USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 590 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 106 ASN : amide:sc= -8.2! C(o=-13!,f=-22!) USER MOD Set 1.2: A 130 ASN : amide:sc= -4.78! C(o=-13!,f=-12!) USER MOD Set 2.1: A 69 TYR OH : rot 16:sc= -1.1 USER MOD Set 2.2: A 77 GLN : amide:sc= 0.574 K(o=-0.52,f=-2.3) USER MOD Single : A 51 MET CE :methyl -178:sc= 0 (180deg=-0.014) USER MOD Single : A 52 HIS : no HD1:sc= -0.0166 X(o=-0.017,f=-0.28) USER MOD Single : A 54 THR OG1 : rot 18:sc= 0.0965! USER MOD Single : A 55 TYR OH : rot -117:sc= 0.283 USER MOD Single : A 63 THR OG1 : rot -110:sc= -1.09 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.0357 K(o=-0.036,f=-2.5!) USER MOD Single : A 74 SER OG : rot 104:sc= -0.605! USER MOD Single : A 87 SER OG : rot -131:sc= -1.52 USER MOD Single : A 89 HIS : no HD1:sc= -1.44! C(o=-1.4!,f=-5!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -140:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.194 K(o=-0.19,f=-1.9) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -6.45! C(o=-6.5!,f=-1.2!) USER MOD Single : A 104 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.52) USER MOD Single : A 107 SER OG : rot -126:sc= -5.17! USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot -18:sc= 0.916 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.659) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -1.92! K(o=-1.9!,f=-0.0031) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 51 -16.656 7.445 44.024 1.00 0.00 N ATOM 2 CA MET A 51 -17.395 8.280 45.013 1.00 0.00 C ATOM 3 C MET A 51 -16.547 9.492 45.385 1.00 0.00 C ATOM 4 O MET A 51 -16.140 9.648 46.536 1.00 0.00 O ATOM 5 CB MET A 51 -17.693 7.446 46.260 1.00 0.00 C ATOM 6 CG MET A 51 -18.948 6.605 46.024 1.00 0.00 C ATOM 7 SD MET A 51 -19.338 5.670 47.523 1.00 0.00 S ATOM 8 CE MET A 51 -21.073 5.333 47.134 1.00 0.00 C ATOM 0 HA MET A 51 -18.335 8.621 44.579 1.00 0.00 H new ATOM 0 HB2 MET A 51 -16.846 6.799 46.488 1.00 0.00 H new ATOM 0 HB3 MET A 51 -17.836 8.099 47.121 1.00 0.00 H new ATOM 0 HG2 MET A 51 -19.785 7.249 45.756 1.00 0.00 H new ATOM 0 HG3 MET A 51 -18.790 5.923 45.188 1.00 0.00 H new ATOM 0 HE1 MET A 51 -21.531 4.785 47.958 1.00 0.00 H new ATOM 0 HE2 MET A 51 -21.602 6.274 46.986 1.00 0.00 H new ATOM 0 HE3 MET A 51 -21.133 4.736 46.224 1.00 0.00 H new ATOM 20 N HIS A 52 -16.288 10.349 44.403 1.00 0.00 N ATOM 21 CA HIS A 52 -15.490 11.546 44.637 1.00 0.00 C ATOM 22 C HIS A 52 -16.362 12.793 44.532 1.00 0.00 C ATOM 23 O HIS A 52 -17.008 13.023 43.512 1.00 0.00 O ATOM 24 CB HIS A 52 -14.359 11.630 43.608 1.00 0.00 C ATOM 25 CG HIS A 52 -13.288 10.631 43.950 1.00 0.00 C ATOM 26 ND1 HIS A 52 -13.484 9.265 43.824 1.00 0.00 N ATOM 27 CD2 HIS A 52 -12.003 10.785 44.409 1.00 0.00 C ATOM 28 CE1 HIS A 52 -12.343 8.656 44.199 1.00 0.00 C ATOM 29 NE2 HIS A 52 -11.408 9.536 44.566 1.00 0.00 N ATOM 0 H HIS A 52 -16.617 10.238 43.444 1.00 0.00 H new ATOM 0 HA HIS A 52 -15.067 11.489 45.640 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -14.748 11.433 42.609 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -13.940 12.636 43.595 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -11.526 11.731 44.617 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -12.201 7.585 44.203 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -10.462 9.336 44.891 1.00 0.00 H new ATOM 38 N LEU A 53 -16.373 13.598 45.591 1.00 0.00 N ATOM 39 CA LEU A 53 -17.171 14.817 45.591 1.00 0.00 C ATOM 40 C LEU A 53 -16.313 16.010 45.189 1.00 0.00 C ATOM 41 O LEU A 53 -15.379 16.384 45.899 1.00 0.00 O ATOM 42 CB LEU A 53 -17.761 15.051 46.984 1.00 0.00 C ATOM 43 CG LEU A 53 -18.828 16.148 46.913 1.00 0.00 C ATOM 44 CD1 LEU A 53 -19.693 16.101 48.174 1.00 0.00 C ATOM 45 CD2 LEU A 53 -18.155 17.519 46.809 1.00 0.00 C ATOM 0 H LEU A 53 -15.846 13.431 46.448 1.00 0.00 H new ATOM 0 HA LEU A 53 -17.981 14.706 44.870 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -18.199 14.128 47.364 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -16.973 15.340 47.680 1.00 0.00 H new ATOM 0 HG LEU A 53 -19.453 15.985 46.035 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -20.452 16.881 48.124 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -20.178 15.127 48.247 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -19.066 16.261 49.051 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -18.918 18.296 46.759 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -17.527 17.683 47.685 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -17.540 17.555 45.910 1.00 0.00 H new ATOM 57 N THR A 54 -16.633 16.599 44.042 1.00 0.00 N ATOM 58 CA THR A 54 -15.883 17.747 43.547 1.00 0.00 C ATOM 59 C THR A 54 -16.820 18.906 43.222 1.00 0.00 C ATOM 60 O THR A 54 -17.838 18.723 42.555 1.00 0.00 O ATOM 61 CB THR A 54 -15.109 17.352 42.288 1.00 0.00 C ATOM 62 OG1 THR A 54 -15.999 17.306 41.182 1.00 0.00 O ATOM 63 CG2 THR A 54 -14.470 15.977 42.492 1.00 0.00 C ATOM 0 H THR A 54 -17.402 16.303 43.441 1.00 0.00 H new ATOM 0 HA THR A 54 -15.188 18.066 44.324 1.00 0.00 H new ATOM 0 HB THR A 54 -14.328 18.087 42.094 1.00 0.00 H new ATOM 0 HG1 THR A 54 -16.820 17.793 41.402 1.00 0.00 H new ATOM 0 HG21 THR A 54 -13.918 15.695 41.595 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.787 16.015 43.341 1.00 0.00 H new ATOM 0 HG23 THR A 54 -15.249 15.239 42.686 1.00 0.00 H new ATOM 71 N TYR A 55 -16.464 20.099 43.684 1.00 0.00 N ATOM 72 CA TYR A 55 -17.278 21.277 43.420 1.00 0.00 C ATOM 73 C TYR A 55 -16.446 22.354 42.735 1.00 0.00 C ATOM 74 O TYR A 55 -15.245 22.470 42.980 1.00 0.00 O ATOM 75 CB TYR A 55 -17.846 21.824 44.731 1.00 0.00 C ATOM 76 CG TYR A 55 -16.713 22.115 45.686 1.00 0.00 C ATOM 77 CD1 TYR A 55 -16.034 21.061 46.311 1.00 0.00 C ATOM 78 CD2 TYR A 55 -16.340 23.440 45.947 1.00 0.00 C ATOM 79 CE1 TYR A 55 -14.984 21.331 47.195 1.00 0.00 C ATOM 80 CE2 TYR A 55 -15.288 23.710 46.831 1.00 0.00 C ATOM 81 CZ TYR A 55 -14.610 22.656 47.457 1.00 0.00 C ATOM 82 OH TYR A 55 -13.574 22.922 48.328 1.00 0.00 O ATOM 0 H TYR A 55 -15.626 20.275 44.238 1.00 0.00 H new ATOM 0 HA TYR A 55 -18.099 20.991 42.762 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -18.419 22.732 44.541 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -18.532 21.101 45.173 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -16.321 20.039 46.110 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -16.864 24.253 45.466 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.461 20.518 47.676 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -14.999 24.731 47.030 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.914 23.427 49.096 1.00 0.00 H new ATOM 92 N GLU A 56 -17.090 23.143 41.883 1.00 0.00 N ATOM 93 CA GLU A 56 -16.395 24.210 41.174 1.00 0.00 C ATOM 94 C GLU A 56 -17.375 25.294 40.739 1.00 0.00 C ATOM 95 O GLU A 56 -18.542 25.015 40.465 1.00 0.00 O ATOM 96 CB GLU A 56 -15.677 23.646 39.944 1.00 0.00 C ATOM 97 CG GLU A 56 -14.734 24.709 39.373 1.00 0.00 C ATOM 98 CD GLU A 56 -14.972 24.868 37.874 1.00 0.00 C ATOM 99 OE1 GLU A 56 -16.030 25.354 37.511 1.00 0.00 O ATOM 100 OE2 GLU A 56 -14.090 24.504 37.114 1.00 0.00 O ATOM 0 H GLU A 56 -18.084 23.065 41.668 1.00 0.00 H new ATOM 0 HA GLU A 56 -15.662 24.648 41.852 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.114 22.753 40.216 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.405 23.347 39.190 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.897 25.661 39.878 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.698 24.424 39.557 1.00 0.00 H new ATOM 107 N ILE A 57 -16.889 26.527 40.673 1.00 0.00 N ATOM 108 CA ILE A 57 -17.730 27.644 40.262 1.00 0.00 C ATOM 109 C ILE A 57 -17.315 28.131 38.878 1.00 0.00 C ATOM 110 O ILE A 57 -16.339 27.645 38.308 1.00 0.00 O ATOM 111 CB ILE A 57 -17.609 28.787 41.271 1.00 0.00 C ATOM 112 CG1 ILE A 57 -16.924 28.274 42.539 1.00 0.00 C ATOM 113 CG2 ILE A 57 -19.004 29.309 41.624 1.00 0.00 C ATOM 114 CD1 ILE A 57 -17.238 29.214 43.706 1.00 0.00 C ATOM 0 H ILE A 57 -15.926 26.778 40.896 1.00 0.00 H new ATOM 0 HA ILE A 57 -18.766 27.309 40.224 1.00 0.00 H new ATOM 0 HB ILE A 57 -17.019 29.594 40.836 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -17.268 27.265 42.768 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -15.847 28.216 42.385 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -18.917 30.123 42.343 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -19.495 29.673 40.722 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -19.595 28.503 42.059 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -16.750 28.848 44.609 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -16.872 30.215 43.476 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -18.316 29.249 43.865 1.00 0.00 H new ATOM 126 N PHE A 58 -18.061 29.088 38.342 1.00 0.00 N ATOM 127 CA PHE A 58 -17.757 29.627 37.023 1.00 0.00 C ATOM 128 C PHE A 58 -17.959 31.140 36.998 1.00 0.00 C ATOM 129 O PHE A 58 -18.826 31.672 37.691 1.00 0.00 O ATOM 130 CB PHE A 58 -18.655 28.971 35.970 1.00 0.00 C ATOM 131 CG PHE A 58 -19.759 28.203 36.655 1.00 0.00 C ATOM 132 CD1 PHE A 58 -20.600 28.849 37.568 1.00 0.00 C ATOM 133 CD2 PHE A 58 -19.944 26.843 36.373 1.00 0.00 C ATOM 134 CE1 PHE A 58 -21.626 28.137 38.200 1.00 0.00 C ATOM 135 CE2 PHE A 58 -20.971 26.131 37.006 1.00 0.00 C ATOM 136 CZ PHE A 58 -21.812 26.778 37.919 1.00 0.00 C ATOM 0 