 N ATOM 1231 CA ILE B 6 6.507 4.776 -8.280 1.00 0.00 C ATOM 1232 C ILE B 6 6.465 5.995 -7.368 1.00 0.00 C ATOM 1233 O ILE B 6 6.486 5.873 -6.142 1.00 0.00 O ATOM 1234 CB ILE B 6 5.252 3.907 -8.053 1.00 0.00 C ATOM 1235 CG1 ILE B 6 5.301 2.669 -8.954 1.00 0.00 C ATOM 1236 CG2 ILE B 6 3.991 4.717 -8.328 1.00 0.00 C ATOM 1237 CD1 ILE B 6 4.129 1.729 -8.770 1.00 0.00 C ATOM 0 H ILE B 6 7.730 3.456 -7.212 1.00 0.00 H new ATOM 0 HA ILE B 6 6.508 5.106 -9.319 1.00 0.00 H new ATOM 0 HB ILE B 6 5.232 3.582 -7.013 1.00 0.00 H new ATOM 0 HG12 ILE B 6 5.336 2.991 -9.995 1.00 0.00 H new ATOM 0 HG13 ILE B 6 6.225 2.125 -8.757 1.00 0.00 H new ATOM 0 HG21 ILE B 6 3.114 4.091 -8.164 1.00 0.00 H new ATOM 0 HG22 ILE B 6 3.956 5.575 -7.656 1.00 0.00 H new ATOM 0 HG23 ILE B 6 4.000 5.065 -9.361 1.00 0.00 H new ATOM 0 HD11 ILE B 6 4.236 0.878 -9.442 1.00 0.00 H new ATOM 0 HD12 ILE B 6 4.104 1.376 -7.739 1.00 0.00 H new ATOM 0 HD13 ILE B 6 3.202 2.255 -8.996 1.00 0.00 H new ATOM 1249 N PHE B 7 6.413 7.166 -7.976 1.00 0.00 N ATOM 1250 CA PHE B 7 6.411 8.419 -7.242 1.00 0.00 C ATOM 1251 C PHE B 7 4.984 8.908 -7.033 1.00 0.00 C ATOM 1252 O PHE B 7 4.236 9.095 -7.992 1.00 0.00 O ATOM 1253 CB PHE B 7 7.233 9.467 -7.999 1.00 0.00 C ATOM 1254 CG PHE B 7 7.277 10.813 -7.332 1.00 0.00 C ATOM 1255 CD1 PHE B 7 8.033 11.011 -6.189 1.00 0.00 C ATOM 1256 CD2 PHE B 7 6.566 11.882 -7.854 1.00 0.00 C ATOM 1257 CE1 PHE B 7 8.079 12.250 -5.578 1.00 0.00 C ATOM 1258 CE2 PHE B 7 6.608 13.122 -7.247 1.00 0.00 C ATOM 1259 CZ PHE B 7 7.365 13.307 -6.108 1.00 0.00 C ATOM 0 H PHE B 7 6.371 7.276 -8.989 1.00 0.00 H new ATOM 0 HA PHE B 7 6.864 8.258 -6.264 1.00 0.00 H new ATOM 0 HB2 PHE B 7 8.252 9.098 -8.116 1.00 0.00 H new ATOM 0 HB3 PHE B 7 6.819 9.583 -9.001 1.00 0.00 H new ATOM 0 HD1 PHE B 7 8.593 10.188 -5.770 1.00 0.00 H new ATOM 0 HD2 PHE B 7 5.972 11.744 -8.746 1.00 0.00 H new ATOM 0 HE1 PHE B 7 8.673 12.392 -4.687 1.00 0.00 H new ATOM 0 HE2 PHE B 7 6.049 13.947 -7.664 1.00 0.00 H new ATOM 0 HZ PHE B 7 7.399 14.276 -5.632 1.00 0.00 H new ATOM 1269 N TYR B 8 4.612 9.101 -5.779 1.00 0.00 N ATOM 1270 CA TYR B 8 3.289 9.602 -5.441 1.00 0.00 C ATOM 1271 C TYR B 8 3.368 11.052 -4.995 1.00 0.00 C ATOM 1272 O TYR B 8 4.107 11.384 -4.066 1.00 0.00 O ATOM 1273 CB TYR B 8 2.654 8.762 -4.330 1.00 0.00 C ATOM 1274 CG TYR B 8 2.111 7.428 -4.790 1.00 0.00 C ATOM 1275 CD1 TYR B 8 0.809 7.318 -5.260 1.00 0.00 C ATOM 1276 CD2 TYR B 8 2.893 6.280 -4.749 1.00 0.00 C ATOM 1277 CE1 TYR B 8 0.299 6.103 -5.678 1.00 0.00 C ATOM 1278 CE2 TYR B 8 2.390 5.060 -5.163 1.00 0.00 C ATOM 1279 CZ TYR B 8 1.093 4.978 -5.627 1.00 0.00 C ATOM 1280 OH TYR B 8 0.587 3.765 -6.039 1.00 0.00 O ATOM 0 H TYR B 8 5.211 8.917 -4.974 1.00 0.00 H new ATOM 0 HA TYR B 8 2.668 9.532 -6.334 1.00 0.00 H new ATOM 0 HB2 TYR B 8 3.397 8.589 -3.552 1.00 0.00 H new ATOM 0 HB3 TYR B 8 1.844 9.334 -3.876 1.00 0.00 H new ATOM 0 HD1 TYR B 8 0.184 8.198 -5.300 1.00 0.00 H new ATOM 0 HD2 TYR B 8 3.909 6.341 -4.388 1.00 0.00 H new ATOM 0 HE1 TYR B 8 -0.715 6.036 -6.042 1.00 0.00 H new ATOM 0 HE2 TYR B 8 3.009 4.176 -5.123 1.00 0.00 H new ATOM 0 HH TYR B 8 1.274 3.073 -5.941 1.00 0.00 H new ATOM 1290 N HIS B 9 2.614 11.914 -5.657 1.00 0.00 N ATOM 1291 CA HIS B 9 2.568 13.317 -5.279 1.00 0.00 C ATOM 1292 C HIS B 9 1.129 13.821 -5.280 1.00 0.00 C ATOM 1293 O HIS B 9 0.218 13.114 -5.711 1.00 0.00 O ATOM 1294 CB HIS B 9 3.449 14.169 -6.204 1.00 0.00 C ATOM 1295 CG HIS B 9 2.932 14.325 -7.601 1.00 0.00 C ATOM 1296 ND1 HIS B 9 2.534 15.549 -8.077 1.00 0.00 N ATOM 1297 CD2 HIS B 9 2.800 13.404 -8.584 1.00 0.00 C ATOM 1298 CE1 HIS B 9 2.177 15.350 -9.333 1.00 0.00 C ATOM 1299 NE2 HIS B 9 2.320 14.065 -9.686 1.00 0.00 N ATOM 0 H HIS B 9 2.028 11.669 -6.455 1.00 0.00 H new ATOM 0 HA HIS B 9 2.964 13.410 -4.268 1.00 0.00 H new ATOM 0 HB2 HIS B 9 3.563 15.159 -5.762 1.00 0.00 H new ATOM 0 HB3 HIS B 9 4.442 13.723 -6.248 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.029 12.351 -8.514 1.00 0.00 H new ATOM 0 HE1 HIS B 9 1.815 16.125 -9.992 1.00 0.00 H new ATOM 0 HE2 HIS B 9 2.112 13.657 -10.598 1.00 0.00 H new ATOM 1307 N ALA B 10 0.930 15.039 -4.796 1.00 0.00 N ATOM 1308 CA ALA B 10 -0.408 15.599 -4.675 1.00 0.00 C ATOM 1309 C ALA B 10 -0.537 16.914 -5.436 1.00 0.00 C ATOM 1310 O ALA B 10 -1.601 17.535 -5.439 1.00 0.00 O ATOM 1311 CB ALA B 10 -0.758 15.800 -3.209 1.00 0.00 C ATOM 0 H ALA B 10 1.677 15.658 -4.481 1.00 0.00 H new ATOM 0 HA ALA B 10 -1.109 14.892 -5.118 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -1.761 16.219 -3.129 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -0.723 14.841 -2.692 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.041 16.484 -2.754 1.00 0.00 H new ATOM 1317 N GLY B 11 0.546 17.336 -6.078 1.00 0.00 N ATOM 1318 CA GLY B 11 0.534 18.584 -6.821 1.00 0.00 C ATOM 1319 C GLY B 11 0.871 19.784 -5.956 1.00 0.00 C ATOM 1320 O GLY B 11 0.965 20.906 -6.449 1.00 0.00 O ATOM 0 H GLY B 11 1.435 16.836 -6.098 1.00 0.00 H new ATOM 0 HA2 GLY B 11 1.249 18.520 -7.641 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -0.450 18.727 -7.266 1.00 0.00 H new ATOM 1324 N CYS B 12 1.058 19.546 -4.665 1.00 0.00 N ATOM 1325 CA CYS B 12 1.377 20.610 -3.723 1.00 0.00 C ATOM 1326 C CYS B 12 2.832 21.054 -3.882 1.00 0.00 C ATOM 1327 O CYS B 12 3.641 20.327 -4.458 1.00 0.00 O ATOM 1328 CB CYS B 12 1.115 20.127 -2.294 1.00 0.00 C ATOM 1329 SG CYS B 12 2.007 18.618 -1.850 1.00 0.00 S ATOM 0 H CYS B 12 0.994 18.619 -4.244 1.00 0.00 H new ATOM 0 HA CYS B 12 0.739 21.469 -3.931 1.00 0.00 H new ATOM 0 HB2 CYS B 12 1.392 20.918 -1.598 1.00 0.00 H new ATOM 0 HB3 CYS B 12 0.046 19.954 -2.171 1.00 0.00 H new ATOM 0 HG CYS B 12 1.723 18.290 -0.625 1.00 0.00 H new ATOM 1335 N PRO B 13 3.183 22.253 -3.375 1.00 0.00 N ATOM 1336 CA PRO B 13 4.548 22.805 -3.469 1.00 0.00 C ATOM 1337 C PRO B 13 5.635 21.824 -3.019 1.00 0.00 C ATOM 1338 O PRO B 13 6.753 21.844 -3.535 1.00 0.00 O ATOM 1339 CB PRO B 13 4.502 24.006 -2.528 1.00 0.00 C ATOM 1340 CG PRO B 13 3.080 24.442 -2.549 1.00 0.00 C ATOM 1341 CD PRO B 13 2.268 23.185 -2.683 1.00 0.00 C ATOM 0 HA PRO B 13 4.808 23.046 -4.500 1.00 0.00 H new ATOM 0 HB2 PRO B 13 4.819 23.734 -1.521 1.00 0.00 H new ATOM 0 HB3 PRO B 13 5.166 24.801 -2.867 1.00 0.00 H new ATOM 0 HG2 PRO B 13 2.822 24.979 -1.636 1.00 0.00 H new ATOM 0 HG3 PRO B 13 2.891 25.120 -3.381 1.00 0.00 H new ATOM 0 HD2 PRO B 13 1.963 22.799 -1.710 1.00 0.00 H new ATOM 0 HD3 PRO B 13 1.358 23.355 -3.258 1.00 0.00 H new ATOM 1349 N VAL B 14 5.298 20.958 -2.068 1.00 0.00 N ATOM 1350 CA VAL B 14 6.242 19.968 -1.560 1.00 0.00 C ATOM 1351 C VAL B 14 6.660 18.995 -2.667 1.00 0.00 C ATOM 1352 O VAL B 14 7.785 18.488 -2.678 1.00 0.00 O ATOM 1353 CB VAL B 14 5.641 19.173 -0.378 1.00 0.00 C ATOM 1354 CG1 VAL B 14 6.687 18.261 0.251 1.00 0.00 C ATOM 1355 CG2 VAL B 14 5.057 20.118 0.663 1.00 0.00 C ATOM 0 H VAL B 14 4.376 20.922 -1.633 1.00 0.00 H new ATOM 0 HA VAL B 14 7.120 20.510 -1.208 1.00 0.00 H new ATOM 0 HB VAL B 14 4.836 18.548 -0.765 1.00 0.00 H new ATOM 0 HG11 VAL B 14 6.240 17.712 1.080 1.00 0.00 H new ATOM 0 HG12 VAL B 14 7.051 17.556 -0.496 1.00 0.00 H new ATOM 0 HG13 VAL B 14 7.519 18.861 0.620 1.00 0.00 H new ATOM 0 HG21 VAL B 14 4.639 19.539 1.486 1.00 0.00 H new ATOM 0 HG22 VAL B 14 5.842 20.772 1.041 1.00 0.00 H new ATOM 0 HG23 VAL B 14 4.271 20.720 0.207 1.00 0.00 H new ATOM 1365 N CYS B 15 5.758 18.766 -3.616 1.00 0.00 N ATOM 1366 CA CYS B 15 6.013 17.836 -4.710 1.00 0.00 C ATOM 1367 C CYS B 15 7.091 18.382 -5.640 1.00 0.00 C ATOM 1368 O CYS B 15 7.875 17.623 -6.205 1.00 0.00 O ATOM 1369 CB CYS B 15 4.727 17.585 -5.501 1.00 0.00 C ATOM 1370 SG CYS B 15 3.319 17.083 -4.483 1.00 0.00 S ATOM 0 H CYS B 15 4.842 19.213 -3.649 1.00 0.00 H new ATOM 0 HA CYS B 15 6.362 16.895 -4.284 1.00 0.00 H new ATOM 0 HB2 