USER MOD reduce.3.24.130724 H: found=0, std=0, add=883, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 885 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 255 THR OG1 : rot 115:sc= 0.256 USER MOD Set 1.2: B 257 SER OG : rot 180:sc= 0.24 USER MOD Set 2.1: B 222 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 225 ASN : amide:sc= -0.11 K(o=-0.11,f=-0.85) USER MOD Set 3.1: B 207 THR OG1 : rot 168:sc= -0.632 USER MOD Set 3.2: B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 TYR OH : rot 119:sc= -1.35! USER MOD Single : A 81 GLN : amide:sc= 0.00656 X(o=0.0066,f=0) USER MOD Single : A 82 LYS NZ :NH3+ -138:sc= 0.108 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -160:sc= -0.0101 (180deg=-0.12) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 201 MET CE :methyl 151:sc= -0.93 (180deg=-2.04) USER MOD Single : B 202 GLN :FLIP amide:sc=-0.00188 F(o=-0.81,f=-0.0019) USER MOD Single : B 206 LYS NZ :NH3+ -140:sc= -6.17! (180deg=-7.49!) USER MOD Single : B 211 LYS NZ :NH3+ -153:sc= -0.0491 (180deg=-0.371) USER MOD Single : B 212 THR OG1 : rot 180:sc= 0 USER MOD Single : B 214 THR OG1 : rot 180:sc= 0 USER MOD Single : B 220 SER OG : rot 180:sc= 0 USER MOD Single : B 227 LYS NZ :NH3+ -151:sc= 0.371 (180deg=0.117) USER MOD Single : B 229 LYS NZ :NH3+ -108:sc= -19.1! (180deg=-28.2!) USER MOD Single : B 231 GLN :FLIP amide:sc= -0.486 F(o=-2.4,f=-0.49) USER MOD Single : B 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 GLN :FLIP amide:sc= -0.0881 F(o=-2.1!,f=-0.088) USER MOD Single : B 241 GLN : amide:sc= -4.45! C(o=-4.4!,f=-7.1!) USER MOD Single : B 248 LYS NZ :NH3+ -164:sc= 0.387 (180deg=-0.141) USER MOD Single : B 249 GLN : amide:sc= -2.49 X(o=-2.5,f=-2.2) USER MOD Single : B 259 TYR OH : rot 30:sc= 0.506 USER MOD Single : B 260 ASN : amide:sc= -1.86! C(o=-1.9!,f=-2.7!) USER MOD Single : B 262 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 265 SER OG : rot -107:sc= -1.88! USER MOD Single : B 266 THR OG1 : rot 180:sc= 0 USER MOD Single : B 268 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 61 -15.502 -0.370 4.060 1.00 0.00 N ATOM 2 CA LYS A 61 -15.072 -1.796 4.083 1.00 0.00 C ATOM 3 C LYS A 61 -13.854 -1.949 3.171 1.00 0.00 C ATOM 4 O LYS A 61 -13.937 -1.735 1.979 1.00 0.00 O ATOM 5 CB LYS A 61 -16.205 -2.692 3.584 1.00 0.00 C ATOM 6 CG LYS A 61 -15.621 -3.990 3.026 1.00 0.00 C ATOM 7 CD LYS A 61 -16.683 -5.090 3.073 1.00 0.00 C ATOM 8 CE LYS A 61 -16.079 -6.404 2.575 1.00 0.00 C ATOM 9 NZ LYS A 61 -15.644 -7.224 3.743 1.00 0.00 N ATOM 0 HA LYS A 61 -14.818 -2.090 5.101 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -16.895 -2.912 4.399 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -16.777 -2.177 2.812 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -15.285 -3.838 2.000 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -14.748 -4.288 3.607 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.052 -5.210 4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.537 -4.813 2.455 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -16.812 -6.953 1.984 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -15.230 -6.202 1.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -15.233 -8.118 3.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -14.931 -6.699 4.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -16.464 -7.427 4.349 1.00 0.00 H new ATOM 23 N ILE A 62 -12.722 -2.291 3.724 1.00 0.00 N ATOM 24 CA ILE A 62 -11.495 -2.424 2.884 1.00 0.00 C ATOM 25 C ILE A 62 -10.989 -3.868 2.867 1.00 0.00 C ATOM 26 O ILE A 62 -10.867 -4.515 3.888 1.00 0.00 O ATOM 27 CB ILE A 62 -10.401 -1.518 3.448 1.00 0.00 C ATOM 28 CG1 ILE A 62 -10.977 -0.116 3.671 1.00 0.00 C ATOM 29 CG2 ILE A 62 -9.246 -1.446 2.446 1.00 0.00 C ATOM 30 CD1 ILE A 62 -9.931 0.775 4.344 1.00 0.00 C ATOM 0 H ILE A 62 -12.593 -2.484 4.717 1.00 0.00 H new ATOM 0 HA ILE A 62 -11.744 -2.134 1.863 1.00 0.00 H new ATOM 0 HB ILE A 62 -10.037 -1.916 4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.279 0.319 2.718 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -11.871 -0.175 4.292 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -8.461 -0.801 2.841 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -8.845 -2.446 2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -9.608 -1.040 1.502 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -10.347 1.770 4.500 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -9.651 0.344 5.305 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -9.049 0.846 3.707 1.00 0.00 H new ATOM 42 N THR A 63 -10.667 -4.360 1.701 1.00 0.00 N ATOM 43 CA THR A 63 -10.134 -5.745 1.572 1.00 0.00 C ATOM 44 C THR A 63 -8.709 -5.654 1.021 1.00 0.00 C ATOM 45 O THR A 63 -8.461 -4.985 0.037 1.00 0.00 O ATOM 46 CB THR A 63 -11.009 -6.548 0.606 1.00 0.00 C ATOM 47 OG1 THR A 63 -12.349 -6.547 1.075 1.00 0.00 O ATOM 48 CG2 THR A 63 -10.494 -7.987 0.524 1.00 0.00 C ATOM 0 H THR A 63 -10.752 -3.853 0.820 1.00 0.00 H new ATOM 0 HA THR A 63 -10.136 -6.243 2.542 1.00 0.00 H new ATOM 0 HB THR A 63 -10.970 -6.095 -0.385 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.912 -7.059 0.458 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.118 -8.558 -0.164 1.00 0.00 H new ATOM 0 HG22 THR A 63 -9.465 -7.985 0.165 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.532 -8.444 1.513 1.00 0.00 H new ATOM 56 N PHE A 64 -7.769 -6.301 1.658 1.00 0.00 N ATOM 57 CA PHE A 64 -6.356 -6.227 1.182 1.00 0.00 C ATOM 58 C PHE A 64 -5.880 -7.602 0.673 1.00 0.00 C ATOM 59 O PHE A 64 -6.093 -8.606 1.323 1.00 0.00 O ATOM 60 CB PHE A 64 -5.458 -5.806 2.349 1.00 0.00 C ATOM 61 CG PHE A 64 -5.795 -4.400 2.784 1.00 0.00 C ATOM 62 CD1 PHE A 64 -5.475 -3.313 1.960 1.00 0.00 C ATOM 63 CD2 PHE A 64 -6.419 -4.183 4.018 1.00 0.00 C ATOM 64 CE1 PHE A 64 -5.778 -2.011 2.373 1.00 0.00 C ATOM 65 CE2 PHE A 64 -6.724 -2.880 4.429 1.00 0.00 C ATOM 66 CZ PHE A 64 -6.404 -1.794 3.607 1.00 0.00 C ATOM 0 H PHE A 64 -7.918 -6.877 2.486 1.00 0.00 H new ATOM 0 HA PHE A 64 -6.300 -5.504 0.368 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -5.588 -6.494 3.184 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -4.411 -5.861 2.050 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.995 -3.480 1.007 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -6.665 -5.021 4.653 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -5.529 -1.172 1.740 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.206 -2.713 5.381 1.00 0.00 H new ATOM 0 HZ PHE A 64 -6.640 -0.789 3.924 1.00 0.00 H new ATOM 76 N PRO A 65 -5.204 -7.654 -0.459 1.00 0.00 N ATOM 77 CA PRO A 65 -4.662 -8.934 -1.011 1.00 0.00 C ATOM 78 C PRO A 65 -3.909 -9.764 0.037 1.00 0.00 C ATOM 79 O PRO A 65 -3.559 -9.288 1.098 1.00 0.00 O ATOM 80 CB PRO A 65 -3.683 -8.483 -2.092 1.00 0.00 C ATOM 81 CG PRO A 65 -4.159 -7.142 -2.533 1.00 0.00 C ATOM 82 CD PRO A 65 -4.898 -6.515 -1.350 1.00 0.00 C ATOM 0 HA PRO A 65 -5.468 -9.573 -1.371 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.667 -8.429 -1.702 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.668 -9.186 -2.925 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.320 -6.517 -2.838 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -4.819 -7.232 -3.395 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.281 -5.771 -0.846 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.807 -6.009 -1.673 1.00 0.00 H new ATOM 90 N SER A 66 -3.664 -11.007 -0.271 1.00 0.00 N ATOM 91 CA SER A 66 -2.937 -11.907 0.673 1.00 0.00 C ATOM 92 C SER A 66 -1.475 -11.467 0.826 1.00 0.00 C ATOM 93 O SER A 66 -0.730 -12.054 1.586 1.00 0.00 O ATOM 94 CB SER A 66 -2.973 -13.334 0.127 1.00 0.00 C ATOM 95 OG SER A 66 -3.972 -14.076 0.811 1.00 0.00 O ATOM 0 H SER A 66 -3.940 -11.445 -1.150 1.00 0.00 H new ATOM 0 HA SER A 66 -3.422 -11.859 1.648 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.183 -13.321 -0.943 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.000 -13.809 0.255 1.00 0.00 H new ATOM 0 HG SER A 66 -3.997 -14.991 0.461 1.00 0.00 H new ATOM 101 N ASP A 67 -1.052 -10.454 0.113 1.00 0.00 N ATOM 102 CA ASP A 67 0.373 -10.003 0.227 1.00 0.00 C ATOM 103 C