USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 660 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 41 THR OG1 : rot -120:sc= -2.02! USER MOD Set 1.2: A 111 GLN : amide:sc= -20.9! C(o=-23!,f=-28!) USER MOD Single : A 38 LYS NZ :NH3+ 157:sc= -0.131 (180deg=-0.859) USER MOD Single : A 40 ASN : amide:sc= -7.17! C(o=-7.2!,f=-6.4!) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.329 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 157:sc= -0.993 (180deg=-1.76) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 74:sc= 0.648 USER MOD Single : A 63 ASN : amide:sc= -0.119 K(o=-0.12,f=-2.9!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -113:sc= -2.95 (180deg=-9.18!) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 75 CYS SG : rot 92:sc= -2.34 USER MOD Single : A 79 THR OG1 : rot 80:sc= -0.873! USER MOD Single : A 80 TYR OH : rot -22:sc= -8.3! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -126:sc= -12.3! (180deg=-13.2!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 94 ASN : amide:sc= -0.173 K(o=-0.17,f=-0.85) USER MOD Single : A 96 THR OG1 : rot -93:sc= -0.245 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 100 SER OG : rot -62:sc= 0.87 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -3.27! C(o=-3.3!,f=-5.1!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl -133:sc= -6.09! (180deg=-8.44!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 25.116 19.728 25.712 1.00 0.00 N ATOM 2 CA ALA A 35 25.131 21.216 25.657 1.00 0.00 C ATOM 3 C ALA A 35 23.695 21.736 25.550 1.00 0.00 C ATOM 4 O ALA A 35 22.913 21.264 24.750 1.00 0.00 O ATOM 5 CB ALA A 35 25.930 21.673 24.434 1.00 0.00 C ATOM 0 HA ALA A 35 25.594 21.609 26.562 1.00 0.00 H new ATOM 0 HB1 ALA A 35 25.941 22.762 24.393 1.00 0.00 H new ATOM 0 HB2 ALA A 35 26.952 21.302 24.508 1.00 0.00 H new ATOM 0 HB3 ALA A 35 25.466 21.281 23.529 1.00 0.00 H new ATOM 11 N PRO A 36 23.350 22.732 26.379 1.00 0.00 N ATOM 12 CA PRO A 36 22.007 23.328 26.387 1.00 0.00 C ATOM 13 C PRO A 36 21.743 24.152 25.121 1.00 0.00 C ATOM 14 O PRO A 36 20.617 24.308 24.695 1.00 0.00 O ATOM 15 CB PRO A 36 22.029 24.243 27.611 1.00 0.00 C ATOM 16 CG PRO A 36 23.471 24.569 27.811 1.00 0.00 C ATOM 17 CD PRO A 36 24.240 23.355 27.373 1.00 0.00 C ATOM 0 HA PRO A 36 21.223 22.571 26.418 1.00 0.00 H new ATOM 0 HB2 PRO A 36 21.438 25.144 27.443 1.00 0.00 H new ATOM 0 HB3 PRO A 36 21.610 23.745 28.486 1.00 0.00 H new ATOM 0 HG2 PRO A 36 23.757 25.443 27.226 1.00 0.00 H new ATOM 0 HG3 PRO A 36 23.676 24.804 28.856 1.00 0.00 H new ATOM 0 HD2 PRO A 36 25.203 23.624 26.939 1.00 0.00 H new ATOM 0 HD3 PRO A 36 24.443 22.684 28.208 1.00 0.00 H new ATOM 25 N ARG A 37 22.775 24.678 24.519 1.00 0.00 N ATOM 26 CA ARG A 37 22.582 25.489 23.285 1.00 0.00 C ATOM 27 C ARG A 37 21.960 24.615 22.193 1.00 0.00 C ATOM 28 O ARG A 37 22.185 23.422 22.135 1.00 0.00 O ATOM 29 CB ARG A 37 23.937 26.018 22.805 1.00 0.00 C ATOM 30 CG ARG A 37 24.486 27.011 23.830 1.00 0.00 C ATOM 31 CD ARG A 37 25.759 27.661 23.281 1.00 0.00 C ATOM 32 NE ARG A 37 26.462 28.382 24.379 1.00 0.00 N ATOM 33 CZ ARG A 37 27.697 28.772 24.217 1.00 0.00 C ATOM 34 NH1 ARG A 37 27.949 29.934 23.677 1.00 0.00 N ATOM 35 NH2 ARG A 37 28.680 28.002 24.594 1.00 0.00 N ATOM 0 H ARG A 37 23.742 24.581 24.829 1.00 0.00 H new ATOM 0 HA ARG A 37 21.920 26.328 23.501 1.00 0.00 H new ATOM 0 HB2 ARG A 37 24.636 25.192 22.672 1.00 0.00 H new ATOM 0 HB3 ARG A 37 23.828 26.503 21.835 1.00 0.00 H new ATOM 0 HG2 ARG A 37 23.740 27.775 24.048 1.00 0.00 H new ATOM 0 HG3 ARG A 37 24.702 26.500 24.768 1.00 0.00 H new ATOM 0 HD2 ARG A 37 26.413 26.901 22.854 1.00 0.00 H new ATOM 0 HD3 ARG A 37 25.509 28.354 22.478 1.00 0.00 H new ATOM 0 HE ARG A 37 25.978 28.571 25.257 1.00 0.00 H new ATOM 0 HH11 ARG A 37 27.181 30.537 23.382 1.00 0.00 H new ATOM 0 HH12 ARG A 37 28.914 30.239 23.550 1.00 0.00 H new ATOM 0 HH21 ARG A 37 28.484 27.094 25.016 1.00 0.00 H new ATOM 0 HH22 ARG A 37 29.645 28.308 24.467 1.00 0.00 H new ATOM 49 N LYS A 38 21.176 25.199 21.328 1.00 0.00 N ATOM 50 CA LYS A 38 20.537 24.402 20.244 1.00 0.00 C ATOM 51 C LYS A 38 21.554 24.148 19.128 1.00 0.00 C ATOM 52 O LYS A 38 22.741 24.345 19.299 1.00 0.00 O ATOM 53 CB LYS A 38 19.344 25.174 19.678 1.00 0.00 C ATOM 54 CG LYS A 38 18.344 25.463 20.800 1.00 0.00 C ATOM 55 CD LYS A 38 17.054 26.025 20.203 1.00 0.00 C ATOM 56 CE LYS A 38 16.091 26.401 21.330 1.00 0.00 C ATOM 57 NZ LYS A 38 16.739 27.404 22.222 1.00 0.00 N ATOM 0 H LYS A 38 20.951 26.194 21.326 1.00 0.00 H new ATOM 0 HA LYS A 38 20.195 23.449 20.649 1.00 0.00 H new ATOM 0 HB2 LYS A 38 19.682 26.108 19.228 1.00 0.00 H new ATOM 0 HB3 LYS A 38 18.864 24.595 18.889 1.00 0.00 H new ATOM 0 HG2 LYS A 38 18.132 24.550 21.356 1.00 0.00 H new ATOM 0 HG3 LYS A 38 18.770 26.175 21.507 1.00 0.00 H new ATOM 0 HD2 LYS A 38 17.275 26.900 19.592 1.00 0.00 H new ATOM 0 HD3 LYS A 38 16.592 25.287 19.547 1.00 0.00 H new ATOM 0 HE2 LYS A 38 15.170 26.809 20.915 1.00 0.00 H new ATOM 0 HE3 LYS A 38 15.818 25.514 21.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 16.007 27.942 22.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.348 26.915 22.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 17.315 28.056 21.651 1.00 0.00 H new ATOM 71 N GLY A 39 21.097 23.713 17.986 1.00 0.00 N ATOM 72 CA GLY A 39 22.035 23.445 16.860 1.00 0.00 C ATOM 73 C GLY A 39 21.274 22.776 15.712 1.00 0.00 C ATOM 74 O GLY A 39 20.082 22.559 15.792 1.00 0.00 O ATOM 0 H GLY A 39 20.114 23.532 17.784 1.00 0.00 H new ATOM 0 HA2 GLY A 39 22.486 24.377 16.518 1.00 0.00 H new ATOM 0 HA3 GLY A 39 22.849 22.802 17.195 1.00 0.00 H new ATOM 78 N ASN A 40 21.948 22.443 14.644 1.00 0.00 N ATOM 79 CA ASN A 40 21.251 21.781 13.502 1.00 0.00 C ATOM 80 C ASN A 40 22.280 21.298 12.476 1.00 0.00 C ATOM 81 O ASN A 40 22.948 22.085 11.836 1.00 0.00 O ATOM 82 CB ASN A 40 20.297 22.775 12.836 1.00 0.00 C ATOM 83 CG ASN A 40 19.326 22.016 11.930 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.065 20.849 12.143 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.777 22.632 10.920 1.00 0.00 N ATOM 0 H ASN A 40 22.947 22.600 14.512 1.00 0.00 H new ATOM 0 HA ASN A 40 20.685 20.927 13.875 1.00 0.00 H new ATOM 0 HB2 ASN A 40 19.746 23.331 13.594 1.00 0.00 H new ATOM 0 HB3 ASN A 40 20.861 23.504 12.254 1.00 0.00 H new ATOM 0 HD21 ASN A 40 18.129 22.134 10.310 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.996 23.612 10.740 1.00 0.00 H new ATOM 92 N THR A 41 22.413 20.009 12.313 1.00 0.00 N ATOM 93 CA THR A 41 23.401 19.479 11.329 1.00 0.00 C ATOM 94 C THR A 41 22.813 19.542 9.917 1.00 0.00 C ATOM 95 O THR A 41 21.612 19.507 9.731 1.00 0.00 O ATOM 96 CB THR A 41 23.738 18.027 11.674 1.00 0.00 C ATOM 97 OG1 THR A 41 24.241 17.962 13.001 1.00 0.00 O ATOM 98 CG2 THR A 41 24.792 17.501 10.700 1.00 0.00 C ATOM 0 H THR A 41 21.881 19.301 12.818 1.00 0.00 H new ATOM 0 HA THR A 41 24.306 20.085 11.370 1.00 0.00 H new ATOM 0 HB THR A 41 22.839 17.416 11.596 1.00 0.00 H new ATOM 0 HG1 THR A 41 25.150 17.595 12.989 1.00 0.00 H new ATOM 0 HG21 THR A 41 25.031 16.467 10.947 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.404 17.551 9.682 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.693 18.110 10.775 1.00 0.00 H new ATOM 106 N LEU A 42 23.653 19.630 8.921 1.00 0.00 N ATOM 107 CA LEU A 42 23.148 19.690 7.518 1.00 0.00 C ATOM 108 C LEU A 42 23.910 18.675 6.662 1.00 0.00 C ATOM 109 O LEU A 42 25.023 18.299 6.972 1.00 0.00 O ATOM 110 CB LEU A 42 23.366 21.097 6.958 1.00 0.00 C ATOM 111 CG LEU A 42 22.602 22.110 7.811 1.00 0.00 C ATOM 112 CD1 LEU A 42 23.536 22.688 8.876 1.00 0.00 C ATOM 113 CD2 LEU A 42 22.083 23.240 6.920 1.00 0.00 C ATOM 0 H LEU A 42 24.668 19.663 9.018 1.00 0.00 H new ATOM 0 HA LEU A 42 22.084 19.455 7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 42 24.429 21.338 6.954 1.00 0.00 H new ATOM 0 HB3 LEU A 42 23.024 21.145 5.924 1.00 0.00 H new ATOM 0 HG LEU A 42 21.761 21.615 8.296 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.991 23.410 9.484 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.905 21.883 9.512 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.378 23.183 8.392 1.00 0.00 H new ATOM 0 HD21 LEU A 42 21.538 23.962 7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 42 22.924 23.736 6.434 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.417 22.829 6.162 1.00 0.00 H new ATOM 125 N TYR A 43 23.320 18.228 5.586 1.00 0.00 N ATOM 126 CA TYR A 43 24.013 17.237 4.715 1.00 0.00 C ATOM 127 C TYR A 43 24.325 17.875 3.359 1.00 0.00 C ATOM 128 O TYR A 43 23.442 18.119 2.559 1.00 0.00 O ATOM 129 CB TYR A 43 23.111 16.019 4.509 1.00 0.00 C ATOM 130 CG TYR A 43 23.740 15.088 3.499 1.00 0.00 C ATOM 131 CD1 TYR A 43 23.523 15.290 2.131 1.00 0.00 C ATOM 132 CD2 TYR A 43 24.540 14.024 3.931 1.00 0.00 C ATOM 133 CE1 TYR A 43 24.106 14.428 1.195 1.00 0.00 C ATOM 134 CE2 TYR A 43 25.123 13.162 2.996 1.00 0.00 C ATOM 135 CZ TYR A 43 24.906 13.362 1.627 1.00 0.00 C ATOM 136 OH TYR A 43 25.481 12.512 0.705 1.00 0.00 O ATOM 0 H TYR A 43 22.390 18.506 5.273 1.00 0.00 H new ATOM 0 HA TYR A 43 24.942 16.925 5.191 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.963 15.499 5.455 1.00 0.00 H new ATOM 0 HB3 TYR A 43 22.127 16.337 4.163 1.00 0.00 H new ATOM 0 HD1 TYR A 43 22.906 16.111 1.798 1.00 0.00 H new ATOM 0 HD2 TYR A 43 24.707 13.868 4.987 1.00 0.00 H new ATOM 0 HE1 TYR A 43 23.939 14.585 0.140 1.00 0.00 H new ATOM 0 HE2 TYR A 43 25.741 12.342 3.330 1.00 0.00 H new ATOM 0 HH TYR A 43 26.005 11.828 1.173 1.00 0.00 H new ATOM 146 N VAL A 44 25.573 18.146 3.094 1.00 0.00 N ATOM 147 CA VAL A 44 25.942 18.768 1.790 1.00 0.00 C ATOM 148 C VAL A 44 26.590 17.716 0.888 1.00 0.00 C ATOM 