CYS B 15 4.464 18.493 -6.043 1.00 0.00 H new ATOM 0 HB3 CYS B 15 4.917 16.812 -6.246 1.00 0.00 H new ATOM 0 HG CYS B 15 3.021 18.038 -3.653 1.00 0.00 H new ATOM 1376 N VAL B 16 7.133 19.705 -5.771 1.00 0.00 N ATOM 1377 CA VAL B 16 8.082 20.367 -6.659 1.00 0.00 C ATOM 1378 C VAL B 16 9.518 20.045 -6.257 1.00 0.00 C ATOM 1379 O VAL B 16 10.336 19.661 -7.094 1.00 0.00 O ATOM 1380 CB VAL B 16 7.883 21.898 -6.647 1.00 0.00 C ATOM 1381 CG1 VAL B 16 8.791 22.573 -7.662 1.00 0.00 C ATOM 1382 CG2 VAL B 16 6.428 22.248 -6.913 1.00 0.00 C ATOM 0 H VAL B 16 6.516 20.343 -5.269 1.00 0.00 H new ATOM 0 HA VAL B 16 7.897 19.993 -7.666 1.00 0.00 H new ATOM 0 HB VAL B 16 8.152 22.267 -5.657 1.00 0.00 H new ATOM 0 HG11 VAL B 16 8.631 23.651 -7.633 1.00 0.00 H new ATOM 0 HG12 VAL B 16 9.831 22.354 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL B 16 8.563 22.199 -8.660 1.00 0.00 H new ATOM 0 HG21 VAL B 16 6.306 23.331 -6.901 1.00 0.00 H new ATOM 0 HG22 VAL B 16 6.133 21.861 -7.888 1.00 0.00 H new ATOM 0 HG23 VAL B 16 5.800 21.804 -6.141 1.00 0.00 H new ATOM 1392 N SER B 17 9.804 20.185 -4.967 1.00 0.00 N ATOM 1393 CA SER B 17 11.131 19.911 -4.435 1.00 0.00 C ATOM 1394 C SER B 17 11.547 18.468 -4.726 1.00 0.00 C ATOM 1395 O SER B 17 12.655 18.210 -5.206 1.00 0.00 O ATOM 1396 CB SER B 17 11.139 20.170 -2.927 1.00 0.00 C ATOM 1397 OG SER B 17 10.605 21.451 -2.629 1.00 0.00 O ATOM 0 H SER B 17 9.128 20.489 -4.267 1.00 0.00 H new ATOM 0 HA SER B 17 11.848 20.573 -4.921 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.556 19.402 -2.419 1.00 0.00 H new ATOM 0 HB3 SER B 17 12.158 20.100 -2.547 1.00 0.00 H new ATOM 0 HG SER B 17 10.619 21.594 -1.660 1.00 0.00 H new ATOM 1403 N ALA B 18 10.642 17.535 -4.457 1.00 0.00 N ATOM 1404 CA ALA B 18 10.921 16.120 -4.651 1.00 0.00 C ATOM 1405 C ALA B 18 11.092 15.789 -6.131 1.00 0.00 C ATOM 1406 O ALA B 18 11.918 14.956 -6.499 1.00 0.00 O ATOM 1407 CB ALA B 18 9.810 15.280 -4.040 1.00 0.00 C ATOM 0 H ALA B 18 9.707 17.735 -4.103 1.00 0.00 H new ATOM 0 HA ALA B 18 11.859 15.885 -4.148 1.00 0.00 H new ATOM 0 HB1 ALA B 18 10.028 14.223 -4.191 1.00 0.00 H new ATOM 0 HB2 ALA B 18 9.742 15.488 -2.972 1.00 0.00 H new ATOM 0 HB3 ALA B 18 8.862 15.526 -4.519 1.00 0.00 H new ATOM 1413 N GLU B 19 10.316 16.455 -6.972 1.00 0.00 N ATOM 1414 CA GLU B 19 10.361 16.229 -8.410 1.00 0.00 C ATOM 1415 C GLU B 19 11.714 16.631 -8.990 1.00 0.00 C ATOM 1416 O GLU B 19 12.416 15.816 -9.589 1.00 0.00 O ATOM 1417 CB GLU B 19 9.250 17.027 -9.093 1.00 0.00 C ATOM 1418 CG GLU B 19 9.223 16.874 -10.604 1.00 0.00 C ATOM 1419 CD GLU B 19 8.215 17.792 -11.258 1.00 0.00 C ATOM 1420 OE1 GLU B 19 7.004 17.517 -11.161 1.00 0.00 O ATOM 1421 OE2 GLU B 19 8.629 18.802 -11.870 1.00 0.00 O ATOM 0 H GLU B 19 9.642 17.163 -6.681 1.00 0.00 H new ATOM 0 HA GLU B 19 10.215 15.164 -8.592 1.00 0.00 H new ATOM 0 HB2 GLU B 19 8.288 16.712 -8.688 1.00 0.00 H new ATOM 0 HB3 GLU B 19 9.369 18.082 -8.846 1.00 0.00 H new ATOM 0 HG2 GLU B 19 10.215 17.083 -11.005 1.00 0.00 H new ATOM 0 HG3 GLU B 19 8.987 15.840 -10.858 1.00 0.00 H new ATOM 1428 N GLN B 20 12.081 17.885 -8.784 1.00 0.00 N ATOM 1429 CA GLN B 20 13.263 18.453 -9.420 1.00 0.00 C ATOM 1430 C GLN B 20 14.549 17.821 -8.905 1.00 0.00 C ATOM 1431 O GLN B 20 15.528 17.709 -9.639 1.00 0.00 O ATOM 1432 CB GLN B 20 13.300 19.960 -9.199 1.00 0.00 C ATOM 1433 CG GLN B 20 12.027 20.654 -9.643 1.00 0.00 C ATOM 1434 CD GLN B 20 12.062 22.147 -9.413 1.00 0.00 C ATOM 1435 OE1 GLN B 20 12.732 22.637 -8.503 1.00 0.00 O ATOM 1436 NE2 GLN B 20 11.335 22.883 -10.234 1.00 0.00 N ATOM 0 H GLN B 20 11.576 18.533 -8.179 1.00 0.00 H new ATOM 0 HA GLN B 20 13.196 18.239 -10.487 1.00 0.00 H new ATOM 0 HB2 GLN B 20 13.468 20.163 -8.141 1.00 0.00 H new ATOM 0 HB3 GLN B 20 14.146 20.381 -9.743 1.00 0.00 H new ATOM 0 HG2 GLN B 20 11.863 20.458 -10.703 1.00 0.00 H new ATOM 0 HG3 GLN B 20 11.180 20.228 -9.105 1.00 0.00 H new ATOM 0 HE21 GLN B 20 10.794 22.437 -10.975 1.00 0.00 H new ATOM 0 HE22 GLN B 20 11.314 23.897 -10.127 1.00 0.00 H new ATOM 1445 N ALA B 21 14.550 17.404 -7.649 1.00 0.00 N ATOM 1446 CA ALA B 21 15.752 16.846 -7.055 1.00 0.00 C ATOM 1447 C ALA B 21 15.703 15.323 -6.991 1.00 0.00 C ATOM 1448 O ALA B 21 16.483 14.648 -7.652 1.00 0.00 O ATOM 1449 CB ALA B 21 15.975 17.432 -5.674 1.00 0.00 C ATOM 0 H ALA B 21 13.742 17.441 -7.028 1.00 0.00 H new ATOM 0 HA ALA B 21 16.592 17.115 -7.696 1.00 0.00 H new ATOM 0 HB1 ALA B 21 16.879 17.006 -5.239 1.00 0.00 H new ATOM 0 HB2 ALA B 21 16.085 18.514 -5.751 1.00 0.00 H new ATOM 0 HB3 ALA B 21 15.122 17.198 -5.037 1.00 0.00 H new ATOM 1455 N VAL B 22 14.774 14.785 -6.210 1.00 0.00 N ATOM 1456 CA VAL B 22 14.729 13.346 -5.952 1.00 0.00 C ATOM 1457 C VAL B 22 14.425 12.551 -7.223 1.00 0.00 C ATOM 1458 O VAL B 22 15.099 11.562 -7.520 1.00 0.00 O ATOM 1459 CB VAL B 22 13.687 12.999 -4.866 1.00 0.00 C ATOM 1460 CG1 VAL B 22 13.737 11.517 -4.524 1.00 0.00 C ATOM 1461 CG2 VAL B 22 13.912 13.844 -3.620 1.00 0.00 C ATOM 0 H VAL B 22 14.042 15.320 -5.744 1.00 0.00 H new ATOM 0 HA VAL B 22 15.719 13.065 -5.594 1.00 0.00 H new ATOM 0 HB VAL B 22 12.696 13.224 -5.260 1.00 0.00 H new ATOM 0 HG11 VAL B 22 12.995 11.295 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL B 22 13.522 10.930 -5.417 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.730 11.263 -4.152 1.00 0.00 H new ATOM 0 HG21 VAL B 22 13.169 13.586 -2.866 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.910 13.653 -3.226 1.00 0.00 H new ATOM 0 HG23 VAL B 22 13.819 14.900 -3.875 1.00 0.00 H new ATOM 1471 N ALA B 23 13.430 12.997 -7.985 1.00 0.00 N ATOM 1472 CA ALA B 23 13.029 12.297 -9.204 1.00 0.00 C ATOM 1473 C ALA B 23 14.047 12.495 -10.328 1.00 0.00 C ATOM 1474 O ALA B 23 13.907 11.925 -11.412 1.00 0.00 O ATOM 1475 CB ALA B 23 11.647 12.752 -9.649 1.00 0.00 C ATOM 0 H ALA B 23 12.888 13.837 -7.782 1.00 0.00 H new ATOM 0 HA ALA B 23 12.992 11.232 -8.977 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.364 12.221 -10.558 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.923 12.538 -8.863 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.663 13.824 -9.845 1.00 0.00 H new ATOM 1481 N ASN B 24 15.060 13.312 -10.072 1.00 0.00 N ATOM 1482 CA ASN B 24 16.140 13.508 -11.030 1.00 0.00 C ATOM 1483 C ASN B 24 17.438 12.901 -10.515 1.00 0.00 C ATOM 1484 O ASN B 24 18.380 12.687 -11.280 1.00 0.00 O ATOM 1485 CB ASN B 24 16.328 14.993 -11.344 1.00 0.00 C ATOM 1486 CG ASN B 24 15.317 15.500 -12.355 1.00 0.00 C ATOM 1487 OD1 ASN B 24 15.559 15.462 -13.561 1.00 0.00 O ATOM 1488 ND2 ASN B 24 14.173 15.966 -11.882 1.00 0.00 N ATOM 0 H ASN B 24 15.157 13.849 -9.210 1.00 0.00 H new ATOM 0 HA ASN B 24 15.867 12.997 -11.953 1.00 0.00 H new ATOM 0 HB2 ASN B 24 16.240 15.571 -10.424 1.00 0.00 H new ATOM 0 HB3 ASN B 24 17.335 15.156 -11.727 1.00 0.00 H new ATOM 0 HD21 ASN B 24 13.458 16.309 -12.523 1.00 0.00 H new ATOM 0 HD22 ASN B 24 14.006 15.983 -10.876 1.00 0.00 H new ATOM 1495 N ALA B 25 17.481 12.625 -9.215 1.00 0.00 N ATOM 1496 CA ALA B 25 18.629 11.970 -8.606 1.00 0.00 C ATOM 1497 C ALA B 25 18.712 10.528 -9.075 1.00 0.00 C ATOM 1498 O ALA B 25 19.779 10.042 -9.456 1.00 0.00 O ATOM 1499 CB ALA B 25 18.540 12.036 -7.088 1.00 0.00 C ATOM 0 H ALA B 25 16.729 12.847 -8.562 1.00 0.00 H new ATOM 0 HA ALA B 25 19.535 12.491 -8.915 1.00 0.00 H new ATOM 0 HB1 ALA B 25 19.407 11.541 -6.651 1.00 0.00 H new ATOM 0 HB2 ALA B 25 18.518 13.078 -6.770 1.00 0.00 H new ATOM 0 HB3 ALA B 25 17.631 11.536 -6.755 1.00 0.00 H new ATOM 1505 N ILE B 26 17.577 9.849 -9.045 1.00 0.00 N ATOM 1506 CA ILE B 26 17.484 8.509 -9.591 1.00 0.00 C ATOM 1507 C ILE B 26 17.317 8.604 -11.101 1.00 0.00 C ATOM 1508 O ILE B 26 16.294 9.082 -11.593 1.00 0.00 O ATOM 1509 CB ILE B 26 16.311 7.719 -8.975 1.00 0.00 C ATOM 1510 CG1 ILE B 26 16.483 