ASP A 67 0.428 -8.534 0.656 1.00 0.00 C ATOM 104 O ASP A 67 1.478 -7.926 0.672 1.00 0.00 O ATOM 105 CB ASP A 67 1.065 -10.157 -1.129 1.00 0.00 C ATOM 106 CG ASP A 67 0.556 -11.419 -1.827 1.00 0.00 C ATOM 107 OD1 ASP A 67 0.061 -12.296 -1.137 1.00 0.00 O ATOM 108 OD2 ASP A 67 0.668 -11.488 -3.039 1.00 0.00 O ATOM 0 H ASP A 67 -1.626 -9.921 -0.540 1.00 0.00 H new ATOM 0 HA ASP A 67 0.880 -10.614 0.974 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.869 -9.282 -1.749 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.145 -10.216 -0.993 1.00 0.00 H new ATOM 113 N ILE A 68 -0.694 -7.956 0.982 1.00 0.00 N ATOM 114 CA ILE A 68 -0.704 -6.518 1.388 1.00 0.00 C ATOM 115 C ILE A 68 -1.022 -6.365 2.877 1.00 0.00 C ATOM 116 O ILE A 68 -1.985 -6.905 3.383 1.00 0.00 O ATOM 117 CB ILE A 68 -1.764 -5.779 0.575 1.00 0.00 C ATOM 118 CG1 ILE A 68 -1.344 -5.709 -0.903 1.00 0.00 C ATOM 119 CG2 ILE A 68 -1.950 -4.367 1.134 1.00 0.00 C ATOM 120 CD1 ILE A 68 0.001 -4.988 -1.052 1.00 0.00 C ATOM 0 H ILE A 68 -1.605 -8.414 0.986 1.00 0.00 H new ATOM 0 HA ILE A 68 0.285 -6.100 1.202 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.708 -6.320 0.645 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.269 -6.716 -1.313 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.108 -5.186 -1.479 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.707 -3.842 0.552 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.269 -4.427 2.174 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.006 -3.825 1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 68 0.279 -4.950 -2.105 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.085 -3.974 -0.663 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.767 -5.527 -0.494 1.00 0.00 H new ATOM 132 N ASP A 69 -0.214 -5.609 3.573 1.00 0.00 N ATOM 133 CA ASP A 69 -0.453 -5.384 5.028 1.00 0.00 C ATOM 134 C ASP A 69 -1.134 -4.014 5.208 1.00 0.00 C ATOM 135 O ASP A 69 -0.768 -3.055 4.557 1.00 0.00 O ATOM 136 CB ASP A 69 0.891 -5.392 5.764 1.00 0.00 C ATOM 137 CG ASP A 69 0.655 -5.300 7.272 1.00 0.00 C ATOM 138 OD1 ASP A 69 0.204 -4.258 7.719 1.00 0.00 O ATOM 139 OD2 ASP A 69 0.930 -6.274 7.955 1.00 0.00 O ATOM 0 H ASP A 69 0.606 -5.135 3.193 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.091 -6.170 5.433 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.440 -6.303 5.527 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.504 -4.555 5.431 1.00 0.00 H new ATOM 144 N PRO A 70 -2.120 -3.913 6.071 1.00 0.00 N ATOM 145 CA PRO A 70 -2.846 -2.627 6.307 1.00 0.00 C ATOM 146 C PRO A 70 -1.994 -1.600 7.061 1.00 0.00 C ATOM 147 O PRO A 70 -2.031 -0.418 6.786 1.00 0.00 O ATOM 148 CB PRO A 70 -4.049 -3.038 7.159 1.00 0.00 C ATOM 149 CG PRO A 70 -3.643 -4.300 7.841 1.00 0.00 C ATOM 150 CD PRO A 70 -2.652 -5.000 6.912 1.00 0.00 C ATOM 0 HA PRO A 70 -3.115 -2.144 5.368 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -4.299 -2.263 7.884 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -4.933 -3.193 6.540 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.185 -4.088 8.807 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -4.509 -4.933 8.031 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -1.859 -5.494 7.474 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -3.142 -5.766 6.311 1.00 0.00 H new ATOM 158 N GLN A 71 -1.231 -2.055 8.014 1.00 0.00 N ATOM 159 CA GLN A 71 -0.371 -1.128 8.806 1.00 0.00 C ATOM 160 C GLN A 71 0.538 -0.317 7.880 1.00 0.00 C ATOM 161 O GLN A 71 0.695 0.878 8.045 1.00 0.00 O ATOM 162 CB GLN A 71 0.493 -1.943 9.767 1.00 0.00 C ATOM 163 CG GLN A 71 1.434 -1.006 10.525 1.00 0.00 C ATOM 164 CD GLN A 71 2.070 -1.760 11.694 1.00 0.00 C ATOM 165 OE1 GLN A 71 1.418 -2.032 12.683 1.00 0.00 O ATOM 166 NE2 GLN A 71 3.323 -2.113 11.622 1.00 0.00 N ATOM 0 H GLN A 71 -1.165 -3.037 8.282 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.011 -0.443 9.362 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.139 -2.487 10.469 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.069 -2.686 9.215 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.208 -0.631 9.856 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.884 -0.140 10.893 1.00 0.00 H new ATOM 0 HE21 GLN A 71 3.870 -1.885 10.792 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.756 -2.617 12.396 1.00 0.00 H new ATOM 175 N VAL A 72 1.149 -0.944 6.916 1.00 0.00 N ATOM 176 CA VAL A 72 2.054 -0.192 6.001 1.00 0.00 C ATOM 177 C VAL A 72 1.240 0.533 4.928 1.00 0.00 C ATOM 178 O VAL A 72 1.693 1.498 4.346 1.00 0.00 O ATOM 179 CB VAL A 72 3.022 -1.159 5.322 1.00 0.00 C ATOM 180 CG1 VAL A 72 3.975 -0.368 4.423 1.00 0.00 C ATOM 181 CG2 VAL A 72 3.829 -1.907 6.384 1.00 0.00 C ATOM 0 H VAL A 72 1.062 -1.941 6.721 1.00 0.00 H new ATOM 0 HA VAL A 72 2.611 0.539 6.587 1.00 0.00 H new ATOM 0 HB VAL A 72 2.461 -1.876 4.723 1.00 0.00 H new ATOM 0 HG11 VAL A 72 4.668 -1.053 3.936 1.00 0.00 H new ATOM 0 HG12 VAL A 72 3.401 0.167 3.666 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.535 0.347 5.026 1.00 0.00 H new ATOM 0 HG21 VAL A 72 4.519 -2.597 5.898 1.00 0.00 H new ATOM 0 HG22 VAL A 72 4.393 -1.192 6.983 1.00 0.00 H new ATOM 0 HG23 VAL A 72 3.151 -2.466 7.029 1.00 0.00 H new ATOM 191 N PHE A 73 0.057 0.069 4.643 1.00 0.00 N ATOM 192 CA PHE A 73 -0.768 0.723 3.588 1.00 0.00 C ATOM 193 C PHE A 73 -1.236 2.111 4.044 1.00 0.00 C ATOM 194 O PHE A 73 -1.049 3.095 3.355 1.00 0.00 O ATOM 195 CB PHE A 73 -1.988 -0.155 3.307 1.00 0.00 C ATOM 196 CG PHE A 73 -2.602 0.240 1.988 1.00 0.00 C ATOM 197 CD1 PHE A 73 -1.883 0.061 0.803 1.00 0.00 C ATOM 198 CD2 PHE A 73 -3.891 0.784 1.951 1.00 0.00 C ATOM 199 CE1 PHE A 73 -2.450 0.431 -0.421 1.00 0.00 C ATOM 200 CE2 PHE A 73 -4.459 1.152 0.727 1.00 0.00 C ATOM 201 CZ PHE A 73 -3.736 0.975 -0.460 1.00 0.00 C ATOM 0 H PHE A 73 -0.376 -0.736 5.095 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.166 0.842 2.687 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -1.696 -1.205 3.284 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -2.720 -0.046 4.108 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.890 -0.363 0.832 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.447 0.920 2.867 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.893 0.296 -1.336 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.454 1.572 0.697 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.173 1.259 -1.406 1.00 0.00 H new ATOM 211 N TYR A 74 -1.858 2.195 5.184 1.00 0.00 N ATOM 212 CA TYR A 74 -2.352 3.519 5.661 1.00 0.00 C ATOM 213 C TYR A 74 -1.174 4.476 5.870 1.00 0.00 C ATOM 214 O TYR A 74 -1.353 5.673 5.976 1.00 0.00 O ATOM 215 CB TYR A 74 -3.126 3.347 6.969 1.00 0.00 C ATOM 216 CG TYR A 74 -4.337 2.479 6.728 1.00 0.00 C ATOM 217 CD1 TYR A 74 -5.331 2.891 5.832 1.00 0.00 C ATOM 218 CD2 TYR A 74 -4.463 1.258 7.400 1.00 0.00 C ATOM 219 CE1 TYR A 74 -6.451 2.079 5.608 1.00 0.00 C ATOM 220 CE2 TYR A 74 -5.582 0.448 7.177 1.00 0.00 C ATOM 221 CZ TYR A 74 -6.576 0.859 6.282 1.00 0.00 C ATOM 222 OH TYR A 74 -7.678 0.058 6.060 1.00 0.00 O ATOM 0 H TYR A 74 -2.047 1.409 5.806 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.018 3.940 4.908 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.486 2.894 7.726 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.433 4.320 7.352 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.235 3.834 5.314 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.696 0.941 8.091 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -7.217 2.395 4.916 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -5.678 -0.494 7.696 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.388 -0.802 5.689 1.00 0.00 H new ATOM 232 N GLU A 75 0.027 3.970 5.927 1.00 0.00 N ATOM 233 CA GLU A 75 1.200 4.869 6.126 1.00 0.00 C ATOM 234 C GLU A 75 1.629 5.461 4.777 1.00 0.00 C ATOM 235 O GLU A 75 2.496 6.309 4.712 1.00 0.00 O ATOM 236 CB GLU A 75 2.360 4.069 6.725 1.00 0.00 C ATOM 237 CG GLU A 75 2.150 3.913 8.232 1.00 0.00 C ATOM 238 CD GLU A 75 3.346 3.181 8.843 1.00 0.00 C ATOM 239 OE1 GLU A 75 4.423 3.754 8.853 1.00 0.00 O ATOM 240 OE2 GLU A 75 3.166 2.061 9.290 1.00 0.00 O ATOM 0 H GLU A 75 0.247 