149 O VAL A 44 27.283 16.830 1.350 1.00 0.00 O ATOM 150 CB VAL A 44 26.931 19.910 2.033 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.211 20.631 0.712 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.334 20.899 3.037 1.00 0.00 C ATOM 0 H VAL A 44 26.354 17.964 3.724 1.00 0.00 H new ATOM 0 HA VAL A 44 25.046 19.158 1.307 1.00 0.00 H new ATOM 0 HB VAL A 44 27.861 19.506 2.432 1.00 0.00 H new ATOM 0 HG11 VAL A 44 27.915 21.445 0.884 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.637 19.927 -0.003 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.280 21.035 0.314 1.00 0.00 H new ATOM 0 HG21 VAL A 44 27.039 21.712 3.210 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.403 21.304 2.639 1.00 0.00 H new ATOM 0 HG23 VAL A 44 26.134 20.386 3.978 1.00 0.00 H new ATOM 162 N TYR A 45 26.373 17.805 -0.396 1.00 0.00 N ATOM 163 CA TYR A 45 26.978 16.809 -1.324 1.00 0.00 C ATOM 164 C TYR A 45 27.562 17.533 -2.539 1.00 0.00 C ATOM 165 O TYR A 45 26.987 18.475 -3.048 1.00 0.00 O ATOM 166 CB TYR A 45 25.904 15.823 -1.786 1.00 0.00 C ATOM 167 CG TYR A 45 26.522 14.808 -2.718 1.00 0.00 C ATOM 168 CD1 TYR A 45 27.073 13.629 -2.203 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.543 15.047 -4.098 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.647 12.688 -3.068 1.00 0.00 C ATOM 171 CE2 TYR A 45 27.115 14.105 -4.962 1.00 0.00 C ATOM 172 CZ TYR A 45 27.667 12.927 -4.446 1.00 0.00 C ATOM 173 OH TYR A 45 28.233 12.000 -5.298 1.00 0.00 O ATOM 0 H TYR A 45 25.803 18.524 -0.842 1.00 0.00 H new ATOM 0 HA TYR A 45 27.770 16.267 -0.808 1.00 0.00 H new ATOM 0 HB2 TYR A 45 25.461 15.321 -0.926 1.00 0.00 H new ATOM 0 HB3 TYR A 45 25.099 16.356 -2.293 1.00 0.00 H new ATOM 0 HD1 TYR A 45 27.056 13.445 -1.139 1.00 0.00 H new ATOM 0 HD2 TYR A 45 26.118 15.957 -4.495 1.00 0.00 H new ATOM 0 HE1 TYR A 45 28.074 11.779 -2.671 1.00 0.00 H new ATOM 0 HE2 TYR A 45 27.130 14.288 -6.026 1.00 0.00 H new ATOM 0 HH TYR A 45 28.163 12.319 -6.222 1.00 0.00 H new ATOM 183 N GLY A 46 28.702 17.102 -3.008 1.00 0.00 N ATOM 184 CA GLY A 46 29.321 17.767 -4.190 1.00 0.00 C ATOM 185 C GLY A 46 30.699 17.159 -4.453 1.00 0.00 C ATOM 186 O GLY A 46 31.034 16.109 -3.940 1.00 0.00 O ATOM 0 H GLY A 46 29.231 16.319 -2.624 1.00 0.00 H new ATOM 0 HA2 GLY A 46 28.684 17.643 -5.066 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.412 18.838 -4.012 1.00 0.00 H new ATOM 190 N GLU A 47 31.502 17.809 -5.252 1.00 0.00 N ATOM 191 CA GLU A 47 32.858 17.266 -5.549 1.00 0.00 C ATOM 192 C GLU A 47 33.923 18.213 -4.992 1.00 0.00 C ATOM 193 O GLU A 47 33.676 19.384 -4.780 1.00 0.00 O ATOM 194 CB GLU A 47 33.035 17.136 -7.063 1.00 0.00 C ATOM 195 CG GLU A 47 31.908 16.273 -7.636 1.00 0.00 C ATOM 196 CD GLU A 47 32.084 16.145 -9.151 1.00 0.00 C ATOM 197 OE1 GLU A 47 32.895 16.874 -9.697 1.00 0.00 O ATOM 198 OE2 GLU A 47 31.405 15.320 -9.738 1.00 0.00 O ATOM 0 H GLU A 47 31.277 18.692 -5.711 1.00 0.00 H new ATOM 0 HA GLU A 47 32.965 16.286 -5.084 1.00 0.00 H new ATOM 0 HB2 GLU A 47 33.024 18.122 -7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 47 34.002 16.687 -7.290 1.00 0.00 H new ATOM 0 HG2 GLU A 47 31.920 15.286 -7.173 1.00 0.00 H new ATOM 0 HG3 GLU A 47 30.941 16.721 -7.408 1.00 0.00 H new ATOM 205 N ASP A 48 35.106 17.716 -4.753 1.00 0.00 N ATOM 206 CA ASP A 48 36.186 18.588 -4.210 1.00 0.00 C ATOM 207 C ASP A 48 35.627 19.452 -3.080 1.00 0.00 C ATOM 208 O ASP A 48 35.877 20.639 -3.010 1.00 0.00 O ATOM 209 CB ASP A 48 36.724 19.488 -5.323 1.00 0.00 C ATOM 210 CG ASP A 48 37.961 20.235 -4.822 1.00 0.00 C ATOM 211 OD1 ASP A 48 38.413 19.927 -3.731 1.00 0.00 O ATOM 212 OD2 ASP A 48 38.436 21.102 -5.537 1.00 0.00 O ATOM 0 H ASP A 48 35.371 16.744 -4.910 1.00 0.00 H new ATOM 0 HA ASP A 48 36.994 17.966 -3.824 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.977 18.890 -6.198 1.00 0.00 H new ATOM 0 HB3 ASP A 48 35.958 20.199 -5.633 1.00 0.00 H new ATOM 217 N MET A 49 34.870 18.867 -2.192 1.00 0.00 N ATOM 218 CA MET A 49 34.297 19.657 -1.066 1.00 0.00 C ATOM 219 C MET A 49 35.346 19.805 0.037 1.00 0.00 C ATOM 220 O MET A 49 35.996 18.853 0.422 1.00 0.00 O ATOM 221 CB MET A 49 33.069 18.933 -0.509 1.00 0.00 C ATOM 222 CG MET A 49 32.197 18.442 -1.665 1.00 0.00 C ATOM 223 SD MET A 49 30.957 17.283 -1.036 1.00 0.00 S ATOM 224 CE MET A 49 30.056 18.458 0.004 1.00 0.00 C ATOM 0 H MET A 49 34.624 17.877 -2.198 1.00 0.00 H new ATOM 0 HA MET A 49 34.005 20.644 -1.425 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.380 18.091 0.109 1.00 0.00 H new ATOM 0 HB3 MET A 49 32.497 19.605 0.132 1.00 0.00 H new ATOM 0 HG2 MET A 49 31.708 19.287 -2.150 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.815 17.956 -2.420 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.041 18.096 0.167 1.00 0.00 H new ATOM 0 HE2 MET A 49 30.564 18.559 0.963 1.00 0.00 H new ATOM 0 HE3 MET A 49 30.020 19.429 -0.491 1.00 0.00 H new ATOM 234 N THR A 50 35.518 20.994 0.550 1.00 0.00 N ATOM 235 CA THR A 50 36.527 21.201 1.626 1.00 0.00 C ATOM 236 C THR A 50 35.857 21.859 2.833 1.00 0.00 C ATOM 237 O THR A 50 34.786 22.423 2.730 1.00 0.00 O ATOM 238 CB THR A 50 37.645 22.108 1.108 1.00 0.00 C ATOM 239 OG1 THR A 50 37.188 22.813 -0.038 1.00 0.00 O ATOM 240 CG2 THR A 50 38.862 21.260 0.736 1.00 0.00 C ATOM 0 H THR A 50 35.004 21.829 0.270 1.00 0.00 H new ATOM 0 HA THR A 50 36.946 20.239 1.922 1.00 0.00 H new ATOM 0 HB THR A 50 37.925 22.819 1.885 1.00 0.00 H new ATOM 0 HG1 THR A 50 37.903 23.396 -0.370 1.00 0.00 H new ATOM 0 HG21 THR A 50 39.658 21.907 0.367 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.212 20.720 1.616 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.585 20.547 -0.041 1.00 0.00 H new ATOM 248 N PRO A 51 36.507 21.782 4.003 1.00 0.00 N ATOM 249 CA PRO A 51 35.982 22.369 5.242 1.00 0.00 C ATOM 250 C PRO A 51 36.033 23.898 5.208 1.00 0.00 C ATOM 251 O PRO A 51 35.044 24.568 5.430 1.00 0.00 O ATOM 252 CB PRO A 51 36.928 21.838 6.319 1.00 0.00 C ATOM 253 CG PRO A 51 38.199 21.546 5.594 1.00 0.00 C ATOM 254 CD PRO A 51 37.805 21.117 4.209 1.00 0.00 C ATOM 0 HA PRO A 51 34.937 22.108 5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 51 37.082 22.573 7.109 1.00 0.00 H new ATOM 0 HB3 PRO A 51 36.527 20.942 6.792 1.00 0.00 H new ATOM 0 HG2 PRO A 51 38.839 22.428 5.561 1.00 0.00 H new ATOM 0 HG3 PRO A 51 38.763 20.761 6.098 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.539 21.430 3.467 1.00 0.00 H new ATOM 0 HD3 PRO A 51 37.718 20.033 4.133 1.00 0.00 H new ATOM 262 N THR A 52 37.180 24.456 4.930 1.00 0.00 N ATOM 263 CA THR A 52 37.293 25.939 4.879 1.00 0.00 C ATOM 264 C THR A 52 36.273 26.490 3.882 1.00 0.00 C ATOM 265 O THR A 52 35.549 27.423 4.172 1.00 0.00 O ATOM 266 CB THR A 52 38.705 26.328 4.433 1.00 0.00 C ATOM 267 OG1 THR A 52 39.658 25.675 5.260 1.00 0.00 O ATOM 268 CG2 THR A 52 38.880 27.842 4.548 1.00 0.00 C ATOM 0 H THR A 52 38.043 23.948 4.736 1.00 0.00 H new ATOM 0 HA THR A 52 37.098 26.355 5.868 1.00 0.00 H new ATOM 0 HB THR A 52 38.855 26.026 3.397 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.562 25.922 4.975 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.886 28.117 4.230 1.00 0.00 H new ATOM 0 HG22 THR A 52 38.149 28.342 3.913 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.730 28.148 5.583 1.00 0.00 H new ATOM 276 N LEU A 53 36.208 25.920 2.710 1.00 0.00 N ATOM 277 CA LEU A 53 35.232 26.411 1.698 1.00 0.00 C ATOM 278 C LEU A 53 33.821 26.349 2.287 1.00 0.00 C ATOM 279 O LEU A 53 33.103 27.330 2.309 1.00 0.00 O ATOM 280 CB LEU A 53 35.302 25.532 0.449 1.00 0.00 C ATOM 281 CG LEU A 53 34.449 26.152 -0.659 1.00 0.00 C ATOM 282 CD1 LEU A 53 35.206 27.324 -1.290 1.00 0.00 C ATOM 283 CD2 LEU A 53 34.156 25.098 -1.729 1.00 0.00 C ATOM 0 H LEU A 53 36.788 25.136 2.410 1.00 0.00 H new ATOM 0 HA LEU A 53 35.472 27.439 1.429 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.336 25.436 0.116 1.00 0.00 H new ATOM 0 HB3 LEU A 53 34.946 24.527 0.678 1.00 0.00 H new ATOM 0 HG LEU A 53 33.510 26.511 -0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.599 27.766 -2.080 1.00 0.00 H new ATOM 0 HD12 LEU A 53 35.414 28.075 -0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 53 36.145 26.966 -1.712 1.00 0.00 H new ATOM 0 HD21 LEU A 53 33.548 25.540 -2.518 1.00 0.00 H new ATOM 0 HD22 LEU A 53 35.094 24.738 -2.152 1.00 0.00 H new ATOM 0 HD23 LEU A 53 33.617 24.264 -1.280 1.00 0.00 H new ATOM 295 N LEU A 54 33.418 25.205 2.768 1.00 0.00 N ATOM 296 CA LEU A 54 32.057 25.084 3.359 1.00 0.00 C ATOM 297 C LEU A 54 31.859 26.189 4.398 1.00 0.00 C ATOM 298 O LEU A 54 30.899 26.932 4.352 1.00 0.00 O ATOM 299 CB LEU A 54 31.910 23.719 4.034 1.00 0.00 C ATOM 300 CG LEU A 54 32.038 22.614 2.984 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.561 21.339 3.648 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.667 22.339 2.363 1.00 0.00 C ATOM 0 H LEU A 54 33.973 24.349 2.777 1.00 0.00 H new ATOM 0 HA LEU A 54 31.308 25.180 2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.675 23.597 4.801 1.00 0.00 H new ATOM 0 HB3 LEU A 54 30.944 23.651 4.533 1.00 0.00 H new ATOM 0 HG LEU A 54 32.733 22.931 2.206 1.00 0.00 H new ATOM 0 HD11 LEU A 54 32.653 20.551 2.901 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.537 21.534 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 54 31.866 21.022 4.426 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.758 21.552 1.615 1.00 0.00 H new ATOM 0 HD22 LEU A 54 29.972 22.022 3.141 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.293 23.247 1.890 1.00 0.00 H new ATOM 314 N ARG A 55 32.762 26.303 5.334 1.00 0.00 N ATOM 315 CA ARG A 55 32.626 27.362 6.373 1.00 0.00 C ATOM 316 C ARG A 55 32.218 28.675 5.703 1.00 0.00 C ATOM 