H PHE A 58 -18.874 29.504 38.796 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.713 29.410 36.796 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -19.080 29.731 35.315 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -18.067 28.301 35.342 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -20.457 29.897 37.785 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -19.295 26.344 35.668 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -22.275 28.636 38.905 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -21.114 25.083 36.790 1.00 0.00 H new ATOM 0 HZ PHE A 58 -22.604 26.229 38.407 1.00 0.00 H new ATOM 146 N GLY A 59 -17.153 31.826 36.193 1.00 0.00 N ATOM 147 CA GLY A 59 -17.252 33.279 36.083 1.00 0.00 C ATOM 148 C GLY A 59 -16.577 33.775 34.807 1.00 0.00 C ATOM 149 O GLY A 59 -15.718 33.096 34.243 1.00 0.00 O ATOM 0 H GLY A 59 -16.429 31.404 35.611 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.300 33.577 36.084 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -16.786 33.746 36.951 1.00 0.00 H new ATOM 153 N PRO A 60 -16.948 34.941 34.347 1.00 0.00 N ATOM 154 CA PRO A 60 -16.372 35.544 33.112 1.00 0.00 C ATOM 155 C PRO A 60 -14.858 35.358 33.032 1.00 0.00 C ATOM 156 O PRO A 60 -14.200 35.087 34.036 1.00 0.00 O ATOM 157 CB PRO A 60 -16.739 37.023 33.232 1.00 0.00 C ATOM 158 CG PRO A 60 -17.978 37.061 34.068 1.00 0.00 C ATOM 159 CD PRO A 60 -17.964 35.814 34.959 1.00 0.00 C ATOM 0 HA PRO A 60 -16.758 35.077 32.206 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -15.934 37.591 33.698 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -16.914 37.465 32.251 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.005 37.966 34.674 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.867 37.073 33.437 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.706 36.063 35.988 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -18.941 35.331 34.983 1.00 0.00 H new ATOM 167 N PRO A 61 -14.305 35.495 31.856 1.00 0.00 N ATOM 168 CA PRO A 61 -12.842 35.338 31.626 1.00 0.00 C ATOM 169 C PRO A 61 -12.045 36.542 32.123 1.00 0.00 C ATOM 170 O PRO A 61 -12.285 37.674 31.702 1.00 0.00 O ATOM 171 CB PRO A 61 -12.732 35.197 30.108 1.00 0.00 C ATOM 172 CG PRO A 61 -13.918 35.921 29.560 1.00 0.00 C ATOM 173 CD PRO A 61 -15.023 35.815 30.611 1.00 0.00 C ATOM 0 HA PRO A 61 -12.430 34.488 32.170 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -11.802 35.629 29.739 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -12.738 34.149 29.809 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -13.675 36.964 29.358 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -14.238 35.480 28.616 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -15.579 36.748 30.700 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -15.743 35.038 30.355 1.00 0.00 H new ATOM 181 N GLY A 62 -11.098 36.289 33.018 1.00 0.00 N ATOM 182 CA GLY A 62 -10.270 37.357 33.565 1.00 0.00 C ATOM 183 C GLY A 62 -10.871 37.909 34.854 1.00 0.00 C ATOM 184 O GLY A 62 -10.436 38.943 35.358 1.00 0.00 O ATOM 0 H GLY A 62 -10.885 35.359 33.379 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -9.266 36.980 33.760 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -10.173 38.158 32.832 1.00 0.00 H new ATOM 188 N THR A 63 -11.871 37.211 35.382 1.00 0.00 N ATOM 189 CA THR A 63 -12.523 37.643 36.613 1.00 0.00 C ATOM 190 C THR A 63 -11.731 37.176 37.831 1.00 0.00 C ATOM 191 O THR A 63 -11.364 36.007 37.932 1.00 0.00 O ATOM 192 CB THR A 63 -13.943 37.075 36.680 1.00 0.00 C ATOM 193 OG1 THR A 63 -14.638 37.404 35.486 1.00 0.00 O ATOM 194 CG2 THR A 63 -14.675 37.671 37.882 1.00 0.00 C ATOM 0 H THR A 63 -12.245 36.351 34.981 1.00 0.00 H new ATOM 0 HA THR A 63 -12.566 38.732 36.615 1.00 0.00 H new ATOM 0 HB THR A 63 -13.899 35.991 36.787 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.333 38.066 35.684 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.686 37.266 37.930 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.139 37.417 38.797 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.722 38.755 37.778 1.00 0.00 H new ATOM 202 N VAL A 64 -11.473 38.099 38.753 1.00 0.00 N ATOM 203 CA VAL A 64 -10.725 37.763 39.959 1.00 0.00 C ATOM 204 C VAL A 64 -11.612 37.891 41.193 1.00 0.00 C ATOM 205 O VAL A 64 -12.158 38.958 41.469 1.00 0.00 O ATOM 206 CB VAL A 64 -9.518 38.692 40.100 1.00 0.00 C ATOM 207 CG1 VAL A 64 -8.465 38.031 40.987 1.00 0.00 C ATOM 208 CG2 VAL A 64 -8.922 38.965 38.716 1.00 0.00 C ATOM 0 H VAL A 64 -11.767 39.074 38.690 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.383 36.731 39.876 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.834 39.632 40.553 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.605 38.694 41.087 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.889 37.836 41.972 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.148 37.091 40.536 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.062 39.627 38.814 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -8.607 38.025 38.264 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -9.673 39.438 38.083 1.00 0.00 H new ATOM 218 N ALA A 65 -11.750 36.795 41.933 1.00 0.00 N ATOM 219 CA ALA A 65 -12.573 36.795 43.136 1.00 0.00 C ATOM 220 C ALA A 65 -11.947 35.917 44.217 1.00 0.00 C ATOM 221 O ALA A 65 -11.184 34.998 43.917 1.00 0.00 O ATOM 222 CB ALA A 65 -13.977 36.283 42.809 1.00 0.00 C ATOM 0 H ALA A 65 -11.306 35.901 41.722 1.00 0.00 H new ATOM 0 HA ALA A 65 -12.637 37.818 43.508 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -14.585 36.286 43.713 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -14.435 36.930 42.061 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -13.912 35.267 42.419 1.00 0.00 H new ATOM 228 N ASP A 66 -12.281 36.201 45.471 1.00 0.00 N ATOM 229 CA ASP A 66 -11.750 35.424 46.586 1.00 0.00 C ATOM 230 C ASP A 66 -12.739 34.329 46.981 1.00 0.00 C ATOM 231 O ASP A 66 -13.851 34.616 47.422 1.00 0.00 O ATOM 232 CB ASP A 66 -11.490 36.337 47.786 1.00 0.00 C ATOM 233 CG ASP A 66 -10.265 37.209 47.521 1.00 0.00 C ATOM 234 OD1 ASP A 66 -9.164 36.729 47.732 1.00 0.00 O ATOM 235 OD2 ASP A 66 -10.449 38.342 47.112 1.00 0.00 O ATOM 0 H ASP A 66 -12.911 36.956 45.740 1.00 0.00 H new ATOM 0 HA ASP A 66 -10.812 34.964 46.275 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.361 36.965 47.971 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.333 35.737 48.683 1.00 0.00 H new ATOM 240 N ILE A 67 -12.327 33.077 46.814 1.00 0.00 N ATOM 241 CA ILE A 67 -13.190 31.952 47.151 1.00 0.00 C ATOM 242 C ILE A 67 -12.817 31.374 48.512 1.00 0.00 C ATOM 243 O ILE A 67 -11.642 31.161 48.809 1.00 0.00 O ATOM 244 CB ILE A 67 -13.068 30.864 46.082 1.00 0.00 C ATOM 245 CG1 ILE A 67 -13.168 31.503 44.695 1.00 0.00 C ATOM 246 CG2 ILE A 67 -14.199 29.850 46.257 1.00 0.00 C ATOM 247 CD1 ILE A 67 -11.763 31.737 44.136 1.00 0.00 C ATOM 0 H ILE A 67 -11.410 32.817 46.451 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.219 32.309 47.193 1.00 0.00 H new ATOM 0 HB ILE A 67 -12.108 30.359 46.183 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -13.734 30.856 44.025 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -13.708 32.448 44.757 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -14.113 29.074 45.496 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -14.132 29.397 47.246 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -15.160 30.355 46.154 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -11.836 32.192 43.148 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.212 32.401 44.802 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.239 30.784 44.059 1.00 0.00 H new ATOM 259 N SER A 68 -13.827 31.112 49.328 1.00 0.00 N ATOM 260 CA SER A 68 -13.626 30.565 50.667 1.00 0.00 C ATOM 261 C SER A 68 -14.605 29.450 50.948 1.00 0.00 C ATOM 262 O SER A 68 -15.811 29.623 50.736 1.00 0.00 O ATOM 263 CB SER A 68 -13.712 31.683 51.736 1.00 0.00 C ATOM 264 OG SER A 68 -13.532 31.192 53.069 1.00 0.00 O ATOM 0 H SER A 68 -14.805 31.270 49.085 1.00 0.00 H new ATOM 0 HA SER A 68 -12.624 30.139 50.716 1.00 0.00 H new ATOM 0 HB2 SER A 68 -12.955 32.438 51.527 1.00 0.00 H new ATOM 0 HB3 SER A 68 -14.682 32.175 51.663 1.00 0.00 H new ATOM 0 HG SER A 68 -13.594 31.937 53.703 1.00 0.00 H new ATOM 270 N TYR A 69 -14.118 28.331 51.463 1.00 0.00 N ATOM 271 CA TYR A 69 -14.986 27.206 51.784 1.00 0.00 C ATOM 272 C TYR A 69 -14.483 26.480 53.028 1.00 0.00 C ATOM 273 O TYR A 69 -13.344 26.674 53.453 1.00 0.00 O ATOM 274 CB TYR A 69 -15.036 26.230 50.604 1.00 0.00 C ATOM 275 CG TYR A 69 -13.659 25.664 50.356 1.00 0.00 C ATOM 276 CD1 TYR A 69 -12.683 26.449 49.732 1.00 0.00 C ATOM 277 CD2 TYR A 69 -13.360 24.354 50.747 1.00 0.00 C ATOM 278 CE1 TYR A 69 -11.406 25.924 49.500 1.00 0.00 C ATOM 279 CE2 TYR A 69 -12.083 23.829 50.515 1.00 0.00 C ATOM 280 CZ TYR A 69 -11.106 24.614 49.892 1.00 0.00 C ATOM 281 OH TYR A 69 -9.848 24.096 49.663 1.00 0.00 O ATOM 0 H TYR A 69 -13.131 28.177 51.667 1.00 0.00 H new ATOM 0 HA TYR A 69 -15.988 27.588 51.980 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -15.739 25.424 50.815 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -15.396 26.741 49.711 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -12.915 27.460 49.429 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -14.114 23.748 51.228 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -10.652 