2.977 5.845 1.00 0.00 H new ATOM 0 HA GLU A 75 0.926 5.677 6.805 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.421 3.089 6.253 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.305 4.577 6.530 1.00 0.00 H new ATOM 0 HG2 GLU A 75 2.034 4.892 8.697 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.233 3.357 8.426 1.00 0.00 H new ATOM 247 N LEU A 76 1.036 5.015 3.702 1.00 0.00 N ATOM 248 CA LEU A 76 1.419 5.549 2.360 1.00 0.00 C ATOM 249 C LEU A 76 0.543 6.761 2.014 1.00 0.00 C ATOM 250 O LEU A 76 -0.584 6.861 2.457 1.00 0.00 O ATOM 251 CB LEU A 76 1.199 4.457 1.309 1.00 0.00 C ATOM 252 CG LEU A 76 2.215 3.330 1.516 1.00 0.00 C ATOM 253 CD1 LEU A 76 1.878 2.165 0.586 1.00 0.00 C ATOM 254 CD2 LEU A 76 3.626 3.835 1.199 1.00 0.00 C ATOM 0 H LEU A 76 0.304 4.305 3.694 1.00 0.00 H new ATOM 0 HA LEU A 76 2.466 5.852 2.375 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.185 4.064 1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.304 4.875 0.308 1.00 0.00 H new ATOM 0 HG LEU A 76 2.174 2.999 2.554 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.600 1.362 0.732 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.877 1.798 0.811 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.916 2.503 -0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.343 3.028 1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.668 4.171 0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.872 4.666 1.860 1.00 0.00 H new ATOM 266 N PRO A 77 1.050 7.674 1.218 1.00 0.00 N ATOM 267 CA PRO A 77 0.288 8.887 0.804 1.00 0.00 C ATOM 268 C PRO A 77 -1.049 8.531 0.147 1.00 0.00 C ATOM 269 O PRO A 77 -1.215 7.462 -0.407 1.00 0.00 O ATOM 270 CB PRO A 77 1.204 9.602 -0.197 1.00 0.00 C ATOM 271 CG PRO A 77 2.286 8.628 -0.541 1.00 0.00 C ATOM 272 CD PRO A 77 2.397 7.659 0.630 1.00 0.00 C ATOM 0 HA PRO A 77 0.036 9.507 1.664 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.650 9.900 -1.088 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.621 10.510 0.237 1.00 0.00 H new ATOM 0 HG2 PRO A 77 2.048 8.095 -1.462 1.00 0.00 H new ATOM 0 HG3 PRO A 77 3.232 9.144 -0.707 1.00 0.00 H new ATOM 0 HD2 PRO A 77 2.679 6.660 0.298 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.152 7.981 1.347 1.00 0.00 H new ATOM 280 N GLU A 78 -2.004 9.416 0.210 1.00 0.00 N ATOM 281 CA GLU A 78 -3.334 9.137 -0.404 1.00 0.00 C ATOM 282 C GLU A 78 -3.206 8.960 -1.921 1.00 0.00 C ATOM 283 O GLU A 78 -3.699 8.004 -2.482 1.00 0.00 O ATOM 284 CB GLU A 78 -4.282 10.301 -0.108 1.00 0.00 C ATOM 285 CG GLU A 78 -5.705 9.918 -0.516 1.00 0.00 C ATOM 286 CD GLU A 78 -6.559 9.711 0.737 1.00 0.00 C ATOM 287 OE1 GLU A 78 -6.515 10.565 1.607 1.00 0.00 O ATOM 288 OE2 GLU A 78 -7.241 8.702 0.805 1.00 0.00 O ATOM 0 H GLU A 78 -1.921 10.326 0.663 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.728 8.215 0.022 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.251 10.548 0.953 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.964 11.190 -0.652 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.139 10.700 -1.139 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.690 9.006 -1.113 1.00 0.00 H new ATOM 295 N ALA A 79 -2.570 9.881 -2.596 1.00 0.00 N ATOM 296 CA ALA A 79 -2.448 9.761 -4.080 1.00 0.00 C ATOM 297 C ALA A 79 -1.970 8.357 -4.461 1.00 0.00 C ATOM 298 O ALA A 79 -2.512 7.729 -5.352 1.00 0.00 O ATOM 299 CB ALA A 79 -1.459 10.804 -4.602 1.00 0.00 C ATOM 0 H ALA A 79 -2.132 10.707 -2.188 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.426 9.933 -4.530 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.372 10.714 -5.685 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.816 11.802 -4.349 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -0.483 10.641 -4.145 1.00 0.00 H new ATOM 305 N VAL A 80 -0.984 7.844 -3.784 1.00 0.00 N ATOM 306 CA VAL A 80 -0.506 6.471 -4.108 1.00 0.00 C ATOM 307 C VAL A 80 -1.531 5.466 -3.589 1.00 0.00 C ATOM 308 O VAL A 80 -1.742 4.419 -4.165 1.00 0.00 O ATOM 309 CB VAL A 80 0.843 6.224 -3.432 1.00 0.00 C ATOM 310 CG1 VAL A 80 1.340 4.821 -3.783 1.00 0.00 C ATOM 311 CG2 VAL A 80 1.855 7.261 -3.928 1.00 0.00 C ATOM 0 H VAL A 80 -0.490 8.312 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.387 6.361 -5.186 1.00 0.00 H new ATOM 0 HB VAL A 80 0.731 6.310 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.302 4.645 -3.301 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.619 4.082 -3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.454 4.735 -4.864 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.818 7.088 -3.448 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.967 7.172 -5.009 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.501 8.262 -3.681 1.00 0.00 H new ATOM 321 N GLN A 81 -2.187 5.794 -2.512 1.00 0.00 N ATOM 322 CA GLN A 81 -3.220 4.881 -1.957 1.00 0.00 C ATOM 323 C GLN A 81 -4.311 4.672 -3.009 1.00 0.00 C ATOM 324 O GLN A 81 -4.685 3.559 -3.325 1.00 0.00 O ATOM 325 CB GLN A 81 -3.831 5.516 -0.705 1.00 0.00 C ATOM 326 CG GLN A 81 -4.617 4.464 0.075 1.00 0.00 C ATOM 327 CD GLN A 81 -4.903 4.983 1.485 1.00 0.00 C ATOM 328 OE1 GLN A 81 -5.541 6.003 1.654 1.00 0.00 O ATOM 329 NE2 GLN A 81 -4.452 4.317 2.514 1.00 0.00 N ATOM 0 H GLN A 81 -2.050 6.660 -1.991 1.00 0.00 H new ATOM 0 HA GLN A 81 -2.772 3.922 -1.696 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -3.045 5.935 -0.078 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -4.487 6.339 -0.987 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -5.552 4.239 -0.438 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -4.050 3.535 0.126 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.916 3.461 2.372 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.635 4.653 3.459 1.00 0.00 H new ATOM 338 N LYS A 82 -4.823 5.742 -3.553 1.00 0.00 N ATOM 339 CA LYS A 82 -5.889 5.627 -4.585 1.00 0.00 C ATOM 340 C LYS A 82 -5.399 4.761 -5.751 1.00 0.00 C ATOM 341 O LYS A 82 -6.096 3.881 -6.215 1.00 0.00 O ATOM 342 CB LYS A 82 -6.240 7.022 -5.108 1.00 0.00 C ATOM 343 CG LYS A 82 -6.638 7.926 -3.937 1.00 0.00 C ATOM 344 CD LYS A 82 -7.968 7.450 -3.348 1.00 0.00 C ATOM 345 CE LYS A 82 -8.608 8.589 -2.551 1.00 0.00 C ATOM 346 NZ LYS A 82 -9.423 8.021 -1.440 1.00 0.00 N ATOM 0 H LYS A 82 -4.546 6.697 -3.324 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.769 5.165 -4.139 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.387 7.448 -5.636 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.059 6.957 -5.825 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.863 7.908 -3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.728 8.958 -4.276 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -8.638 7.129 -4.146 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.804 6.587 -2.703 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.836 9.246 -2.151 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -9.236 9.196 -3.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -10.319 8.543 -1.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -9.621 7.018 -1.