317 O ARG A 55 31.398 29.413 6.211 1.00 0.00 O ATOM 318 CB ARG A 55 33.965 27.550 7.091 1.00 0.00 C ATOM 319 CG ARG A 55 34.226 26.352 8.006 1.00 0.00 C ATOM 320 CD ARG A 55 35.526 26.578 8.782 1.00 0.00 C ATOM 321 NE ARG A 55 35.949 25.304 9.427 1.00 0.00 N ATOM 322 CZ ARG A 55 36.381 25.306 10.658 1.00 0.00 C ATOM 323 NH1 ARG A 55 35.539 25.437 11.646 1.00 0.00 N ATOM 324 NH2 ARG A 55 37.657 25.176 10.901 1.00 0.00 N ATOM 0 H ARG A 55 33.587 25.709 5.424 1.00 0.00 H new ATOM 0 HA ARG A 55 31.866 27.068 7.097 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.770 27.647 6.362 1.00 0.00 H new ATOM 0 HB3 ARG A 55 33.951 28.471 7.675 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.394 26.221 8.698 1.00 0.00 H new ATOM 0 HG3 ARG A 55 34.296 25.438 7.416 1.00 0.00 H new ATOM 0 HD2 ARG A 55 36.306 26.934 8.109 1.00 0.00 H new ATOM 0 HD3 ARG A 55 35.381 27.350 9.538 1.00 0.00 H new ATOM 0 HE ARG A 55 35.901 24.429 8.906 1.00 0.00 H new ATOM 0 HH11 ARG A 55 34.542 25.538 11.456 1.00 0.00 H new ATOM 0 HH12 ARG A 55 35.878 25.438 12.608 1.00 0.00 H new ATOM 0 HH21 ARG A 55 38.315 25.073 10.129 1.00 0.00 H new ATOM 0 HH22 ARG A 55 37.996 25.177 11.863 1.00 0.00 H new ATOM 338 N GLY A 56 32.783 28.969 4.564 1.00 0.00 N ATOM 339 CA GLY A 56 32.423 30.232 3.860 1.00 0.00 C ATOM 340 C GLY A 56 30.998 30.119 3.315 1.00 0.00 C ATOM 341 O GLY A 56 30.267 31.087 3.255 1.00 0.00 O ATOM 0 H GLY A 56 33.477 28.390 4.091 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.497 31.077 4.545 1.00 0.00 H new ATOM 0 HA3 GLY A 56 33.122 30.420 3.045 1.00 0.00 H new ATOM 345 N ALA A 57 30.597 28.941 2.920 1.00 0.00 N ATOM 346 CA ALA A 57 29.220 28.764 2.382 1.00 0.00 C ATOM 347 C ALA A 57 28.227 28.675 3.543 1.00 0.00 C ATOM 348 O ALA A 57 27.033 28.821 3.365 1.00 0.00 O ATOM 349 CB ALA A 57 29.156 27.477 1.557 1.00 0.00 C ATOM 0 H ALA A 57 31.165 28.094 2.947 1.00 0.00 H new ATOM 0 HA ALA A 57 28.965 29.614 1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 57 28.148 27.347 1.163 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.864 27.539 0.730 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.411 26.626 2.189 1.00 0.00 H new ATOM 355 N PHE A 58 28.710 28.435 4.731 1.00 0.00 N ATOM 356 CA PHE A 58 27.797 28.336 5.905 1.00 0.00 C ATOM 357 C PHE A 58 28.239 29.330 6.981 1.00 0.00 C ATOM 358 O PHE A 58 27.770 29.297 8.102 1.00 0.00 O ATOM 359 CB PHE A 58 27.852 26.914 6.469 1.00 0.00 C ATOM 360 CG PHE A 58 27.315 25.944 5.444 1.00 0.00 C ATOM 361 CD1 PHE A 58 28.171 25.397 4.481 1.00 0.00 C ATOM 362 CD2 PHE A 58 25.960 25.590 5.457 1.00 0.00 C ATOM 363 CE1 PHE A 58 27.674 24.497 3.531 1.00 0.00 C ATOM 364 CE2 PHE A 58 25.462 24.690 4.507 1.00 0.00 C ATOM 365 CZ PHE A 58 26.319 24.144 3.544 1.00 0.00 C ATOM 0 H PHE A 58 29.700 28.303 4.940 1.00 0.00 H new ATOM 0 HA PHE A 58 26.778 28.568 5.596 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.878 26.654 6.729 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.266 26.852 7.386 1.00 0.00 H new ATOM 0 HD1 PHE A 58 29.216 25.670 4.471 1.00 0.00 H new ATOM 0 HD2 PHE A 58 25.299 26.011 6.200 1.00 0.00 H new ATOM 0 HE1 PHE A 58 28.335 24.075 2.789 1.00 0.00 H new ATOM 0 HE2 PHE A 58 24.417 24.417 4.517 1.00 0.00 H new ATOM 0 HZ PHE A 58 25.935 23.450 2.811 1.00 0.00 H new ATOM 375 N SER A 59 29.143 30.211 6.651 1.00 0.00 N ATOM 376 CA SER A 59 29.625 31.204 7.654 1.00 0.00 C ATOM 377 C SER A 59 28.589 32.320 7.837 1.00 0.00 C ATOM 378 O SER A 59 28.168 32.605 8.941 1.00 0.00 O ATOM 379 CB SER A 59 30.944 31.811 7.174 1.00 0.00 C ATOM 380 OG SER A 59 32.015 31.294 7.951 1.00 0.00 O ATOM 0 H SER A 59 29.570 30.287 5.728 1.00 0.00 H new ATOM 0 HA SER A 59 29.775 30.699 8.608 1.00 0.00 H new ATOM 0 HB2 SER A 59 31.101 31.580 6.120 1.00 0.00 H new ATOM 0 HB3 SER A 59 30.909 32.897 7.260 1.00 0.00 H new ATOM 0 HG SER A 59 32.195 30.368 7.685 1.00 0.00 H new ATOM 386 N PRO A 60 28.184 32.974 6.736 1.00 0.00 N ATOM 387 CA PRO A 60 27.209 34.073 6.784 1.00 0.00 C ATOM 388 C PRO A 60 25.796 33.582 7.115 1.00 0.00 C ATOM 389 O PRO A 60 25.040 34.254 7.787 1.00 0.00 O ATOM 390 CB PRO A 60 27.245 34.648 5.369 1.00 0.00 C ATOM 391 CG PRO A 60 27.710 33.519 4.514 1.00 0.00 C ATOM 392 CD PRO A 60 28.639 32.696 5.362 1.00 0.00 C ATOM 0 HA PRO A 60 27.455 34.797 7.561 1.00 0.00 H new ATOM 0 HB2 PRO A 60 26.261 35.000 5.059 1.00 0.00 H new ATOM 0 HB3 PRO A 60 27.923 35.499 5.304 1.00 0.00 H new ATOM 0 HG2 PRO A 60 26.867 32.921 4.169 1.00 0.00 H new ATOM 0 HG3 PRO A 60 28.222 33.890 3.626 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.568 31.635 5.122 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.679 32.987 5.217 1.00 0.00 H new ATOM 400 N PHE A 61 25.433 32.419 6.650 1.00 0.00 N ATOM 401 CA PHE A 61 24.068 31.899 6.943 1.00 0.00 C ATOM 402 C PHE A 61 23.881 31.780 8.457 1.00 0.00 C ATOM 403 O PHE A 61 22.801 31.981 8.977 1.00 0.00 O ATOM 404 CB PHE A 61 23.896 30.523 6.297 1.00 0.00 C ATOM 405 CG PHE A 61 23.773 30.680 4.800 1.00 0.00 C ATOM 406 CD1 PHE A 61 22.541 31.029 4.232 1.00 0.00 C ATOM 407 CD2 PHE A 61 24.889 30.476 3.982 1.00 0.00 C ATOM 408 CE1 PHE A 61 22.428 31.173 2.844 1.00 0.00 C ATOM 409 CE2 PHE A 61 24.775 30.619 2.594 1.00 0.00 C ATOM 410 CZ PHE A 61 23.545 30.968 2.026 1.00 0.00 C ATOM 0 H PHE A 61 26.020 31.808 6.082 1.00 0.00 H new ATOM 0 HA PHE A 61 23.324 32.585 6.538 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.748 29.888 6.538 1.00 0.00 H new ATOM 0 HB3 PHE A 61 23.009 30.031 6.696 1.00 0.00 H new ATOM 0 HD1 PHE A 61 21.680 31.187 4.864 1.00 0.00 H new ATOM 0 HD2 PHE A 61 25.839 30.208 4.421 1.00 0.00 H new ATOM 0 HE1 PHE A 61 21.479 31.442 2.405 1.00 0.00 H new ATOM 0 HE2 PHE A 61 25.636 30.460 1.962 1.00 0.00 H new ATOM 0 HZ PHE A 61 23.457 31.079 0.955 1.00 0.00 H new ATOM 420 N GLY A 62 24.926 31.456 9.170 1.00 0.00 N ATOM 421 CA GLY A 62 24.805 31.327 10.649 1.00 0.00 C ATOM 422 C GLY A 62 26.133 30.832 11.229 1.00 0.00 C ATOM 423 O GLY A 62 27.076 30.570 10.508 1.00 0.00 O ATOM 0 H GLY A 62 25.856 31.276 8.792 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.540 32.289 11.088 1.00 0.00 H new ATOM 0 HA3 GLY A 62 24.005 30.631 10.900 1.00 0.00 H new ATOM 427 N ASN A 63 26.214 30.699 12.524 1.00 0.00 N ATOM 428 CA ASN A 63 27.480 30.220 13.146 1.00 0.00 C ATOM 429 C ASN A 63 27.484 28.691 13.179 1.00 0.00 C ATOM 430 O ASN A 63 26.462 28.062 13.374 1.00 0.00 O ATOM 431 CB ASN A 63 27.586 30.762 14.573 1.00 0.00 C ATOM 432 CG ASN A 63 28.983 30.474 15.127 1.00 0.00 C ATOM 433 OD1 ASN A 63 29.903 30.211 14.379 1.00 0.00 O ATOM 434 ND2 ASN A 63 29.181 30.510 16.417 1.00 0.00 N ATOM 0 H ASN A 63 25.458 30.901 13.178 1.00 0.00 H new ATOM 0 HA ASN A 63 28.329 30.573 12.561 1.00 0.00 H new ATOM 0 HB2 ASN A 63 27.394 31.835 14.581 1.00 0.00 H new ATOM 0 HB3 ASN A 63 26.830 30.299 15.206 1.00 0.00 H new ATOM 0 HD21 ASN A 63 30.108 30.317 16.796 1.00 0.00 H new ATOM 0 HD22 ASN A 63 28.409 30.731 17.046 1.00 0.00 H new ATOM 441 N ILE A 64 28.624 28.087 12.991 1.00 0.00 N ATOM 442 CA ILE A 64 28.692 26.599 13.011 1.00 0.00 C ATOM 443 C ILE A 64 29.354 26.138 14.312 1.00 0.00 C ATOM 444 O ILE A 64 30.366 26.668 14.727 1.00 0.00 O ATOM 445 CB ILE A 64 29.513 26.113 11.816 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.900 26.656 10.522 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.508 24.584 11.780 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.863 26.416 9.358 1.00 0.00 C ATOM 0 H ILE A 64 29.512 28.560 12.824 1.00 0.00 H new ATOM 0 HA ILE A 64 27.685 26.185 12.951 1.00 0.00 H new ATOM 0 HB ILE A 64 30.539 26.470 11.911 1.00 0.00 H new ATOM 0 HG12 ILE A 64 27.947 26.165 10.326 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.695 27.722 10.624 1.00 0.00 H new ATOM 0 HG21 ILE A 64 30.093 24.238 10.928 1.00 0.00 H new ATOM 0 HG22 ILE A 64 29.944 24.197 12.701 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.483 24.226 11.685 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.425 26.803 8.438 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.806 26.927 9.554 1.00 0.00 H new ATOM 0 HD13 ILE A 64 30.045 25.347 9.251 1.00 0.00 H new ATOM 460 N ILE A 65 28.789 25.157 14.961 1.00 0.00 N ATOM 461 CA ILE A 65 29.383 24.667 16.236 1.00 0.00 C ATOM 462 C ILE A 65 30.158 23.372 15.979 1.00 0.00 C ATOM 463 O ILE A 65 31.076 23.035 16.699 1.00 0.00 O ATOM 464 CB ILE A 65 28.268 24.401 17.248 1.00 0.00 C ATOM 465 CG1 ILE A 65 27.408 23.229 16.768 1.00 0.00 C ATOM 466 CG2 ILE A 65 27.394 25.650 17.384 1.00 0.00 C ATOM 467 CD1 ILE A 65 26.406 22.851 17.860 1.00 0.00 C ATOM 0 H ILE A 65 27.942 24.674 14.663 1.00 0.00 H new ATOM 0 HA ILE A 65 30.062 25.422 16.632 1.00 0.00 H new ATOM 0 HB ILE A 65 28.708 24.156 18.215 1.00 0.00 H new ATOM 0 HG12 ILE A 65 26.880 23.502 15.854 1.00 0.00 H new ATOM 0 HG13 ILE A 65 28.040 22.374 16.528 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.599 25.461 18.105 1.00 0.00 H new ATOM 0 HG22 ILE A 65 28.004 26.485 17.727 1.00 0.00 H new ATOM 0 HG23 ILE A 65 26.956 25.894 16.416 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.793 22.017 17.519 1.00 0.00 H new ATOM 0 HD12 ILE A 65 26.944 22.561 18.763 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.766 23.706 18.078 1.00 0.00 H new ATOM 479 N ASP A 66 29.795 22.643 14.960 1.00 0.00 N ATOM 480 CA ASP A 66 30.512 21.370 14.664 1.00 0.00 C ATOM 481 C ASP A 66 30.642 21.194 13.149 1.00 0.00 C ATOM 482 O ASP A 66 29.661 21.055 12.445 1.00 0.00 O ATOM 483 CB ASP A 66 29.729 20.195 15.249 1.00 0.00 C ATOM 484 CG ASP A 66 30.583 18.927 15.181 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.690 19.009 14.677 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.113 17.895 15.631 