26.530 49.019 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.852 22.818 50.817 1.00 0.00 H new ATOM 0 HH TYR A 69 -9.225 24.826 49.463 1.00 0.00 H new ATOM 291 N PHE A 70 -15.339 25.645 53.607 1.00 0.00 N ATOM 292 CA PHE A 70 -14.968 24.896 54.802 1.00 0.00 C ATOM 293 C PHE A 70 -14.239 23.612 54.422 1.00 0.00 C ATOM 294 O PHE A 70 -14.654 22.898 53.510 1.00 0.00 O ATOM 295 CB PHE A 70 -16.219 24.556 55.616 1.00 0.00 C ATOM 296 CG PHE A 70 -15.963 24.833 57.078 1.00 0.00 C ATOM 297 CD1 PHE A 70 -15.287 23.889 57.861 1.00 0.00 C ATOM 298 CD2 PHE A 70 -16.403 26.032 57.651 1.00 0.00 C ATOM 299 CE1 PHE A 70 -15.049 24.145 59.217 1.00 0.00 C ATOM 300 CE2 PHE A 70 -16.165 26.289 59.008 1.00 0.00 C ATOM 301 CZ PHE A 70 -15.489 25.346 59.790 1.00 0.00 C ATOM 0 H PHE A 70 -16.286 25.471 53.272 1.00 0.00 H new ATOM 0 HA PHE A 70 -14.302 25.514 55.404 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -17.065 25.148 55.266 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -16.483 23.508 55.475 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -14.949 22.963 57.419 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -16.926 26.759 57.047 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -14.527 23.418 59.821 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -16.503 27.215 59.450 1.00 0.00 H new ATOM 0 HZ PHE A 70 -15.306 25.544 60.836 1.00 0.00 H new ATOM 311 N ASP A 71 -13.149 23.326 55.126 1.00 0.00 N ATOM 312 CA ASP A 71 -12.369 22.125 54.852 1.00 0.00 C ATOM 313 C ASP A 71 -12.732 21.014 55.833 1.00 0.00 C ATOM 314 O ASP A 71 -13.155 21.280 56.958 1.00 0.00 O ATOM 315 CB ASP A 71 -10.875 22.437 54.962 1.00 0.00 C ATOM 316 CG ASP A 71 -10.077 21.478 54.086 1.00 0.00 C ATOM 317 OD1 ASP A 71 -10.296 21.481 52.886 1.00 0.00 O ATOM 318 OD2 ASP A 71 -9.257 20.754 54.628 1.00 0.00 O ATOM 0 H ASP A 71 -12.788 23.904 55.885 1.00 0.00 H new ATOM 0 HA ASP A 71 -12.597 21.789 53.840 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.686 23.466 54.655 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.552 22.349 55.999 1.00 0.00 H new ATOM 323 N VAL A 72 -12.566 19.770 55.395 1.00 0.00 N ATOM 324 CA VAL A 72 -12.880 18.625 56.242 1.00 0.00 C ATOM 325 C VAL A 72 -11.968 18.597 57.464 1.00 0.00 C ATOM 326 O VAL A 72 -12.363 18.138 58.536 1.00 0.00 O ATOM 327 CB VAL A 72 -12.711 17.329 55.448 1.00 0.00 C ATOM 328 CG1 VAL A 72 -11.234 16.932 55.422 1.00 0.00 C ATOM 329 CG2 VAL A 72 -13.525 16.215 56.111 1.00 0.00 C ATOM 0 H VAL A 72 -12.219 19.530 54.466 1.00 0.00 H new ATOM 0 HA VAL A 72 -13.914 18.715 56.576 1.00 0.00 H new ATOM 0 HB VAL A 72 -13.064 17.481 54.428 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -11.115 16.008 54.856 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -10.653 17.724 54.950 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -10.880 16.780 56.442 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -13.405 15.291 55.546 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -13.172 16.065 57.131 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.578 16.495 56.129 1.00 0.00 H new ATOM 339 N ASN A 73 -10.746 19.091 57.295 1.00 0.00 N ATOM 340 CA ASN A 73 -9.785 19.119 58.390 1.00 0.00 C ATOM 341 C ASN A 73 -10.126 20.235 59.371 1.00 0.00 C ATOM 342 O ASN A 73 -9.401 20.464 60.341 1.00 0.00 O ATOM 343 CB ASN A 73 -8.374 19.333 57.840 1.00 0.00 C ATOM 344 CG ASN A 73 -7.774 18.001 57.403 1.00 0.00 C ATOM 345 OD1 ASN A 73 -8.483 16.998 57.321 1.00 0.00 O ATOM 346 ND2 ASN A 73 -6.503 17.931 57.116 1.00 0.00 N ATOM 0 H ASN A 73 -10.400 19.475 56.416 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.829 18.164 58.914 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.405 20.021 56.995 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.744 19.792 58.602 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.094 17.044 56.823 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.918 18.764 57.185 1.00 0.00 H new ATOM 353 N SER A 74 -11.229 20.929 59.111 1.00 0.00 N ATOM 354 CA SER A 74 -11.655 22.022 59.975 1.00 0.00 C ATOM 355 C SER A 74 -11.073 23.342 59.483 1.00 0.00 C ATOM 356 O SER A 74 -11.798 24.313 59.275 1.00 0.00 O ATOM 357 CB SER A 74 -11.200 21.763 61.412 1.00 0.00 C ATOM 358 OG SER A 74 -11.223 20.364 61.665 1.00 0.00 O ATOM 0 H SER A 74 -11.841 20.755 58.313 1.00 0.00 H new ATOM 0 HA SER A 74 -12.743 22.082 59.948 1.00 0.00 H new ATOM 0 HB2 SER A 74 -10.195 22.156 61.564 1.00 0.00 H new ATOM 0 HB3 SER A 74 -11.854 22.282 62.112 1.00 0.00 H new ATOM 0 HG SER A 74 -10.307 20.015 61.656 1.00 0.00 H new ATOM 364 N GLU A 75 -9.757 23.367 59.294 1.00 0.00 N ATOM 365 CA GLU A 75 -9.087 24.571 58.820 1.00 0.00 C ATOM 366 C GLU A 75 -9.638 24.976 57.450 1.00 0.00 C ATOM 367 O GLU A 75 -9.456 24.254 56.470 1.00 0.00 O ATOM 368 CB GLU A 75 -7.580 24.324 58.709 1.00 0.00 C ATOM 369 CG GLU A 75 -7.326 22.920 58.156 1.00 0.00 C ATOM 370 CD GLU A 75 -5.873 22.787 57.716 1.00 0.00 C ATOM 371 OE1 GLU A 75 -5.041 23.491 58.265 1.00 0.00 O ATOM 372 OE2 GLU A 75 -5.610 21.983 56.836 1.00 0.00 O ATOM 0 H GLU A 75 -9.138 22.573 59.461 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.270 25.375 59.533 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -7.127 25.070 58.056 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.111 24.430 59.687 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.554 22.174 58.917 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.989 22.727 57.313 1.00 0.00 H new ATOM 379 N PRO A 76 -10.304 26.102 57.357 1.00 0.00 N ATOM 380 CA PRO A 76 -10.883 26.579 56.070 1.00 0.00 C ATOM 381 C PRO A 76 -9.816 27.119 55.121 1.00 0.00 C ATOM 382 O PRO A 76 -8.869 27.781 55.547 1.00 0.00 O ATOM 383 CB PRO A 76 -11.853 27.683 56.491 1.00 0.00 C ATOM 384 CG PRO A 76 -11.337 28.192 57.798 1.00 0.00 C ATOM 385 CD PRO A 76 -10.579 27.041 58.460 1.00 0.00 C ATOM 0 HA PRO A 76 -11.366 25.773 55.518 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -11.889 28.479 55.747 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.867 27.296 56.593 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.680 29.049 57.646 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.158 28.528 58.432 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.657 27.388 58.926 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -11.174 26.571 59.243 1.00 0.00 H new ATOM 393 N GLN A 77 -9.979 26.831 53.833 1.00 0.00 N ATOM 394 CA GLN A 77 -9.024 27.290 52.828 1.00 0.00 C ATOM 395 C GLN A 77 -9.623 28.417 51.993 1.00 0.00 C ATOM 396 O GLN A 77 -10.825 28.431 51.723 1.00 0.00 O ATOM 397 CB GLN A 77 -8.632 26.128 51.913 1.00 0.00 C ATOM 398 CG GLN A 77 -7.639 26.619 50.858 1.00 0.00 C ATOM 399 CD GLN A 77 -6.850 25.440 50.297 1.00 0.00 C ATOM 400 OE1 GLN A 77 -7.272 24.816 49.324 1.00 0.00 O ATOM 401 NE2 GLN A 77 -5.723 25.094 50.857 1.00 0.00 N ATOM 0 H GLN A 77 -10.757 26.286 53.462 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.138 27.665 53.340 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.187 25.324 52.499 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -9.518 25.717 51.430 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.171 27.127 50.054 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.958 27.347 51.299 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.374 25.612 51.663 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.191 24.306 50.488 1.00 0.00 H new ATOM 410 N ARG A 78 -8.780 29.360 51.587 1.00 0.00 N ATOM 411 CA ARG A 78 -9.239 30.487 50.781 1.00 0.00 C ATOM 412 C ARG A 78 -8.226 30.809 49.684 1.00 0.00 C ATOM 413 O ARG A 78 -7.031 30.936 49.948 1.00 0.00 O ATOM 414 CB ARG A 78 -9.442 31.717 51.670 1.00 0.00 C ATOM 415 CG ARG A 78 -9.523 32.969 50.797 1.00 0.00 C ATOM 416 CD ARG A 78 -10.004 34.152 51.640 1.00 0.00 C ATOM 417 NE ARG A 78 -8.984 34.525 52.615 1.00 0.00 N ATOM 418 CZ ARG A 78 -8.896 35.769 53.075 1.00 0.00 C ATOM 419 NH1 ARG A 78 -9.730 36.681 52.655 1.00 0.00 N ATOM 420 NH2 ARG A 78 -7.976 36.078 53.948 1.00 0.00 N ATOM 0 H ARG A 78 -7.783 29.368 51.800 1.00 0.00 H new ATOM 0 HA ARG A 78 -10.187 30.216 50.316 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -10.355 31.609 52.255 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.618 31.807 52.378 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -8.546 33.189 50.367 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.206 32.801 49.965 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -10.227 35.001 50.994 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.929 33.890 52.153 1.00 0.00 H new ATOM 0 HE ARG A 78 -8.328 33.819 52.949 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -10.450 36.439 51.974 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.662 37.636 53.008 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.325 35.365 54.277 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.908 37.032 54.301 1.00 0.00 H new ATOM 434 N VAL A 79 -8.713 30.936 48.453 1.00 0.00 N ATOM 435 CA VAL A 79 -7.840 31.238 47.324 1.00 0.00 C ATOM 436 C VAL A 79 -8.002 32.694 46.896 1.00 0.00 C ATOM 437 O VAL A 79 -9.106 33.138 46.578 1.00 0.00 O ATOM 438 CB VAL A 79 -8.170 30.317 46.146 1.00 0.00 C ATOM 439 CG1 VAL A 79 -7.068 30.423 45.090 1.00 0.00 C ATOM 440 CG2 VAL A 79 -8.263 28.869 46.635 1.00 0.00 C ATOM 0 H VAL A 79 -9.699 30.835 48.213 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.808 