7.625 -7.456 1.00 0.00 C ATOM 1511 CG2 ILE B 26 16.222 6.329 -9.594 1.00 0.00 C ATOM 1512 CD1 ILE B 26 15.359 6.891 -6.760 1.00 0.00 C ATOM 0 H ILE B 26 16.708 10.206 -8.648 1.00 0.00 H new ATOM 0 HA ILE B 26 18.399 7.970 -9.346 1.00 0.00 H new ATOM 0 HB ILE B 26 15.381 8.246 -9.188 1.00 0.00 H new ATOM 0 HG12 ILE B 26 17.424 7.121 -7.237 1.00 0.00 H new ATOM 0 HG13 ILE B 26 16.557 8.632 -7.045 1.00 0.00 H new ATOM 0 HG21 ILE B 26 15.389 5.785 -9.148 1.00 0.00 H new ATOM 0 HG22 ILE B 26 16.063 6.419 -10.669 1.00 0.00 H new ATOM 0 HG23 ILE B 26 17.150 5.788 -9.408 1.00 0.00 H new ATOM 0 HD11 ILE B 26 15.551 6.865 -5.687 1.00 0.00 H new ATOM 0 HD12 ILE B 26 14.417 7.406 -6.948 1.00 0.00 H new ATOM 0 HD13 ILE B 26 15.298 5.872 -7.142 1.00 0.00 H new ATOM 1524 N ASP B 27 18.338 8.175 -11.825 1.00 0.00 N ATOM 1525 CA ASP B 27 18.382 8.363 -13.269 1.00 0.00 C ATOM 1526 C ASP B 27 17.331 7.505 -13.971 1.00 0.00 C ATOM 1527 O ASP B 27 17.274 6.290 -13.765 1.00 0.00 O ATOM 1528 CB ASP B 27 19.774 8.029 -13.801 1.00 0.00 C ATOM 1529 CG ASP B 27 19.991 8.558 -15.201 1.00 0.00 C ATOM 1530 OD1 ASP B 27 19.622 7.865 -16.169 1.00 0.00 O ATOM 1531 OD2 ASP B 27 20.535 9.676 -15.338 1.00 0.00 O ATOM 0 H ASP B 27 19.149 7.693 -11.437 1.00 0.00 H new ATOM 0 HA ASP B 27 18.160 9.409 -13.480 1.00 0.00 H new ATOM 0 HB2 ASP B 27 20.527 8.450 -13.134 1.00 0.00 H new ATOM 0 HB3 ASP B 27 19.913 6.948 -13.797 1.00 0.00 H new ATOM 1536 N PRO B 28 16.489 8.130 -14.815 1.00 0.00 N ATOM 1537 CA PRO B 28 15.404 7.438 -15.529 1.00 0.00 C ATOM 1538 C PRO B 28 15.909 6.406 -16.535 1.00 0.00 C ATOM 1539 O PRO B 28 15.145 5.561 -17.002 1.00 0.00 O ATOM 1540 CB PRO B 28 14.665 8.567 -16.261 1.00 0.00 C ATOM 1541 CG PRO B 28 15.110 9.825 -15.598 1.00 0.00 C ATOM 1542 CD PRO B 28 16.510 9.567 -15.128 1.00 0.00 C ATOM 0 HA PRO B 28 14.779 6.874 -14.836 1.00 0.00 H new ATOM 0 HB2 PRO B 28 14.911 8.574 -17.323 1.00 0.00 H new ATOM 0 HB3 PRO B 28 13.585 8.444 -16.185 1.00 0.00 H new ATOM 0 HG2 PRO B 28 15.079 10.665 -16.292 1.00 0.00 H new ATOM 0 HG3 PRO B 28 14.458 10.078 -14.762 1.00 0.00 H new ATOM 0 HD2 PRO B 28 17.245 9.803 -15.898 1.00 0.00 H new ATOM 0 HD3 PRO B 28 16.760 10.168 -14.254 1.00 0.00 H new ATOM 1550 N SER B 29 17.188 6.473 -16.876 1.00 0.00 N ATOM 1551 CA SER B 29 17.775 5.504 -17.790 1.00 0.00 C ATOM 1552 C SER B 29 18.293 4.309 -17.001 1.00 0.00 C ATOM 1553 O SER B 29 18.561 3.243 -17.554 1.00 0.00 O ATOM 1554 CB SER B 29 18.919 6.139 -18.581 1.00 0.00 C ATOM 1555 OG SER B 29 18.734 7.540 -18.711 1.00 0.00 O ATOM 0 H SER B 29 17.836 7.184 -16.536 1.00 0.00 H new ATOM 0 HA SER B 29 17.010 5.173 -18.492 1.00 0.00 H new ATOM 0 HB2 SER B 29 19.866 5.939 -18.080 1.00 0.00 H new ATOM 0 HB3 SER B 29 18.979 5.684 -19.570 1.00 0.00 H new ATOM 0 HG SER B 29 19.036 7.987 -17.893 1.00 0.00 H new ATOM 1561 N LYS B 30 18.418 4.500 -15.695 1.00 0.00 N ATOM 1562 CA LYS B 30 18.955 3.478 -14.815 1.00 0.00 C ATOM 1563 C LYS B 30 17.819 2.737 -14.114 1.00 0.00 C ATOM 1564 O LYS B 30 17.900 1.533 -13.876 1.00 0.00 O ATOM 1565 CB LYS B 30 19.888 4.122 -13.785 1.00 0.00 C ATOM 1566 CG LYS B 30 20.757 3.131 -13.031 1.00 0.00 C ATOM 1567 CD LYS B 30 21.575 3.826 -11.951 1.00 0.00 C ATOM 1568 CE LYS B 30 22.504 2.854 -11.243 1.00 0.00 C ATOM 1569 NZ LYS B 30 23.611 2.406 -12.127 1.00 0.00 N ATOM 0 H LYS B 30 18.151 5.363 -15.221 1.00 0.00 H new ATOM 0 HA LYS B 30 19.523 2.759 -15.406 1.00 0.00 H new ATOM 0 HB2 LYS B 30 20.532 4.840 -14.293 1.00 0.00 H new ATOM 0 HB3 LYS B 30 19.288 4.682 -13.068 1.00 0.00 H new ATOM 0 HG2 LYS B 30 20.129 2.364 -12.578 1.00 0.00 H new ATOM 0 HG3 LYS B 30 21.425 2.625 -13.728 1.00 0.00 H new ATOM 0 HD2 LYS B 30 22.160 4.630 -12.397 1.00 0.00 H new ATOM 0 HD3 LYS B 30 20.905 4.285 -11.224 1.00 0.00 H new ATOM 0 HE2 LYS B 30 22.918 3.329 -10.354 1.00 0.00 H new ATOM 0 HE3 LYS B 30 21.935 1.988 -10.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 24.233 1.757 -11.603 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 23.217 1.915 -12.955 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 24.159 3.232 -12.442 1.00 0.00 H new ATOM 1583 N TYR B 31 16.763 3.471 -13.780 1.00 0.00 N ATOM 1584 CA TYR B 31 15.590 2.892 -13.137 1.00 0.00 C ATOM 1585 C TYR B 31 14.318 3.448 -13.763 1.00 0.00 C ATOM 1586 O TYR B 31 14.335 4.506 -14.388 1.00 0.00 O ATOM 1587 CB TYR B 31 15.596 3.177 -11.631 1.00 0.00 C ATOM 1588 CG TYR B 31 16.731 2.513 -10.883 1.00 0.00 C ATOM 1589 CD1 TYR B 31 16.604 1.220 -10.395 1.00 0.00 C ATOM 1590 CD2 TYR B 31 17.927 3.179 -10.660 1.00 0.00 C ATOM 1591 CE1 TYR B 31 17.636 0.610 -9.709 1.00 0.00 C ATOM 1592 CE2 TYR B 31 18.963 2.575 -9.978 1.00 0.00 C ATOM 1593 CZ TYR B 31 18.813 1.293 -9.503 1.00 0.00 C ATOM 1594 OH TYR B 31 19.846 0.692 -8.818 1.00 0.00 O ATOM 0 H TYR B 31 16.696 4.475 -13.946 1.00 0.00 H new ATOM 0 HA TYR B 31 15.620 1.813 -13.285 1.00 0.00 H new ATOM 0 HB2 TYR B 31 15.654 4.254 -11.476 1.00 0.00 H new ATOM 0 HB3 TYR B 31 14.650 2.844 -11.205 1.00 0.00 H new ATOM 0 HD1 TYR B 31 15.682 0.681 -10.555 1.00 0.00 H new ATOM 0 HD2 TYR B 31 18.049 4.188 -11.026 1.00 0.00 H new ATOM 0 HE1 TYR B 31 17.520 -0.397 -9.336 1.00 0.00 H new ATOM 0 HE2 TYR B 31 19.889 3.107 -9.818 1.00 0.00 H new ATOM 0 HH TYR B 31 20.508 1.369 -8.565 1.00 0.00 H new ATOM 1604 N THR B 32 13.215 2.740 -13.582 1.00 0.00 N ATOM 1605 CA THR B 32 11.947 3.146 -14.168 1.00 0.00 C ATOM 1606 C THR B 32 11.121 3.938 -13.160 1.00 0.00 C ATOM 1607 O THR B 32 10.569 3.372 -12.218 1.00 0.00 O ATOM 1608 CB THR B 32 11.138 1.923 -14.643 1.00 0.00 C ATOM 1609 OG1 THR B 32 11.936 1.123 -15.527 1.00 0.00 O ATOM 1610 CG2 THR B 32 9.863 2.353 -15.357 1.00 0.00 C ATOM 0 H THR B 32 13.172 1.881 -13.034 1.00 0.00 H new ATOM 0 HA THR B 32 12.169 3.776 -15.029 1.00 0.00 H new ATOM 0 HB THR B 32 10.862 1.338 -13.766 1.00 0.00 H new ATOM 0 HG1 THR B 32 12.423 0.449 -15.008 1.00 0.00 H new ATOM 0 HG21 THR B 32 9.312 1.470 -15.681 1.00 0.00 H new ATOM 0 HG22 THR B 32 9.244 2.937 -14.676 1.00 0.00 H new ATOM 0 HG23 THR B 32 10.119 2.960 -16.225 1.00 0.00 H new ATOM 1618 N VAL B 33 11.053 5.246 -13.352 1.00 0.00 N ATOM 1619 CA VAL B 33 10.301 6.110 -12.455 1.00 0.00 C ATOM 1620 C VAL B 33 8.909 6.386 -13.016 1.00 0.00 C ATOM 1621 O VAL B 33 8.763 7.054 -14.039 1.00 0.00 O ATOM 1622 CB VAL B 33 11.031 7.450 -12.214 1.00 0.00 C ATOM 1623 CG1 VAL B 33 10.263 8.316 -11.225 1.00 0.00 C ATOM 1624 CG2 VAL B 33 12.452 7.207 -11.725 1.00 0.00 C ATOM 0 H VAL B 33 11.510 5.734 -14.122 1.00 0.00 H new ATOM 0 HA VAL B 33 10.212 5.587 -11.503 1.00 0.00 H new ATOM 0 HB VAL B 33 11.082 7.984 -13.163 1.00 0.00 H new ATOM 0 HG11 VAL B 33 10.797 9.254 -11.072 1.00 0.00 H new ATOM 0 HG12 VAL B 33 9.269 8.525 -11.620 1.00 0.00 H new ATOM 0 HG13 VAL B 33 10.173 7.790 -10.274 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.949 8.163 -11.561 1.00 0.00 H new ATOM 0 HG22 VAL B 33 12.424 6.648 -10.790 1.00 0.00 H new ATOM 0 HG23 VAL B 33 13.002 6.636 -12.473 1.00 0.00 H new ATOM 1634 N GLU B 34 7.895 5.857 -12.349 1.00 0.00 N ATOM 1635 CA GLU B 34 6.512 6.063 -12.756 1.00 0.00 C ATOM 1636 C GLU B 34 5.827 7.001 -11.768 1.00 0.00 C ATOM 1637 O GLU B 34 5.806 6.736 -10.569 1.00 0.00 O ATOM 1638 CB GLU B 34 5.777 4.719 -12.831 1.00 0.00 C ATOM 1639 CG GLU B 34 4.372 4.816 -13.406 1.00 0.00 C ATOM 1640 CD GLU B 34 3.732 3.457 -13.610 1.00 0.00 C ATOM 1641 OE1 GLU B 34 4.173 2.719 -14.517 1.00 0.00 O ATOM 1642 OE2 GLU B 34 2.779 3.121 -12.877 1.00 0.00 O ATOM 0 H GLU B 34 8.005 5.277 -11.517 1.00 0.00 H new ATOM 0 HA GLU B 34 6.488 6.517 -13.747 1.00 0.00 H new ATOM 0 HB2 GLU B 34 6.362 4.030 -13.440 1.00 0.00 H new ATOM 0 HB3 GLU B 34 5.721 4.290 -11.830 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.750 5.410 -12.737 1.00 0.00 H new ATOM 0 HG3 GLU B 34 4.409 