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -8.898 8.105 -0.546 1.00 0.00 H new ATOM 360 N GLU A 83 -4.215 5.013 -6.241 1.00 0.00 N ATOM 361 CA GLU A 83 -3.706 4.207 -7.393 1.00 0.00 C ATOM 362 C GLU A 83 -3.658 2.719 -7.027 1.00 0.00 C ATOM 363 O GLU A 83 -3.937 1.864 -7.846 1.00 0.00 O ATOM 364 CB GLU A 83 -2.300 4.672 -7.777 1.00 0.00 C ATOM 365 CG GLU A 83 -2.340 6.135 -8.219 1.00 0.00 C ATOM 366 CD GLU A 83 -0.938 6.582 -8.637 1.00 0.00 C ATOM 367 OE1 GLU A 83 -0.113 5.719 -8.889 1.00 0.00 O ATOM 368 OE2 GLU A 83 -0.712 7.780 -8.696 1.00 0.00 O ATOM 0 H GLU A 83 -3.581 5.735 -5.899 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.383 4.349 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.625 4.557 -6.929 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.909 4.050 -8.582 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.034 6.256 -9.051 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.705 6.762 -7.405 1.00 0.00 H new ATOM 375 N LEU A 84 -3.301 2.393 -5.817 1.00 0.00 N ATOM 376 CA LEU A 84 -3.231 0.954 -5.436 1.00 0.00 C ATOM 377 C LEU A 84 -4.644 0.386 -5.256 1.00 0.00 C ATOM 378 O LEU A 84 -4.927 -0.720 -5.677 1.00 0.00 O ATOM 379 CB LEU A 84 -2.417 0.808 -4.149 1.00 0.00 C ATOM 380 CG LEU A 84 -0.993 1.310 -4.405 1.00 0.00 C ATOM 381 CD1 LEU A 84 -0.180 1.264 -3.110 1.00 0.00 C ATOM 382 CD2 LEU A 84 -0.322 0.423 -5.457 1.00 0.00 C ATOM 0 H LEU A 84 -3.056 3.054 -5.080 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.739 0.390 -6.229 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.879 1.379 -3.344 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.398 -0.234 -3.831 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.037 2.338 -4.763 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.831 1.623 -3.302 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.654 1.898 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.137 0.238 -2.743 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.692 0.779 -5.640 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.286 -0.605 -5.097 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.894 0.462 -6.384 1.00 0.00 H new ATOM 394 N LEU A 85 -5.543 1.126 -4.666 1.00 0.00 N ATOM 395 CA LEU A 85 -6.933 0.603 -4.508 1.00 0.00 C ATOM 396 C LEU A 85 -7.602 0.550 -5.885 1.00 0.00 C ATOM 397 O LEU A 85 -8.325 -0.375 -6.201 1.00 0.00 O ATOM 398 CB LEU A 85 -7.740 1.514 -3.576 1.00 0.00 C ATOM 399 CG LEU A 85 -7.374 1.232 -2.119 1.00 0.00 C ATOM 400 CD1 LEU A 85 -7.843 2.395 -1.242 1.00 0.00 C ATOM 401 CD2 LEU A 85 -8.061 -0.054 -1.651 1.00 0.00 C ATOM 0 H LEU A 85 -5.380 2.060 -4.290 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.897 -0.396 -4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -7.540 2.559 -3.814 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.807 1.351 -3.729 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.293 1.118 -2.038 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.583 2.195 -0.203 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.357 3.315 -1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.924 2.505 -1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.797 -0.250 -0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.142 0.059 -1.735 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.734 -0.888 -2.272 1.00 0.00 H new ATOM 413 N ALA A 86 -7.356 1.530 -6.712 1.00 0.00 N ATOM 414 CA ALA A 86 -7.969 1.528 -8.071 1.00 0.00 C ATOM 415 C ALA A 86 -7.475 0.298 -8.836 1.00 0.00 C ATOM 416 O ALA A 86 -8.200 -0.304 -9.602 1.00 0.00 O ATOM 417 CB ALA A 86 -7.560 2.798 -8.820 1.00 0.00 C ATOM 0 H ALA A 86 -6.758 2.330 -6.506 1.00 0.00 H new ATOM 0 HA ALA A 86 -9.055 1.498 -7.987 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -8.009 2.795 -9.813 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.905 3.673 -8.269 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.474 2.832 -8.913 1.00 0.00 H new ATOM 423 N GLU A 87 -6.247 -0.090 -8.617 1.00 0.00 N ATOM 424 CA GLU A 87 -5.709 -1.294 -9.313 1.00 0.00 C ATOM 425 C GLU A 87 -6.413 -2.537 -8.767 1.00 0.00 C ATOM 426 O GLU A 87 -6.741 -3.455 -9.500 1.00 0.00 O ATOM 427 CB GLU A 87 -4.204 -1.403 -9.064 1.00 0.00 C ATOM 428 CG GLU A 87 -3.675 -2.696 -9.689 1.00 0.00 C ATOM 429 CD GLU A 87 -3.501 -3.755 -8.601 1.00 0.00 C ATOM 430 OE1 GLU A 87 -2.954 -3.424 -7.561 1.00 0.00 O ATOM 431 OE2 GLU A 87 -3.919 -4.880 -8.824 1.00 0.00 O ATOM 0 H GLU A 87 -5.594 0.375 -7.986 1.00 0.00 H new ATOM 0 HA GLU A 87 -5.886 -1.211 -10.385 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.690 -0.543 -9.493 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.000 -1.394 -7.993 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.367 -3.053 -10.452 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.723 -2.509 -10.185 1.00 0.00 H new ATOM 438 N TRP A 88 -6.669 -2.572 -7.490 1.00 0.00 N ATOM 439 CA TRP A 88 -7.367 -3.751 -6.913 1.00 0.00 C ATOM 440 C TRP A 88 -8.853 -3.672 -7.264 1.00 0.00 C ATOM 441 O TRP A 88 -9.589 -4.620 -7.090 1.00 0.00 O ATOM 442 CB TRP A 88 -7.201 -3.760 -5.390 1.00 0.00 C ATOM 443 CG TRP A 88 -5.745 -3.759 -5.023 1.00 0.00 C ATOM 444 CD1 TRP A 88 -4.739 -4.296 -5.761 1.00 0.00 C ATOM 445 CD2 TRP A 88 -5.119 -3.208 -3.829 1.00 0.00 C ATOM 446 NE1 TRP A 88 -3.544 -4.103 -5.094 1.00 0.00 N ATOM 447 CE2 TRP A 88 -3.725 -3.438 -3.901 1.00 0.00 C ATOM 448 CE3 TRP A 88 -5.622 -2.534 -2.702 1.00 0.00 C ATOM 449 CZ2 TRP A 88 -2.861 -3.017 -2.890 1.00 0.00 C ATOM 450 CZ3 TRP A 88 -4.755 -2.109 -1.681 1.00 0.00 C ATOM 451 CH2 TRP A 88 -3.377 -2.350 -1.777 1.00 0.00 C ATOM 0 H TRP A 88 -6.426 -1.838 -6.824 1.00 0.00 H new ATOM 0 HA TRP A 88 -6.938 -4.665 -7.323 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -7.692 -2.887 -4.959 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.688 -4.640 -4.970 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.854 -4.793 -6.713 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -2.638 -4.415 -5.443 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.682 -2.342 -2.621 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -1.800 -3.206 -2.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -5.152 -1.594 -0.818 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -2.715 -2.020 -0.990 1.00 0.00 H new ATOM 462 N LYS A 89 -9.302 -2.549 -7.762 1.00 0.00 N ATOM 463 CA LYS A 89 -10.742 -2.429 -8.124 1.00 0.00 C ATOM 464 C LYS A 89 -10.930 -2.827 -9.591 1.00 0.00 C ATOM 465 O LYS A 89 -11.814 -3.592 -9.922 1.00 0.00 O ATOM 466 CB LYS A 89 -11.214 -0.989 -7.915 1.00 0.00 C ATOM 467 CG LYS A 89 -11.477 -0.748 -6.429 1.00 0.00 C ATOM 468 CD LYS A 89 -11.825 0.725 -6.204 1.00 0.00 C ATOM 469 CE LYS A 89 -13.165 0.828 -5.474 1.00 0.00 C ATOM 470 NZ LYS A 89 -14.263 0.382 -6.380 1.00 0.00 N ATOM 0 H LYS A 89 -8.737 -1.717 -7.932 1.00 0.00 H new ATOM 0 HA LYS A 89 -11.331 -3.090 -7.488 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -10.460 -0.292 -8.279 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -12.122 -0.806 -8.490 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -12.295 -1.382 -6.086 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -10.597 -1.018 -5.845 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -11.043 1.209 -5.620 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -11.878 1.247 -7.159 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -13.149 0.212 -4.575 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -13.338 1.855 -5.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -15.170 0.756 -6.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -14.085 0.735 -7.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -14.301 -0.657 -6.395 1.00 0.00 H new ATOM 484 N ARG A 90 -10.104 -2.330 -10.475 1.00 0.00 N ATOM 485 CA ARG A 90 -10.253 -2.709 -11.908 1.00 0.00 C ATOM 486 C ARG A 90 -10.156 -4.230 -12.018 1.00 0.00 C ATOM 487 O ARG A 90 -10.921 -4.862 -12.720 1.00 0.00 O ATOM 488 CB ARG A 90 -9.150 -2.053 -12.745 1.00 0.00 C ATOM 489 CG ARG A 90 -7.783 -2.429 -12.183 1.00 0.00 C ATOM 490 CD ARG A 90 -6.704 -1.571 -12.849 1.00 0.00 C ATOM 491 NE ARG A 90 -6.997 -1.446 -14.305 1.00 0.00 N ATOM 492 CZ ARG A 90 -6.550 -0.418 -14.974 1.00 0.00 C ATOM 493 NH1 ARG A 90 -5.837 0.495 -14.371 1.00 0.00 N ATOM 494 NH2 ARG A 90 -6.815 -0.301 -16.246 1.00 0.00 N ATOM 0 H ARG A 90 -9.341 -1.685 -10.268 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.218 -2.367 -12.283 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.228 -2.376 -13.783 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -9.271 -0.970 -12.738 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.768 -2.278 -11.104 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.583 -3.486 -12.360 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.673 -0.584 -12.387 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.723 -2.023 -12.702 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.546 -2.163 -14.778 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.629 0.405 -13.376 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.488 1.298 -14.895 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.372 -1.013 -16.719 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.465 0.503 -16.768 1.00 0.00 H new ATOM 508 N