31.075 47.633 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.124 30.617 45.712 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.303 29.767 44.252 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.000 31.452 44.738 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -6.115 30.125 45.527 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.498 28.216 45.795 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.310 28.570 47.071 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -9.048 28.789 47.387 1.00 0.00 H new ATOM 450 N ASP A 80 -6.897 33.433 46.891 1.00 0.00 N ATOM 451 CA ASP A 80 -6.929 34.839 46.501 1.00 0.00 C ATOM 452 C ASP A 80 -5.992 35.093 45.326 1.00 0.00 C ATOM 453 O ASP A 80 -4.852 34.627 45.316 1.00 0.00 O ATOM 454 CB ASP A 80 -6.517 35.717 47.685 1.00 0.00 C ATOM 455 CG ASP A 80 -6.530 37.186 47.273 1.00 0.00 C ATOM 456 OD1 ASP A 80 -6.149 37.468 46.148 1.00 0.00 O ATOM 457 OD2 ASP A 80 -6.917 38.005 48.088 1.00 0.00 O ATOM 0 H ASP A 80 -5.974 33.085 47.151 1.00 0.00 H new ATOM 0 HA ASP A 80 -7.946 35.089 46.198 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -7.199 35.559 48.521 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.521 35.436 48.028 1.00 0.00 H new ATOM 462 N GLY A 81 -6.476 35.837 44.338 1.00 0.00 N ATOM 463 CA GLY A 81 -5.671 36.149 43.163 1.00 0.00 C ATOM 464 C GLY A 81 -5.934 35.151 42.042 1.00 0.00 C ATOM 465 O GLY A 81 -5.139 35.027 41.110 1.00 0.00 O ATOM 0 H GLY A 81 -7.416 36.233 44.327 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.899 37.157 42.818 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.614 36.134 43.427 1.00 0.00 H new ATOM 469 N ALA A 82 -7.054 34.442 42.136 1.00 0.00 N ATOM 470 CA ALA A 82 -7.411 33.458 41.121 1.00 0.00 C ATOM 471 C ALA A 82 -8.206 34.113 39.996 1.00 0.00 C ATOM 472 O ALA A 82 -9.195 34.803 40.243 1.00 0.00 O ATOM 473 CB ALA A 82 -8.242 32.337 41.750 1.00 0.00 C ATOM 0 H ALA A 82 -7.726 34.529 42.899 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.493 33.041 40.707 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.505 31.606 40.985 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.662 31.850 42.534 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.152 32.756 42.179 1.00 0.00 H new ATOM 479 N VAL A 83 -7.768 33.892 38.761 1.00 0.00 N ATOM 480 CA VAL A 83 -8.450 34.465 37.606 1.00 0.00 C ATOM 481 C VAL A 83 -9.725 33.686 37.297 1.00 0.00 C ATOM 482 O VAL A 83 -10.582 34.152 36.548 1.00 0.00 O ATOM 483 CB VAL A 83 -7.521 34.443 36.389 1.00 0.00 C ATOM 484 CG1 VAL A 83 -6.863 33.065 36.271 1.00 0.00 C ATOM 485 CG2 VAL A 83 -8.332 34.734 35.124 1.00 0.00 C ATOM 0 H VAL A 83 -6.951 33.325 38.535 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.718 35.496 37.837 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.748 35.203 36.508 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.202 33.050 35.404 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -6.285 32.860 37.172 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.633 32.303 36.153 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -7.672 34.719 34.257 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -9.105 33.975 35.005 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -8.798 35.716 35.208 1.00 0.00 H new ATOM 495 N LEU A 84 -9.844 32.500 37.884 1.00 0.00 N ATOM 496 CA LEU A 84 -11.022 31.668 37.670 1.00 0.00 C ATOM 497 C LEU A 84 -11.163 30.641 38.789 1.00 0.00 C ATOM 498 O LEU A 84 -10.186 30.280 39.445 1.00 0.00 O ATOM 499 CB LEU A 84 -10.922 30.949 36.322 1.00 0.00 C ATOM 500 CG LEU A 84 -9.454 30.840 35.901 1.00 0.00 C ATOM 501 CD1 LEU A 84 -8.688 30.009 36.932 1.00 0.00 C ATOM 502 CD2 LEU A 84 -9.367 30.158 34.535 1.00 0.00 C ATOM 0 H LEU A 84 -9.145 32.096 38.507 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.901 32.312 37.670 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -11.364 29.955 36.396 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.487 31.494 35.566 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.018 31.837 35.841 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.643 29.931 36.633 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.751 30.491 37.907 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.124 29.012 36.992 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.323 30.079 34.233 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.803 29.161 34.598 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.914 30.747 33.799 1.00 0.00 H new ATOM 514 N PRO A 85 -12.359 30.173 39.010 1.00 0.00 N ATOM 515 CA PRO A 85 -12.654 29.164 40.070 1.00 0.00 C ATOM 516 C PRO A 85 -11.829 27.892 39.903 1.00 0.00 C ATOM 517 O PRO A 85 -11.425 27.541 38.794 1.00 0.00 O ATOM 518 CB PRO A 85 -14.152 28.868 39.903 1.00 0.00 C ATOM 519 CG PRO A 85 -14.535 29.418 38.567 1.00 0.00 C ATOM 520 CD PRO A 85 -13.566 30.556 38.270 1.00 0.00 C ATOM 0 HA PRO A 85 -12.401 29.539 41.062 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.346 27.797 39.954 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -14.733 29.335 40.698 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.474 28.647 37.799 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -15.564 29.778 38.577 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.370 30.649 37.202 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -13.957 31.516 38.607 1.00 0.00 H new ATOM 528 N TRP A 86 -11.584 27.203 41.013 1.00 0.00 N ATOM 529 CA TRP A 86 -10.808 25.969 40.983 1.00 0.00 C ATOM 530 C TRP A 86 -11.652 24.798 41.474 1.00 0.00 C ATOM 531 O TRP A 86 -12.675 24.992 42.132 1.00 0.00 O ATOM 532 CB TRP A 86 -9.566 26.111 41.869 1.00 0.00 C ATOM 533 CG TRP A 86 -8.340 26.178 41.016 1.00 0.00 C ATOM 534 CD1 TRP A 86 -7.946 25.221 40.144 1.00 0.00 C ATOM 535 CD2 TRP A 86 -7.344 27.237 40.938 1.00 0.00 C ATOM 536 NE1 TRP A 86 -6.771 25.628 39.536 1.00 0.00 N ATOM 537 CE2 TRP A 86 -6.360 26.864 39.993 1.00 0.00 C ATOM 538 CE3 TRP A 86 -7.201 28.474 41.592 1.00 0.00 C ATOM 539 CZ2 TRP A 86 -5.272 27.690 39.705 1.00 0.00 C ATOM 540 CZ3 TRP A 86 -6.108 29.308 41.304 1.00 0.00 C ATOM 541 CH2 TRP A 86 -5.145 28.915 40.363 1.00 0.00 C ATOM 0 H TRP A 86 -11.910 27.477 41.940 1.00 0.00 H new ATOM 0 HA TRP A 86 -10.501 25.778 39.955 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.645 27.010 42.480 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -9.498 25.266 42.554 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -8.463 24.292 39.954 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -6.270 25.081 38.836 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -7.936 28.784 42.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -4.534 27.384 38.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -6.009 30.257 41.810 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -4.306 29.560 40.147 1.00 0.00 H new ATOM 552 N SER A 87 -11.218 23.590 41.165 1.00 0.00 N ATOM 553 CA SER A 87 -11.925 22.380 41.572 1.00 0.00 C ATOM 554 C SER A 87 -11.144 21.624 42.622 1.00 0.00 C ATOM 555 O SER A 87 -9.924 21.480 42.498 1.00 0.00 O ATOM 556 CB SER A 87 -12.239 21.486 40.345 1.00 0.00 C ATOM 557 OG SER A 87 -13.175 22.089 39.444 1.00 0.00 O ATOM 0 H SER A 87 -10.369 23.415 40.627 1.00 0.00 H new ATOM 0 HA SER A 87 -12.875 22.675 42.019 1.00 0.00 H new ATOM 0 HB2 SER A 87 -11.313 21.272 39.811 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.636 20.531 40.689 1.00 0.00 H new ATOM 0 HG SER A 87 -13.881 21.445 39.226 1.00 0.00 H new ATOM 563 N LEU A 88 -11.837 21.100 43.623 1.00 0.00 N ATOM 564 CA LEU A 88 -11.179 20.336 44.678 1.00 0.00 C ATOM 565 C LEU A 88 -11.896 19.010 44.901 1.00 0.00 C ATOM 566 O LEU A 88 -13.126 18.945 44.867 1.00 0.00 O ATOM 567 CB LEU A 88 -11.173 21.143 45.979 1.00 0.00 C ATOM 568 CG LEU A 88 -9.735 21.305 46.479 1.00 0.00 C ATOM 569 CD1 LEU A 88 -8.922 22.095 45.450 1.00 0.00 C ATOM 570 CD2 LEU A 88 -9.744 22.058 47.811 1.00 0.00 C ATOM 0 H LEU A 88 -12.848 21.188 43.729 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.152 20.134 44.372 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.623 22.122 45.813 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -11.776 20.639 46.734 1.00 0.00 H new ATOM 0 HG LEU A 88 -9.284 20.322 46.619 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.898 22.210 45.806 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -8.918 21.559 44.501 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -9.370 23.079 45.310 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -8.721 22.175 48.170 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.194 23.041 47.670 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -10.323 21.495 48.543 1.00 0.00 H new ATOM 582 N HIS A 89 -11.124 17.953 45.129 1.00 0.00 N ATOM 583 CA HIS A 89 -11.703 16.635 45.357 1.00 0.00 C ATOM 584 C HIS A 89 -11.501 16.203 46.805 1.00 0.00 C ATOM 585 O HIS A 89 -10.369 16.071 47.274 1.00 0.00 O ATOM 586 CB HIS A 89 -11.058 15.610 44.421 1.00 0.00 C ATOM 587 CG HIS A 89 -9.626 15.991 44.167 1.00 0.00 C ATOM 588 ND1 HIS A 89 -9.277 17.179 43.544 1.00 0.00 N ATOM 589 CD2 HIS A 89 -8.444 15.351 44.445 1.00 0.00 C ATOM 590 CE1 HIS A 89 -7.934 17.217 43.468 1.00 0.00 C ATOM 591 NE2 HIS A 89 -7.376 16.127 44.002 1.00 0.00 N ATOM 0 H HIS A 89 -10.105 17.982 45.161 1.00 0.00 H new ATOM 0 HA HIS A 89 -12.772 16.690 45.153 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -11.107 