5.343 -14.359 1.00 0.00 H new ATOM 1649 N ILE B 35 5.288 8.103 -12.263 1.00 0.00 N ATOM 1650 CA ILE B 35 4.704 9.115 -11.395 1.00 0.00 C ATOM 1651 C ILE B 35 3.180 9.022 -11.388 1.00 0.00 C ATOM 1652 O ILE B 35 2.542 9.020 -12.440 1.00 0.00 O ATOM 1653 CB ILE B 35 5.140 10.533 -11.825 1.00 0.00 C ATOM 1654 CG1 ILE B 35 6.668 10.657 -11.762 1.00 0.00 C ATOM 1655 CG2 ILE B 35 4.481 11.588 -10.948 1.00 0.00 C ATOM 1656 CD1 ILE B 35 7.194 12.013 -12.184 1.00 0.00 C ATOM 0 H ILE B 35 5.242 8.320 -13.259 1.00 0.00 H new ATOM 0 HA ILE B 35 5.069 8.927 -10.385 1.00 0.00 H new ATOM 0 HB ILE B 35 4.818 10.698 -12.853 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.997 10.452 -10.743 1.00 0.00 H new ATOM 0 HG13 ILE B 35 7.111 9.892 -12.400 1.00 0.00 H new ATOM 0 HG21 ILE B 35 4.802 12.579 -11.268 1.00 0.00 H new ATOM 0 HG22 ILE B 35 3.397 11.511 -11.038 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.771 11.431 -9.909 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.282 12.020 -12.112 1.00 0.00 H new ATOM 0 HD12 ILE B 35 6.897 12.214 -13.213 1.00 0.00 H new ATOM 0 HD13 ILE B 35 6.782 12.782 -11.531 1.00 0.00 H new ATOM 1668 N VAL B 36 2.608 8.941 -10.192 1.00 0.00 N ATOM 1669 CA VAL B 36 1.165 8.840 -10.030 1.00 0.00 C ATOM 1670 C VAL B 36 0.645 9.978 -9.154 1.00 0.00 C ATOM 1671 O VAL B 36 1.198 10.260 -8.086 1.00 0.00 O ATOM 1672 CB VAL B 36 0.758 7.484 -9.406 1.00 0.00 C ATOM 1673 CG1 VAL B 36 -0.753 7.385 -9.248 1.00 0.00 C ATOM 1674 CG2 VAL B 36 1.278 6.327 -10.245 1.00 0.00 C ATOM 0 H VAL B 36 3.128 8.944 -9.314 1.00 0.00 H new ATOM 0 HA VAL B 36 0.720 8.911 -11.023 1.00 0.00 H new ATOM 0 HB VAL B 36 1.209 7.425 -8.415 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -1.010 6.422 -8.807 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -1.104 8.187 -8.599 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -1.228 7.475 -10.225 1.00 0.00 H new ATOM 0 HG21 VAL B 36 0.980 5.383 -9.788 1.00 0.00 H new ATOM 0 HG22 VAL B 36 0.861 6.391 -11.250 1.00 0.00 H new ATOM 0 HG23 VAL B 36 2.366 6.377 -10.299 1.00 0.00 H new ATOM 1684 N HIS B 37 -0.414 10.631 -9.611 1.00 0.00 N ATOM 1685 CA HIS B 37 -1.007 11.737 -8.875 1.00 0.00 C ATOM 1686 C HIS B 37 -2.028 11.210 -7.870 1.00 0.00 C ATOM 1687 O HIS B 37 -3.058 10.650 -8.248 1.00 0.00 O ATOM 1688 CB HIS B 37 -1.679 12.713 -9.841 1.00 0.00 C ATOM 1689 CG HIS B 37 -1.886 14.083 -9.272 1.00 0.00 C ATOM 1690 ND1 HIS B 37 -2.922 14.366 -8.415 1.00 0.00 N ATOM 1691 CD2 HIS B 37 -1.169 15.210 -9.483 1.00 0.00 C ATOM 1692 CE1 HIS B 37 -2.809 15.652 -8.129 1.00 0.00 C ATOM 1693 NE2 HIS B 37 -1.762 16.205 -8.754 1.00 0.00 N ATOM 0 H HIS B 37 -0.881 10.413 -10.491 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.219 12.262 -8.336 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.072 12.793 -10.743 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -2.644 12.305 -10.141 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -0.294 15.307 -10.109 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -3.478 16.189 -7.473 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -1.464 17.179 -8.698 1.00 0.00 H new ATOM 1701 N LEU B 38 -1.736 11.387 -6.592 1.00 0.00 N ATOM 1702 CA LEU B 38 -2.605 10.892 -5.534 1.00 0.00 C ATOM 1703 C LEU B 38 -3.291 12.059 -4.826 1.00 0.00 C ATOM 1704 O LEU B 38 -3.888 11.903 -3.763 1.00 0.00 O ATOM 1705 CB LEU B 38 -1.789 10.048 -4.545 1.00 0.00 C ATOM 1706 CG LEU B 38 -2.599 9.322 -3.466 1.00 0.00 C ATOM 1707 CD1 LEU B 38 -3.677 8.462 -4.099 1.00 0.00 C ATOM 1708 CD2 LEU B 38 -1.688 8.471 -2.595 1.00 0.00 C ATOM 0 H LEU B 38 -0.902 11.871 -6.260 1.00 0.00 H new ATOM 0 HA LEU B 38 -3.380 10.260 -5.968 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -1.223 9.307 -5.109 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -1.064 10.697 -4.054 1.00 0.00 H new ATOM 0 HG LEU B 38 -3.078 10.071 -2.836 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -4.242 7.954 -3.318 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -4.349 9.092 -4.682 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -3.215 7.722 -4.752 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.282 7.963 -1.835 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -1.181 7.731 -3.214 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -0.948 9.108 -2.111 1.00 0.00 H new ATOM 1720 N GLY B 39 -3.225 13.229 -5.442 1.00 0.00 N ATOM 1721 CA GLY B 39 -3.832 14.406 -4.856 1.00 0.00 C ATOM 1722 C GLY B 39 -5.087 14.829 -5.588 1.00 0.00 C ATOM 1723 O GLY B 39 -5.404 16.016 -5.659 1.00 0.00 O ATOM 0 H GLY B 39 -2.762 13.385 -6.337 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -4.073 14.206 -3.812 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -3.114 15.226 -4.866 1.00 0.00 H new ATOM 1727 N THR B 40 -5.793 13.863 -6.154 1.00 0.00 N ATOM 1728 CA THR B 40 -7.031 14.141 -6.865 1.00 0.00 C ATOM 1729 C THR B 40 -7.953 12.926 -6.860 1.00 0.00 C ATOM 1730 O THR B 40 -9.112 13.022 -6.458 1.00 0.00 O ATOM 1731 CB THR B 40 -6.764 14.575 -8.323 1.00 0.00 C ATOM 1732 OG1 THR B 40 -6.031 15.807 -8.341 1.00 0.00 O ATOM 1733 CG2 THR B 40 -8.066 14.751 -9.091 1.00 0.00 C ATOM 0 H THR B 40 -5.529 12.878 -6.135 1.00 0.00 H new ATOM 0 HA THR B 40 -7.519 14.962 -6.340 1.00 0.00 H new ATOM 0 HB THR B 40 -6.180 13.791 -8.805 1.00 0.00 H new ATOM 0 HG1 THR B 40 -5.857 16.098 -7.421 1.00 0.00 H new ATOM 0 HG21 THR B 40 -7.847 15.057 -10.114 1.00 0.00 H new ATOM 0 HG22 THR B 40 -8.612 13.807 -9.103 1.00 0.00 H new ATOM 0 HG23 THR B 40 -8.674 15.515 -8.606 1.00 0.00 H new ATOM 1741 N ASP B 41 -7.440 11.785 -7.299 1.00 0.00 N ATOM 1742 CA ASP B 41 -8.256 10.581 -7.389 1.00 0.00 C ATOM 1743 C ASP B 41 -8.234 9.812 -6.079 1.00 0.00 C ATOM 1744 O ASP B 41 -7.217 9.226 -5.707 1.00 0.00 O ATOM 1745 CB ASP B 41 -7.780 9.674 -8.526 1.00 0.00 C ATOM 1746 CG ASP B 41 -7.822 10.352 -9.878 1.00 0.00 C ATOM 1747 OD1 ASP B 41 -8.932 10.575 -10.408 1.00 0.00 O ATOM 1748 OD2 ASP B 41 -6.743 10.666 -10.419 1.00 0.00 O ATOM 0 H ASP B 41 -6.471 11.667 -7.596 1.00 0.00 H new ATOM 0 HA ASP B 41 -9.278 10.896 -7.598 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.761 9.347 -8.321 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -8.402 8.779 -8.555 1.00 0.00 H new ATOM 1753 N LYS B 42 -9.367 9.807 -5.392 1.00 0.00 N ATOM 1754 CA LYS B 42 -9.507 9.089 -4.132 1.00 0.00 C ATOM 1755 C LYS B 42 -9.457 7.585 -4.372 1.00 0.00 C ATOM 1756 O LYS B 42 -9.151 6.805 -3.470 1.00 0.00 O ATOM 1757 CB LYS B 42 -10.823 9.470 -3.452 1.00 0.00 C ATOM 1758 CG LYS B 42 -10.870 10.910 -2.966 1.00 0.00 C ATOM 1759 CD LYS B 42 -12.280 11.310 -2.566 1.00 0.00 C ATOM 1760 CE LYS B 42 -12.322 12.690 -1.925 1.00 0.00 C ATOM 1761 NZ LYS B 42 -11.610 13.713 -2.737 1.00 0.00 N ATOM 0 H LYS B 42 -10.211 10.297 -5.689 1.00 0.00 H new ATOM 0 HA LYS B 42 -8.680 9.366 -3.479 1.00 0.00 H new ATOM 0 HB2 LYS B 42 -11.643 9.306 -4.151 1.00 0.00 H new ATOM 0 HB3 LYS B 42 -10.989 8.805 -2.604 1.00 0.00 H new ATOM 0 HG2 LYS B 42 -10.200 11.031 -2.115 1.00 0.00 H new ATOM 0 HG3 LYS B 42 -10.510 11.574 -3.752 1.00 0.00 H new ATOM 0 HD2 LYS B 42 -12.923 11.300 -3.446 1.00 0.00 H new ATOM 0 HD3 LYS B 42 -12.681 10.574 -1.869 1.00 0.00 H new ATOM 0 HE2 LYS B 42 -13.360 12.994 -1.791 1.00 0.00 H new ATOM 0 HE3 LYS B 42 -11.874 12.641 -0.933 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 -11.834 14.662 -2.374 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 -10.584 13.552 -2.