1.00 0.00 O ATOM 0 H ASP A 66 29.034 22.873 14.320 1.00 0.00 H new ATOM 0 HA ASP A 66 31.506 21.403 15.111 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.454 20.406 16.282 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.801 20.051 14.696 1.00 0.00 H new ATOM 491 N LEU A 67 31.844 21.196 12.643 1.00 0.00 N ATOM 492 CA LEU A 67 32.037 21.027 11.176 1.00 0.00 C ATOM 493 C LEU A 67 32.556 19.616 10.889 1.00 0.00 C ATOM 494 O LEU A 67 33.639 19.249 11.295 1.00 0.00 O ATOM 495 CB LEU A 67 33.053 22.054 10.674 1.00 0.00 C ATOM 496 CG LEU A 67 33.365 21.786 9.200 1.00 0.00 C ATOM 497 CD1 LEU A 67 32.223 22.320 8.333 1.00 0.00 C ATOM 498 CD2 LEU A 67 34.668 22.489 8.817 1.00 0.00 C ATOM 0 H LEU A 67 32.702 21.308 13.183 1.00 0.00 H new ATOM 0 HA LEU A 67 31.086 21.176 10.665 1.00 0.00 H new ATOM 0 HB2 LEU A 67 32.657 23.062 10.795 1.00 0.00 H new ATOM 0 HB3 LEU A 67 33.966 21.997 11.266 1.00 0.00 H new ATOM 0 HG LEU A 67 33.472 20.713 9.041 1.00 0.00 H new ATOM 0 HD11 LEU A 67 32.444 22.130 7.283 1.00 0.00 H new ATOM 0 HD12 LEU A 67 31.294 21.818 8.605 1.00 0.00 H new ATOM 0 HD13 LEU A 67 32.116 23.393 8.493 1.00 0.00 H new ATOM 0 HD21 LEU A 67 34.890 22.298 7.767 1.00 0.00 H new ATOM 0 HD22 LEU A 67 34.563 23.562 8.976 1.00 0.00 H new ATOM 0 HD23 LEU A 67 35.482 22.109 9.435 1.00 0.00 H new ATOM 510 N SER A 68 31.790 18.823 10.191 1.00 0.00 N ATOM 511 CA SER A 68 32.242 17.437 9.879 1.00 0.00 C ATOM 512 C SER A 68 32.221 17.224 8.363 1.00 0.00 C ATOM 513 O SER A 68 31.391 17.768 7.662 1.00 0.00 O ATOM 514 CB SER A 68 31.304 16.433 10.550 1.00 0.00 C ATOM 515 OG SER A 68 31.447 16.520 11.960 1.00 0.00 O ATOM 0 H SER A 68 30.872 19.074 9.824 1.00 0.00 H new ATOM 0 HA SER A 68 33.256 17.291 10.252 1.00 0.00 H new ATOM 0 HB2 SER A 68 30.272 16.637 10.265 1.00 0.00 H new ATOM 0 HB3 SER A 68 31.534 15.422 10.212 1.00 0.00 H new ATOM 0 HG SER A 68 30.845 15.878 12.390 1.00 0.00 H new ATOM 521 N MET A 69 33.129 16.439 7.851 1.00 0.00 N ATOM 522 CA MET A 69 33.159 16.196 6.381 1.00 0.00 C ATOM 523 C MET A 69 33.266 14.694 6.111 1.00 0.00 C ATOM 524 O MET A 69 33.819 13.949 6.895 1.00 0.00 O ATOM 525 CB MET A 69 34.368 16.910 5.773 1.00 0.00 C ATOM 526 CG MET A 69 34.211 18.421 5.954 1.00 0.00 C ATOM 527 SD MET A 69 35.411 19.282 4.906 1.00 0.00 S ATOM 528 CE MET A 69 34.693 18.819 3.312 1.00 0.00 C ATOM 0 H MET A 69 33.851 15.956 8.386 1.00 0.00 H new ATOM 0 HA MET A 69 32.243 16.580 5.931 1.00 0.00 H new ATOM 0 HB2 MET A 69 35.285 16.569 6.253 1.00 0.00 H new ATOM 0 HB3 MET A 69 34.453 16.667 4.714 1.00 0.00 H new ATOM 0 HG2 MET A 69 33.198 18.726 5.692 1.00 0.00 H new ATOM 0 HG3 MET A 69 34.365 18.691 6.999 1.00 0.00 H new ATOM 0 HE1 MET A 69 35.377 18.155 2.784 1.00 0.00 H new ATOM 0 HE2 MET A 69 33.745 18.307 3.475 1.00 0.00 H new ATOM 0 HE3 MET A 69 34.524 19.715 2.715 1.00 0.00 H new ATOM 538 N ASP A 70 32.742 14.243 5.003 1.00 0.00 N ATOM 539 CA ASP A 70 32.814 12.790 4.679 1.00 0.00 C ATOM 540 C ASP A 70 33.431 12.609 3.290 1.00 0.00 C ATOM 541 O ASP A 70 32.790 12.830 2.283 1.00 0.00 O ATOM 542 CB ASP A 70 31.406 12.193 4.693 1.00 0.00 C ATOM 543 CG ASP A 70 31.393 10.931 5.557 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.265 10.807 6.402 1.00 0.00 O ATOM 545 OD2 ASP A 70 30.513 10.110 5.359 1.00 0.00 O ATOM 0 H ASP A 70 32.267 14.819 4.308 1.00 0.00 H new ATOM 0 HA ASP A 70 33.430 12.282 5.421 1.00 0.00 H new ATOM 0 HB2 ASP A 70 30.695 12.921 5.084 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.091 11.954 3.677 1.00 0.00 H new ATOM 550 N PRO A 71 34.709 12.199 3.243 1.00 0.00 N ATOM 551 CA PRO A 71 35.422 11.987 1.983 1.00 0.00 C ATOM 552 C PRO A 71 35.008 10.699 1.243 1.00 0.00 C ATOM 553 O PRO A 71 35.109 10.634 0.034 1.00 0.00 O ATOM 554 CB PRO A 71 36.888 11.907 2.407 1.00 0.00 C ATOM 555 CG PRO A 71 36.865 11.466 3.833 1.00 0.00 C ATOM 556 CD PRO A 71 35.551 11.916 4.420 1.00 0.00 C ATOM 0 HA PRO A 71 35.203 12.786 1.274 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.438 11.200 1.786 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.380 12.874 2.303 1.00 0.00 H new ATOM 0 HG2 PRO A 71 36.966 10.383 3.902 1.00 0.00 H new ATOM 0 HG3 PRO A 71 37.700 11.900 4.383 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.110 11.143 5.049 1.00 0.00 H new ATOM 0 HD3 PRO A 71 35.675 12.802 5.043 1.00 0.00 H new ATOM 564 N PRO A 72 34.539 9.648 1.953 1.00 0.00 N ATOM 565 CA PRO A 72 34.136 8.398 1.298 1.00 0.00 C ATOM 566 C PRO A 72 32.789 8.536 0.581 1.00 0.00 C ATOM 567 O PRO A 72 32.496 7.815 -0.351 1.00 0.00 O ATOM 568 CB PRO A 72 34.010 7.406 2.449 1.00 0.00 C ATOM 569 CG PRO A 72 33.723 8.242 3.650 1.00 0.00 C ATOM 570 CD PRO A 72 34.364 9.584 3.419 1.00 0.00 C ATOM 0 HA PRO A 72 34.852 8.095 0.534 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.209 6.689 2.266 1.00 0.00 H new ATOM 0 HB3 PRO A 72 34.928 6.832 2.578 1.00 0.00 H new ATOM 0 HG2 PRO A 72 32.648 8.349 3.797 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.123 7.774 4.550 1.00 0.00 H new ATOM 0 HD2 PRO A 72 33.733 10.396 3.782 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.318 9.665 3.939 1.00 0.00 H new ATOM 578 N ARG A 73 31.967 9.454 1.011 1.00 0.00 N ATOM 579 CA ARG A 73 30.640 9.630 0.353 1.00 0.00 C ATOM 580 C ARG A 73 30.587 10.992 -0.344 1.00 0.00 C ATOM 581 O ARG A 73 29.580 11.371 -0.909 1.00 0.00 O ATOM 582 CB ARG A 73 29.536 9.555 1.408 1.00 0.00 C ATOM 583 CG ARG A 73 29.558 8.177 2.072 1.00 0.00 C ATOM 584 CD ARG A 73 28.394 8.066 3.059 1.00 0.00 C ATOM 585 NE ARG A 73 28.545 6.824 3.866 1.00 0.00 N ATOM 586 CZ ARG A 73 28.575 5.661 3.274 1.00 0.00 C ATOM 587 NH1 ARG A 73 27.896 5.470 2.178 1.00 0.00 N ATOM 588 NH2 ARG A 73 29.285 4.690 3.780 1.00 0.00 N ATOM 0 H ARG A 73 32.156 10.088 1.787 1.00 0.00 H new ATOM 0 HA ARG A 73 30.495 8.841 -0.385 1.00 0.00 H new ATOM 0 HB2 ARG A 73 29.680 10.334 2.157 1.00 0.00 H new ATOM 0 HB3 ARG A 73 28.565 9.733 0.947 1.00 0.00 H new ATOM 0 HG2 ARG A 73 29.483 7.396 1.315 1.00 0.00 H new ATOM 0 HG3 ARG A 73 30.504 8.027 2.591 1.00 0.00 H new ATOM 0 HD2 ARG A 73 28.374 8.937 3.713 1.00 0.00 H new ATOM 0 HD3 ARG A 73 27.447 8.050 2.520 1.00 0.00 H new ATOM 0 HE ARG A 73 28.625 6.882 4.881 1.00 0.00 H new ATOM 0 HH11 ARG A 73 27.341 6.229 1.783 1.00 0.00 H new ATOM 0 HH12 ARG A 73 27.919 4.561 1.715 1.00 0.00 H new ATOM 0 HH21 ARG A 73 29.816 4.840 4.638 1.00 0.00 H new ATOM 0 HH22 ARG A 73 29.309 3.781 3.318 1.00 0.00 H new ATOM 602 N ASN A 74 31.662 11.732 -0.312 1.00 0.00 N ATOM 603 CA ASN A 74 31.667 13.065 -0.975 1.00 0.00 C ATOM 604 C ASN A 74 30.558 13.936 -0.381 1.00 0.00 C ATOM 605 O ASN A 74 29.895 14.677 -1.079 1.00 0.00 O ATOM 606 CB ASN A 74 31.424 12.890 -2.476 1.00 0.00 C ATOM 607 CG ASN A 74 32.535 12.026 -3.077 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.690 12.171 -2.728 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.232 11.128 -3.974 1.00 0.00 N ATOM 0 H ASN A 74 32.536 11.470 0.145 1.00 0.00 H new ATOM 0 HA ASN A 74 32.633 13.545 -0.815 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.454 12.423 -2.646 1.00 0.00 H new ATOM 0 HB3 ASN A 74 31.400 13.863 -2.967 1.00 0.00 H new ATOM 0 HD21 ASN A 74 32.965 10.548 -4.382 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.263 11.006 -4.267 1.00 0.00 H new ATOM 616 N CYS A 75 30.350 13.853 0.905 1.00 0.00 N ATOM 617 CA CYS A 75 29.282 14.677 1.539 1.00 0.00 C ATOM 618 C CYS A 75 29.815 15.302 2.829 1.00 0.00 C ATOM 619 O CYS A 75 30.439 14.643 3.637 1.00 0.00 O ATOM 620 CB CYS A 75 28.078 13.790 1.861 1.00 0.00 C ATOM 621 SG CYS A 75 28.565 12.525 3.059 1.00 0.00 S ATOM 0 H CYS A 75 30.872 13.252 1.543 1.00 0.00 H new ATOM 0 HA CYS A 75 28.978 15.467 0.853 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.265 14.394 2.264 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.705 13.320 0.951 1.00 0.00 H new ATOM 0 HG CYS A 75 28.327 12.953 4.263 1.00 0.00 H new ATOM 627 N ALA A 76 29.572 16.568 3.031 1.00 0.00 N ATOM 628 CA ALA A 76 30.063 17.232 4.270 1.00 0.00 C ATOM 629 C ALA A 76 28.884 17.482 5.212 1.00 0.00 C ATOM 630 O ALA A 76 27.739 17.464 4.806 1.00 0.00 O ATOM 631 CB ALA A 76 30.720 18.567 3.909 1.00 0.00 C ATOM 0 H ALA A 76 29.055 17.171 2.391 1.00 0.00 H new ATOM 0 HA ALA A 76 30.794 16.590 4.762 1.00 0.00 H new ATOM 0 HB1 ALA A 76 31.079 19.053 4.816 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.559 18.389 3.236 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.990 19.210 3.418 1.00 0.00 H new ATOM 637 N PHE A 77 29.153 17.712 6.467 1.00 0.00 N ATOM 638 CA PHE A 77 28.044 17.959 7.431 1.00 0.00 C ATOM 639 C PHE A 77 28.280 19.286 8.156 1.00 0.00 C ATOM 640 O PHE A 77 29.336 19.526 8.705 1.00 0.00 O ATOM 641 CB PHE A 77 27.995 16.821 8.454 1.00 0.00 C ATOM 642 CG PHE A 77 27.673 15.523 7.750 1.00 0.00 C ATOM 643 CD1 PHE A 77 28.709 14.723 7.252 1.00 0.00 C ATOM 644 CD2 PHE A 77 26.341 15.121 7.596 1.00 0.00 C ATOM 645 CE1 PHE A 77 28.411 13.520 6.602 1.00 0.00 C ATOM 646 CE2 PHE A 77 26.045 13.918 6.945 1.00 0.00 C ATOM 647 CZ PHE A 77 27.079 13.118 6.448 1.00 0.00 C ATOM 0 H PHE A 77 30.091 17.740 6.867 1.00 0.00 H new ATOM 0 HA PHE A 77 27.098 18.005 6.891 1.00 0.00 H new ATOM 0 HB2 PHE A 77 28.952 16.740 8.969 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.241 17.032 9.213 1.00 0.00 H new ATOM 0 HD1 PHE A 77 29.737 15.034 7.369 1.00 0.00 H new ATOM 0 HD2 PHE A 77 25.542 15.739 7.979 1.00 0.00 H new ATOM 0 HE1 PHE A 77 29.209 12.901 6.219 1.00 0.00 H new ATOM 0 HE2 PHE A 77 25.018 13.607 6.826 1.00 0.00 H new ATOM 0 HZ PHE A 77 26.850 12.190 5.945 1.00 0.00 H new ATOM 657 N VAL A 78 27.300 20.149 8.166 1.00 0.00 N ATOM 658 CA VAL A 78 27.466 21.457 8.859 1.00 0.00 C ATOM 659 C VAL A 