14.616 44.865 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -11.606 15.567 43.480 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -8.356 14.392 44.933 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -7.375 18.030 43.029 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -6.382 15.910 44.070 1.00 0.00 H new ATOM 600 N ILE A 90 -12.607 15.979 47.506 1.00 0.00 N ATOM 601 CA ILE A 90 -12.547 15.555 48.901 1.00 0.00 C ATOM 602 C ILE A 90 -13.415 14.321 49.117 1.00 0.00 C ATOM 603 O ILE A 90 -14.579 14.292 48.716 1.00 0.00 O ATOM 604 CB ILE A 90 -13.027 16.688 49.813 1.00 0.00 C ATOM 605 CG1 ILE A 90 -12.212 17.951 49.528 1.00 0.00 C ATOM 606 CG2 ILE A 90 -12.837 16.279 51.276 1.00 0.00 C ATOM 607 CD1 ILE A 90 -12.829 19.134 50.277 1.00 0.00 C ATOM 0 H ILE A 90 -13.551 16.083 47.134 1.00 0.00 H new ATOM 0 HA ILE A 90 -11.514 15.308 49.146 1.00 0.00 H new ATOM 0 HB ILE A 90 -14.082 16.885 49.624 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -11.178 17.808 49.841 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -12.196 18.153 48.457 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -13.178 17.085 51.926 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -13.416 15.378 51.480 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -11.782 16.083 51.465 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -12.249 20.035 50.075 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -13.856 19.281 49.943 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -12.822 18.930 51.348 1.00 0.00 H new ATOM 619 N THR A 91 -12.842 13.301 49.748 1.00 0.00 N ATOM 620 CA THR A 91 -13.576 12.068 50.004 1.00 0.00 C ATOM 621 C THR A 91 -13.989 11.976 51.469 1.00 0.00 C ATOM 622 O THR A 91 -13.148 12.037 52.365 1.00 0.00 O ATOM 623 CB THR A 91 -12.711 10.860 49.640 1.00 0.00 C ATOM 624 OG1 THR A 91 -11.632 11.283 48.818 1.00 0.00 O ATOM 625 CG2 THR A 91 -13.556 9.832 48.885 1.00 0.00 C ATOM 0 H THR A 91 -11.881 13.303 50.089 1.00 0.00 H new ATOM 0 HA THR A 91 -14.475 12.073 49.388 1.00 0.00 H new ATOM 0 HB THR A 91 -12.320 10.406 50.551 1.00 0.00 H new ATOM 0 HG1 THR A 91 -11.076 10.510 48.585 1.00 0.00 H new ATOM 0 HG21 THR A 91 -12.938 8.972 48.627 1.00 0.00 H new ATOM 0 HG22 THR A 91 -14.384 9.507 49.516 1.00 0.00 H new ATOM 0 HG23 THR A 91 -13.949 10.283 47.974 1.00 0.00 H new ATOM 633 N THR A 92 -15.287 11.821 51.702 1.00 0.00 N ATOM 634 CA THR A 92 -15.805 11.714 53.060 1.00 0.00 C ATOM 635 C THR A 92 -16.050 10.251 53.418 1.00 0.00 C ATOM 636 O THR A 92 -16.290 9.421 52.541 1.00 0.00 O ATOM 637 CB THR A 92 -17.109 12.500 53.187 1.00 0.00 C ATOM 638 OG1 THR A 92 -17.167 13.486 52.165 1.00 0.00 O ATOM 639 CG2 THR A 92 -17.170 13.178 54.556 1.00 0.00 C ATOM 0 H THR A 92 -15.997 11.767 50.972 1.00 0.00 H new ATOM 0 HA THR A 92 -15.068 12.129 53.747 1.00 0.00 H new ATOM 0 HB THR A 92 -17.954 11.819 53.085 1.00 0.00 H new ATOM 0 HG1 THR A 92 -17.543 14.314 52.530 1.00 0.00 H new ATOM 0 HG21 THR A 92 -18.101 13.738 54.644 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.127 12.421 55.339 1.00 0.00 H new ATOM 0 HG23 THR A 92 -16.326 13.859 54.663 1.00 0.00 H new ATOM 647 N ASN A 93 -15.986 9.940 54.708 1.00 0.00 N ATOM 648 CA ASN A 93 -16.201 8.572 55.163 1.00 0.00 C ATOM 649 C ASN A 93 -17.598 8.090 54.777 1.00 0.00 C ATOM 650 O ASN A 93 -18.030 7.014 55.193 1.00 0.00 O ATOM 651 CB ASN A 93 -16.034 8.493 56.681 1.00 0.00 C ATOM 652 CG ASN A 93 -17.306 8.966 57.373 1.00 0.00 C ATOM 653 OD1 ASN A 93 -17.952 9.908 56.910 1.00 0.00 O ATOM 654 ND2 ASN A 93 -17.710 8.368 58.460 1.00 0.00 N ATOM 0 H ASN A 93 -15.789 10.610 55.451 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.462 7.931 54.683 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -15.809 7.468 56.977 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.190 9.108 56.994 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.561 8.680 58.927 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.175 7.588 58.842 1.00 0.00 H new ATOM 661 N ASP A 94 -18.298 8.891 53.979 1.00 0.00 N ATOM 662 CA ASP A 94 -19.644 8.535 53.544 1.00 0.00 C ATOM 663 C ASP A 94 -19.726 8.518 52.019 1.00 0.00 C ATOM 664 O ASP A 94 -19.258 7.579 51.376 1.00 0.00 O ATOM 665 CB ASP A 94 -20.658 9.534 54.107 1.00 0.00 C ATOM 666 CG ASP A 94 -22.076 9.068 53.795 1.00 0.00 C ATOM 667 OD1 ASP A 94 -22.355 8.822 52.634 1.00 0.00 O ATOM 668 OD2 ASP A 94 -22.861 8.963 54.723 1.00 0.00 O ATOM 0 H ASP A 94 -17.958 9.784 53.623 1.00 0.00 H new ATOM 0 HA ASP A 94 -19.877 7.538 53.918 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -20.527 9.630 55.185 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -20.487 10.520 53.676 1.00 0.00 H new ATOM 673 N ALA A 95 -20.319 9.561 51.447 1.00 0.00 N ATOM 674 CA ALA A 95 -20.451 9.652 49.998 1.00 0.00 C ATOM 675 C ALA A 95 -21.397 10.786 49.613 1.00 0.00 C ATOM 676 O ALA A 95 -21.023 11.692 48.867 1.00 0.00 O ATOM 677 CB ALA A 95 -20.981 8.329 49.438 1.00 0.00 C ATOM 0 H ALA A 95 -20.713 10.349 51.960 1.00 0.00 H new ATOM 0 HA ALA A 95 -19.467 9.858 49.576 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -21.077 8.405 48.355 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -20.288 7.525 49.686 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -21.956 8.114 49.874 1.00 0.00 H new ATOM 683 N ALA A 96 -22.621 10.731 50.128 1.00 0.00 N ATOM 684 CA ALA A 96 -23.611 11.761 49.831 1.00 0.00 C ATOM 685 C ALA A 96 -23.508 12.907 50.832 1.00 0.00 C ATOM 686 O ALA A 96 -23.765 12.727 52.023 1.00 0.00 O ATOM 687 CB ALA A 96 -25.019 11.163 49.880 1.00 0.00 C ATOM 0 H ALA A 96 -22.950 9.991 50.748 1.00 0.00 H new ATOM 0 HA ALA A 96 -23.416 12.148 48.831 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -25.752 11.939 49.657 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -25.101 10.364 49.143 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -25.209 10.760 50.875 1.00 0.00 H new ATOM 693 N VAL A 97 -23.128 14.084 50.344 1.00 0.00 N ATOM 694 CA VAL A 97 -22.994 15.249 51.210 1.00 0.00 C ATOM 695 C VAL A 97 -22.828 16.521 50.386 1.00 0.00 C ATOM 696 O VAL A 97 -22.199 16.512 49.328 1.00 0.00 O ATOM 697 CB VAL A 97 -21.784 15.075 52.130 1.00 0.00 C ATOM 698 CG1 VAL A 97 -20.510 15.000 51.287 1.00 0.00 C ATOM 699 CG2 VAL A 97 -21.694 16.267 53.083 1.00 0.00 C ATOM 0 H VAL A 97 -22.909 14.255 49.363 1.00 0.00 H new ATOM 0 HA VAL A 97 -23.901 15.337 51.808 1.00 0.00 H new ATOM 0 HB VAL A 97 -21.894 14.156 52.706 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -19.647 14.876 51.942 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -20.574 14.151 50.606 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -20.400 15.919 50.712 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -20.832 16.144 53.739 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -21.584 17.186 52.507 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -22.602 16.322 53.683 1.00 0.00 H new ATOM 709 N MET A 98 -23.393 17.617 50.883 1.00 0.00 N ATOM 710 CA MET A 98 -23.302 18.896 50.191 1.00 0.00 C ATOM 711 C MET A 98 -22.633 19.937 51.085 1.00 0.00 C ATOM 712 O MET A 98 -22.840 19.949 52.298 1.00 0.00 O ATOM 713 CB MET A 98 -24.698 19.382 49.798 1.00 0.00 C ATOM 714 CG MET A 98 -25.559 19.526 51.055 1.00 0.00 C ATOM 715 SD MET A 98 -27.304 19.613 50.584 1.00 0.00 S ATOM 716 CE MET A 98 -27.915 18.372 51.752 1.00 0.00 C ATOM 0 H MET A 98 -23.916 17.645 51.758 1.00 0.00 H new ATOM 0 HA MET A 98 -22.701 18.760 49.292 1.00 0.00 H new ATOM 0 HB2 MET A 98 -24.629 20.338 49.279 1.00 0.00 H new ATOM 0 HB3 MET A 98 -25.159 18.677 49.107 1.00 0.00 H new ATOM 0 HG2 MET A 98 -25.393 18.680 51.721 1.00 0.00 H new ATOM 0 HG3 MET A 98 -25.274 20.424 51.603 1.00 0.00 H new ATOM 0 HE1 MET A 98 -28.993 18.261 51.634 1.00 0.00 H new ATOM 0 HE2 MET A 98 -27.428 17.417 51.556 1.00 0.00 H new ATOM 0 HE3 MET A 98 -27.692 18.690 52.770 1.00 0.00 H new ATOM 726 N GLY A 99 -21.829 20.804 50.479 1.00 0.00 N ATOM 727 CA GLY A 99 -21.136 21.839 51.236 1.00 0.00 C ATOM 728 C GLY A 99 -21.686 23.222 50.904 1.00 0.00 C ATOM 729 O GLY A 99 -22.355 23.408 49.888 1.00 0.00 O ATOM 0 H GLY A 99 -21.642 20.811 49.476 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -21.245 21.648 52.304 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.070 21.805 51.013 1.00 0.00 H new ATOM 733 N ASN A 100 -21.398 24.190 51.769 1.00 0.00 N ATOM 734 CA ASN A 100 -21.869 25.554 51.559 1.00 0.00 C ATOM 735 C ASN A 100 -20.727 26.447 51.087 1.00 0.00 C ATOM 736 O ASN A 100 -19.740 26.634 51.797 1.00 0.00 O ATOM 737 CB ASN A 100 -22.449 26.112 52.860 1.00 0.00 C ATOM 738 CG ASN A 100 -23.398 25.097 53.486 1.00 0.00 C ATOM 739 OD1 ASN A 100 -23.877 25.299 54.603 1.00 0.00 O ATOM 740 ND2 ASN A 100 -23.698 24.008 52.833 1.00 0.00 N ATOM 0 H ASN A 100 -20.845 24.057 52.616 1.00 0.00 H new ATOM 0 HA ASN A 100 -22.644 25.537 50.793 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -21.643 26.346 53.556 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -22.979 27.043 52.661 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -24.330 23.323 53.247 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -23.301 23.842 51.908 1.00 0.00 H new ATOM 747 N ILE A 101 -20.867 26.993 49.883 1.00 0.00 N ATOM 748 CA ILE A 101 -19.839 27.865 49.327 1.00 0.00 C ATOM 749 C ILE A 101 -20.457 29.150 48.786 1.00 0.00 C ATOM 750 O ILE A 101 -21.443 