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 -11.913 13.641 -3.729 1.00 0.00 H new ATOM 1775 N ALA B 43 -9.751 7.190 -5.604 1.00 0.00 N ATOM 1776 CA ALA B 43 -9.715 5.790 -5.997 1.00 0.00 C ATOM 1777 C ALA B 43 -8.295 5.238 -5.940 1.00 0.00 C ATOM 1778 O ALA B 43 -8.089 4.042 -5.732 1.00 0.00 O ATOM 1779 CB ALA B 43 -10.296 5.623 -7.392 1.00 0.00 C ATOM 0 H ALA B 43 -10.019 7.827 -6.354 1.00 0.00 H new ATOM 0 HA ALA B 43 -10.322 5.222 -5.291 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -10.264 4.571 -7.676 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -11.329 5.970 -7.400 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -9.712 6.208 -8.102 1.00 0.00 H new ATOM 1785 N ARG B 44 -7.311 6.116 -6.102 1.00 0.00 N ATOM 1786 CA ARG B 44 -5.919 5.692 -6.080 1.00 0.00 C ATOM 1787 C ARG B 44 -5.440 5.531 -4.645 1.00 0.00 C ATOM 1788 O ARG B 44 -4.402 4.924 -4.390 1.00 0.00 O ATOM 1789 CB ARG B 44 -5.022 6.685 -6.823 1.00 0.00 C ATOM 1790 CG ARG B 44 -5.494 7.003 -8.229 1.00 0.00 C ATOM 1791 CD ARG B 44 -4.454 7.801 -8.995 1.00 0.00 C ATOM 1792 NE ARG B 44 -5.029 8.470 -10.161 1.00 0.00 N ATOM 1793 CZ ARG B 44 -5.025 7.975 -11.394 1.00 0.00 C ATOM 1794 NH1 ARG B 44 -4.509 6.780 -11.646 1.00 0.00 N ATOM 1795 NH2 ARG B 44 -5.557 8.673 -12.382 1.00 0.00 N ATOM 0 H ARG B 44 -7.451 7.116 -6.249 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.855 4.731 -6.590 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -4.968 7.611 -6.250 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -4.011 6.281 -6.872 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -5.708 6.076 -8.761 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -6.426 7.567 -8.183 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -4.007 8.544 -8.334 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -3.652 7.137 -9.317 1.00 0.00 H new ATOM 0 HE ARG B 44 -5.464 9.381 -10.018 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -4.108 6.228 -10.888 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -4.513 6.413 -12.598 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -5.968 9.588 -12.196 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -5.556 8.297 -13.330 1.00 0.00 H new ATOM 1809 N ILE B 45 -6.207 6.077 -3.707 1.00 0.00 N ATOM 1810 CA ILE B 45 -5.888 5.949 -2.292 1.00 0.00 C ATOM 1811 C ILE B 45 -5.990 4.488 -1.870 1.00 0.00 C ATOM 1812 O ILE B 45 -5.175 3.994 -1.092 1.00 0.00 O ATOM 1813 CB ILE B 45 -6.818 6.819 -1.415 1.00 0.00 C ATOM 1814 CG1 ILE B 45 -6.646 8.300 -1.764 1.00 0.00 C ATOM 1815 CG2 ILE B 45 -6.543 6.584 0.063 1.00 0.00 C ATOM 1816 CD1 ILE B 45 -7.557 9.224 -0.982 1.00 0.00 C ATOM 0 H ILE B 45 -7.053 6.612 -3.902 1.00 0.00 H new ATOM 0 HA ILE B 45 -4.868 6.303 -2.145 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.849 6.531 -1.618 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.610 8.588 -1.583 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -6.834 8.437 -2.829 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -7.209 7.207 0.660 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.715 5.535 0.303 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -5.508 6.842 0.286 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -7.376 10.255 -1.285 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -8.597 8.964 -1.181 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -7.355 9.118 0.084 1.00 0.00 H new ATOM 1828 N ALA B 46 -6.981 3.794 -2.418 1.00 0.00 N ATOM 1829 CA ALA B 46 -7.147 2.369 -2.167 1.00 0.00 C ATOM 1830 C ALA B 46 -5.936 1.594 -2.679 1.00 0.00 C ATOM 1831 O ALA B 46 -5.496 0.628 -2.059 1.00 0.00 O ATOM 1832 CB ALA B 46 -8.423 1.861 -2.820 1.00 0.00 C ATOM 0 H ALA B 46 -7.682 4.197 -3.040 1.00 0.00 H new ATOM 0 HA ALA B 46 -7.225 2.212 -1.091 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -8.533 0.795 -2.623 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -9.280 2.396 -2.410 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -8.373 2.028 -3.896 1.00 0.00 H new ATOM 1838 N GLU B 47 -5.395 2.040 -3.808 1.00 0.00 N ATOM 1839 CA GLU B 47 -4.193 1.440 -4.378 1.00 0.00 C ATOM 1840 C GLU B 47 -2.982 1.750 -3.507 1.00 0.00 C ATOM 1841 O GLU B 47 -2.116 0.900 -3.297 1.00 0.00 O ATOM 1842 CB GLU B 47 -3.961 1.965 -5.793 1.00 0.00 C ATOM 1843 CG GLU B 47 -5.094 1.651 -6.752 1.00 0.00 C ATOM 1844 CD GLU B 47 -4.921 2.338 -8.086 1.00 0.00 C ATOM 1845 OE1 GLU B 47 -5.406 3.476 -8.235 1.00 0.00 O ATOM 1846 OE2 GLU B 47 -4.297 1.747 -8.991 1.00 0.00 O ATOM 0 H GLU B 47 -5.772 2.818 -4.349 1.00 0.00 H new ATOM 0 HA GLU B 47 -4.332 0.360 -4.418 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -3.820 3.045 -5.752 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -3.037 1.538 -6.183 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -5.150 0.573 -6.905 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -6.040 1.959 -6.307 1.00 0.00 H new ATOM 1853 N ALA B 48 -2.937 2.970 -2.992 1.00 0.00 N ATOM 1854 CA ALA B 48 -1.863 3.391 -2.105 1.00 0.00 C ATOM 1855 C ALA B 48 -1.837 2.534 -0.844 1.00 0.00 C ATOM 1856 O ALA B 48 -0.769 2.181 -0.342 1.00 0.00 O ATOM 1857 CB ALA B 48 -2.019 4.861 -1.749 1.00 0.00 C ATOM 0 H ALA B 48 -3.637 3.689 -3.175 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.914 3.258 -2.625 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -1.209 5.163 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -1.985 5.461 -2.658 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -2.975 5.015 -1.248 1.00 0.00 H new ATOM 1863 N GLU B 49 -3.019 2.180 -0.352 1.00 0.00 N ATOM 1864 CA GLU B 49 -3.134 1.349 0.840 1.00 0.00 C ATOM 1865 C GLU B 49 -2.774 -0.103 0.534 1.00 0.00 C ATOM 1866 O GLU B 49 -2.573 -0.908 1.442 1.00 0.00 O ATOM 1867 CB GLU B 49 -4.546 1.439 1.421 1.00 0.00 C ATOM 1868 CG GLU B 49 -4.959 2.860 1.761 1.00 0.00 C ATOM 1869 CD GLU B 49 -6.193 2.927 2.632 1.00 0.00 C ATOM 1870 OE1 GLU B 49 -7.319 2.884 2.097 1.00 0.00 O ATOM 1871 OE2 GLU B 49 -6.038 3.042 3.866 1.00 0.00 O ATOM 0 H GLU B 49 -3.912 2.456 -0.761 1.00 0.00 H new ATOM 0 HA GLU B 49 -2.428 1.723 1.581 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.255 1.022 0.705 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.603 0.825 2.320 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -4.135 3.360 2.270 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.143 3.409 0.838 1.00 0.00 H new ATOM 1878 N LYS B 50 -2.696 -0.435 -0.751 1.00 0.00 N ATOM 1879 CA LYS B 50 -2.257 -1.760 -1.173 1.00 0.00 C ATOM 1880 C LYS B 50 -0.740 -1.859 -1.077 1.00 0.00 C ATOM 1881 O LYS B 50 -0.196 -2.866 -0.619 1.00 0.00 O ATOM 1882 CB LYS B 50 -2.701 -2.047 -2.610 1.00 0.00 C ATOM 1883 CG LYS B 50 -4.207 -2.104 -2.795 1.00 0.00 C ATOM 1884 CD LYS B 50 -4.581 -2.195 -4.265 1.00 0.00 C ATOM 1885 CE LYS B 50 -6.085 -2.311 -4.456 1.00 0.00 C ATOM 1886 NZ LYS B 50 -6.616 -3.595 -3.929 1.00 0.00 N ATOM 0 H LYS B 50 -2.931 0.195 -1.518 1.00 0.00 H new ATOM 0 HA LYS B 50 -2.713 -2.499 -0.513 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -2.294 -1.276 -3.265 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -2.271 -2.996 -2.929 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -4.608 -2.966 -2.262 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -4.663 -1.217 -2.356 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -4.215 -1.312 -4.789 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -4.089 -3.059 -4.713 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -6.579 -1.480 -3.952 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -6.323 -2.228 -5.516 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -7.595 -3.726 -4.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -6.028 -4.381 -4.