78 26.450 21.555 9.997 1.00 0.00 C ATOM 660 O VAL A 78 25.320 21.129 9.870 1.00 0.00 O ATOM 661 CB VAL A 78 27.232 22.595 7.865 1.00 0.00 C ATOM 662 CG1 VAL A 78 27.666 23.921 8.494 1.00 0.00 C ATOM 663 CG2 VAL A 78 28.052 22.341 6.597 1.00 0.00 C ATOM 0 H VAL A 78 26.392 20.004 7.724 1.00 0.00 H new ATOM 0 HA VAL A 78 28.476 21.533 9.262 1.00 0.00 H new ATOM 0 HB VAL A 78 26.173 22.643 7.611 1.00 0.00 H new ATOM 0 HG11 VAL A 78 27.499 24.732 7.785 1.00 0.00 H new ATOM 0 HG12 VAL A 78 27.084 24.103 9.397 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.725 23.874 8.748 1.00 0.00 H new ATOM 0 HG21 VAL A 78 27.886 23.152 5.888 1.00 0.00 H new ATOM 0 HG22 VAL A 78 29.111 22.293 6.852 1.00 0.00 H new ATOM 0 HG23 VAL A 78 27.744 21.397 6.148 1.00 0.00 H new ATOM 673 N THR A 79 26.844 22.107 11.110 1.00 0.00 N ATOM 674 CA THR A 79 25.902 22.224 12.257 1.00 0.00 C ATOM 675 C THR A 79 25.566 23.699 12.498 1.00 0.00 C ATOM 676 O THR A 79 26.442 24.531 12.628 1.00 0.00 O ATOM 677 CB THR A 79 26.555 21.634 13.509 1.00 0.00 C ATOM 678 OG1 THR A 79 27.453 20.600 13.128 1.00 0.00 O ATOM 679 CG2 THR A 79 25.477 21.063 14.431 1.00 0.00 C ATOM 0 H THR A 79 27.778 22.482 11.275 1.00 0.00 H new ATOM 0 HA THR A 79 24.985 21.679 12.033 1.00 0.00 H new ATOM 0 HB THR A 79 27.101 22.416 14.037 1.00 0.00 H new ATOM 0 HG1 THR A 79 28.294 20.995 12.817 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.945 20.644 15.322 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.789 21.857 14.722 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.927 20.281 13.907 1.00 0.00 H new ATOM 687 N TYR A 80 24.303 24.027 12.557 1.00 0.00 N ATOM 688 CA TYR A 80 23.908 25.446 12.788 1.00 0.00 C ATOM 689 C TYR A 80 23.273 25.577 14.173 1.00 0.00 C ATOM 690 O TYR A 80 22.352 24.862 14.513 1.00 0.00 O ATOM 691 CB TYR A 80 22.898 25.876 11.723 1.00 0.00 C ATOM 692 CG TYR A 80 23.632 26.505 10.562 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.642 27.443 10.799 1.00 0.00 C ATOM 694 CD2 TYR A 80 23.303 26.145 9.249 1.00 0.00 C ATOM 695 CE1 TYR A 80 25.326 28.022 9.723 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.987 26.723 8.174 1.00 0.00 C ATOM 697 CZ TYR A 80 24.998 27.662 8.411 1.00 0.00 C ATOM 698 OH TYR A 80 25.672 28.231 7.351 1.00 0.00 O ATOM 0 H TYR A 80 23.527 23.373 12.455 1.00 0.00 H new ATOM 0 HA TYR A 80 24.791 26.083 12.729 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.324 25.015 11.381 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.187 26.586 12.146 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.894 27.721 11.812 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.522 25.422 9.067 1.00 0.00 H new ATOM 0 HE1 TYR A 80 26.106 28.746 9.906 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.735 26.445 7.161 1.00 0.00 H new ATOM 0 HH TYR A 80 26.064 29.084 7.633 1.00 0.00 H new ATOM 708 N GLU A 81 23.764 26.484 14.975 1.00 0.00 N ATOM 709 CA GLU A 81 23.202 26.670 16.344 1.00 0.00 C ATOM 710 C GLU A 81 21.675 26.566 16.307 1.00 0.00 C ATOM 711 O GLU A 81 21.062 26.008 17.195 1.00 0.00 O ATOM 712 CB GLU A 81 23.604 28.047 16.875 1.00 0.00 C ATOM 713 CG GLU A 81 23.097 28.209 18.310 1.00 0.00 C ATOM 714 CD GLU A 81 23.537 29.570 18.854 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.114 30.331 18.095 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.289 29.828 20.021 1.00 0.00 O ATOM 0 H GLU A 81 24.535 27.108 14.738 1.00 0.00 H new ATOM 0 HA GLU A 81 23.595 25.892 16.998 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.688 28.157 16.846 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.187 28.829 16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.010 28.129 18.335 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.490 27.410 18.939 1.00 0.00 H new ATOM 723 N LYS A 82 21.053 27.099 15.293 1.00 0.00 N ATOM 724 CA LYS A 82 19.566 27.028 15.215 1.00 0.00 C ATOM 725 C LYS A 82 19.151 26.435 13.868 1.00 0.00 C ATOM 726 O LYS A 82 19.883 26.491 12.900 1.00 0.00 O ATOM 727 CB LYS A 82 18.980 28.433 15.357 1.00 0.00 C ATOM 728 CG LYS A 82 19.387 29.022 16.709 1.00 0.00 C ATOM 729 CD LYS A 82 18.780 30.419 16.860 1.00 0.00 C ATOM 730 CE LYS A 82 19.253 31.041 18.176 1.00 0.00 C ATOM 731 NZ LYS A 82 20.569 31.706 17.964 1.00 0.00 N ATOM 0 H LYS A 82 21.508 27.580 14.517 1.00 0.00 H new ATOM 0 HA LYS A 82 19.191 26.395 16.019 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.337 29.071 14.548 1.00 0.00 H new ATOM 0 HB3 LYS A 82 17.894 28.395 15.277 1.00 0.00 H new ATOM 0 HG2 LYS A 82 19.045 28.376 17.517 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.473 29.076 16.782 1.00 0.00 H new ATOM 0 HD2 LYS A 82 19.076 31.048 16.021 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.692 30.358 16.845 1.00 0.00 H new ATOM 0 HE2 LYS A 82 18.521 31.765 18.533 1.00 0.00 H new ATOM 0 HE3 LYS A 82 19.341 30.272 18.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 20.892 32.129 18.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 21.265 31.004 17.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 20.470 32.450 17.244 1.00 0.00 H new ATOM 745 N MET A 83 17.978 25.869 13.798 1.00 0.00 N ATOM 746 CA MET A 83 17.512 25.274 12.515 1.00 0.00 C ATOM 747 C MET A 83 17.136 26.393 11.543 1.00 0.00 C ATOM 748 O MET A 83 17.090 26.199 10.345 1.00 0.00 O ATOM 749 CB MET A 83 16.290 24.391 12.776 1.00 0.00 C ATOM 750 CG MET A 83 16.690 23.221 13.677 1.00 0.00 C ATOM 751 SD MET A 83 15.426 21.929 13.583 1.00 0.00 S ATOM 752 CE MET A 83 16.219 20.752 14.706 1.00 0.00 C ATOM 0 H MET A 83 17.322 25.793 14.575 1.00 0.00 H new ATOM 0 HA MET A 83 18.310 24.670 12.083 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.500 24.975 13.249 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.890 24.018 11.833 1.00 0.00 H new ATOM 0 HG2 MET A 83 17.656 22.823 13.367 1.00 0.00 H new ATOM 0 HG3 MET A 83 16.801 23.562 14.706 1.00 0.00 H new ATOM 0 HE1 MET A 83 16.319 19.787 14.210 1.00 0.00 H new ATOM 0 HE2 MET A 83 17.206 21.122 14.983 1.00 0.00 H new ATOM 0 HE3 MET A 83 15.610 20.638 15.603 1.00 0.00 H new ATOM 762 N GLU A 84 16.869 27.566 12.050 1.00 0.00 N ATOM 763 CA GLU A 84 16.499 28.697 11.153 1.00 0.00 C ATOM 764 C GLU A 84 17.694 29.057 10.271 1.00 0.00 C ATOM 765 O GLU A 84 17.582 29.155 9.065 1.00 0.00 O ATOM 766 CB GLU A 84 16.104 29.911 11.997 1.00 0.00 C ATOM 767 CG GLU A 84 14.794 29.619 12.730 1.00 0.00 C ATOM 768 CD GLU A 84 14.351 30.864 13.500 1.00 0.00 C ATOM 769 OE1 GLU A 84 15.128 31.803 13.569 1.00 0.00 O ATOM 770 OE2 GLU A 84 13.241 30.858 14.008 1.00 0.00 O ATOM 0 H GLU A 84 16.891 27.789 13.045 1.00 0.00 H new ATOM 0 HA GLU A 84 15.658 28.403 10.525 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.892 30.140 12.715 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.989 30.788 11.360 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.023 29.326 12.017 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.928 28.783 13.416 1.00 0.00 H new ATOM 777 N SER A 85 18.843 29.252 10.861 1.00 0.00 N ATOM 778 CA SER A 85 20.043 29.602 10.051 1.00 0.00 C ATOM 779 C SER A 85 20.310 28.488 9.038 1.00 0.00 C ATOM 780 O SER A 85 20.739 28.734 7.929 1.00 0.00 O ATOM 781 CB SER A 85 21.253 29.757 10.973 1.00 0.00 C ATOM 782 OG SER A 85 20.963 30.718 11.977 1.00 0.00 O ATOM 0 H SER A 85 19.001 29.184 11.866 1.00 0.00 H new ATOM 0 HA SER A 85 19.869 30.540 9.524 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.499 28.799 11.432 1.00 0.00 H new ATOM 0 HB3 SER A 85 22.125 30.068 10.397 1.00 0.00 H new ATOM 0 HG SER A 85 21.738 30.816 12.569 1.00 0.00 H new ATOM 788 N ALA A 86 20.054 27.263 9.411 1.00 0.00 N ATOM 789 CA ALA A 86 20.288 26.135 8.468 1.00 0.00 C ATOM 790 C ALA A 86 19.182 26.125 7.414 1.00 0.00 C ATOM 791 O ALA A 86 19.390 25.734 6.282 1.00 0.00 O ATOM 792 CB ALA A 86 20.273 24.813 9.239 1.00 0.00 C ATOM 0 H ALA A 86 19.693 26.996 10.327 1.00 0.00 H new ATOM 0 HA ALA A 86 21.256 26.257 7.982 1.00 0.00 H new ATOM 0 HB1 ALA A 86 20.444 23.987 8.549 1.00 0.00 H new ATOM 0 HB2 ALA A 86 21.059 24.823 9.994 1.00 0.00 H new ATOM 0 HB3 ALA A 86 19.305 24.686 9.724 1.00 0.00 H new ATOM 798 N ASP A 87 18.004 26.557 7.776 1.00 0.00 N ATOM 799 CA ASP A 87 16.883 26.577 6.797 1.00 0.00 C ATOM 800 C ASP A 87 17.177 27.616 5.714 1.00 0.00 C ATOM 801 O ASP A 87 16.881 27.418 4.552 1.00 0.00 O ATOM 802 CB ASP A 87 15.585 26.946 7.519 1.00 0.00 C ATOM 803 CG ASP A 87 15.094 25.746 8.332 1.00 0.00 C ATOM 804 OD1 ASP A 87 15.650 24.673 8.160 1.00 0.00 O ATOM 805 OD2 ASP A 87 14.173 25.920 9.111 1.00 0.00 O ATOM 0 H ASP A 87 17.771 26.897 8.709 1.00 0.00 H new ATOM 0 HA ASP A 87 16.778 25.593 6.340 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.752 27.800 8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 87 14.826 27.244 6.796 1.00 0.00 H new ATOM 810 N GLN A 88 17.762 28.723 6.085 1.00 0.00 N ATOM 811 CA GLN A 88 18.079 29.774 5.077 1.00 0.00 C ATOM 812 C GLN A 88 19.221 29.290 4.181 1.00 0.00 C ATOM 813 O GLN A 88 19.199 29.469 2.980 1.00 0.00 O ATOM 814 CB GLN A 88 18.503 31.057 5.795 1.00 0.00 C ATOM 815 CG GLN A 88 18.723 32.167 4.769 1.00 0.00 C ATOM 816 CD GLN A 88 19.147 33.450 5.489 1.00 0.00 C ATOM 817 OE1 GLN A 88 19.144 33.509 6.703 1.00 0.00 O ATOM 818 NE2 GLN A 88 19.513 34.488 4.787 1.00 0.00 N ATOM 0 H GLN A 88 18.034 28.944 7.043 1.00 0.00 H new ATOM 0 HA GLN A 88 17.197 29.973 4.468 1.00 0.00 H new ATOM 0 HB2 GLN A 88 17.737 31.356 6.511 1.00 0.00 H new ATOM 0 HB3 GLN A 88 19.418 30.884 6.361 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.489 31.869 4.053 1.00 0.00 H new ATOM 0 HG3 GLN A 88 17.808 32.340 4.203 1.00 0.00 H new ATOM 0 HE21 GLN A 88 19.516 34.439 3.768 1.00 0.00 H new ATOM 0 HE22 GLN A 88 