THR A 91 -9.234 -4.831 -11.309 1.00 0.00 N ATOM 509 CA THR A 91 -9.115 -6.317 -11.357 1.00 0.00 C ATOM 510 C THR A 91 -10.112 -6.916 -10.362 1.00 0.00 C ATOM 511 O THR A 91 -10.724 -7.936 -10.613 1.00 0.00 O ATOM 512 CB THR A 91 -7.693 -6.727 -10.963 1.00 0.00 C ATOM 513 OG1 THR A 91 -7.512 -8.113 -11.215 1.00 0.00 O ATOM 514 CG2 THR A 91 -7.472 -6.444 -9.476 1.00 0.00 C ATOM 0 H THR A 91 -8.563 -4.359 -10.703 1.00 0.00 H new ATOM 0 HA THR A 91 -9.326 -6.678 -12.363 1.00 0.00 H new ATOM 0 HB THR A 91 -6.975 -6.155 -11.551 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.602 -8.375 -10.964 1.00 0.00 H new ATOM 0 HG21 THR A 91 -6.460 -6.736 -9.197 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.609 -5.380 -9.284 1.00 0.00 H new ATOM 0 HG23 THR A 91 -8.190 -7.014 -8.886 1.00 0.00 H new ATOM 522 N GLY A 92 -10.282 -6.280 -9.236 1.00 0.00 N ATOM 523 CA GLY A 92 -11.242 -6.800 -8.222 1.00 0.00 C ATOM 524 C GLY A 92 -12.634 -6.889 -8.846 1.00 0.00 C ATOM 525 O GLY A 92 -13.064 -7.939 -9.279 1.00 0.00 O ATOM 0 H GLY A 92 -9.797 -5.422 -8.974 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.924 -7.782 -7.873 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.262 -6.143 -7.352 1.00 0.00 H new TER 529 GLY A 92 ATOM 530 N MET B 201 25.298 6.432 7.288 1.00 0.00 N ATOM 531 CA MET B 201 24.001 6.355 8.022 1.00 0.00 C ATOM 532 C MET B 201 23.157 5.223 7.432 1.00 0.00 C ATOM 533 O MET B 201 23.069 5.060 6.231 1.00 0.00 O ATOM 534 CB MET B 201 23.258 7.686 7.880 1.00 0.00 C ATOM 535 CG MET B 201 22.688 7.811 6.471 1.00 0.00 C ATOM 536 SD MET B 201 22.612 9.560 6.009 1.00 0.00 S ATOM 537 CE MET B 201 21.542 9.371 4.562 1.00 0.00 C ATOM 0 HA MET B 201 24.184 6.158 9.078 1.00 0.00 H new ATOM 0 HB2 MET B 201 22.454 7.745 8.614 1.00 0.00 H new ATOM 0 HB3 MET B 201 23.936 8.515 8.083 1.00 0.00 H new ATOM 0 HG2 MET B 201 23.311 7.263 5.764 1.00 0.00 H new ATOM 0 HG3 MET B 201 21.693 7.368 6.428 1.00 0.00 H new ATOM 0 HE1 MET B 201 20.956 10.279 4.422 1.00 0.00 H new ATOM 0 HE2 MET B 201 22.154 9.194 3.678 1.00 0.00 H new ATOM 0 HE3 MET B 201 20.871 8.526 4.714 1.00 0.00 H new ATOM 547 N GLN B 202 22.546 4.426 8.266 1.00 0.00 N ATOM 548 CA GLN B 202 21.723 3.298 7.744 1.00 0.00 C ATOM 549 C GLN B 202 20.257 3.708 7.664 1.00 0.00 C ATOM 550 O GLN B 202 19.841 4.698 8.237 1.00 0.00 O ATOM 551 CB GLN B 202 21.862 2.087 8.668 1.00 0.00 C ATOM 552 CG GLN B 202 20.784 2.144 9.752 1.00 0.00 C ATOM 553 CD GLN B 202 21.164 1.208 10.901 1.00 0.00 C ATOM 554 OE1 GLN B 202 22.059 0.281 10.703 1.00 0.00 O flip ATOM 555 NE2 GLN B 202 20.640 1.323 11.992 1.00 0.00 N flip ATOM 0 H GLN B 202 22.581 4.507 9.282 1.00 0.00 H new ATOM 0 HA GLN B 202 22.076 3.039 6.746 1.00 0.00 H new ATOM 0 HB2 GLN B 202 21.766 1.165 8.094 1.00 0.00 H new ATOM 0 HB3 GLN B 202 22.852 2.077 9.125 1.00 0.00 H new ATOM 0 HG2 GLN B 202 20.678 3.164 10.120 1.00 0.00 H new ATOM 0 HG3 GLN B 202 19.819 1.853 9.336 1.00 0.00 H new ATOM 0 HE21 GLN B 202 19.940 2.048 12.148 1.00 0.00 H new ATOM 0 HE22 GLN B 202 20.901 0.694 12.752 1.00 0.00 H new ATOM 564 N ILE B 203 19.467 2.946 6.952 1.00 0.00 N ATOM 565 CA ILE B 203 18.024 3.281 6.822 1.00 0.00 C ATOM 566 C ILE B 203 17.200 1.990 6.783 1.00 0.00 C ATOM 567 O ILE B 203 17.645 0.973 6.288 1.00 0.00 O ATOM 568 CB ILE B 203 17.811 4.058 5.521 1.00 0.00 C ATOM 569 CG1 ILE B 203 18.354 3.237 4.345 1.00 0.00 C ATOM 570 CG2 ILE B 203 18.554 5.392 5.600 1.00 0.00 C ATOM 571 CD1 ILE B 203 17.188 2.654 3.545 1.00 0.00 C ATOM 0 H ILE B 203 19.763 2.106 6.456 1.00 0.00 H new ATOM 0 HA ILE B 203 17.708 3.885 7.672 1.00 0.00 H new ATOM 0 HB ILE B 203 16.747 4.243 5.374 1.00 0.00 H new ATOM 0 HG12 ILE B 203 18.970 3.866 3.703 1.00 0.00 H new ATOM 0 HG13 ILE B 203 18.993 2.434 4.713 1.00 0.00 H new ATOM 0 HG21 ILE B 203 18.404 5.947 4.674 1.00 0.00 H new ATOM 0 HG22 ILE B 203 18.170 5.973 6.438 1.00 0.00 H new ATOM 0 HG23 ILE B 203 19.619 5.208 5.744 1.00 0.00 H new ATOM 0 HD11 ILE B 203 17.575 2.071 2.710 1.00 0.00 H new ATOM 0 HD12 ILE B 203 16.590 2.011 4.190 1.00 0.00 H new ATOM 0 HD13 ILE B 203 16.567 3.465 3.164 1.00 0.00 H new ATOM 583 N PHE B 204 16.002 2.024 7.298 1.00 0.00 N ATOM 584 CA PHE B 204 15.144 0.805 7.287 1.00 0.00 C ATOM 585 C PHE B 204 14.107 0.929 6.169 1.00 0.00 C ATOM 586 O PHE B 204 13.621 2.004 5.883 1.00 0.00 O ATOM 587 CB PHE B 204 14.421 0.670 8.628 1.00 0.00 C ATOM 588 CG PHE B 204 15.385 0.931 9.762 1.00 0.00 C ATOM 589 CD1 PHE B 204 16.609 0.248 9.819 1.00 0.00 C ATOM 590 CD2 PHE B 204 15.050 1.853 10.761 1.00 0.00 C ATOM 591 CE1 PHE B 204 17.496 0.492 10.875 1.00 0.00 C ATOM 592 CE2 PHE B 204 15.938 2.094 11.816 1.00 0.00 C ATOM 593 CZ PHE B 204 17.161 1.413 11.872 1.00 0.00 C ATOM 0 H PHE B 204 15.579 2.846 7.728 1.00 0.00 H new ATOM 0 HA PHE B 204 15.767 -0.074 7.121 1.00 0.00 H new ATOM 0 HB2 PHE B 204 13.591 1.375 8.676 1.00 0.00 H new ATOM 0 HB3 PHE B 204 13.997 -0.329 8.723 1.00 0.00 H new ATOM 0 HD1 PHE B 204 16.867 -0.465 9.050 1.00 0.00 H new ATOM 0 HD2 PHE B 204 14.107 2.378 10.718 1.00 0.00 H new ATOM 0 HE1 PHE B 204 18.439 -0.032 10.919 1.00 0.00 H new ATOM 0 HE2 PHE B 204 15.680 2.805 12.587 1.00 0.00 H new ATOM 0 HZ PHE B 204 17.846 1.600 12.686 1.00 0.00 H new ATOM 603 N VAL B 205 13.774 -0.157 5.526 1.00 0.00 N ATOM 604 CA VAL B 205 12.777 -0.092 4.418 1.00 0.00 C ATOM 605 C VAL B 205 11.632 -1.073 4.686 1.00 0.00 C ATOM 606 O VAL B 205 11.808 -2.275 4.650 1.00 0.00 O ATOM 607 CB VAL B 205 13.470 -0.450 3.100 1.00 0.00 C ATOM 608 CG1 VAL B 205 12.494 -0.280 1.933 1.00 0.00 C ATOM 609 CG2 VAL B 205 14.669 0.479 2.895 1.00 0.00 C ATOM 0 H VAL B 205 14.148 -1.086 5.719 1.00 0.00 H new ATOM 0 HA VAL B 205 12.367 0.916 4.355 1.00 0.00 H new ATOM 0 HB VAL B 205 13.804 -1.487 3.139 1.00 0.00 H new ATOM 0 HG11 VAL B 205 12.995 -0.537 0.999 1.00 0.00 H new ATOM 0 HG12 VAL B 205 11.636 -0.937 2.077 1.00 0.00 H new ATOM 0 HG13 VAL B 205 12.155 0.755 1.890 1.00 0.00 H new ATOM 0 HG21 VAL B 205 15.167 0.229 1.958 1.00 0.00 H new ATOM 0 HG22 VAL B 205 14.326 1.513 2.859 1.00 0.00 H new ATOM 0 HG23 VAL B 205 15.369 0.357 3.722 1.00 0.00 H new ATOM 619 N LYS B 206 10.453 -0.565 4.935 1.00 0.00 N ATOM 620 CA LYS B 206 9.291 -1.464 5.183 1.00 0.00 C ATOM 621 C LYS B 206 8.503 -1.609 3.879 1.00 0.00 C ATOM 622 O LYS B 206 8.252 -0.642 3.186 1.00 0.00 O ATOM 623 CB LYS B 206 8.392 -0.876 6.279 1.00 0.00 C ATOM 624 CG LYS B 206 8.147 0.608 6.011 1.00 0.00 C ATOM 625 CD LYS B 206 6.995 1.113 6.888 1.00 0.00 C ATOM 626 CE LYS B 206 7.132 0.553 8.308 1.00 0.00 C ATOM 627 NZ LYS B 206 8.528 0.752 8.792 1.00 0.00 N ATOM 0 H LYS B 206 10.246 0.433 4.977 1.00 0.00 H new ATOM 0 HA LYS B 206 9.642 -2.441 5.516 1.00 0.00 H new ATOM 0 HB2 LYS B 206 7.443 -1.411 6.308 1.00 0.00 H new ATOM 0 HB3 LYS B 206 8.861 -1.006 7.254 1.00 0.00 H new ATOM 0 HG2 LYS B 206 9.052 1.179 6.220 1.00 0.00 H new ATOM 0 HG3 LYS B 206 7.909 0.762 4.959 1.00 0.00 H new ATOM 0 HD2 LYS B 206 6.999 2.203 6.916 1.00 0.00 H new ATOM 0 HD3 LYS B 206 6.040 0.809 6.459 1.00 0.00 H new ATOM 0 HE2 LYS B 206 6.430 1.052 8.976 1.00 0.00 H new ATOM 0 HE3 LYS B 206 6.881 -0.508 8.