29.113 48.048 1.00 0.00 O ATOM 751 CB ILE A 101 -19.090 27.144 48.207 1.00 0.00 C ATOM 752 CG1 ILE A 101 -17.786 27.889 47.907 1.00 0.00 C ATOM 753 CG2 ILE A 101 -19.959 27.112 46.948 1.00 0.00 C ATOM 754 CD1 ILE A 101 -16.809 26.947 47.200 1.00 0.00 C ATOM 0 H ILE A 101 -21.675 26.849 49.278 1.00 0.00 H new ATOM 0 HA ILE A 101 -19.140 28.121 50.123 1.00 0.00 H new ATOM 0 HB ILE A 101 -18.865 26.124 48.518 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -17.987 28.758 47.280 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -17.345 28.259 48.833 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -19.424 26.598 46.150 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -20.889 26.584 47.161 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -20.184 28.132 46.635 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -15.881 27.478 46.987 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -16.598 26.092 47.843 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -17.251 26.599 46.266 1.00 0.00 H new ATOM 766 N VAL A 102 -19.871 30.282 49.156 1.00 0.00 N ATOM 767 CA VAL A 102 -20.371 31.575 48.700 1.00 0.00 C ATOM 768 C VAL A 102 -19.271 32.349 47.980 1.00 0.00 C ATOM 769 O VAL A 102 -18.092 32.227 48.315 1.00 0.00 O ATOM 770 CB VAL A 102 -20.875 32.392 49.890 1.00 0.00 C ATOM 771 CG1 VAL A 102 -20.896 33.876 49.518 1.00 0.00 C ATOM 772 CG2 VAL A 102 -22.289 31.939 50.256 1.00 0.00 C ATOM 0 H VAL A 102 -19.055 30.333 49.766 1.00 0.00 H new ATOM 0 HA VAL A 102 -21.194 31.400 48.006 1.00 0.00 H new ATOM 0 HB VAL A 102 -20.212 32.240 50.742 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -21.255 34.459 50.366 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -19.889 34.200 49.256 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -21.559 34.028 48.666 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -22.649 32.521 51.104 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -22.952 32.091 49.404 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -22.275 30.882 50.521 1.00 0.00 H new ATOM 782 N ALA A 103 -19.665 33.144 46.991 1.00 0.00 N ATOM 783 CA ALA A 103 -18.703 33.931 46.231 1.00 0.00 C ATOM 784 C ALA A 103 -19.129 35.393 46.175 1.00 0.00 C ATOM 785 O ALA A 103 -20.307 35.701 45.991 1.00 0.00 O ATOM 786 CB ALA A 103 -18.583 33.379 44.809 1.00 0.00 C ATOM 0 H ALA A 103 -20.636 33.260 46.699 1.00 0.00 H new ATOM 0 HA ALA A 103 -17.736 33.865 46.730 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -17.862 33.973 44.248 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -18.247 32.343 44.848 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.554 33.427 44.317 1.00 0.00 H new ATOM 792 N GLN A 104 -18.163 36.293 46.333 1.00 0.00 N ATOM 793 CA GLN A 104 -18.452 37.721 46.298 1.00 0.00 C ATOM 794 C GLN A 104 -17.626 38.406 45.212 1.00 0.00 C ATOM 795 O GLN A 104 -16.672 39.125 45.506 1.00 0.00 O ATOM 796 CB GLN A 104 -18.140 38.349 47.658 1.00 0.00 C ATOM 797 CG GLN A 104 -18.809 37.529 48.762 1.00 0.00 C ATOM 798 CD GLN A 104 -20.317 37.747 48.733 1.00 0.00 C ATOM 799 OE1 GLN A 104 -21.054 36.927 48.186 1.00 0.00 O ATOM 800 NE2 GLN A 104 -20.824 38.812 49.295 1.00 0.00 N ATOM 0 H GLN A 104 -17.182 36.061 46.485 1.00 0.00 H new ATOM 0 HA GLN A 104 -19.510 37.856 46.072 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -17.062 38.382 47.817 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -18.498 39.378 47.686 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -18.584 36.471 48.628 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -18.410 37.819 49.734 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -20.211 39.490 49.748 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -21.832 38.965 49.281 1.00 0.00 H new ATOM 809 N GLY A 105 -18.002 38.178 43.958 1.00 0.00 N ATOM 810 CA GLY A 105 -17.292 38.777 42.834 1.00 0.00 C ATOM 811 C GLY A 105 -18.254 39.522 41.916 1.00 0.00 C ATOM 812 O GLY A 105 -19.467 39.321 41.978 1.00 0.00 O ATOM 0 H GLY A 105 -18.790 37.586 43.695 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -16.531 39.464 43.204 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -16.774 38.001 42.271 1.00 0.00 H new ATOM 816 N ASN A 106 -17.708 40.382 41.065 1.00 0.00 N ATOM 817 CA ASN A 106 -18.531 41.152 40.138 1.00 0.00 C ATOM 818 C ASN A 106 -18.837 40.340 38.884 1.00 0.00 C ATOM 819 O ASN A 106 -18.865 40.878 37.777 1.00 0.00 O ATOM 820 CB ASN A 106 -17.808 42.443 39.745 1.00 0.00 C ATOM 821 CG ASN A 106 -18.583 43.159 38.646 1.00 0.00 C ATOM 822 OD1 ASN A 106 -19.755 42.858 38.413 1.00 0.00 O ATOM 823 ND2 ASN A 106 -17.998 44.096 37.951 1.00 0.00 N ATOM 0 H ASN A 106 -16.707 40.564 40.997 1.00 0.00 H new ATOM 0 HA ASN A 106 -19.469 41.396 40.636 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -17.709 43.093 40.614 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.799 42.215 39.401 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.511 44.580 37.214 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.028 44.344 38.145 1.00 0.00 H new ATOM 830 N SER A 107 -19.064 39.043 39.062 1.00 0.00 N ATOM 831 CA SER A 107 -19.367 38.171 37.933 1.00 0.00 C ATOM 832 C SER A 107 -20.754 38.479 37.376 1.00 0.00 C ATOM 833 O SER A 107 -21.433 39.390 37.846 1.00 0.00 O ATOM 834 CB SER A 107 -19.303 36.708 38.370 1.00 0.00 C ATOM 835 OG SER A 107 -19.922 36.572 39.642 1.00 0.00 O ATOM 0 H SER A 107 -19.044 38.576 39.968 1.00 0.00 H new ATOM 0 HA SER A 107 -18.627 38.348 37.153 1.00 0.00 H new ATOM 0 HB2 SER A 107 -19.806 36.075 37.638 1.00 0.00 H new ATOM 0 HB3 SER A 107 -18.266 36.376 38.420 1.00 0.00 H new ATOM 0 HG SER A 107 -19.302 36.135 40.262 1.00 0.00 H new ATOM 841 N ASP A 108 -21.165 37.714 36.370 1.00 0.00 N ATOM 842 CA ASP A 108 -22.472 37.916 35.756 1.00 0.00 C ATOM 843 C ASP A 108 -23.443 36.822 36.187 1.00 0.00 C ATOM 844 O ASP A 108 -24.614 37.090 36.457 1.00 0.00 O ATOM 845 CB ASP A 108 -22.341 37.915 34.232 1.00 0.00 C ATOM 846 CG ASP A 108 -22.115 39.336 33.727 1.00 0.00 C ATOM 847 OD1 ASP A 108 -21.062 39.882 34.008 1.00 0.00 O ATOM 848 OD2 ASP A 108 -22.999 39.856 33.067 1.00 0.00 O ATOM 0 H ASP A 108 -20.617 36.955 35.965 1.00 0.00 H new ATOM 0 HA ASP A 108 -22.860 38.880 36.085 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -21.510 37.277 33.931 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -23.242 37.499 33.782 1.00 0.00 H new ATOM 853 N SER A 109 -22.949 35.593 36.260 1.00 0.00 N ATOM 854 CA SER A 109 -23.774 34.451 36.644 1.00 0.00 C ATOM 855 C SER A 109 -23.037 33.551 37.607 1.00 0.00 C ATOM 856 O SER A 109 -22.032 32.933 37.225 1.00 0.00 O ATOM 857 CB SER A 109 -24.255 33.675 35.393 1.00 0.00 C ATOM 858 OG SER A 109 -25.034 32.520 35.721 1.00 0.00 O ATOM 0 H SER A 109 -21.977 35.359 36.058 1.00 0.00 H new ATOM 0 HA SER A 109 -24.658 34.826 37.160 1.00 0.00 H new ATOM 0 HB2 SER A 109 -24.847 34.340 34.764 1.00 0.00 H new ATOM 0 HB3 SER A 109 -23.389 33.369 34.806 1.00 0.00 H new ATOM 0 HG SER A 109 -25.313 32.069 34.897 1.00 0.00 H new ATOM 864 N ILE A 110 -23.534 33.429 38.827 1.00 0.00 N ATOM 865 CA ILE A 110 -22.904 32.572 39.824 1.00 0.00 C ATOM 866 C ILE A 110 -23.850 31.451 40.240 1.00 0.00 C ATOM 867 O ILE A 110 -25.062 31.548 40.056 1.00 0.00 O ATOM 868 CB ILE A 110 -22.518 33.393 41.055 1.00 0.00 C ATOM 869 CG1 ILE A 110 -21.446 34.413 40.670 1.00 0.00 C ATOM 870 CG2 ILE A 110 -21.968 32.459 42.135 1.00 0.00 C ATOM 871 CD1 ILE A 110 -21.669 35.711 41.450 1.00 0.00 C ATOM 0 H ILE A 110 -24.371 33.911 39.153 1.00 0.00 H new ATOM 0 HA ILE A 110 -22.008 32.136 39.383 1.00 0.00 H new ATOM 0 HB ILE A 110 -23.396 33.915 41.436 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -20.455 34.013 40.885 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -21.485 34.609 39.599 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.692 33.042 43.014 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -22.731 31.730 42.408 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -21.089 31.939 41.753 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -20.904 36.437 41.175 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -22.654 36.114 41.213 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -21.608 35.508 42.519 1.00 0.00 H new ATOM 883 N GLY A 111 -23.286 30.388 40.803 1.00 0.00 N ATOM 884 CA GLY A 111 -24.089 29.252 41.245 1.00 0.00 C ATOM 885 C GLY A 111 -23.205 28.113 41.737 1.00 0.00 C ATOM 886 O GLY A 111 -22.085 27.929 41.257 1.00 0.00 O ATOM 0 H GLY A 111 -22.284 30.288 40.964 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -24.760 29.566 42.044 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -24.714 28.903 40.423 1.00 0.00 H new ATOM 890 N CYS A 112 -23.715 27.346 42.696 1.00 0.00 N ATOM 891 CA CYS A 112 -22.962 26.223 43.246 1.00 0.00 C ATOM 892 C CYS A 112 -23.692 24.908 42.985 1.00 0.00 C ATOM 893 O CYS A 112 -24.917 24.880 42.875 1.00 0.00 O ATOM 894 CB CYS A 112 -22.768 26.410 44.753 1.00 0.00 C ATOM 895 SG CYS A 112 -24.298 25.967 45.614 1.00 0.00 S ATOM 0 H CYS A 112 -24.639 27.480 43.106 1.00 0.00 H new ATOM 0 HA CYS A 112 -21.989 26.189 42.756 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -21.946 25.787 45.105 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -22.501 27.444 44.971 1.00 0.00 H new ATOM 0 HG CYS A 112 -25.287 25.972 44.771 1.00 0.00 H new ATOM 901 N ARG A 113 -22.928 23.823 42.888 1.00 0.00 N ATOM 902 CA ARG A 113 -23.514 22.510 42.639 1.00 0.00 C ATOM 903 C ARG A 113 -22.607 21.408 43.181 1.00 0.00 C ATOM 904 O ARG A 113 -21.396 21.596 43.308 1.00 0.00 O ATOM 905 CB ARG A 113 -23.718 22.307 41.137 1.00 0.00 C ATOM 906 CG ARG A 113 -22.427 22.661 40.396 1.00 0.00 C ATOM 907 CD ARG A 113 -22.515 22.170 38.950 1.00 0.00 C ATOM 908 NE ARG A 113 -23.907 22.100 38.524 1.00 0.00 N ATOM 909 CZ ARG A 113 -24.571 23.195 38.167 1.00 0.00 C ATOM 910 NH1 ARG A 113 -23.979 24.357 38.202 1.00 0.00 N ATOM 911 NH2 ARG A 113 -25.815 23.108 37.781 1.00 0.00 N ATOM 0 H ARG A 113 -21.912 23.826 42.977 1.00 0.00 H new ATOM 0 HA ARG A 113 -24.476 22.460 43.148 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -23.995 21.273 40.933 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -24.537 22.933 40.782 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -22.268 23.739 40.416 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.572 22.204 40.895 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -21.961 22.843 38.296 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -22.051 21.187 38.863 1.00 0.00 H new ATOM 0 HE ARG A 113 -24.379 21.196 38.499 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -23.007 24.425 38.503 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -24.488 25.197 37.928 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -26.278 22.200 37.753 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -26.324 23.948 37.507 1.00 0.00 H new ATOM 925 N ILE A 114 -23.198 20.261 43.496 1.00 0.00 N ATOM 926 CA ILE A 114 -22.432 19.136 44.019 1.00 0.00 C ATOM 927 C ILE A 114 -22.890 17.831 43.377 1.00 0.00 C ATOM 928 O ILE A 114 -24.071 17.486 43.421 1.00 0.00 O ATOM 929 CB ILE A 114 -22.598 19.049 45.538 1.00 0.00 C ATOM 930 CG1 ILE A 114 -22.227 20.395 46.167 1.00 0.00 C ATOM 931 CG2 ILE A 114 -21.677 17.959 46.090 1.00 0.00 C ATOM 932 CD1 ILE A 114 -23.502 21.187 46.462 1.00 0.00 C ATOM 0 H ILE A 114 -24.198 20.086 43.399 1.00 0.00 H new ATOM 0 HA ILE A 114 -21.381 19.295 43.780 1.00 0.00 H new ATOM 0 HB ILE A 114 -23.633 18.806 45.778 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -21.664 20.236 47.086 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -21.583 20.959 45.492 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -21.795 17.897 47.172 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -21.937 17.001 45.641 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -20.642 18.202 45.851 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -23.240 22.145 46.910 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -24.047 21.357 45.534 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -24.129 20.623 47.153 1.00 0.00 H new ATOM 944 N THR A 115 -21.947 17.109 42.778 1.00 0.00 N ATOM 945 CA THR A 115 -22.264 15.844 42.124 1.00 0.00 C ATOM 946 C THR A 115 -21.441 14.709 42.720 1.00 0.00 C ATOM 947 O THR A 115 -20.263 14.881 43.035 1.00 0.00 O ATOM 948 CB THR A 115 -21.980 15.947 40.625 1.00 0.00 C ATOM 949 OG1 THR A 115 -20.575 15.949 40.411 1.00 0.00 O ATOM 950 CG2 THR A 115 -22.583 17.242 40.077 1.00 0.00 C ATOM 0 H THR A 115 -20.964 17.376 42.732 1.00 0.00 H new ATOM 0 HA THR A 115 -23.321 15.632 42.282 1.00 0.00 H new ATOM 0 HB THR A 115 -22.426 15.096 40.111 1.00 0.00 H new ATOM 0 HG1 THR A 115 -20.390 16.013 39.451 1.00 0.00 H new ATOM 0 HG21 THR A 115 -22.380 17.314 39.009 1.00 0.00 H new ATOM 0 HG22 THR A 115 -23.660 17.240 40.242 1.00 0.00 H new ATOM 0 HG23 THR A 115 -22.139 18.095 40.589 1.00 0.00 H new ATOM 958 N VAL A 116 -22.068 13.546 42.871 1.00 0.00 N ATOM 959 CA VAL A 116 -21.382 12.386 43.430 1.00 0.00 C ATOM 960 C VAL A 116 -21.891 11.101 42.784 1.00 0.00 C ATOM 961 O VAL A 116 -23.052 11.014 42.381 1.00 0.00 O ATOM 962 CB VAL A 116 -21.606 12.325 44.940 1.00 0.00 C ATOM 963 CG1 VAL A 116 -21.188 13.655 45.571 1.00 0.00 C ATOM 964 CG2 VAL A 116 -23.089 12.070 45.226 1.00 0.00 C ATOM 0 H VAL A 116 -23.042 13.382 42.616 1.00 0.00 H new ATOM 0 HA VAL A 116 -20.316 12.484 43.226 1.00 0.00 H new ATOM 0 HB VAL A 116 -21.009 11.517 45.364 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -21.347 13.613 46.648 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -20.133 13.839 45.367 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -21.785 14.462 45.147 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -23.250 12.026 46.303 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -23.685 12.878 44.803 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -23.389 11.124 44.776 1.00 0.00 H new ATOM 974 N ASP A 117 -21.015 10.106 42.687 1.00 0.00 N ATOM 975 CA ASP A 117 -21.386 8.829 42.087 1.00 0.00 C ATOM 976 C ASP A 117 -22.072 9.046 40.742 1.00 0.00 C ATOM 977 O ASP A 117 -22.735 8.150 40.223 1.00 0.00 O ATOM 978 CB ASP A 117 -22.324 8.064 43.024 1.00 0.00 C ATOM 979 CG ASP A 117 -21.928 6.593 43.068 1.00 0.00 C ATOM 980 OD1 ASP A 117 -21.654 6.041 42.015 1.00 0.00 O ATOM 981 OD2 ASP A 117 -21.904 6.038 44.154 1.00 0.00 O ATOM 0 H ASP A 117 -20.050 10.158 43.013 1.00 0.00 H new ATOM 0 HA ASP A 117 -20.478 8.247 41.928 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.279 8.492 44.026 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -23.354 8.162 42.681 1.00 0.00 H new ATOM 986 N GLY A 118 -21.908 10.242 40.185 1.00 0.00 N ATOM 987 CA GLY A 118 -22.516 10.566 38.899 1.00 0.00 C ATOM 988 C GLY A 118 -23.954 11.040 39.081 1.00 0.00 C ATOM 989 O GLY A 118 -24.582 11.525 38.139 1.00 0.00 O ATOM 0 H GLY A 118 -21.363 10.998 40.600 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -21.933 11.342 38.402 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -22.497 9.689 38.252 1.00 0.00 H new ATOM 993 N LYS A 119 -24.470 10.895 40.297 1.00 0.00 N ATOM 994 CA LYS A 119 -25.836 11.312 40.590 1.00 0.00 C ATOM 995 C LYS A 119 -25.839 12.509 41.536 1.00 0.00 C ATOM 996 O LYS A 119 -25.255 12.457 42.618 1.00 0.00 O ATOM 997 CB LYS A 119 -26.609 10.157 41.226 1.00 0.00 C ATOM 998 CG LYS A 119 -26.185 8.837 40.579 1.00 0.00 C ATOM 999 CD LYS A 119 -26.795 7.667 41.353 1.00 0.00 C ATOM 1000 CE LYS A 119 -25.945 6.414 41.138 1.00 0.00 C ATOM 1001 NZ LYS A 119 -25.589 6.296 39.694 1.00 0.00 N ATOM 0 H LYS A 119 -23.968 10.495 41.090 1.00 0.00 H new ATOM 0 HA LYS A 119 -26.317 11.600 39.655 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -26.418 10.126 42.299 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -27.681 10.309 41.097 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -26.512 8.808 39.540 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -25.098 8.756 40.574 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -26.846 7.907 42.415 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -27.817 7.488 41.017 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -25.040 6.467 41.743 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -26.494 5.529 41.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -25.352 5.307 39.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -26.397 6.596 39.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -24.770 6.903 39.488 1.00 0.00 H new ATOM 1015 N VAL A 120 -26.498 13.586 41.121 1.00 0.00 N ATOM 1016 CA VAL A 120 -26.567 14.790 41.941 1.00 0.00 C ATOM 1017 C VAL A 120 -27.665 14.661 42.991 1.00 0.00 C ATOM 1018 O VAL A 120 -28.823 14.402 42.665 1.00 0.00 O ATOM 1019 CB VAL A 120 -26.841 16.008 41.060 1.00 0.00 C ATOM 1020 CG1 VAL A 120 -28.306 16.006 40.622 1.00 0.00 C ATOM 1021 CG2 VAL A 120 -26.545 17.284 41.850 1.00 0.00 C ATOM 0 H VAL A 120 -26.988 13.650 40.229 1.00 0.00 H new ATOM 0 HA VAL A 120 -25.610 14.917 42.447 1.00 0.00 H new ATOM 0 HB VAL A 120 -26.201 15.969 40.178 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -28.499 16.876 39.994 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -28.516 15.097 40.058 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -28.949 16.044 41.502 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -26.740 18.154 41.223 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -27.184 17.322 42.732 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -25.500 17.286 42.159 1.00 0.00 H new ATOM 1031 N ARG A 121 -27.291 14.841 44.255 1.00 0.00 N ATOM 1032 CA ARG A 121 -28.252 14.741 45.348 1.00 0.00 C ATOM 1033 C ARG A 121 -28.805 16.120 45.703 1.00 0.00 C ATOM 1034 O ARG A 121 -29.973 16.254 46.068 1.00 0.00 O ATOM 1035 CB ARG A 121 -27.580 14.126 46.577 1.00 0.00 C ATOM 1036 CG ARG A 121 -28.647 13.532 47.500 1.00 0.00 C ATOM 1037 CD ARG A 121 -28.694 12.015 47.314 1.00 0.00 C ATOM 1038 NE ARG A 121 -29.970 11.488 47.785 1.00 0.00 N ATOM 1039 CZ ARG A 121 -30.537 10.436 47.203 1.00 0.00 C ATOM 1040 NH1 ARG A 121 -29.951 9.855 46.190 1.00 0.00 N ATOM 1041 NH2 ARG A 121 -31.678 9.982 47.644 1.00 0.00 N ATOM 0 H ARG A 121 -26.337 15.055 44.546 1.00 0.00 H new ATOM 0 HA ARG A 121 -29.076 14.104 45.027 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -26.877 13.351 46.271 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -27.006 14.885 47.109 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -28.421 13.775 48.538 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -29.621 13.967 47.275 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -28.556 11.766 46.262 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -27.875 11.549 47.862 1.00 0.00 H new ATOM 0 HE ARG A 121 -30.435 11.935 48.575 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -29.058 