19.796 35.348 5.257 1.00 0.00 H new ATOM 827 N ALA A 89 20.219 28.675 4.756 1.00 0.00 N ATOM 828 CA ALA A 89 21.361 28.181 3.936 1.00 0.00 C ATOM 829 C ALA A 89 20.889 27.019 3.060 1.00 0.00 C ATOM 830 O ALA A 89 21.228 26.929 1.897 1.00 0.00 O ATOM 831 CB ALA A 89 22.482 27.700 4.860 1.00 0.00 C ATOM 0 H ALA A 89 20.292 28.494 5.757 1.00 0.00 H new ATOM 0 HA ALA A 89 21.733 28.988 3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.318 27.339 4.261 1.00 0.00 H new ATOM 0 HB2 ALA A 89 22.816 28.526 5.487 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.112 26.892 5.491 1.00 0.00 H new ATOM 837 N VAL A 90 20.111 26.127 3.608 1.00 0.00 N ATOM 838 CA VAL A 90 19.620 24.972 2.806 1.00 0.00 C ATOM 839 C VAL A 90 18.849 25.487 1.587 1.00 0.00 C ATOM 840 O VAL A 90 18.921 24.927 0.513 1.00 0.00 O ATOM 841 CB VAL A 90 18.695 24.110 3.666 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.046 23.033 2.794 1.00 0.00 C ATOM 843 CG2 VAL A 90 19.506 23.444 4.779 1.00 0.00 C ATOM 0 H VAL A 90 19.794 26.148 4.577 1.00 0.00 H new ATOM 0 HA VAL A 90 20.469 24.375 2.474 1.00 0.00 H new ATOM 0 HB VAL A 90 17.920 24.737 4.107 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.386 22.418 3.406 1.00 0.00 H new ATOM 0 HG12 VAL A 90 17.468 23.507 2.001 1.00 0.00 H new ATOM 0 HG13 VAL A 90 18.821 22.406 2.353 1.00 0.00 H new ATOM 0 HG21 VAL A 90 18.847 22.830 5.392 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.281 22.817 4.339 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.969 24.211 5.400 1.00 0.00 H new ATOM 853 N ALA A 91 18.110 26.551 1.748 1.00 0.00 N ATOM 854 CA ALA A 91 17.333 27.098 0.600 1.00 0.00 C ATOM 855 C ALA A 91 18.275 27.842 -0.349 1.00 0.00 C ATOM 856 O ALA A 91 18.309 27.580 -1.535 1.00 0.00 O ATOM 857 CB ALA A 91 16.271 28.069 1.121 1.00 0.00 C ATOM 0 H ALA A 91 18.011 27.064 2.624 1.00 0.00 H new ATOM 0 HA ALA A 91 16.851 26.279 0.067 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.702 28.470 0.282 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.598 27.543 1.798 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.756 28.887 1.654 1.00 0.00 H new ATOM 863 N GLU A 92 19.035 28.769 0.163 1.00 0.00 N ATOM 864 CA GLU A 92 19.970 29.533 -0.710 1.00 0.00 C ATOM 865 C GLU A 92 21.068 28.601 -1.228 1.00 0.00 C ATOM 866 O GLU A 92 21.435 28.642 -2.385 1.00 0.00 O ATOM 867 CB GLU A 92 20.602 30.670 0.095 1.00 0.00 C ATOM 868 CG GLU A 92 19.506 31.607 0.603 1.00 0.00 C ATOM 869 CD GLU A 92 18.804 32.262 -0.588 1.00 0.00 C ATOM 870 OE1 GLU A 92 19.341 32.189 -1.681 1.00 0.00 O ATOM 871 OE2 GLU A 92 17.741 32.827 -0.387 1.00 0.00 O ATOM 0 H GLU A 92 19.049 29.031 1.149 1.00 0.00 H new ATOM 0 HA GLU A 92 19.420 29.947 -1.556 1.00 0.00 H new ATOM 0 HB2 GLU A 92 21.167 30.265 0.935 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.307 31.222 -0.527 1.00 0.00 H new ATOM 0 HG2 GLU A 92 18.786 31.050 1.202 1.00 0.00 H new ATOM 0 HG3 GLU A 92 19.937 32.371 1.250 1.00 0.00 H new ATOM 878 N LEU A 93 21.598 27.763 -0.380 1.00 0.00 N ATOM 879 CA LEU A 93 22.674 26.833 -0.825 1.00 0.00 C ATOM 880 C LEU A 93 22.090 25.793 -1.785 1.00 0.00 C ATOM 881 O LEU A 93 22.712 25.419 -2.760 1.00 0.00 O ATOM 882 CB LEU A 93 23.273 26.126 0.392 1.00 0.00 C ATOM 883 CG LEU A 93 23.876 27.165 1.338 1.00 0.00 C ATOM 884 CD1 LEU A 93 24.476 26.459 2.556 1.00 0.00 C ATOM 885 CD2 LEU A 93 24.973 27.943 0.608 1.00 0.00 C ATOM 0 H LEU A 93 21.333 27.682 0.602 1.00 0.00 H new ATOM 0 HA LEU A 93 23.453 27.399 -1.336 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.503 25.552 0.908 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.039 25.419 0.075 1.00 0.00 H new ATOM 0 HG LEU A 93 23.097 27.854 1.665 1.00 0.00 H new ATOM 0 HD11 LEU A 93 24.906 27.199 3.231 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.695 25.904 3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.255 25.770 2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 93 25.403 28.684 1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 93 25.752 27.254 0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 93 24.546 28.446 -0.260 1.00 0.00 H new ATOM 897 N ASN A 94 20.903 25.322 -1.518 1.00 0.00 N ATOM 898 CA ASN A 94 20.288 24.307 -2.419 1.00 0.00 C ATOM 899 C ASN A 94 19.968 24.950 -3.770 1.00 0.00 C ATOM 900 O ASN A 94 19.356 25.996 -3.841 1.00 0.00 O ATOM 901 CB ASN A 94 19.000 23.777 -1.788 1.00 0.00 C ATOM 902 CG ASN A 94 18.350 22.764 -2.729 1.00 0.00 C ATOM 903 OD1 ASN A 94 17.697 23.135 -3.685 1.00 0.00 O ATOM 904 ND2 ASN A 94 18.502 21.490 -2.499 1.00 0.00 N ATOM 0 H ASN A 94 20.334 25.595 -0.717 1.00 0.00 H new ATOM 0 HA ASN A 94 20.986 23.483 -2.566 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.219 23.309 -0.828 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.313 24.600 -1.592 1.00 0.00 H new ATOM 0 HD21 ASN A 94 18.073 20.805 -3.121 1.00 0.00 H new ATOM 0 HD22 ASN A 94 19.050 21.178 -1.697 1.00 0.00 H new ATOM 911 N GLY A 95 20.377 24.330 -4.843 1.00 0.00 N ATOM 912 CA GLY A 95 20.097 24.905 -6.188 1.00 0.00 C ATOM 913 C GLY A 95 21.191 25.909 -6.552 1.00 0.00 C ATOM 914 O GLY A 95 20.951 26.884 -7.237 1.00 0.00 O ATOM 0 H GLY A 95 20.893 23.450 -4.846 1.00 0.00 H new ATOM 0 HA2 GLY A 95 20.055 24.111 -6.933 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.124 25.395 -6.190 1.00 0.00 H new ATOM 918 N THR A 96 22.394 25.681 -6.100 1.00 0.00 N ATOM 919 CA THR A 96 23.503 26.624 -6.421 1.00 0.00 C ATOM 920 C THR A 96 24.595 25.882 -7.193 1.00 0.00 C ATOM 921 O THR A 96 24.678 24.670 -7.161 1.00 0.00 O ATOM 922 CB THR A 96 24.088 27.184 -5.122 1.00 0.00 C ATOM 923 OG1 THR A 96 24.813 26.163 -4.452 1.00 0.00 O ATOM 924 CG2 THR A 96 22.956 27.683 -4.224 1.00 0.00 C ATOM 0 H THR A 96 22.657 24.883 -5.522 1.00 0.00 H new ATOM 0 HA THR A 96 23.119 27.443 -7.030 1.00 0.00 H new ATOM 0 HB THR A 96 24.757 28.013 -5.352 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.226 25.712 -3.810 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.374 28.081 -3.299 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.402 28.467 -4.739 1.00 0.00 H new ATOM 0 HG23 THR A 96 22.284 26.856 -3.992 1.00 0.00 H new ATOM 932 N GLN A 97 25.434 26.600 -7.888 1.00 0.00 N ATOM 933 CA GLN A 97 26.520 25.936 -8.663 1.00 0.00 C ATOM 934 C GLN A 97 27.832 26.696 -8.457 1.00 0.00 C ATOM 935 O GLN A 97 27.839 27.848 -8.070 1.00 0.00 O ATOM 936 CB GLN A 97 26.158 25.935 -10.149 1.00 0.00 C ATOM 937 CG GLN A 97 27.248 25.208 -10.938 1.00 0.00 C ATOM 938 CD GLN A 97 26.914 25.257 -12.431 1.00 0.00 C ATOM 939 OE1 GLN A 97 25.851 25.702 -12.813 1.00 0.00 O ATOM 940 NE2 GLN A 97 27.785 24.815 -13.296 1.00 0.00 N ATOM 0 H GLN A 97 25.414 27.618 -7.953 1.00 0.00 H new ATOM 0 HA GLN A 97 26.638 24.909 -8.317 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.196 25.445 -10.300 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.054 26.958 -10.510 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.216 25.674 -10.755 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.324 24.173 -10.605 1.00 0.00 H new ATOM 0 HE21 GLN A 97 28.678 24.441 -12.975 1.00 0.00 H new ATOM 0 HE22 GLN A 97 27.573 24.843 -14.293 1.00 0.00 H new ATOM 949 N VAL A 98 28.943 26.061 -8.713 1.00 0.00 N ATOM 950 CA VAL A 98 30.253 26.749 -8.531 1.00 0.00 C ATOM 951 C VAL A 98 30.922 26.934 -9.894 1.00 0.00 C ATOM 952 O VAL A 98 30.279 26.885 -10.924 1.00 0.00 O ATOM 953 CB VAL A 98 31.158 25.903 -7.627 1.00 0.00 C ATOM 954 CG1 VAL A 98 32.098 26.823 -6.846 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.300 25.102 -6.644 1.00 0.00 C ATOM 0 H VAL A 98 29.000 25.097 -9.040 1.00 0.00 H new ATOM 0 HA VAL A 98 30.091 27.723 -8.069 1.00 0.00 H new ATOM 0 HB VAL A 98 31.742 25.217 -8.240 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.742 26.224 -6.203 1.00 0.00 H new ATOM 0 HG12 VAL A 98 32.711 27.393 -7.544 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.511 27.508 -6.234 1.00 0.00 H new ATOM 0 HG21 VAL A 98 30.946 24.502 -6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.715 25.787 -6.030 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.628 24.446 -7.198 1.00 0.00 H new ATOM 965 N GLU A 99 32.210 27.147 -9.911 1.00 0.00 N ATOM 966 CA GLU A 99 32.917 27.336 -11.209 1.00 0.00 C ATOM 967 C GLU A 99 32.571 26.183 -12.153 1.00 0.00 C ATOM 968 O GLU A 99 32.453 26.361 -13.349 1.00 0.00 O ATOM 969 CB GLU A 99 34.428 27.364 -10.968 1.00 0.00 C ATOM 970 CG GLU A 99 34.784 28.574 -10.103 1.00 0.00 C ATOM 971 CD GLU A 99 36.304 28.659 -9.944 1.00 0.00 C ATOM 972 OE1 GLU A 99 36.974 27.722 -10.345 1.00 0.00 O ATOM 973 OE2 GLU A 99 36.770 29.660 -9.426 1.00 0.00 O ATOM 0 H GLU A 99 32.803 27.198 -9.082 1.00 0.00 H new ATOM 0 HA GLU A 99 32.604 28.278 -11.659 1.00 0.00 H new ATOM 0 HB2 GLU A 99 34.745 26.445 -10.475 1.00 0.00 H new ATOM 0 HB3 GLU A 99 34.958 27.415 -11.919 1.00 0.00 H new ATOM 0 HG2 GLU A 99 34.404 29.487 -10.562 1.00 0.00 H new ATOM 0 HG3 GLU A 99 34.310 28.488 -9.125 1.00 0.00 H new ATOM 980 N SER A 100 32.407 25.000 -11.626 1.00 0.00 N ATOM 981 CA SER A 100 32.070 23.838 -12.496 1.00 0.00 C ATOM 982 C SER A 100 31.568 22.680 -11.630 1.00 0.00 C ATOM 983 O SER A 100 31.714 21.524 -11.978 1.00 0.00 O ATOM 984 CB SER A 100 33.317 23.398 -13.265 1.00 0.00 C ATOM 985 OG SER A 100 33.132 22.074 -13.749 1.00 0.00 O ATOM 0 H SER A 100 32.492 24.788 -10.632 1.00 0.00 H new ATOM 0 HA SER A 100 31.291 24.127 -13.202 1.00 0.00 H new ATOM 0 HB2 SER A 100 33.504 24.078 -14.096 1.00 0.00 H new ATOM 0 HB3 SER A 100 34.192 23.441 -12.616 1.00 0.00 H new ATOM 0 HG SER A 100 33.020 21.462 -12.992 1.00 0.00 H new ATOM 991 N VAL A 101 30.977 22.979 -10.505 1.00 0.00 N ATOM 992 CA VAL A 101 30.467 21.893 -9.621 1.00 