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 206 8.836 -0.090 9.320 1.00 0.00 H new ATOM 0 HZ2 LYS B 206 9.159 0.901 7.979 1.00 0.00 H new ATOM 0 HZ3 LYS B 206 8.564 1.584 9.415 1.00 0.00 H new ATOM 641 N THR B 207 8.132 -2.807 3.521 1.00 0.00 N ATOM 642 CA THR B 207 7.388 -2.998 2.244 1.00 0.00 C ATOM 643 C THR B 207 5.879 -2.990 2.489 1.00 0.00 C ATOM 644 O THR B 207 5.406 -2.740 3.580 1.00 0.00 O ATOM 645 CB THR B 207 7.789 -4.330 1.612 1.00 0.00 C ATOM 646 OG1 THR B 207 7.259 -5.397 2.386 1.00 0.00 O ATOM 647 CG2 THR B 207 9.314 -4.435 1.563 1.00 0.00 C ATOM 0 H THR B 207 8.310 -3.658 4.054 1.00 0.00 H new ATOM 0 HA THR B 207 7.639 -2.177 1.573 1.00 0.00 H new ATOM 0 HB THR B 207 7.393 -4.387 0.598 1.00 0.00 H new ATOM 0 HG1 THR B 207 7.345 -6.237 1.888 1.00 0.00 H new ATOM 0 HG21 THR B 207 9.599 -5.386 1.112 1.00 0.00 H new ATOM 0 HG22 THR B 207 9.716 -3.616 0.967 1.00 0.00 H new ATOM 0 HG23 THR B 207 9.715 -4.379 2.575 1.00 0.00 H new ATOM 655 N LEU B 208 5.127 -3.262 1.460 1.00 0.00 N ATOM 656 CA LEU B 208 3.645 -3.271 1.594 1.00 0.00 C ATOM 657 C LEU B 208 3.212 -4.503 2.390 1.00 0.00 C ATOM 658 O LEU B 208 2.076 -4.617 2.804 1.00 0.00 O ATOM 659 CB LEU B 208 3.006 -3.301 0.206 1.00 0.00 C ATOM 660 CG LEU B 208 3.668 -2.250 -0.684 1.00 0.00 C ATOM 661 CD1 LEU B 208 3.048 -2.296 -2.083 1.00 0.00 C ATOM 662 CD2 LEU B 208 3.447 -0.865 -0.079 1.00 0.00 C ATOM 0 H LEU B 208 5.478 -3.480 0.527 1.00 0.00 H new ATOM 0 HA LEU B 208 3.322 -2.372 2.118 1.00 0.00 H new ATOM 0 HB2 LEU B 208 3.119 -4.291 -0.236 1.00 0.00 H new ATOM 0 HB3 LEU B 208 1.936 -3.106 0.282 1.00 0.00 H new ATOM 0 HG LEU B 208 4.736 -2.455 -0.754 1.00 0.00 H new ATOM 0 HD11 LEU B 208 3.522 -1.546 -2.716 1.00 0.00 H new ATOM 0 HD12 LEU B 208 3.200 -3.285 -2.516 1.00 0.00 H new ATOM 0 HD13 LEU B 208 1.980 -2.091 -2.014 1.00 0.00 H new ATOM 0 HD21 LEU B 208 3.918 -0.112 -0.711 1.00 0.00 H new ATOM 0 HD22 LEU B 208 2.378 -0.664 -0.011 1.00 0.00 H new ATOM 0 HD23 LEU B 208 3.887 -0.829 0.917 1.00 0.00 H new ATOM 674 N THR B 209 4.109 -5.427 2.604 1.00 0.00 N ATOM 675 CA THR B 209 3.746 -6.653 3.369 1.00 0.00 C ATOM 676 C THR B 209 4.286 -6.545 4.797 1.00 0.00 C ATOM 677 O THR B 209 4.066 -7.412 5.619 1.00 0.00 O ATOM 678 CB THR B 209 4.353 -7.884 2.689 1.00 0.00 C ATOM 679 OG1 THR B 209 5.738 -7.956 2.996 1.00 0.00 O ATOM 680 CG2 THR B 209 4.172 -7.782 1.173 1.00 0.00 C ATOM 0 H THR B 209 5.076 -5.386 2.282 1.00 0.00 H new ATOM 0 HA THR B 209 2.661 -6.751 3.396 1.00 0.00 H new ATOM 0 HB THR B 209 3.849 -8.780 3.051 1.00 0.00 H new ATOM 0 HG1 THR B 209 6.128 -8.744 2.563 1.00 0.00 H new ATOM 0 HG21 THR B 209 4.606 -8.660 0.695 1.00 0.00 H new ATOM 0 HG22 THR B 209 3.109 -7.727 0.936 1.00 0.00 H new ATOM 0 HG23 THR B 209 4.672 -6.885 0.806 1.00 0.00 H new ATOM 688 N GLY B 210 4.986 -5.486 5.104 1.00 0.00 N ATOM 689 CA GLY B 210 5.528 -5.330 6.484 1.00 0.00 C ATOM 690 C GLY B 210 6.967 -5.844 6.540 1.00 0.00 C ATOM 691 O GLY B 210 7.592 -5.850 7.583 1.00 0.00 O ATOM 0 H GLY B 210 5.205 -4.725 4.461 1.00 0.00 H new ATOM 0 HA2 GLY B 210 5.495 -4.282 6.780 1.00 0.00 H new ATOM 0 HA3 GLY B 210 4.908 -5.881 7.192 1.00 0.00 H new ATOM 695 N LYS B 211 7.505 -6.267 5.429 1.00 0.00 N ATOM 696 CA LYS B 211 8.907 -6.769 5.426 1.00 0.00 C ATOM 697 C LYS B 211 9.850 -5.601 5.719 1.00 0.00 C ATOM 698 O LYS B 211 9.915 -4.645 4.974 1.00 0.00 O ATOM 699 CB LYS B 211 9.231 -7.366 4.049 1.00 0.00 C ATOM 700 CG LYS B 211 10.736 -7.637 3.924 1.00 0.00 C ATOM 701 CD LYS B 211 11.201 -8.540 5.068 1.00 0.00 C ATOM 702 CE LYS B 211 12.343 -9.434 4.577 1.00 0.00 C ATOM 703 NZ LYS B 211 11.798 -10.475 3.662 1.00 0.00 N ATOM 0 H LYS B 211 7.034 -6.286 4.524 1.00 0.00 H new ATOM 0 HA LYS B 211 9.030 -7.539 6.187 1.00 0.00 H new ATOM 0 HB2 LYS B 211 8.675 -8.293 3.908 1.00 0.00 H new ATOM 0 HB3 LYS B 211 8.912 -6.680 3.264 1.00 0.00 H new ATOM 0 HG2 LYS B 211 10.950 -8.110 2.966 1.00 0.00 H new ATOM 0 HG3 LYS B 211 11.286 -6.696 3.945 1.00 0.00 H new ATOM 0 HD2 LYS B 211 11.535 -7.935 5.911 1.00 0.00 H new ATOM 0 HD3 LYS B 211 10.372 -9.152 5.423 1.00 0.00 H new ATOM 0 HE2 LYS B 211 13.092 -8.835 4.059 1.00 0.00 H new ATOM 0 HE3 LYS B 211 12.842 -9.904 5.425 1.00 0.00 H new ATOM 0 HZ1 LYS B 211 12.411 -11.315 3.688 1.00 0.00 H new ATOM 0 HZ2 LYS B 211 10.839 -10.737 3.966 1.00 0.00 H new ATOM 0 HZ3 LYS B 211 11.764 -10.101 2.692 1.00 0.00 H new ATOM 717 N THR B 212 10.588 -5.671 6.795 1.00 0.00 N ATOM 718 CA THR B 212 11.526 -4.562 7.121 1.00 0.00 C ATOM 719 C THR B 212 12.933 -4.956 6.684 1.00 0.00 C ATOM 720 O THR B 212 13.356 -6.082 6.862 1.00 0.00 O ATOM 721 CB THR B 212 11.514 -4.293 8.626 1.00 0.00 C ATOM 722 OG1 THR B 212 10.173 -4.271 9.093 1.00 0.00 O ATOM 723 CG2 THR B 212 12.178 -2.943 8.903 1.00 0.00 C ATOM 0 H THR B 212 10.581 -6.446 7.459 1.00 0.00 H new ATOM 0 HA THR B 212 11.215 -3.658 6.598 1.00 0.00 H new ATOM 0 HB THR B 212 12.062 -5.080 9.143 1.00 0.00 H new ATOM 0 HG1 THR B 212 10.165 -4.100 10.058 1.00 0.00 H new ATOM 0 HG21 THR B 212 12.171 -2.747 9.975 1.00 0.00 H new ATOM 0 HG22 THR B 212 13.207 -2.963 8.544 1.00 0.00 H new ATOM 0 HG23 THR B 212 11.629 -2.155 8.387 1.00 0.00 H new ATOM 731 N ILE B 213 13.659 -4.043 6.102 1.00 0.00 N ATOM 732 CA ILE B 213 15.036 -4.366 5.640 1.00 0.00 C ATOM 733 C ILE B 213 15.984 -3.238 6.047 1.00 0.00 C ATOM 734 O ILE B 213 15.673 -2.072 5.902 1.00 0.00 O ATOM 735 CB ILE B 213 15.029 -4.515 4.117 1.00 0.00 C ATOM 736 CG1 ILE B 213 13.903 -5.466 3.704 1.00 0.00 C ATOM 737 CG2 ILE B 213 16.366 -5.087 3.646 1.00 0.00 C ATOM 738 CD1 ILE B 213 13.750 -5.445 2.187 1.00 0.00 C ATOM 0 H ILE B 213 13.357 -3.085 5.926 1.00 0.00 H new ATOM 0 HA ILE B 213 15.373 -5.298 6.095 1.00 0.00 H new ATOM 0 HB ILE B 213 14.873 -3.537 3.662 1.00 0.00 H new ATOM 0 HG12 ILE B 213 14.124 -6.478 4.044 1.00 0.00 H new ATOM 0 HG13 ILE B 213 12.968 -5.168 4.179 1.00 0.00 H new ATOM 0 HG21 ILE B 213 16.355 -5.191 2.561 1.00 0.00 H new ATOM 0 HG22 ILE B 213 17.173 -4.415 3.938 1.00 0.00 H new ATOM 0 HG23 ILE B 213 16.525 -6.064 4.102 1.00 0.00 H new ATOM 0 HD11 ILE B 213 12.948 -6.122 1.893 1.00 0.00 H new ATOM 0 HD12 ILE B 213 13.509 -4.434 1.860 1.00 0.00 H new ATOM 0 HD13 ILE B 213 14.683 -5.764 1.723 1.00 0.00 H new ATOM 750 N THR B 214 17.142 -3.573 6.549 1.00 0.00 N ATOM 751 CA THR B 214 18.114 -2.520 6.959 1.00 0.00 C ATOM 752 C THR B 214 19.237 -2.451 5.924 1.00 0.00 C ATOM 753 O THR B 214 19.925 -3.422 5.681 1.00 0.00 O ATOM 754 CB THR B 214 18.700 -2.872 8.330 1.00 0.00 C ATOM 755 OG1 THR B 214 17.642 -3.020 9.268 1.00 0.00 O ATOM 756 CG2 THR B 214 19.639 -1.757 8.790 1.00 0.00 C ATOM 0 H THR B 214 17.457 -4.532 6.693 1.00 0.00 H new ATOM 0 HA THR B 214 17.611 -1.555 7.021 1.00 0.00 H new ATOM 0 HB THR B 214 19.259 -3.805 8.258 1.00 0.00 H new ATOM 0 HG1 THR B 214 18.013 -3.247 10.146 1.00 0.00 H new ATOM 0 HG21 THR B 214 20.054 -2.010 9.765 1.00 0.00 H new ATOM 0 HG22 THR B 214 20.449 -1.643 8.069 1.00 0.00 H new ATOM 0 HG23 THR B 214 19.084 -0.822 8.864 1.00 0.00 H new ATOM 764 N LEU B 215 19.415 -1.316 5.303 1.00 0.00 N ATOM 765 CA LEU B 215 20.483 -1.190 4.269 1.00 0.00 C ATOM 766 C LEU B 215 21.405 -0.007 4.608 1.00 0.00 C ATOM 767 O LEU B 215 20.968 1.123 4.731 1.00 0.00 O ATOM 768 CB LEU B 215 19.837 -0.963 2.892 1.00 0.00 C ATOM 769 CG LEU B 215 18.626 -1.890 2.708 1.00 0.00 C ATOM 770 CD1 LEU B 215 17.844 -1.474 1.458 1.00 0.00 C ATOM 771 CD2 LEU B 215 19.103 -3.337 2.535 1.00 0.00 C ATOM 0 H LEU B 215 18.868 -0.471 5.467 1.00 0.00 H new ATOM 0 HA LEU B 215 21.073 -2.106 4.249 1.00 0.00 H new ATOM 0 HB2 LEU B 215 19.524 0.077 2.797 1.00 0.00 H new ATOM 0 HB3 LEU B 215 20.568 -1.149 2.105 1.00 0.00 H new ATOM 0 HG LEU B 215 17.986 -1.815 3.587 1.00 0.00 H new ATOM 0 HD11 LEU B 215 16.985 -2.133 1.330 1.00 0.00 H new ATOM 0 HD12 LEU B 215 17.499 -0.446 1.570 1.00 0.00 H new ATOM 0 HD13 LEU B 215 18.491 -1.546 0.584 1.00 0.00 H new ATOM 0 HD21 LEU B 215 18.241 -3.991 2.405 1.00 0.00 H new ATOM 0 HD22 LEU B 215 19.746 -3.406 1.658 1.00 0.00 H new ATOM 0 HD23 LEU B 215 19.661 -3.644 3.419 1.00 0.00 H new ATOM 783 N GLU B 216 22.680 -0.269 4.764 1.00 0.00 N ATOM 784 CA GLU B 216 23.647 0.824 5.095 1.00 0.00 C ATOM 785 C GLU B 216 23.762 1.785 3.904 1.00 0.00 C ATOM 786 O GLU B 216 23.985 1.368 2.787 1.00 0.00 O ATOM 787 CB GLU B 216 25.019 0.217 5.391 1.00 0.00 C ATOM 788 CG GLU B 216 25.017 -0.395 6.793 1.00 0.00 C ATOM 789 CD GLU B 216 25.820 -1.697 6.785 1.00 0.00 C ATOM 790 OE1 GLU B 216 25.237 -2.727 6.487 1.00 0.00 O ATOM 791 OE2 GLU B 216 27.003 -1.643 7.077 1.00 0.00 O ATOM 0 H GLU B 216 23.094 -1.197 4.676 1.00 0.00 H new ATOM 0 HA GLU B 216 23.292 1.369 5.970 1.00 0.00 H new ATOM 0 HB2 GLU B 216 25.258 -0.546 4.650 1.00 0.00 H new ATOM 0 HB3 GLU B 216 25.790 0.984 5.319 1.00 0.00 H new ATOM 0 HG2 GLU B 216 25.449 0.306 7.507 1.00 0.00 H new ATOM 0 HG3 GLU B 216 23.994 -0.589 7.115 1.00 0.00 H new ATOM 798 N VAL B 217 23.641 3.069 4.135 1.00 0.00 N ATOM 799 CA VAL B 217 23.758 4.042 3.005 1.00 0.00 C ATOM 800 C VAL B 217 24.623 5.233 3.423 1.00 0.00 C ATOM 801 O VAL B 217 25.190 5.259 4.498 1.00 0.00 O ATOM 802 CB VAL B 217 22.371 4.558 2.612 1.00 