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -6.597 -3.578 -2.889 1.00 0.00 H new ATOM 1900 N ALA B 51 -0.064 -0.801 -1.509 1.00 0.00 N ATOM 1901 CA ALA B 51 1.390 -0.748 -1.463 1.00 0.00 C ATOM 1902 C ALA B 51 1.880 -0.435 -0.053 1.00 0.00 C ATOM 1903 O ALA B 51 2.971 -0.844 0.342 1.00 0.00 O ATOM 1904 CB ALA B 51 1.911 0.286 -2.451 1.00 0.00 C ATOM 0 H ALA B 51 -0.503 0.034 -1.896 1.00 0.00 H new ATOM 0 HA ALA B 51 1.777 -1.727 -1.744 1.00 0.00 H new ATOM 0 HB1 ALA B 51 3.000 0.316 -2.406 1.00 0.00 H new ATOM 0 HB2 ALA B 51 1.596 0.017 -3.459 1.00 0.00 H new ATOM 0 HB3 ALA B 51 1.511 1.267 -2.196 1.00 0.00 H new ATOM 1910 N GLY B 52 1.064 0.286 0.702 1.00 0.00 N ATOM 1911 CA GLY B 52 1.423 0.628 2.065 1.00 0.00 C ATOM 1912 C GLY B 52 1.865 2.071 2.198 1.00 0.00 C ATOM 1913 O GLY B 52 2.635 2.414 3.094 1.00 0.00 O ATOM 0 H GLY B 52 0.158 0.641 0.396 1.00 0.00 H new ATOM 0 HA2 GLY B 52 0.569 0.450 2.719 1.00 0.00 H new ATOM 0 HA3 GLY B 52 2.225 -0.028 2.403 1.00 0.00 H new ATOM 1917 N VAL B 53 1.373 2.919 1.304 1.00 0.00 N ATOM 1918 CA VAL B 53 1.729 4.330 1.304 1.00 0.00 C ATOM 1919 C VAL B 53 0.991 5.060 2.420 1.00 0.00 C ATOM 1920 O VAL B 53 -0.230 4.955 2.537 1.00 0.00 O ATOM 1921 CB VAL B 53 1.396 4.990 -0.051 1.00 0.00 C ATOM 1922 CG1 VAL B 53 1.858 6.439 -0.082 1.00 0.00 C ATOM 1923 CG2 VAL B 53 2.019 4.204 -1.194 1.00 0.00 C ATOM 0 H VAL B 53 0.722 2.651 0.566 1.00 0.00 H new ATOM 0 HA VAL B 53 2.804 4.402 1.470 1.00 0.00 H new ATOM 0 HB VAL B 53 0.313 4.981 -0.174 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.611 6.879 -1.048 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.358 6.997 0.710 1.00 0.00 H new ATOM 0 HG13 VAL B 53 2.937 6.480 0.070 1.00 0.00 H new ATOM 0 HG21 VAL B 53 1.774 4.684 -2.142 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.102 4.178 -1.070 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.629 3.186 -1.191 1.00 0.00 H new ATOM 1933 N LYS B 54 1.733 5.780 3.249 1.00 0.00 N ATOM 1934 CA LYS B 54 1.139 6.501 4.367 1.00 0.00 C ATOM 1935 C LYS B 54 1.096 8.000 4.110 1.00 0.00 C ATOM 1936 O LYS B 54 0.386 8.733 4.798 1.00 0.00 O ATOM 1937 CB LYS B 54 1.907 6.223 5.661 1.00 0.00 C ATOM 1938 CG LYS B 54 1.745 4.803 6.169 1.00 0.00 C ATOM 1939 CD LYS B 54 2.408 4.614 7.521 1.00 0.00 C ATOM 1940 CE LYS B 54 2.023 3.281 8.136 1.00 0.00 C ATOM 1941 NZ LYS B 54 0.568 3.209 8.445 1.00 0.00 N ATOM 0 H LYS B 54 2.745 5.881 3.170 1.00 0.00 H new ATOM 0 HA LYS B 54 0.115 6.142 4.472 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.966 6.422 5.495 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.569 6.916 6.431 1.00 0.00 H new ATOM 0 HG2 LYS B 54 0.685 4.562 6.246 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.178 4.107 5.450 1.00 0.00 H new ATOM 0 HD2 LYS B 54 3.491 4.667 7.409 1.00 0.00 H new ATOM 0 HD3 LYS B 54 2.116 5.424 8.189 1.00 0.00 H new ATOM 0 HE2 LYS B 54 2.289 2.476 7.451 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.596 3.124 9.050 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 0.401 2.473 9.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.245 4.127 8.811 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.040 2.976 7.580 1.00 0.00 H new ATOM 1955 N SER B 55 1.867 8.469 3.141 1.00 0.00 N ATOM 1956 CA SER B 55 1.876 9.888 2.814 1.00 0.00 C ATOM 1957 C SER B 55 2.236 10.125 1.349 1.00 0.00 C ATOM 1958 O SER B 55 2.985 9.353 0.754 1.00 0.00 O ATOM 1959 CB SER B 55 2.870 10.628 3.721 1.00 0.00 C ATOM 1960 OG SER B 55 2.562 10.427 5.092 1.00 0.00 O ATOM 0 H SER B 55 2.489 7.895 2.572 1.00 0.00 H new ATOM 0 HA SER B 55 0.870 10.275 2.979 1.00 0.00 H new ATOM 0 HB2 SER B 55 3.882 10.278 3.518 1.00 0.00 H new ATOM 0 HB3 SER B 55 2.850 11.694 3.494 1.00 0.00 H new ATOM 0 HG SER B 55 3.211 10.908 5.647 1.00 0.00 H new ATOM 1966 N VAL B 56 1.672 11.184 0.771 1.00 0.00 N ATOM 1967 CA VAL B 56 2.096 11.658 -0.536 1.00 0.00 C ATOM 1968 C VAL B 56 3.369 12.495 -0.365 1.00 0.00 C ATOM 1969 O VAL B 56 3.820 12.665 0.774 1.00 0.00 O ATOM 1970 CB VAL B 56 0.982 12.433 -1.275 1.00 0.00 C ATOM 1971 CG1 VAL B 56 -0.080 11.475 -1.776 1.00 0.00 C ATOM 1972 CG2 VAL B 56 0.359 13.486 -0.384 1.00 0.00 C ATOM 0 H VAL B 56 0.919 11.728 1.192 1.00 0.00 H new ATOM 0 HA VAL B 56 2.313 10.799 -1.170 1.00 0.00 H new ATOM 0 HB VAL B 56 1.435 12.940 -2.127 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -0.859 12.034 -2.295 1.00 0.00 H new ATOM 0 HG12 VAL B 56 0.371 10.759 -2.463 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -0.517 10.942 -0.931 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.421 14.013 -0.934 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.076 13.009 0.494 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.124 14.196 -0.070 1.00 0.00 H new ATOM 1982 N PRO B 57 3.834 13.215 -1.412 1.00 0.00 N ATOM 1983 CA PRO B 57 5.226 13.270 -1.786 1.00 0.00 C ATOM 1984 C PRO B 57 6.096 12.191 -1.144 1.00 0.00 C ATOM 1985 O PRO B 57 6.734 12.382 -0.107 1.00 0.00 O ATOM 1986 CB PRO B 57 5.527 14.703 -1.391 1.00 0.00 C ATOM 1987 CG PRO B 57 4.254 15.423 -1.804 1.00 0.00 C ATOM 1988 CD PRO B 57 3.201 14.341 -2.061 1.00 0.00 C ATOM 0 HA PRO B 57 5.445 13.047 -2.830 1.00 0.00 H new ATOM 0 HB2 PRO B 57 5.721 14.799 -0.323 1.00 0.00 H new ATOM 0 HB3 PRO B 57 6.402 15.093 -1.910 1.00 0.00 H new ATOM 0 HG2 PRO B 57 3.924 16.106 -1.021 1.00 0.00 H new ATOM 0 HG3 PRO B 57 4.421 16.021 -2.700 1.00 0.00 H new ATOM 0 HD2 PRO B 57 2.235 14.587 -1.620 1.00 0.00 H new ATOM 0 HD3 PRO B 57 3.032 14.168 -3.124 1.00 0.00 H new ATOM 1996 N ALA B 58 6.080 11.035 -1.808 1.00 0.00 N ATOM 1997 CA ALA B 58 6.831 9.860 -1.396 1.00 0.00 C ATOM 1998 C ALA B 58 7.220 9.042 -2.626 1.00 0.00 C ATOM 1999 O ALA B 58 6.621 9.194 -3.693 1.00 0.00 O ATOM 2000 CB ALA B 58 6.001 9.012 -0.446 1.00 0.00 C ATOM 0 H ALA B 58 5.536 10.892 -2.659 1.00 0.00 H new ATOM 0 HA ALA B 58 7.735 10.179 -0.877 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.575 8.135 -0.145 1.00 0.00 H new ATOM 0 HB2 ALA B 58 5.745 9.599 0.436 1.00 0.00 H new ATOM 0 HB3 ALA B 58 5.087 8.693 -0.947 1.00 0.00 H new ATOM 2006 N LEU B 59 8.211 8.175 -2.477 1.00 0.00 N ATOM 2007 CA LEU B 59 8.691 7.362 -3.587 1.00 0.00 C ATOM 2008 C LEU B 59 8.664 5.879 -3.222 1.00 0.00 C ATOM 2009 O LEU B 59 9.384 5.434 -2.332 1.00 0.00 O ATOM 2010 CB LEU B 59 10.112 7.788 -3.966 1.00 0.00 C ATOM 2011 CG LEU B 59 10.736 7.033 -5.142 1.00 0.00 C ATOM 2012 CD1 LEU B 59 9.949 7.275 -6.420 1.00 0.00 C ATOM 2013 CD2 LEU B 59 12.187 7.448 -5.323 1.00 0.00 C ATOM 0 H LEU B 59 8.700 8.016 -1.596 1.00 0.00 H new ATOM 0 HA LEU B 59 8.032 7.515 -4.442 1.00 0.00 H new ATOM 0 HB2 LEU B 59 10.102 8.852 -4.204 1.00 0.00 H new ATOM 0 HB3 LEU B 59 10.755 7.662 -3.095 1.00 0.00 H new ATOM 0 HG LEU B 59 10.702 5.966 -4.921 1.00 0.00 H new ATOM 0 HD11 LEU B 59 10.412 6.728 -7.241 1.00 0.00 H new ATOM 0 HD12 LEU B 59 8.924 6.930 -6.287 1.00 0.00 H new ATOM 0 HD13 LEU B 59 9.946 8.341 -6.649 1.00 0.00 H new ATOM 0 HD21 LEU B 59 12.619 6.904 -6.163 1.00 0.00 H new ATOM 0 HD22 LEU B 59 12.237 8.519 -5.520 1.00 0.00 H new ATOM 0 HD23 LEU B 59 12.747 7.220 -4.416 1.00 0.00 H new ATOM 2025 N VAL B 60 7.827 5.120 -3.910 1.00 0.00 N ATOM 2026 CA VAL B 60 7.698 3.693 -3.646 1.00 0.00 C ATOM 2027 C VAL B 60 8.591 2.894 -4.588 1.00 0.00 C ATOM 2028 O VAL B 60 8.273 2.718 -5.763 1.00 0.00 O ATOM 2029 CB VAL B 60 6.237 3.218 -3.801 1.00 0.00 C ATOM 2030 CG1 VAL B 60 6.105 1.740 -3.456 1.00 0.00 C ATOM 2031 CG2 VAL B 60 5.309 4.058 -2.937 1.00 0.00 C ATOM 0 H VAL B 60 7.225 5.467 -4.657 1.00 0.00 H new ATOM 0 HA VAL B 60 8.009 3.524 -2.615 1.00 0.00 H new ATOM 0 HB VAL B 60 5.946 3.346 -4.844 1.00 0.00 H new ATOM 0 HG11 VAL B 60 5.066 1.430 -3.573 1.00 0.00 H new ATOM 0 HG12 VAL B 60 6.736 1.153 -4.123 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.418 1.578 -2.425 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.284 3.709 -3.059 1.00 0.00 H new ATOM 0 HG22 VAL B 60 5.602 3.965 -1.891 1.00 0.00 H new ATOM 0 HG23 VAL B 60 5.375 5.103 -3.241 1.00 0.00 H new ATOM 2041 N ILE B 61 9.715 2.424 -4.073 1.00 0.00 N ATOM 2042 CA ILE B 61 10.652 1.652 -4.871 1.00 0.00 C ATOM 2043 C ILE B 61 10.371 0.161 -4.724 1.00 0.00 C ATOM 2044 O ILE B 61 10.764 -0.457 -3.732 1.00 0.00 O