0.00 C ATOM 993 C VAL A 101 29.121 22.310 -9.026 1.00 0.00 C ATOM 994 O VAL A 101 28.872 23.475 -8.786 1.00 0.00 O ATOM 995 CB VAL A 101 31.468 21.645 -8.491 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.966 20.502 -7.607 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.827 21.269 -9.087 1.00 0.00 C ATOM 0 H VAL A 101 30.826 23.927 -10.160 1.00 0.00 H new ATOM 0 HA VAL A 101 30.340 20.980 -10.203 1.00 0.00 H new ATOM 0 HB VAL A 101 31.571 22.550 -7.892 1.00 0.00 H new ATOM 0 HG11 VAL A 101 31.679 20.325 -6.802 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.998 20.768 -7.183 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.863 19.597 -8.206 1.00 0.00 H new ATOM 0 HG21 VAL A 101 33.541 21.092 -8.282 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.724 20.364 -9.686 1.00 0.00 H new ATOM 0 HG23 VAL A 101 33.185 22.083 -9.718 1.00 0.00 H new ATOM 1007 N GLN A 102 28.250 21.369 -8.787 1.00 0.00 N ATOM 1008 CA GLN A 102 26.920 21.712 -8.208 1.00 0.00 C ATOM 1009 C GLN A 102 26.950 21.493 -6.694 1.00 0.00 C ATOM 1010 O GLN A 102 27.619 20.607 -6.199 1.00 0.00 O ATOM 1011 CB GLN A 102 25.845 20.817 -8.831 1.00 0.00 C ATOM 1012 CG GLN A 102 25.797 21.056 -10.342 1.00 0.00 C ATOM 1013 CD GLN A 102 24.770 20.113 -10.974 1.00 0.00 C ATOM 1014 OE1 GLN A 102 24.348 19.154 -10.358 1.00 0.00 O ATOM 1015 NE2 GLN A 102 24.346 20.347 -12.186 1.00 0.00 N ATOM 0 H GLN A 102 28.402 20.377 -8.968 1.00 0.00 H new ATOM 0 HA GLN A 102 26.691 22.756 -8.420 1.00 0.00 H new ATOM 0 HB2 GLN A 102 26.064 19.769 -8.624 1.00 0.00 H new ATOM 0 HB3 GLN A 102 24.874 21.033 -8.386 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.531 22.093 -10.549 1.00 0.00 H new ATOM 0 HG3 GLN A 102 26.781 20.886 -10.780 1.00 0.00 H new ATOM 0 HE21 GLN A 102 24.700 21.152 -12.704 1.00 0.00 H new ATOM 0 HE22 GLN A 102 23.661 19.725 -12.616 1.00 0.00 H new ATOM 1024 N LEU A 103 26.232 22.292 -5.955 1.00 0.00 N ATOM 1025 CA LEU A 103 26.220 22.130 -4.474 1.00 0.00 C ATOM 1026 C LEU A 103 24.841 21.641 -4.025 1.00 0.00 C ATOM 1027 O LEU A 103 23.822 22.135 -4.468 1.00 0.00 O ATOM 1028 CB LEU A 103 26.523 23.474 -3.810 1.00 0.00 C ATOM 1029 CG LEU A 103 27.990 23.841 -4.049 1.00 0.00 C ATOM 1030 CD1 LEU A 103 28.274 25.219 -3.446 1.00 0.00 C ATOM 1031 CD2 LEU A 103 28.892 22.798 -3.387 1.00 0.00 C ATOM 0 H LEU A 103 25.652 23.051 -6.313 1.00 0.00 H new ATOM 0 HA LEU A 103 26.977 21.402 -4.184 1.00 0.00 H new ATOM 0 HB2 LEU A 103 25.872 24.248 -4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 103 26.321 23.417 -2.740 1.00 0.00 H new ATOM 0 HG LEU A 103 28.189 23.864 -5.120 1.00 0.00 H new ATOM 0 HD11 LEU A 103 29.318 25.482 -3.615 1.00 0.00 H new ATOM 0 HD12 LEU A 103 27.631 25.962 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 103 28.075 25.195 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 103 29.936 23.059 -3.557 1.00 0.00 H new ATOM 0 HD22 LEU A 103 28.694 22.773 -2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 103 28.689 21.817 -3.816 1.00 0.00 H new ATOM 1043 N LYS A 104 24.799 20.674 -3.150 1.00 0.00 N ATOM 1044 CA LYS A 104 23.485 20.156 -2.675 1.00 0.00 C ATOM 1045 C LYS A 104 23.398 20.303 -1.155 1.00 0.00 C ATOM 1046 O LYS A 104 24.359 20.085 -0.444 1.00 0.00 O ATOM 1047 CB LYS A 104 23.353 18.678 -3.053 1.00 0.00 C ATOM 1048 CG LYS A 104 23.365 18.538 -4.577 1.00 0.00 C ATOM 1049 CD LYS A 104 23.131 17.074 -4.955 1.00 0.00 C ATOM 1050 CE LYS A 104 23.279 16.909 -6.470 1.00 0.00 C ATOM 1051 NZ LYS A 104 22.335 15.861 -6.949 1.00 0.00 N ATOM 0 H LYS A 104 25.617 20.220 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 104 22.680 20.724 -3.141 1.00 0.00 H new ATOM 0 HB2 LYS A 104 24.173 18.106 -2.618 1.00 0.00 H new ATOM 0 HB3 LYS A 104 22.428 18.269 -2.647 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.591 19.167 -5.017 1.00 0.00 H new ATOM 0 HG3 LYS A 104 24.319 18.880 -4.977 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.846 16.435 -4.437 1.00 0.00 H new ATOM 0 HD3 LYS A 104 22.136 16.760 -4.640 1.00 0.00 H new ATOM 0 HE2 LYS A 104 23.074 17.855 -6.971 1.00 0.00 H new ATOM 0 HE3 LYS A 104 24.304 16.632 -6.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 22.435 15.748 -7.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 22.551 14.959 -6.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 21.360 16.144 -6.725 1.00 0.00 H new ATOM 1065 N VAL A 105 22.252 20.670 -0.651 1.00 0.00 N ATOM 1066 CA VAL A 105 22.104 20.831 0.823 1.00 0.00 C ATOM 1067 C VAL A 105 20.920 19.993 1.310 1.00 0.00 C ATOM 1068 O VAL A 105 19.934 19.834 0.617 1.00 0.00 O ATOM 1069 CB VAL A 105 21.856 22.304 1.154 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.849 22.491 2.673 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.967 23.158 0.540 1.00 0.00 C ATOM 0 H VAL A 105 21.412 20.865 -1.196 1.00 0.00 H new ATOM 0 HA VAL A 105 23.016 20.496 1.318 1.00 0.00 H new ATOM 0 HB VAL A 105 20.893 22.612 0.746 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.672 23.540 2.910 1.00 0.00 H new ATOM 0 HG12 VAL A 105 21.058 21.882 3.111 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.812 22.184 3.082 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.791 24.208 0.775 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.930 22.851 0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.973 23.025 -0.542 1.00 0.00 H new ATOM 1081 N ASN A 106 21.009 19.458 2.496 1.00 0.00 N ATOM 1082 CA ASN A 106 19.887 18.631 3.025 1.00 0.00 C ATOM 1083 C ASN A 106 19.930 18.630 4.553 1.00 0.00 C ATOM 1084 O ASN A 106 20.628 19.414 5.165 1.00 0.00 O ATOM 1085 CB ASN A 106 20.023 17.198 2.507 1.00 0.00 C ATOM 1086 CG ASN A 106 19.749 17.172 1.002 1.00 0.00 C ATOM 1087 OD1 ASN A 106 18.811 17.785 0.533 1.00 0.00 O ATOM 1088 ND2 ASN A 106 20.535 16.484 0.219 1.00 0.00 N ATOM 0 H ASN A 106 21.809 19.557 3.121 1.00 0.00 H new ATOM 0 HA ASN A 106 18.937 19.049 2.691 1.00 0.00 H new ATOM 0 HB2 ASN A 106 21.024 16.819 2.712 1.00 0.00 H new ATOM 0 HB3 ASN A 106 19.323 16.544 3.026 1.00 0.00 H new ATOM 0 HD21 ASN A 106 20.361 16.461 -0.786 1.00 0.00 H new ATOM 0 HD22 ASN A 106 21.323 15.969 0.612 1.00 0.00 H new ATOM 1095 N ILE A 107 19.187 17.756 5.177 1.00 0.00 N ATOM 1096 CA ILE A 107 19.186 17.709 6.666 1.00 0.00 C ATOM 1097 C ILE A 107 19.831 16.404 7.137 1.00 0.00 C ATOM 1098 O ILE A 107 19.580 15.346 6.597 1.00 0.00 O ATOM 1099 CB ILE A 107 17.745 17.778 7.177 1.00 0.00 C ATOM 1100 CG1 ILE A 107 17.077 19.048 6.649 1.00 0.00 C ATOM 1101 CG2 ILE A 107 17.746 17.801 8.707 1.00 0.00 C ATOM 1102 CD1 ILE A 107 15.616 19.081 7.101 1.00 0.00 C ATOM 0 H ILE A 107 18.582 17.074 4.720 1.00 0.00 H new ATOM 0 HA ILE A 107 19.752 18.555 7.056 1.00 0.00 H new ATOM 0 HB ILE A 107 17.194 16.905 6.827 1.00 0.00 H new ATOM 0 HG12 ILE A 107 17.603 19.929 7.018 1.00 0.00 H new ATOM 0 HG13 ILE A 107 17.133 19.076 5.561 1.00 0.00 H new ATOM 0 HG21 ILE A 107 16.720 17.850 9.071 1.00 0.00 H new ATOM 0 HG22 ILE A 107 18.222 16.896 9.084 1.00 0.00 H new ATOM 0 HG23 ILE A 107 18.297 18.674 9.057 1.00 0.00 H new ATOM 0 HD11 ILE A 107 15.139 19.986 6.725 1.00 0.00 H new ATOM 0 HD12 ILE A 107 15.095 18.207 6.711 1.00 0.00 H new ATOM 0 HD13 ILE A 107 15.572 19.073 8.190 1.00 0.00 H new ATOM 1114 N ALA A 108 20.661 16.472 8.142 1.00 0.00 N ATOM 1115 CA ALA A 108 21.320 15.236 8.648 1.00 0.00 C ATOM 1116 C ALA A 108 20.764 14.893 10.033 1.00 0.00 C ATOM 1117 O ALA A 108 20.271 15.748 10.742 1.00 0.00 O ATOM 1118 CB ALA A 108 22.829 15.465 8.746 1.00 0.00 C ATOM 0 H ALA A 108 20.911 17.330 8.634 1.00 0.00 H new ATOM 0 HA ALA A 108 21.123 14.412 7.962 1.00 0.00 H new ATOM 0 HB1 ALA A 108 23.311 14.560 9.116 1.00 0.00 H new ATOM 0 HB2 ALA A 108 23.225 15.709 7.760 1.00 0.00 H new ATOM 0 HB3 ALA A 108 23.028 16.289 9.431 1.00 0.00 H new ATOM 1124 N ARG A 109 20.838 13.650 10.421 1.00 0.00 N ATOM 1125 CA ARG A 109 20.313 13.255 11.759 1.00 0.00 C ATOM 1126 C ARG A 109 21.432 13.351 12.796 1.00 0.00 C ATOM 1127 O ARG A 109 21.325 12.828 13.888 1.00 0.00 O ATOM 1128 CB ARG A 109 19.795 11.818 11.698 1.00 0.00 C ATOM 1129 CG ARG A 109 18.697 11.716 10.639 1.00 0.00 C ATOM 1130 CD ARG A 109 18.170 10.281 10.587 1.00 0.00 C ATOM 1131 NE ARG A 109 19.308 9.345 10.366 1.00 0.00 N ATOM 1132 CZ ARG A 109 19.238 8.443 9.426 1.00 0.00 C ATOM 1133 NH1 ARG A 109 18.387 7.459 9.529 1.00 0.00 N ATOM 1134 NH2 ARG A 109 20.017 8.527 8.383 1.00 0.00 N ATOM 0 H ARG A 109 21.239 12.891 9.870 1.00 0.00 H new ATOM 0 HA ARG A 109 19.500 13.923 12.042 1.00 0.00 H new ATOM 0 HB2 ARG A 109 20.611 11.136 11.458 1.00 0.00 H new ATOM 0 HB3 ARG A 109 19.405 11.519 12.671 1.00 0.00 H new ATOM 0 HG2 ARG A 109 17.885 12.404 10.874 1.00 0.00 H new ATOM 0 HG3 ARG A 109 19.089 12.006 9.664 1.00 0.00 H new ATOM 0 HD2 ARG A 109 17.658 10.036 11.518 1.00 0.00 H new ATOM 0 HD3 ARG A 109 17.439 10.179 9.785 1.00 0.00 H new ATOM 0 HE ARG A 109 20.142 9.409 10.950 1.00 0.00 H new ATOM 0 HH11 ARG A 109 17.777 7.395 10.344 1.00 0.00 H new ATOM 0 HH12 ARG A 109 18.332 6.753 8.794 1.00 0.00 H new ATOM 0 HH21 ARG A 109 20.680 9.298 8.303 1.00 0.00 H new ATOM 0 HH22 ARG A 109 19.963 7.822 7.648 1.00 0.00 H new ATOM 1148 N LYS A 110 22.505 14.015 12.464 1.00 0.00 N ATOM 1149 CA LYS A 110 23.628 14.144 13.434 1.00 0.00 C ATOM 1150 C LYS A 110 23.229 15.115 14.546 1.00 0.00 C ATOM 1151 O LYS A 110 22.091 15.531 14.640 1.00 0.00 O ATOM 1152 CB LYS A 110 24.866 14.678 12.711 1.00 0.00 C ATOM 1153 CG LYS A 110 25.376 13.625 11.725 1.00 0.00 C ATOM 1154 CD LYS A 110 26.712 14.082 11.137 1.00 0.00 C ATOM 1155 CE LYS A 110 27.168 13.087 10.069 1.00 0.00 C ATOM 1156 NZ LYS A 110 28.465 12.479 10.476 1.00 0.00 N ATOM 0 H LYS A 110 22.652 14.473 11.565 1.00 0.00 H new ATOM 0 HA LYS A 110 23.852 13.168 13.865 1.00 0.00 H new ATOM 0 HB2 LYS A 110 24.622 15.599 12.182 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.645 14.922 13.433 1.00 0.00 H new ATOM 0 HG2 LYS A 110 25.498 12.667 12.230 1.00 0.00 H new ATOM 0 HG3 LYS A 110 24.648 13.475 10.928 1.00 0.00 H new ATOM 0 HD2 LYS A 110 26.609 15.076 10.702 1.00 0.00 H new ATOM 0 HD3 LYS A 110 27.462 14.155 11.925 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.416 12.309 9.937 1.00 0.00 H new ATOM 0 HE3 LYS A 110 27.277 13.592 9.