0.00 C ATOM 803 CG1 VAL B 217 21.538 3.415 2.032 1.00 0.00 C ATOM 804 CG2 VAL B 217 21.661 5.125 3.841 1.00 0.00 C ATOM 0 H VAL B 217 23.467 3.483 5.051 1.00 0.00 H new ATOM 0 HA VAL B 217 24.217 3.532 2.158 1.00 0.00 H new ATOM 0 HB VAL B 217 22.485 5.342 1.863 1.00 0.00 H new ATOM 0 HG11 VAL B 217 20.552 3.788 1.754 1.00 0.00 H new ATOM 0 HG12 VAL B 217 22.036 3.013 1.150 1.00 0.00 H new ATOM 0 HG13 VAL B 217 21.431 2.628 2.778 1.00 0.00 H new ATOM 0 HG21 VAL B 217 20.675 5.491 3.555 1.00 0.00 H new ATOM 0 HG22 VAL B 217 21.554 4.343 4.593 1.00 0.00 H new ATOM 0 HG23 VAL B 217 22.247 5.947 4.253 1.00 0.00 H new ATOM 814 N GLU B 218 24.718 6.221 2.576 1.00 0.00 N ATOM 815 CA GLU B 218 25.534 7.421 2.907 1.00 0.00 C ATOM 816 C GLU B 218 24.729 8.679 2.562 1.00 0.00 C ATOM 817 O GLU B 218 23.850 8.647 1.725 1.00 0.00 O ATOM 818 CB GLU B 218 26.825 7.394 2.084 1.00 0.00 C ATOM 819 CG GLU B 218 27.903 6.627 2.852 1.00 0.00 C ATOM 820 CD GLU B 218 29.226 6.703 2.088 1.00 0.00 C ATOM 821 OE1 GLU B 218 29.679 7.808 1.836 1.00 0.00 O ATOM 822 OE2 GLU B 218 29.762 5.656 1.766 1.00 0.00 O ATOM 0 H GLU B 218 24.262 6.248 1.664 1.00 0.00 H new ATOM 0 HA GLU B 218 25.782 7.424 3.968 1.00 0.00 H new ATOM 0 HB2 GLU B 218 26.644 6.920 1.119 1.00 0.00 H new ATOM 0 HB3 GLU B 218 27.161 8.411 1.882 1.00 0.00 H new ATOM 0 HG2 GLU B 218 28.023 7.048 3.850 1.00 0.00 H new ATOM 0 HG3 GLU B 218 27.603 5.587 2.979 1.00 0.00 H new ATOM 829 N PRO B 219 25.025 9.780 3.202 1.00 0.00 N ATOM 830 CA PRO B 219 24.311 11.066 2.953 1.00 0.00 C ATOM 831 C PRO B 219 24.435 11.524 1.497 1.00 0.00 C ATOM 832 O PRO B 219 23.653 12.321 1.018 1.00 0.00 O ATOM 833 CB PRO B 219 24.995 12.070 3.890 1.00 0.00 C ATOM 834 CG PRO B 219 26.278 11.430 4.313 1.00 0.00 C ATOM 835 CD PRO B 219 26.065 9.920 4.229 1.00 0.00 C ATOM 0 HA PRO B 219 23.241 10.969 3.137 1.00 0.00 H new ATOM 0 HB2 PRO B 219 25.180 13.016 3.381 1.00 0.00 H new ATOM 0 HB3 PRO B 219 24.366 12.290 4.752 1.00 0.00 H new ATOM 0 HG2 PRO B 219 27.098 11.742 3.666 1.00 0.00 H new ATOM 0 HG3 PRO B 219 26.543 11.727 5.328 1.00 0.00 H new ATOM 0 HD2 PRO B 219 26.981 9.400 3.947 1.00 0.00 H new ATOM 0 HD3 PRO B 219 25.744 9.506 5.185 1.00 0.00 H new ATOM 843 N SER B 220 25.415 11.031 0.792 1.00 0.00 N ATOM 844 CA SER B 220 25.598 11.441 -0.629 1.00 0.00 C ATOM 845 C SER B 220 25.146 10.314 -1.562 1.00 0.00 C ATOM 846 O SER B 220 25.351 10.372 -2.758 1.00 0.00 O ATOM 847 CB SER B 220 27.078 11.733 -0.879 1.00 0.00 C ATOM 848 OG SER B 220 27.434 12.948 -0.235 1.00 0.00 O ATOM 0 H SER B 220 26.099 10.359 1.140 1.00 0.00 H new ATOM 0 HA SER B 220 25.001 12.332 -0.825 1.00 0.00 H new ATOM 0 HB2 SER B 220 27.691 10.915 -0.500 1.00 0.00 H new ATOM 0 HB3 SER B 220 27.270 11.806 -1.949 1.00 0.00 H new ATOM 0 HG SER B 220 28.383 13.136 -0.393 1.00 0.00 H new ATOM 854 N ASP B 221 24.545 9.281 -1.035 1.00 0.00 N ATOM 855 CA ASP B 221 24.105 8.161 -1.915 1.00 0.00 C ATOM 856 C ASP B 221 22.899 8.604 -2.745 1.00 0.00 C ATOM 857 O ASP B 221 22.052 9.341 -2.281 1.00 0.00 O ATOM 858 CB ASP B 221 23.728 6.948 -1.064 1.00 0.00 C ATOM 859 CG ASP B 221 24.576 5.748 -1.488 1.00 0.00 C ATOM 860 OD1 ASP B 221 24.536 5.403 -2.657 1.00 0.00 O ATOM 861 OD2 ASP B 221 25.252 5.194 -0.636 1.00 0.00 O ATOM 0 H ASP B 221 24.341 9.165 -0.042 1.00 0.00 H new ATOM 0 HA ASP B 221 24.922 7.888 -2.582 1.00 0.00 H new ATOM 0 HB2 ASP B 221 23.889 7.166 -0.008 1.00 0.00 H new ATOM 0 HB3 ASP B 221 22.669 6.720 -1.185 1.00 0.00 H new ATOM 866 N THR B 222 22.818 8.163 -3.972 1.00 0.00 N ATOM 867 CA THR B 222 21.670 8.566 -4.832 1.00 0.00 C ATOM 868 C THR B 222 20.487 7.620 -4.610 1.00 0.00 C ATOM 869 O THR B 222 20.654 6.438 -4.377 1.00 0.00 O ATOM 870 CB THR B 222 22.089 8.515 -6.304 1.00 0.00 C ATOM 871 OG1 THR B 222 22.363 7.170 -6.672 1.00 0.00 O ATOM 872 CG2 THR B 222 23.341 9.369 -6.513 1.00 0.00 C ATOM 0 H THR B 222 23.496 7.543 -4.414 1.00 0.00 H new ATOM 0 HA THR B 222 21.371 9.581 -4.569 1.00 0.00 H new ATOM 0 HB THR B 222 21.281 8.904 -6.924 1.00 0.00 H new ATOM 0 HG1 THR B 222 22.630 7.137 -7.614 1.00 0.00 H new ATOM 0 HG21 THR B 222 23.637 9.331 -7.561 1.00 0.00 H new ATOM 0 HG22 THR B 222 23.128 10.401 -6.233 1.00 0.00 H new ATOM 0 HG23 THR B 222 24.151 8.985 -5.893 1.00 0.00 H new ATOM 880 N ILE B 223 19.291 8.135 -4.692 1.00 0.00 N ATOM 881 CA ILE B 223 18.088 7.277 -4.502 1.00 0.00 C ATOM 882 C ILE B 223 18.197 6.059 -5.419 1.00 0.00 C ATOM 883 O ILE B 223 17.649 5.010 -5.147 1.00 0.00 O ATOM 884 CB ILE B 223 16.840 8.080 -4.873 1.00 0.00 C ATOM 885 CG1 ILE B 223 16.683 9.277 -3.919 1.00 0.00 C ATOM 886 CG2 ILE B 223 15.601 7.183 -4.812 1.00 0.00 C ATOM 887 CD1 ILE B 223 16.417 8.811 -2.479 1.00 0.00 C ATOM 0 H ILE B 223 19.095 9.117 -4.883 1.00 0.00 H new ATOM 0 HA ILE B 223 18.021 6.952 -3.464 1.00 0.00 H new ATOM 0 HB ILE B 223 16.948 8.455 -5.891 1.00 0.00 H new ATOM 0 HG12 ILE B 223 17.586 9.887 -3.945 1.00 0.00 H new ATOM 0 HG13 ILE B 223 15.862 9.909 -4.257 1.00 0.00 H new ATOM 0 HG21 ILE B 223 14.718 7.764 -5.078 1.00 0.00 H new ATOM 0 HG22 ILE B 223 15.716 6.356 -5.513 1.00 0.00 H new ATOM 0 HG23 ILE B 223 15.486 6.790 -3.802 1.00 0.00 H new ATOM 0 HD11 ILE B 223 16.311 9.680 -1.829 1.00 0.00 H new ATOM 0 HD12 ILE B 223 15.500 8.222 -2.451 1.00 0.00 H new ATOM 0 HD13 ILE B 223 17.251 8.200 -2.134 1.00 0.00 H new ATOM 899 N GLU B 224 18.907 6.192 -6.506 1.00 0.00 N ATOM 900 CA GLU B 224 19.060 5.047 -7.446 1.00 0.00 C ATOM 901 C GLU B 224 19.840 3.929 -6.754 1.00 0.00 C ATOM 902 O GLU B 224 19.575 2.761 -6.954 1.00 0.00 O ATOM 903 CB GLU B 224 19.803 5.524 -8.704 1.00 0.00 C ATOM 904 CG GLU B 224 21.107 4.740 -8.904 1.00 0.00 C ATOM 905 CD GLU B 224 21.803 5.237 -10.172 1.00 0.00 C ATOM 906 OE1 GLU B 224 21.256 6.119 -10.815 1.00 0.00 O ATOM 907 OE2 GLU B 224 22.868 4.729 -10.479 1.00 0.00 O ATOM 0 H GLU B 224 19.389 7.047 -6.784 1.00 0.00 H new ATOM 0 HA GLU B 224 18.082 4.665 -7.737 1.00 0.00 H new ATOM 0 HB2 GLU B 224 19.163 5.400 -9.577 1.00 0.00 H new ATOM 0 HB3 GLU B 224 20.024 6.588 -8.619 1.00 0.00 H new ATOM 0 HG2 GLU B 224 21.760 4.871 -8.041 1.00 0.00 H new ATOM 0 HG3 GLU B 224 20.896 3.674 -8.985 1.00 0.00 H new ATOM 914 N ASN B 225 20.800 4.273 -5.938 1.00 0.00 N ATOM 915 CA ASN B 225 21.585 3.220 -5.239 1.00 0.00 C ATOM 916 C ASN B 225 20.694 2.543 -4.198 1.00 0.00 C ATOM 917 O ASN B 225 20.557 1.337 -4.181 1.00 0.00 O ATOM 918 CB ASN B 225 22.795 3.851 -4.546 1.00 0.00 C ATOM 919 CG ASN B 225 23.982 3.877 -5.511 1.00 0.00 C ATOM 920 OD1 ASN B 225 24.261 2.900 -6.176 1.00 0.00 O ATOM 921 ND2 ASN B 225 24.697 4.964 -5.615 1.00 0.00 N ATOM 0 H ASN B 225 21.072 5.233 -5.727 1.00 0.00 H new ATOM 0 HA ASN B 225 21.933 2.483 -5.962 1.00 0.00 H new ATOM 0 HB2 ASN B 225 22.554 4.864 -4.222 1.00 0.00 H new ATOM 0 HB3 ASN B 225 23.052 3.283 -3.652 1.00 0.00 H new ATOM 0 HD21 ASN B 225 25.491 4.993 -6.255 1.00 0.00 H new ATOM 0 HD22 ASN B 225 24.462 5.784 -5.056 1.00 0.00 H new ATOM 928 N VAL B 226 20.075 3.307 -3.338 1.00 0.00 N ATOM 929 CA VAL B 226 19.186 2.697 -2.309 1.00 0.00 C ATOM 930 C VAL B 226 18.185 1.778 -3.002 1.00 0.00 C ATOM 931 O VAL B 226 17.842 0.725 -2.507 1.00 0.00 O ATOM 932 CB VAL B 226 18.437 3.799 -1.563 1.00 0.00 C ATOM 933 CG1 VAL B 226 17.634 3.187 -0.415 1.00 0.00 C ATOM 934 CG2 VAL B 226 19.446 4.795 -0.995 1.00 0.00 C ATOM 0 H VAL B 226 20.147 4.324 -3.304 1.00 0.00 H new ATOM 0 HA VAL B 226 19.782 2.125 -1.598 1.00 0.00 H new ATOM 0 HB VAL B 226 17.760 4.307 -2.249 1.00 0.00 H new ATOM 0 HG11 VAL B 226 17.100 3.975 0.116 1.00 0.00 H new ATOM 0 HG12 VAL B 226 16.918 2.469 -0.814 1.00 0.00 H new ATOM 0 HG13 VAL B 226 18.311 2.680 0.273 1.00 0.00 H new ATOM 0 HG21 VAL B 226 18.917 5.584 -0.461 1.00 0.00 H new ATOM 0 HG22 VAL B 226 20.118 4.280 -0.309 1.00 0.00 H new ATOM 0 HG23 VAL B 226 20.024 5.232 -1.809 1.00 0.00 H new ATOM 944 N LYS B 227 17.721 2.170 -4.151 1.00 0.00 N ATOM 945 CA LYS B 227 16.747 1.327 -4.892 1.00 0.00 C ATOM 946 C LYS B 227 17.434 0.022 -5.309 1.00 0.00 C ATOM 947 O LYS B 227 16.822 -1.028 -5.376 1.00 0.00 O ATOM 948 CB LYS B 227 16.289 2.099 -6.138 1.00 0.00 C ATOM 949 CG LYS B 227 14.866 1.694 -6.530 1.00 0.00 C ATOM 950 CD LYS B 227 14.272 2.762 -7.450 1.00 0.00 C ATOM 951 CE LYS B 227 13.482 3.768 -6.611 1.00 0.00 C ATOM 952 NZ LYS B 227 13.159 4.963 -7.441 1.00 0.00 N ATOM 0 H LYS B 227 17.976 3.043 -4.612 1.00 0.00 H new ATOM 0 HA LYS B 227 15.885 1.093 -4.266 1.00 0.00 H new ATOM 0 HB2 LYS B 227 16.327 3.171 -5.943 1.00 0.00 H new ATOM 0 HB3 LYS B 227 16.970 1.901 -6.966 1.00 0.00 H new ATOM 0 HG2 LYS B 227 14.876 0.728 -7.035 1.00 0.00 H new ATOM 0 HG3 LYS B 227 14.249 1.581 -5.639 1.00 0.00 H new ATOM 0 HD2 LYS B 227 15.066 3.271 -7.996 1.00 0.00 H new ATOM 0 HD3 LYS B 227 13.621 2.299 -8.192 1.00 0.00 H new ATOM 0 HE2 LYS B 227 12.564 3.309 -6.243 1.00 0.00 H new ATOM 0 HE3 LYS B 227 14.063 4.065 -5.