ATOM 2045 CB ILE B 61 12.117 1.940 -4.477 1.00 0.00 C ATOM 2046 CG1 ILE B 61 12.405 3.442 -4.572 1.00 0.00 C ATOM 2047 CG2 ILE B 61 13.072 1.155 -5.370 1.00 0.00 C ATOM 2048 CD1 ILE B 61 13.805 3.826 -4.141 1.00 0.00 C ATOM 0 H ILE B 61 10.001 2.564 -3.104 1.00 0.00 H new ATOM 0 HA ILE B 61 10.514 1.952 -5.910 1.00 0.00 H new ATOM 0 HB ILE B 61 12.271 1.621 -3.446 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.250 3.768 -5.601 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.685 3.980 -3.955 1.00 0.00 H new ATOM 0 HG21 ILE B 61 14.101 1.369 -5.079 1.00 0.00 H new ATOM 0 HG22 ILE B 61 12.878 0.088 -5.260 1.00 0.00 H new ATOM 0 HG23 ILE B 61 12.921 1.446 -6.409 1.00 0.00 H new ATOM 0 HD11 ILE B 61 13.932 4.904 -4.237 1.00 0.00 H new ATOM 0 HD12 ILE B 61 13.959 3.533 -3.103 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.533 3.317 -4.773 1.00 0.00 H new ATOM 2060 N ASP B 62 9.660 -0.388 -5.709 1.00 0.00 N ATOM 2061 CA ASP B 62 9.333 -1.815 -5.759 1.00 0.00 C ATOM 2062 C ASP B 62 8.811 -2.325 -4.416 1.00 0.00 C ATOM 2063 O ASP B 62 9.530 -2.981 -3.659 1.00 0.00 O ATOM 2064 CB ASP B 62 10.554 -2.627 -6.206 1.00 0.00 C ATOM 2065 CG ASP B 62 10.263 -4.109 -6.345 1.00 0.00 C ATOM 2066 OD1 ASP B 62 9.483 -4.483 -7.249 1.00 0.00 O ATOM 2067 OD2 ASP B 62 10.840 -4.907 -5.572 1.00 0.00 O ATOM 0 H ASP B 62 9.293 0.145 -6.497 1.00 0.00 H new ATOM 0 HA ASP B 62 8.535 -1.945 -6.490 1.00 0.00 H new ATOM 0 HB2 ASP B 62 10.910 -2.241 -7.161 1.00 0.00 H new ATOM 0 HB3 ASP B 62 11.360 -2.487 -5.486 1.00 0.00 H new ATOM 2072 N GLY B 63 7.571 -1.981 -4.105 1.00 0.00 N ATOM 2073 CA GLY B 63 6.958 -2.441 -2.875 1.00 0.00 C ATOM 2074 C GLY B 63 7.281 -1.570 -1.673 1.00 0.00 C ATOM 2075 O GLY B 63 6.405 -1.285 -0.858 1.00 0.00 O ATOM 0 H GLY B 63 6.975 -1.389 -4.684 1.00 0.00 H new ATOM 0 HA2 GLY B 63 5.877 -2.476 -3.008 1.00 0.00 H new ATOM 0 HA3 GLY B 63 7.287 -3.460 -2.674 1.00 0.00 H new ATOM 2079 N ALA B 64 8.531 -1.142 -1.561 1.00 0.00 N ATOM 2080 CA ALA B 64 8.970 -0.381 -0.400 1.00 0.00 C ATOM 2081 C ALA B 64 8.653 1.101 -0.563 1.00 0.00 C ATOM 2082 O ALA B 64 9.193 1.769 -1.446 1.00 0.00 O ATOM 2083 CB ALA B 64 10.457 -0.591 -0.166 1.00 0.00 C ATOM 0 H ALA B 64 9.257 -1.308 -2.258 1.00 0.00 H new ATOM 0 HA ALA B 64 8.425 -0.743 0.472 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.773 -0.017 0.705 1.00 0.00 H new ATOM 0 HB2 ALA B 64 10.652 -1.649 0.007 1.00 0.00 H new ATOM 0 HB3 ALA B 64 11.014 -0.258 -1.042 1.00 0.00 H new ATOM 2089 N ALA B 65 7.771 1.608 0.286 1.00 0.00 N ATOM 2090 CA ALA B 65 7.369 3.005 0.228 1.00 0.00 C ATOM 2091 C ALA B 65 8.334 3.889 1.009 1.00 0.00 C ATOM 2092 O ALA B 65 8.359 3.869 2.241 1.00 0.00 O ATOM 2093 CB ALA B 65 5.951 3.172 0.756 1.00 0.00 C ATOM 0 H ALA B 65 7.319 1.070 1.026 1.00 0.00 H new ATOM 0 HA ALA B 65 7.395 3.319 -0.816 1.00 0.00 H new ATOM 0 HB1 ALA B 65 5.665 4.223 0.706 1.00 0.00 H new ATOM 0 HB2 ALA B 65 5.265 2.580 0.150 1.00 0.00 H new ATOM 0 HB3 ALA B 65 5.906 2.833 1.791 1.00 0.00 H new ATOM 2099 N PHE B 66 9.139 4.653 0.290 1.00 0.00 N ATOM 2100 CA PHE B 66 10.065 5.580 0.914 1.00 0.00 C ATOM 2101 C PHE B 66 9.511 6.992 0.846 1.00 0.00 C ATOM 2102 O PHE B 66 9.567 7.646 -0.193 1.00 0.00 O ATOM 2103 CB PHE B 66 11.439 5.514 0.246 1.00 0.00 C ATOM 2104 CG PHE B 66 12.099 4.174 0.387 1.00 0.00 C ATOM 2105 CD1 PHE B 66 12.721 3.819 1.572 1.00 0.00 C ATOM 2106 CD2 PHE B 66 12.089 3.268 -0.659 1.00 0.00 C ATOM 2107 CE1 PHE B 66 13.323 2.585 1.711 1.00 0.00 C ATOM 2108 CE2 PHE B 66 12.688 2.032 -0.526 1.00 0.00 C ATOM 2109 CZ PHE B 66 13.306 1.690 0.661 1.00 0.00 C ATOM 0 H PHE B 66 9.169 4.649 -0.730 1.00 0.00 H new ATOM 0 HA PHE B 66 10.185 5.296 1.959 1.00 0.00 H new ATOM 0 HB2 PHE B 66 11.333 5.750 -0.813 1.00 0.00 H new ATOM 0 HB3 PHE B 66 12.084 6.278 0.680 1.00 0.00 H new ATOM 0 HD1 PHE B 66 12.735 4.516 2.397 1.00 0.00 H new ATOM 0 HD2 PHE B 66 11.607 3.531 -1.589 1.00 0.00 H new ATOM 0 HE1 PHE B 66 13.806 2.320 2.640 1.00 0.00 H new ATOM 0 HE2 PHE B 66 12.674 1.333 -1.349 1.00 0.00 H new ATOM 0 HZ PHE B 66 13.775 0.723 0.767 1.00 0.00 H new ATOM 2119 N HIS B 67 8.949 7.442 1.952 1.00 0.00 N ATOM 2120 CA HIS B 67 8.349 8.764 2.020 1.00 0.00 C ATOM 2121 C HIS B 67 9.428 9.831 1.987 1.00 0.00 C ATOM 2122 O HIS B 67 10.463 9.691 2.622 1.00 0.00 O ATOM 2123 CB HIS B 67 7.506 8.905 3.290 1.00 0.00 C ATOM 2124 CG HIS B 67 6.389 7.908 3.383 1.00 0.00 C ATOM 2125 ND1 HIS B 67 6.493 6.697 4.033 1.00 0.00 N ATOM 2126 CD2 HIS B 67 5.127 7.959 2.889 1.00 0.00 C ATOM 2127 CE1 HIS B 67 5.319 6.065 3.916 1.00 0.00 C ATOM 2128 NE2 HIS B 67 4.453 6.789 3.229 1.00 0.00 N ATOM 0 H HIS B 67 8.895 6.910 2.820 1.00 0.00 H new ATOM 0 HA HIS B 67 7.698 8.894 1.155 1.00 0.00 H new ATOM 0 HB2 HIS B 67 8.153 8.795 4.160 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.088 9.911 3.329 1.00 0.00 H new ATOM 0 HD1 HIS B 67 7.319 6.345 4.517 1.00 0.00 H new ATOM 0 HD2 HIS B 67 4.710 8.778 2.321 1.00 0.00 H new ATOM 0 HE1 HIS B 67 5.107 5.090 4.329 1.00 0.00 H new ATOM 2136 N ILE B 68 9.191 10.886 1.238 1.00 0.00 N ATOM 2137 CA ILE B 68 10.146 11.974 1.147 1.00 0.00 C ATOM 2138 C ILE B 68 9.728 13.053 2.146 1.00 0.00 C ATOM 2139 O ILE B 68 8.830 12.804 2.955 1.00 0.00 O ATOM 2140 CB ILE B 68 10.195 12.527 -0.305 1.00 0.00 C ATOM 2141 CG1 ILE B 68 10.173 11.363 -1.302 1.00 0.00 C ATOM 2142 CG2 ILE B 68 11.440 13.378 -0.540 1.00 0.00 C ATOM 2143 CD1 ILE B 68 10.169 11.797 -2.750 1.00 0.00 C ATOM 0 H ILE B 68 8.346 11.016 0.682 1.00 0.00 H new ATOM 0 HA ILE B 68 11.150 11.627 1.390 1.00 0.00 H new ATOM 0 HB ILE B 68 9.320 13.161 -0.452 1.00 0.00 H new ATOM 0 HG12 ILE B 68 11.042 10.729 -1.125 1.00 0.00 H new ATOM 0 HG13 ILE B 68 9.290 10.753 -1.113 1.00 0.00 H new ATOM 0 HG21 ILE B 68 11.440 13.747 -1.566 1.00 0.00 H new ATOM 0 HG22 ILE B 68 11.439 14.222 0.150 1.00 0.00 H new ATOM 0 HG23 ILE B 68 12.331 12.773 -0.372 1.00 0.00 H new ATOM 0 HD11 ILE B 68 10.153 10.917 -3.393 1.00 0.00 H new ATOM 0 HD12 ILE B 68 9.286 12.405 -2.945 1.00 0.00 H new ATOM 0 HD13 ILE B 68 11.065 12.382 -2.957 1.00 0.00 H new ATOM 2155 N ASN B 69 10.428 14.193 2.151 1.00 0.00 N ATOM 2156 CA ASN B 69 9.979 15.400 2.863 1.00 0.00 C ATOM 2157 C ASN B 69 8.463 15.431 2.960 1.00 0.00 C ATOM 2158 O ASN B 69 7.779 15.479 1.937 1.00 0.00 O ATOM 2159 CB ASN B 69 10.462 16.655 2.132 1.00 0.00 C ATOM 2160 CG ASN B 69 11.959 16.841 2.221 1.00 0.00 C ATOM 2161 OD1 ASN B 69 12.716 16.136 1.563 1.00 0.00 O ATOM 2162 ND2 ASN B 69 12.396 17.810 3.011 1.00 0.00 N ATOM 0 H ASN B 69 11.317 14.307 1.665 1.00 0.00 H new ATOM 0 HA ASN B 69 10.401 15.377 3.868 1.00 0.00 H new ATOM 0 HB2 ASN B 69 10.169 16.596 1.084 1.00 0.00 H new ATOM 0 HB3 ASN B 69 9.966 17.529 2.553 1.00 0.00 H new ATOM 0 HD21 ASN B 69 13.397 17.993 3.089 1.00 0.00 H new ATOM 0 HD22 ASN B 69 11.732 18.374 3.542 1.00 0.00 H new ATOM 2169 N PHE B 70 7.966 15.395 4.197 1.00 0.00 N ATOM 2170 CA PHE B 70 6.549 15.184 4.478 1.00 0.00 C ATOM 2171 C PHE B 70 5.652 16.013 3.571 1.00 0.00 C ATOM 2172 O PHE B 70 5.553 17.234 3.716 1.00 0.00 O ATOM 2173 CB PHE B 70 6.245 15.496 5.947 1.00 0.00 C ATOM 2174 CG PHE B 70 4.805 15.278 6.324 1.00 0.00 C ATOM 2175 CD1 PHE B 70 4.291 13.996 6.434 1.00 0.00 C ATOM 2176 CD2 PHE B 70 3.964 16.355 6.561 1.00 0.00 C ATOM 2177 CE1 PHE B 70 2.968 13.791 6.774 1.00 0.00 C ATOM 2178 CE2 PHE B 70 2.640 16.157 6.900 1.00 0.00 C ATOM 2179 CZ PHE B 70 2.140 14.873 7.007 1.00 0.00 C ATOM 0 H PHE B 70 8.538 15.512 5.033 1.00 0.00 H new ATOM 0 HA PHE B 70 6.334 14.134 4.278 1.00 0.00 H new ATOM 0 HB2 PHE B 70 6.876 14.872 6.580 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.513 16.532 6.152 1.00 0.00 H new ATOM 0 HD1 PHE B 70 4.933 13.147 6.252 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.349 17.361 6.479 1.00 0.00 H new