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 28.774 11.802 9.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 29.181 13.226 10.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 28.347 11.983 11.383 1.00 0.00 H new ATOM 1170 N GLN A 111 24.155 15.480 15.389 1.00 0.00 N ATOM 1171 CA GLN A 111 23.826 16.426 16.493 1.00 0.00 C ATOM 1172 C GLN A 111 22.914 15.732 17.506 1.00 0.00 C ATOM 1173 O GLN A 111 21.865 16.236 17.856 1.00 0.00 O ATOM 1174 CB GLN A 111 23.112 17.651 15.919 1.00 0.00 C ATOM 1175 CG GLN A 111 23.204 18.807 16.915 1.00 0.00 C ATOM 1176 CD GLN A 111 23.404 20.118 16.157 1.00 0.00 C ATOM 1177 OE1 GLN A 111 22.938 20.268 15.046 1.00 0.00 O ATOM 1178 NE2 GLN A 111 24.087 21.079 16.714 1.00 0.00 N ATOM 0 H GLN A 111 25.125 15.165 15.362 1.00 0.00 H new ATOM 0 HA GLN A 111 24.745 16.740 16.988 1.00 0.00 H new ATOM 0 HB2 GLN A 111 23.565 17.938 14.970 1.00 0.00 H new ATOM 0 HB3 GLN A 111 22.068 17.414 15.715 1.00 0.00 H new ATOM 0 HG2 GLN A 111 22.296 18.857 17.516 1.00 0.00 H new ATOM 0 HG3 GLN A 111 24.033 18.643 17.604 1.00 0.00 H new ATOM 0 HE21 GLN A 111 24.478 20.952 17.647 1.00 0.00 H new ATOM 0 HE22 GLN A 111 24.230 21.958 16.216 1.00 0.00 H new ATOM 1187 N PRO A 112 23.327 14.549 17.982 1.00 0.00 N ATOM 1188 CA PRO A 112 22.551 13.773 18.957 1.00 0.00 C ATOM 1189 C PRO A 112 22.574 14.415 20.350 1.00 0.00 C ATOM 1190 O PRO A 112 21.675 14.225 21.144 1.00 0.00 O ATOM 1191 CB PRO A 112 23.272 12.426 18.995 1.00 0.00 C ATOM 1192 CG PRO A 112 24.670 12.731 18.571 1.00 0.00 C ATOM 1193 CD PRO A 112 24.581 13.877 17.603 1.00 0.00 C ATOM 0 HA PRO A 112 21.499 13.705 18.679 1.00 0.00 H new ATOM 0 HB2 PRO A 112 23.247 11.992 19.995 1.00 0.00 H new ATOM 0 HB3 PRO A 112 22.803 11.707 18.324 1.00 0.00 H new ATOM 0 HG2 PRO A 112 25.287 12.995 19.430 1.00 0.00 H new ATOM 0 HG3 PRO A 112 25.132 11.862 18.102 1.00 0.00 H new ATOM 0 HD2 PRO A 112 25.437 14.545 17.692 1.00 0.00 H new ATOM 0 HD3 PRO A 112 24.554 13.529 16.570 1.00 0.00 H new ATOM 1201 N MET A 113 23.597 15.168 20.651 1.00 0.00 N ATOM 1202 CA MET A 113 23.677 15.816 21.993 1.00 0.00 C ATOM 1203 C MET A 113 22.400 16.619 22.255 1.00 0.00 C ATOM 1204 O MET A 113 21.982 16.788 23.383 1.00 0.00 O ATOM 1205 CB MET A 113 24.886 16.752 22.036 1.00 0.00 C ATOM 1206 CG MET A 113 24.645 17.939 21.101 1.00 0.00 C ATOM 1207 SD MET A 113 26.231 18.539 20.466 1.00 0.00 S ATOM 1208 CE MET A 113 25.944 18.135 18.727 1.00 0.00 C ATOM 0 H MET A 113 24.380 15.363 20.027 1.00 0.00 H new ATOM 0 HA MET A 113 23.783 15.048 22.759 1.00 0.00 H new ATOM 0 HB2 MET A 113 25.050 17.105 23.054 1.00 0.00 H new ATOM 0 HB3 MET A 113 25.786 16.215 21.735 1.00 0.00 H new ATOM 0 HG2 MET A 113 24.000 17.640 20.275 1.00 0.00 H new ATOM 0 HG3 MET A 113 24.129 18.737 21.635 1.00 0.00 H new ATOM 0 HE1 MET A 113 26.819 17.627 18.322 1.00 0.00 H new ATOM 0 HE2 MET A 113 25.075 17.482 18.644 1.00 0.00 H new ATOM 0 HE3 MET A 113 25.764 19.052 18.165 1.00 0.00 H new ATOM 1218 N LEU A 114 21.777 17.116 21.223 1.00 0.00 N ATOM 1219 CA LEU A 114 20.530 17.910 21.415 1.00 0.00 C ATOM 1220 C LEU A 114 19.604 17.697 20.218 1.00 0.00 C ATOM 1221 O LEU A 114 18.803 18.545 19.883 1.00 0.00 O ATOM 1222 CB LEU A 114 20.882 19.394 21.524 1.00 0.00 C ATOM 1223 CG LEU A 114 19.599 20.220 21.657 1.00 0.00 C ATOM 1224 CD1 LEU A 114 19.671 21.076 22.922 1.00 0.00 C ATOM 1225 CD2 LEU A 114 19.446 21.128 20.433 1.00 0.00 C ATOM 0 H LEU A 114 22.077 17.007 20.254 1.00 0.00 H new ATOM 0 HA LEU A 114 20.030 17.586 22.328 1.00 0.00 H new ATOM 0 HB2 LEU A 114 21.526 19.563 22.387 1.00 0.00 H new ATOM 0 HB3 LEU A 114 21.440 19.711 20.643 1.00 0.00 H new ATOM 0 HG LEU A 114 18.742 19.550 21.721 1.00 0.00 H new ATOM 0 HD11 LEU A 114 18.758 21.664 23.016 1.00 0.00 H new ATOM 0 HD12 LEU A 114 19.778 20.430 23.793 1.00 0.00 H new ATOM 0 HD13 LEU A 114 20.529 21.746 22.860 1.00 0.00 H new ATOM 0 HD21 LEU A 114 18.533 21.716 20.528 1.00 0.00 H new ATOM 0 HD22 LEU A 114 20.303 21.798 20.367 1.00 0.00 H new ATOM 0 HD23 LEU A 114 19.393 20.518 19.532 1.00 0.00 H new ATOM 1237 N ASP A 115 19.711 16.576 19.564 1.00 0.00 N ATOM 1238 CA ASP A 115 18.837 16.329 18.385 1.00 0.00 C ATOM 1239 C ASP A 115 18.845 17.576 17.501 1.00 0.00 C ATOM 1240 O ASP A 115 17.844 17.944 16.919 1.00 0.00 O ATOM 1241 CB ASP A 115 17.410 16.041 18.856 1.00 0.00 C ATOM 1242 CG ASP A 115 17.401 14.771 19.709 1.00 0.00 C ATOM 1243 OD1 ASP A 115 18.376 14.039 19.656 1.00 0.00 O ATOM 1244 OD2 ASP A 115 16.421 14.553 20.400 1.00 0.00 O ATOM 0 H ASP A 115 20.361 15.824 19.792 1.00 0.00 H new ATOM 0 HA ASP A 115 19.205 15.472 17.821 1.00 0.00 H new ATOM 0 HB2 ASP A 115 17.030 16.883 19.434 1.00 0.00 H new ATOM 0 HB3 ASP A 115 16.750 15.920 17.997 1.00 0.00 H new ATOM 1249 N ALA A 116 19.971 18.231 17.406 1.00 0.00 N ATOM 1250 CA ALA A 116 20.058 19.458 16.569 1.00 0.00 C ATOM 1251 C ALA A 116 19.310 20.601 17.250 1.00 0.00 C ATOM 1252 O ALA A 116 19.903 21.450 17.884 1.00 0.00 O ATOM 1253 CB ALA A 116 19.440 19.186 15.202 1.00 0.00 C ATOM 0 H ALA A 116 20.837 17.966 17.875 1.00 0.00 H new ATOM 0 HA ALA A 116 21.105 19.737 16.446 1.00 0.00 H new ATOM 0 HB1 ALA A 116 19.504 20.085 14.589 1.00 0.00 H new ATOM 0 HB2 ALA A 116 19.980 18.375 14.714 1.00 0.00 H new ATOM 0 HB3 ALA A 116 18.394 18.904 15.325 1.00 0.00 H new ATOM 1259 N ALA A 117 18.015 20.638 17.122 1.00 0.00 N ATOM 1260 CA ALA A 117 17.248 21.739 17.762 1.00 0.00 C ATOM 1261 C ALA A 117 15.770 21.352 17.856 1.00 0.00 C ATOM 1262 O ALA A 117 15.279 20.544 17.093 1.00 0.00 O ATOM 1263 CB ALA A 117 17.398 23.007 16.922 1.00 0.00 C ATOM 0 H ALA A 117 17.457 19.958 16.605 1.00 0.00 H new ATOM 0 HA ALA A 117 17.632 21.918 18.766 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.838 23.819 17.386 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.451 23.281 16.862 1.00 0.00 H new ATOM 0 HB3 ALA A 117 17.012 22.827 15.919 1.00 0.00 H new ATOM 1269 N THR A 118 15.058 21.921 18.790 1.00 0.00 N ATOM 1270 CA THR A 118 13.614 21.586 18.936 1.00 0.00 C ATOM 1271 C THR A 118 12.780 22.866 18.846 1.00 0.00 C ATOM 1272 O THR A 118 13.291 23.961 18.967 1.00 0.00 O ATOM 1273 CB THR A 118 13.381 20.920 20.295 1.00 0.00 C ATOM 1274 OG1 THR A 118 13.395 21.910 21.314 1.00 0.00 O ATOM 1275 CG2 THR A 118 14.487 19.898 20.559 1.00 0.00 C ATOM 0 H THR A 118 15.415 22.604 19.459 1.00 0.00 H new ATOM 0 HA THR A 118 13.317 20.903 18.140 1.00 0.00 H new ATOM 0 HB THR A 118 12.415 20.415 20.292 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.244 21.486 22.184 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.321 19.424 21.526 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.476 19.139 19.776 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.454 20.401 20.563 1.00 0.00 H new ATOM 1283 N GLY A 119 11.498 22.736 18.635 1.00 0.00 N ATOM 1284 CA GLY A 119 10.633 23.946 18.536 1.00 0.00 C ATOM 1285 C GLY A 119 9.287 23.666 19.208 1.00 0.00 C ATOM 1286 O GLY A 119 8.994 22.551 19.593 1.00 0.00 O ATOM 0 H GLY A 119 11.013 21.845 18.527 1.00 0.00 H new ATOM 0 HA2 GLY A 119 11.121 24.795 19.014 1.00 0.00 H new ATOM 0 HA3 GLY A 119 10.481 24.213 17.490 1.00 0.00 H new ATOM 1290 N LYS A 120 8.465 24.670 19.353 1.00 0.00 N ATOM 1291 CA LYS A 120 7.140 24.461 19.998 1.00 0.00 C ATOM 1292 C LYS A 120 6.209 23.731 19.027 1.00 0.00 C ATOM 1293 O LYS A 120 6.092 24.095 17.874 1.00 0.00 O ATOM 1294 CB LYS A 120 6.533 25.816 20.366 1.00 0.00 C ATOM 1295 CG LYS A 120 5.291 25.601 21.233 1.00 0.00 C ATOM 1296 CD LYS A 120 4.654 26.955 21.555 1.00 0.00 C ATOM 1297 CE LYS A 120 3.490 26.753 22.526 1.00 0.00 C ATOM 1298 NZ LYS A 120 3.493 27.845 23.540 1.00 0.00 N ATOM 0 H LYS A 120 8.655 25.626 19.052 1.00 0.00 H new ATOM 0 HA LYS A 120 7.265 23.862 20.900 1.00 0.00 H new ATOM 0 HB2 LYS A 120 7.264 26.420 20.903 1.00 0.00 H new ATOM 0 HB3 LYS A 120 6.268 26.365 19.462 1.00 0.00 H new ATOM 0 HG2 LYS A 120 4.576 24.965 20.711 1.00 0.00 H new ATOM 0 HG3 LYS A 120 5.562 25.086 22.155 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.396 27.623 21.994 1.00 0.00 H new ATOM 0 HD3 LYS A 120 4.300 27.429 20.640 1.00 0.00 H new ATOM 0 HE2 LYS A 120 2.545 26.750 21.982 1.00 0.00 H new ATOM 0 HE3 LYS A 120 3.577 25.785 23.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 2.701 27.708 24.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 4.390 27.828 24.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 3.390 28.763 23.062 1.00 0.00 H new ATOM 1312 N SER A 121 5.546 22.704 19.485 1.00 0.00 N ATOM 1313 CA SER A 121 4.624 21.954 18.587 1.00 0.00 C ATOM 1314 C SER A 121 3.180 22.367 18.876 1.00 0.00 C ATOM 1315 O SER A 121 2.627 21.877 19.847 1.00 0.00 O ATOM 1316 CB SER A 121 4.783 20.452 18.832 1.00 0.00 C ATOM 1317 OG SER A 121 6.041 20.203 19.444 1.00 0.00 O ATOM 1318 OXT SER A 121 2.651 23.167 18.121 1.00 0.00 O ATOM 0 H SER A 121 5.603 22.353 20.441 1.00 0.00 H new ATOM 0 HA SER A 121 4.865 22.181 17.549 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.978 20.090 19.471 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.711 19.909 17.889 1.00 0.00 H new ATOM 0 HG SER A 121 6.143 19.241 19.603 1.00 0.00 H new TER 1324 SER A 121