10.209 45.846 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -30.386 9.048 45.743 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -32.135 10.434 48.436 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -32.113 9.175 47.197 1.00 0.00 H new ATOM 1055 N ALA A 122 -27.959 17.139 45.594 1.00 0.00 N ATOM 1056 CA ALA A 122 -28.374 18.502 45.907 1.00 0.00 C ATOM 1057 C ALA A 122 -27.761 19.488 44.917 1.00 0.00 C ATOM 1058 O ALA A 122 -26.607 19.339 44.514 1.00 0.00 O ATOM 1059 CB ALA A 122 -27.941 18.870 47.328 1.00 0.00 C ATOM 0 H ALA A 122 -26.988 17.049 45.293 1.00 0.00 H new ATOM 0 HA ALA A 122 -29.460 18.555 45.834 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -28.256 19.889 47.552 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -28.402 18.184 48.038 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -26.856 18.799 47.408 1.00 0.00 H new ATOM 1065 N GLU A 123 -28.539 20.492 44.529 1.00 0.00 N ATOM 1066 CA GLU A 123 -28.057 21.494 43.584 1.00 0.00 C ATOM 1067 C GLU A 123 -28.708 22.847 43.851 1.00 0.00 C ATOM 1068 O GLU A 123 -29.931 22.974 43.829 1.00 0.00 O ATOM 1069 CB GLU A 123 -28.364 21.052 42.151 1.00 0.00 C ATOM 1070 CG GLU A 123 -27.159 21.349 41.259 1.00 0.00 C ATOM 1071 CD GLU A 123 -27.509 21.075 39.800 1.00 0.00 C ATOM 1072 OE1 GLU A 123 -28.594 21.455 39.390 1.00 0.00 O ATOM 1073 OE2 GLU A 123 -26.688 20.488 39.113 1.00 0.00 O ATOM 0 H GLU A 123 -29.497 20.634 44.850 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.979 21.593 43.712 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -28.593 19.987 42.129 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -29.244 21.575 41.778 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -26.855 22.389 41.379 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -26.312 20.732 41.560 1.00 0.00 H new ATOM 1080 N ARG A 124 -27.878 23.855 44.098 1.00 0.00 N ATOM 1081 CA ARG A 124 -28.377 25.199 44.363 1.00 0.00 C ATOM 1082 C ARG A 124 -27.699 26.204 43.439 1.00 0.00 C ATOM 1083 O ARG A 124 -26.486 26.400 43.505 1.00 0.00 O ATOM 1084 CB ARG A 124 -28.111 25.580 45.820 1.00 0.00 C ATOM 1085 CG ARG A 124 -28.731 24.528 46.743 1.00 0.00 C ATOM 1086 CD ARG A 124 -28.961 25.133 48.129 1.00 0.00 C ATOM 1087 NE ARG A 124 -28.921 24.087 49.147 1.00 0.00 N ATOM 1088 CZ ARG A 124 -27.822 23.859 49.860 1.00 0.00 C ATOM 1089 NH1 ARG A 124 -26.749 24.576 49.661 1.00 0.00 N ATOM 1090 NH2 ARG A 124 -27.816 22.914 50.761 1.00 0.00 N ATOM 0 H ARG A 124 -26.862 23.768 44.120 1.00 0.00 H new ATOM 0 HA ARG A 124 -29.451 25.214 44.179 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -27.038 25.649 45.999 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -28.534 26.562 46.034 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -29.675 24.176 46.327 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -28.073 23.662 46.818 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -28.198 25.883 48.338 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -29.925 25.641 48.157 1.00 0.00 H new ATOM 0 HE ARG A 124 -29.752 23.520 49.314 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -26.752 25.314 48.957 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -25.908 24.398 50.210 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -28.653 22.352 50.917 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -26.974 22.737 51.309 1.00 0.00 H new ATOM 1104 N VAL A 125 -28.486 26.832 42.573 1.00 0.00 N ATOM 1105 CA VAL A 125 -27.943 27.807 41.637 1.00 0.00 C ATOM 1106 C VAL A 125 -28.638 29.157 41.789 1.00 0.00 C ATOM 1107 O VAL A 125 -29.845 29.273 41.577 1.00 0.00 O ATOM 1108 CB VAL A 125 -28.113 27.306 40.203 1.00 0.00 C ATOM 1109 CG1 VAL A 125 -26.917 27.750 39.359 1.00 0.00 C ATOM 1110 CG2 VAL A 125 -28.194 25.778 40.204 1.00 0.00 C ATOM 0 H VAL A 125 -29.493 26.685 42.500 1.00 0.00 H new ATOM 0 HA VAL A 125 -26.883 27.934 41.858 1.00 0.00 H new ATOM 0 HB VAL A 125 -29.029 27.721 39.781 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -27.040 27.392 38.337 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -26.857 28.838 39.357 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -26.001 27.337 39.781 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -28.315 25.419 39.182 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -27.278 25.365 40.627 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -29.046 25.459 40.804 1.00 0.00 H new ATOM 1120 N SER A 126 -27.863 30.174 42.152 1.00 0.00 N ATOM 1121 CA SER A 126 -28.406 31.515 42.322 1.00 0.00 C ATOM 1122 C SER A 126 -27.715 32.486 41.371 1.00 0.00 C ATOM 1123 O SER A 126 -26.501 32.681 41.444 1.00 0.00 O ATOM 1124 CB SER A 126 -28.209 31.981 43.765 1.00 0.00 C ATOM 1125 OG SER A 126 -28.003 30.849 44.600 1.00 0.00 O ATOM 0 H SER A 126 -26.862 30.095 42.333 1.00 0.00 H new ATOM 0 HA SER A 126 -29.472 31.492 42.095 1.00 0.00 H new ATOM 0 HB2 SER A 126 -27.354 32.654 43.828 1.00 0.00 H new ATOM 0 HB3 SER A 126 -29.082 32.541 44.101 1.00 0.00 H new ATOM 0 HG SER A 126 -27.875 31.144 45.526 1.00 0.00 H new ATOM 1131 N ASN A 127 -28.491 33.086 40.476 1.00 0.00 N ATOM 1132 CA ASN A 127 -27.936 34.028 39.510 1.00 0.00 C ATOM 1133 C ASN A 127 -28.051 35.460 40.021 1.00 0.00 C ATOM 1134 O ASN A 127 -29.123 35.896 40.444 1.00 0.00 O ATOM 1135 CB ASN A 127 -28.671 33.898 38.174 1.00 0.00 C ATOM 1136 CG ASN A 127 -28.249 32.613 37.471 1.00 0.00 C ATOM 1137 OD1 ASN A 127 -28.660 32.361 36.338 1.00 0.00 O ATOM 1138 ND2 ASN A 127 -27.450 31.778 38.078 1.00 0.00 N ATOM 0 H ASN A 127 -29.497 32.939 40.398 1.00 0.00 H new ATOM 0 HA ASN A 127 -26.881 33.793 39.370 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -29.748 33.894 38.341 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -28.449 34.758 37.542 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -27.165 30.916 37.614 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -27.110 31.988 39.017 1.00 0.00 H new ATOM 1145 N GLU A 128 -26.940 36.187 39.974 1.00 0.00 N ATOM 1146 CA GLU A 128 -26.920 37.572 40.431 1.00 0.00 C ATOM 1147 C GLU A 128 -25.861 38.367 39.672 1.00 0.00 C ATOM 1148 O GLU A 128 -24.745 37.890 39.465 1.00 0.00 O ATOM 1149 CB GLU A 128 -26.624 37.623 41.931 1.00 0.00 C ATOM 1150 CG GLU A 128 -27.496 38.695 42.587 1.00 0.00 C ATOM 1151 CD GLU A 128 -28.843 38.101 42.986 1.00 0.00 C ATOM 1152 OE1 GLU A 128 -29.220 37.098 42.404 1.00 0.00 O ATOM 1153 OE2 GLU A 128 -29.476 38.658 43.867 1.00 0.00 O ATOM 0 H GLU A 128 -26.045 35.843 39.626 1.00 0.00 H new ATOM 0 HA GLU A 128 -27.898 38.014 40.241 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -26.821 36.652 42.384 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -25.570 37.845 42.097 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -26.992 39.097 43.466 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -27.646 39.526 41.897 1.00 0.00 H new ATOM 1160 N VAL A 129 -26.219 39.578 39.259 1.00 0.00 N ATOM 1161 CA VAL A 129 -25.291 40.426 38.522 1.00 0.00 C ATOM 1162 C VAL A 129 -24.586 41.401 39.461 1.00 0.00 C ATOM 1163 O VAL A 129 -25.231 42.110 40.234 1.00 0.00 O ATOM 1164 CB VAL A 129 -26.040 41.209 37.443 1.00 0.00 C ATOM 1165 CG1 VAL A 129 -25.049 42.052 36.640 1.00 0.00 C ATOM 1166 CG2 VAL A 129 -26.749 40.228 36.506 1.00 0.00 C ATOM 0 H VAL A 129 -27.137 39.991 39.421 1.00 0.00 H new ATOM 0 HA VAL A 129 -24.543 39.786 38.055 1.00 0.00 H new ATOM 0 HB VAL A 129 -26.774 41.864 37.913 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -25.585 42.609 35.871 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -24.541 42.749 37.306 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -24.314 41.399 36.169 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -27.284 40.783 35.735 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -26.012 39.575 36.038 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -27.456 39.626 37.077 1.00 0.00 H new ATOM 1176 N ASN A 130 -23.260 41.434 39.382 1.00 0.00 N ATOM 1177 CA ASN A 130 -22.473 42.328 40.226 1.00 0.00 C ATOM 1178 C ASN A 130 -22.688 42.012 41.703 1.00 0.00 C ATOM 1179 O ASN A 130 -22.702 42.912 42.542 1.00 0.00 O ATOM 1180 CB ASN A 130 -22.868 43.780 39.952 1.00 0.00 C ATOM 1181 CG ASN A 130 -22.092 44.314 38.752 1.00 0.00 C ATOM 1182 OD1 ASN A 130 -22.586 44.274 37.625 1.00 0.00 O ATOM 1183 ND2 ASN A 130 -20.898 44.811 38.927 1.00 0.00 N ATOM 0 H ASN A 130 -22.710 40.856 38.747 1.00 0.00 H new ATOM 0 HA ASN A 130 -21.419 42.182 39.989 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -23.939 43.844 39.761 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -22.664 44.393 40.830 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -20.372 45.167 38.129 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -20.491 44.843 39.862 1.00 0.00 H new ATOM 1190 N ALA A 131 -22.850 40.731 42.014 1.00 0.00 N ATOM 1191 CA ALA A 131 -23.059 40.313 43.397 1.00 0.00 C ATOM 1192 C ALA A 131 -21.848 40.678 44.250 1.00 0.00 C ATOM 1193 O ALA A 131 -20.722 40.287 43.945 1.00 0.00 O ATOM 1194 CB ALA A 131 -23.293 38.803 43.456 1.00 0.00 C ATOM 0 H ALA A 131 -22.841 39.970 41.335 1.00 0.00 H new ATOM 0 HA ALA A 131 -23.936 40.829 43.788 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -23.448 38.499 44.491 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -24.174 38.548 42.867 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -22.424 38.284 43.052 1.00 0.00 H new