ATOM 0 HE1 PHE B 70 2.581 12.786 6.858 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.996 17.005 7.081 1.00 0.00 H new ATOM 0 HZ PHE B 70 1.105 14.715 7.272 1.00 0.00 H new ATOM 2189 N GLY B 71 5.033 15.336 2.616 1.00 0.00 N ATOM 2190 CA GLY B 71 4.064 15.976 1.767 1.00 0.00 C ATOM 2191 C GLY B 71 2.720 16.047 2.443 1.00 0.00 C ATOM 2192 O GLY B 71 2.407 17.031 3.113 1.00 0.00 O ATOM 0 H GLY B 71 5.190 14.348 2.417 1.00 0.00 H new ATOM 0 HA2 GLY B 71 4.403 16.981 1.516 1.00 0.00 H new ATOM 0 HA3 GLY B 71 3.976 15.426 0.830 1.00 0.00 H new ATOM 2196 N ALA B 72 1.906 15.019 2.264 1.00 0.00 N ATOM 2197 CA ALA B 72 0.615 14.975 2.952 1.00 0.00 C ATOM 2198 C ALA B 72 0.308 13.573 3.444 1.00 0.00 C ATOM 2199 O ALA B 72 0.574 12.605 2.746 1.00 0.00 O ATOM 2200 CB ALA B 72 -0.506 15.496 2.062 1.00 0.00 C ATOM 0 H ALA B 72 2.104 14.219 1.664 1.00 0.00 H new ATOM 0 HA ALA B 72 0.682 15.631 3.820 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -1.451 15.450 2.603 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -0.298 16.529 1.782 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -0.572 14.883 1.163 1.00 0.00 H new ATOM 2206 N GLY B 73 -0.257 13.459 4.636 1.00 0.00 N ATOM 2207 CA GLY B 73 -0.640 12.155 5.138 1.00 0.00 C ATOM 2208 C GLY B 73 -1.798 11.574 4.350 1.00 0.00 C ATOM 2209 O GLY B 73 -2.691 12.308 3.926 1.00 0.00 O ATOM 0 H GLY B 73 -0.456 14.240 5.262 1.00 0.00 H new ATOM 0 HA2 GLY B 73 0.213 11.479 5.085 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -0.918 12.236 6.189 1.00 0.00 H new ATOM 2213 N ILE B 74 -1.790 10.263 4.143 1.00 0.00 N ATOM 2214 CA ILE B 74 -2.858 9.607 3.396 1.00 0.00 C ATOM 2215 C ILE B 74 -4.177 9.720 4.156 1.00 0.00 C ATOM 2216 O ILE B 74 -5.259 9.701 3.568 1.00 0.00 O ATOM 2217 CB ILE B 74 -2.530 8.120 3.111 1.00 0.00 C ATOM 2218 CG1 ILE B 74 -3.560 7.519 2.149 1.00 0.00 C ATOM 2219 CG2 ILE B 74 -2.475 7.318 4.405 1.00 0.00 C ATOM 2220 CD1 ILE B 74 -3.258 6.093 1.741 1.00 0.00 C ATOM 0 H ILE B 74 -1.060 9.635 4.480 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.951 10.114 2.436 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.548 8.072 2.641 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -4.543 7.552 2.618 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -3.613 8.139 1.254 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -2.243 6.277 4.178 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -1.702 7.729 5.055 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.440 7.373 4.909 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -4.031 5.738 1.060 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -2.290 6.055 1.242 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -3.235 5.458 2.627 1.00 0.00 H new ATOM 2232 N ASP B 75 -4.070 9.867 5.470 1.00 0.00 N ATOM 2233 CA ASP B 75 -5.231 10.067 6.324 1.00 0.00 C ATOM 2234 C ASP B 75 -5.817 11.457 6.104 1.00 0.00 C ATOM 2235 O ASP B 75 -7.028 11.654 6.206 1.00 0.00 O ATOM 2236 CB ASP B 75 -4.846 9.888 7.796 1.00 0.00 C ATOM 2237 CG ASP B 75 -4.471 8.458 8.133 1.00 0.00 C ATOM 2238 OD1 ASP B 75 -3.346 8.034 7.799 1.00 0.00 O ATOM 2239 OD2 ASP B 75 -5.307 7.747 8.733 1.00 0.00 O ATOM 0 H ASP B 75 -3.181 9.851 5.970 1.00 0.00 H new ATOM 0 HA ASP B 75 -5.984 9.323 6.064 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -4.008 10.544 8.030 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -5.680 10.199 8.426 1.00 0.00 H new ATOM 2244 N ASP B 76 -4.949 12.411 5.779 1.00 0.00 N ATOM 2245 CA ASP B 76 -5.368 13.787 5.534 1.00 0.00 C ATOM 2246 C ASP B 76 -6.074 13.892 4.189 1.00 0.00 C ATOM 2247 O ASP B 76 -6.918 14.761 3.985 1.00 0.00 O ATOM 2248 CB ASP B 76 -4.168 14.743 5.549 1.00 0.00 C ATOM 2249 CG ASP B 76 -3.463 14.805 6.891 1.00 0.00 C ATOM 2250 OD1 ASP B 76 -3.956 15.513 7.795 1.00 0.00 O ATOM 2251 OD2 ASP B 76 -2.402 14.163 7.040 1.00 0.00 O ATOM 0 H ASP B 76 -3.946 12.255 5.679 1.00 0.00 H new ATOM 0 HA ASP B 76 -6.053 14.071 6.333 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -3.455 14.431 4.786 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -4.506 15.743 5.278 1.00 0.00 H new ATOM 2256 N LEU B 77 -5.718 12.999 3.273 1.00 0.00 N ATOM 2257 CA LEU B 77 -6.295 12.997 1.932 1.00 0.00 C ATOM 2258 C LEU B 77 -7.721 12.458 1.947 1.00 0.00 C ATOM 2259 O LEU B 77 -8.471 12.629 0.985 1.00 0.00 O ATOM 2260 CB LEU B 77 -5.436 12.156 0.986 1.00 0.00 C ATOM 2261 CG LEU B 77 -4.002 12.648 0.799 1.00 0.00 C ATOM 2262 CD1 LEU B 77 -3.231 11.696 -0.098 1.00 0.00 C ATOM 2263 CD2 LEU B 77 -3.989 14.055 0.218 1.00 0.00 C ATOM 0 H LEU B 77 -5.030 12.264 3.435 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.319 14.028 1.578 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -5.406 11.133 1.361 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.922 12.124 0.011 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.517 12.676 1.775 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.211 12.059 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.211 10.705 0.355 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.717 11.639 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.959 14.387 0.092 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.490 14.054 -0.750 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.509 14.733 0.895 1.00 0.00 H new ATOM 2275 N LYS B 78 -8.087 11.805 3.040 1.00 0.00 N ATOM 2276 CA LYS B 78 -9.419 11.241 3.183 1.00 0.00 C ATOM 2277 C LYS B 78 -10.341 12.231 3.884 1.00 0.00 C ATOM 2278 O LYS B 78 -10.329 12.344 5.110 1.00 0.00 O ATOM 2279 CB LYS B 78 -9.368 9.928 3.973 1.00 0.00 C ATOM 2280 CG LYS B 78 -8.489 8.860 3.340 1.00 0.00 C ATOM 2281 CD LYS B 78 -8.437 7.608 4.201 1.00 0.00 C ATOM 2282 CE LYS B 78 -7.506 6.558 3.613 1.00 0.00 C ATOM 2283 NZ LYS B 78 -7.425 5.346 4.472 1.00 0.00 N ATOM 0 H LYS B 78 -7.477 11.653 3.843 1.00 0.00 H new ATOM 0 HA LYS B 78 -9.810 11.035 2.187 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -9.003 10.135 4.979 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -10.381 9.537 4.075 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -8.873 8.609 2.351 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -7.481 9.251 3.201 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -8.102 7.870 5.204 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -9.440 7.192 4.298 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -7.857 6.277 2.620 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -6.510 6.983 3.490 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -6.544 4.833 4.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -7.435 5.629 5.473 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -8.239 4.728 4.279 1.00 0.00 H new ATOM 2297 N GLY B 79 -11.108 12.977 3.101 1.00 0.00 N ATOM 2298 CA GLY B 79 -12.072 13.897 3.670 1.00 0.00 C ATOM 2299 C GLY B 79 -11.695 15.349 3.455 1.00 0.00 C ATOM 2300 O GLY B 79 -12.563 16.220 3.382 1.00 0.00 O ATOM 0 H GLY B 79 -11.080 12.961 2.082 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -13.050 13.711 3.227 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -12.164 13.705 4.739 1.00 0.00 H new ATOM 2304 N SER B 80 -10.405 15.616 3.352 1.00 0.00 N ATOM 2305 CA SER B 80 -9.930 16.974 3.157 1.00 0.00 C ATOM 2306 C SER B 80 -9.379 17.151 1.741 1.00 0.00 C ATOM 2307 O SER B 80 -8.162 16.958 1.533 1.00 0.00 O ATOM 2308 CB SER B 80 -8.870 17.306 4.208 1.00 0.00 C ATOM 2309 OG SER B 80 -9.357 17.041 5.519 1.00 0.00 O ATOM 2310 OXT SER B 80 -10.176 17.462 0.829 1.00 0.00 O ATOM 0 H SER B 80 -9.669 14.912 3.400 1.00 0.00 H new ATOM 0 HA SER B 80 -10.764 17.666 3.276 1.00 0.00 H new ATOM 0 HB2 SER B 80 -7.971 16.717 4.023 1.00 0.00 H new ATOM 0 HB3 SER B 80 -8.586 18.355 4.126 1.00 0.00 H new ATOM 0 HG SER B 80 -8.663 17.258 6.176 1.00 0.00 H new TER 2316 SER B 80