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 227 13.086 5.801 -6.829 1.00 0.00 H new ATOM 0 HZ2 LYS B 227 13.911 5.111 -8.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 227 12.254 4.812 -7.930 1.00 0.00 H new ATOM 966 N ALA B 228 18.711 0.082 -5.582 1.00 0.00 N ATOM 967 CA ALA B 228 19.450 -1.147 -5.987 1.00 0.00 C ATOM 968 C ALA B 228 19.620 -2.057 -4.769 1.00 0.00 C ATOM 969 O ALA B 228 19.567 -3.266 -4.870 1.00 0.00 O ATOM 970 CB ALA B 228 20.826 -0.761 -6.536 1.00 0.00 C ATOM 0 H ALA B 228 19.274 0.932 -5.541 1.00 0.00 H new ATOM 0 HA ALA B 228 18.890 -1.673 -6.760 1.00 0.00 H new ATOM 0 HB1 ALA B 228 21.365 -1.661 -6.832 1.00 0.00 H new ATOM 0 HB2 ALA B 228 20.703 -0.111 -7.402 1.00 0.00 H new ATOM 0 HB3 ALA B 228 21.391 -0.236 -5.766 1.00 0.00 H new ATOM 976 N LYS B 229 19.819 -1.487 -3.612 1.00 0.00 N ATOM 977 CA LYS B 229 19.984 -2.326 -2.394 1.00 0.00 C ATOM 978 C LYS B 229 18.745 -3.212 -2.234 1.00 0.00 C ATOM 979 O LYS B 229 18.844 -4.418 -2.117 1.00 0.00 O ATOM 980 CB LYS B 229 20.157 -1.418 -1.172 1.00 0.00 C ATOM 981 CG LYS B 229 21.297 -0.433 -1.449 1.00 0.00 C ATOM 982 CD LYS B 229 21.389 0.596 -0.320 1.00 0.00 C ATOM 983 CE LYS B 229 22.368 0.107 0.740 1.00 0.00 C ATOM 984 NZ LYS B 229 21.948 0.619 2.069 1.00 0.00 N ATOM 0 H LYS B 229 19.874 -0.480 -3.459 1.00 0.00 H new ATOM 0 HA LYS B 229 20.867 -2.958 -2.485 1.00 0.00 H new ATOM 0 HB2 LYS B 229 19.232 -0.878 -0.969 1.00 0.00 H new ATOM 0 HB3 LYS B 229 20.379 -2.014 -0.287 1.00 0.00 H new ATOM 0 HG2 LYS B 229 22.240 -0.972 -1.538 1.00 0.00 H new ATOM 0 HG3 LYS B 229 21.128 0.073 -2.400 1.00 0.00 H new ATOM 0 HD2 LYS B 229 21.717 1.557 -0.716 1.00 0.00 H new ATOM 0 HD3 LYS B 229 20.406 0.753 0.124 1.00 0.00 H new ATOM 0 HE2 LYS B 229 22.397 -0.983 0.750 1.00 0.00 H new ATOM 0 HE3 LYS B 229 23.376 0.451 0.507 1.00 0.00 H new ATOM 0 HZ1 LYS B 229 22.607 1.362 2.379 1.00 0.00 H new ATOM 0 HZ2 LYS B 229 20.988 1.014 2.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 229 21.955 -0.159 2.759 1.00 0.00 H new ATOM 998 N ILE B 230 17.575 -2.629 -2.247 1.00 0.00 N ATOM 999 CA ILE B 230 16.339 -3.450 -2.114 1.00 0.00 C ATOM 1000 C ILE B 230 16.287 -4.455 -3.269 1.00 0.00 C ATOM 1001 O ILE B 230 15.851 -5.575 -3.111 1.00 0.00 O ATOM 1002 CB ILE B 230 15.104 -2.542 -2.170 1.00 0.00 C ATOM 1003 CG1 ILE B 230 15.001 -1.711 -0.883 1.00 0.00 C ATOM 1004 CG2 ILE B 230 13.844 -3.399 -2.309 1.00 0.00 C ATOM 1005 CD1 ILE B 230 15.816 -0.422 -1.023 1.00 0.00 C ATOM 0 H ILE B 230 17.424 -1.625 -2.344 1.00 0.00 H new ATOM 0 HA ILE B 230 16.349 -3.978 -1.160 1.00 0.00 H new ATOM 0 HB ILE B 230 15.197 -1.874 -3.027 1.00 0.00 H new ATOM 0 HG12 ILE B 230 13.958 -1.471 -0.679 1.00 0.00 H new ATOM 0 HG13 ILE B 230 15.366 -2.291 -0.036 1.00 0.00 H new ATOM 0 HG21 ILE B 230 12.967 -2.753 -2.349 1.00 0.00 H new ATOM 0 HG22 ILE B 230 13.903 -3.987 -3.225 1.00 0.00 H new ATOM 0 HG23 ILE B 230 13.763 -4.068 -1.453 1.00 0.00 H new ATOM 0 HD11 ILE B 230 15.736 0.160 -0.105 1.00 0.00 H new ATOM 0 HD12 ILE B 230 16.861 -0.671 -1.206 1.00 0.00 H new ATOM 0 HD13 ILE B 230 15.431 0.163 -1.858 1.00 0.00 H new ATOM 1017 N GLN B 231 16.726 -4.061 -4.434 1.00 0.00 N ATOM 1018 CA GLN B 231 16.700 -4.995 -5.598 1.00 0.00 C ATOM 1019 C GLN B 231 17.548 -6.238 -5.295 1.00 0.00 C ATOM 1020 O GLN B 231 17.167 -7.347 -5.608 1.00 0.00 O ATOM 1021 CB GLN B 231 17.270 -4.287 -6.832 1.00 0.00 C ATOM 1022 CG GLN B 231 17.354 -5.273 -8.000 1.00 0.00 C ATOM 1023 CD GLN B 231 17.798 -4.532 -9.261 1.00 0.00 C ATOM 1024 OE1 GLN B 231 17.031 -4.545 -10.316 1.00 0.00 O flip ATOM 1025 NE2 GLN B 231 18.858 -3.937 -9.289 1.00 0.00 N flip ATOM 0 H GLN B 231 17.102 -3.133 -4.631 1.00 0.00 H new ATOM 0 HA GLN B 231 15.670 -5.299 -5.786 1.00 0.00 H new ATOM 0 HB2 GLN B 231 16.638 -3.441 -7.102 1.00 0.00 H new ATOM 0 HB3 GLN B 231 18.259 -3.887 -6.609 1.00 0.00 H new ATOM 0 HG2 GLN B 231 18.059 -6.071 -7.767 1.00 0.00 H new ATOM 0 HG3 GLN B 231 16.384 -5.743 -8.164 1.00 0.00 H new ATOM 0 HE21 GLN B 231 19.459 -3.926 -8.465 1.00 0.00 H new ATOM 0 HE22 GLN B 231 19.147 -3.449 -10.137 1.00 0.00 H new ATOM 1034 N ASP B 232 18.702 -6.061 -4.711 1.00 0.00 N ATOM 1035 CA ASP B 232 19.578 -7.233 -4.415 1.00 0.00 C ATOM 1036 C ASP B 232 18.982 -8.089 -3.293 1.00 0.00 C ATOM 1037 O ASP B 232 19.175 -9.288 -3.252 1.00 0.00 O ATOM 1038 CB ASP B 232 20.959 -6.734 -3.983 1.00 0.00 C ATOM 1039 CG ASP B 232 21.896 -6.716 -5.191 1.00 0.00 C ATOM 1040 OD1 ASP B 232 21.913 -7.696 -5.917 1.00 0.00 O ATOM 1041 OD2 ASP B 232 22.581 -5.723 -5.370 1.00 0.00 O ATOM 0 H ASP B 232 19.077 -5.156 -4.426 1.00 0.00 H new ATOM 0 HA ASP B 232 19.659 -7.842 -5.315 1.00 0.00 H new ATOM 0 HB2 ASP B 232 20.879 -5.734 -3.557 1.00 0.00 H new ATOM 0 HB3 ASP B 232 21.364 -7.381 -3.205 1.00 0.00 H new ATOM 1046 N LYS B 233 18.277 -7.492 -2.372 1.00 0.00 N ATOM 1047 CA LYS B 233 17.700 -8.294 -1.253 1.00 0.00 C ATOM 1048 C LYS B 233 16.275 -8.744 -1.591 1.00 0.00 C ATOM 1049 O LYS B 233 15.932 -9.902 -1.454 1.00 0.00 O ATOM 1050 CB LYS B 233 17.674 -7.442 0.018 1.00 0.00 C ATOM 1051 CG LYS B 233 19.076 -6.894 0.298 1.00 0.00 C ATOM 1052 CD LYS B 233 19.435 -7.133 1.767 1.00 0.00 C ATOM 1053 CE LYS B 233 20.773 -6.461 2.085 1.00 0.00 C ATOM 1054 NZ LYS B 233 21.843 -7.496 2.165 1.00 0.00 N ATOM 0 H LYS B 233 18.076 -6.492 -2.344 1.00 0.00 H new ATOM 0 HA LYS B 233 18.319 -9.178 -1.099 1.00 0.00 H new ATOM 0 HB2 LYS B 233 16.968 -6.620 -0.098 1.00 0.00 H new ATOM 0 HB3 LYS B 233 17.331 -8.040 0.862 1.00 0.00 H new ATOM 0 HG2 LYS B 233 19.805 -7.382 -0.349 1.00 0.00 H new ATOM 0 HG3 LYS B 233 19.113 -5.828 0.073 1.00 0.00 H new ATOM 0 HD2 LYS B 233 18.653 -6.733 2.413 1.00 0.00 H new ATOM 0 HD3 LYS B 233 19.497 -8.203 1.967 1.00 0.00 H new ATOM 0 HE2 LYS B 233 21.017 -5.730 1.315 1.00 0.00 H new ATOM 0 HE3 LYS B 233 20.705 -5.919 3.029 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 22.752 -7.039 2.381 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 21.611 -8.178 2.915 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 21.913 -7.994 1.255 1.00 0.00 H new ATOM 1068 N GLU B 234 15.437 -7.838 -2.007 1.00 0.00 N ATOM 1069 CA GLU B 234 14.029 -8.214 -2.322 1.00 0.00 C ATOM 1070 C GLU B 234 13.885 -8.665 -3.781 1.00 0.00 C ATOM 1071 O GLU B 234 12.836 -9.131 -4.183 1.00 0.00 O ATOM 1072 CB GLU B 234 13.122 -7.012 -2.077 1.00 0.00 C ATOM 1073 CG GLU B 234 13.037 -6.740 -0.575 1.00 0.00 C ATOM 1074 CD GLU B 234 12.159 -7.803 0.088 1.00 0.00 C ATOM 1075 OE1 GLU B 234 12.693 -8.833 0.468 1.00 0.00 O ATOM 1076 OE2 GLU B 234 10.967 -7.572 0.204 1.00 0.00 O ATOM 0 H GLU B 234 15.664 -6.853 -2.143 1.00 0.00 H new ATOM 0 HA GLU B 234 13.744 -9.045 -1.677 1.00 0.00 H new ATOM 0 HB2 GLU B 234 13.512 -6.136 -2.595 1.00 0.00 H new ATOM 0 HB3 GLU B 234 12.128 -7.204 -2.480 1.00 0.00 H new ATOM 0 HG2 GLU B 234 14.034 -6.752 -0.136 1.00 0.00 H new ATOM 0 HG3 GLU B 234 12.622 -5.748 -0.397 1.00 0.00 H new ATOM 1083 N GLY B 235 14.910 -8.553 -4.581 1.00 0.00 N ATOM 1084 CA GLY B 235 14.790 -9.001 -6.000 1.00 0.00 C ATOM 1085 C GLY B 235 13.783 -8.127 -6.754 1.00 0.00 C ATOM 1086 O GLY B 235 13.173 -8.562 -7.710 1.00 0.00 O ATOM 0 H GLY B 235 15.819 -8.174 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY B 235 15.763 -8.948 -6.488 1.00 0.00 H new ATOM 0 HA3 GLY B 235 14.473 -10.043 -6.033 1.00 0.00 H new ATOM 1090 N ILE B 236 13.601 -6.902 -6.337 1.00 0.00 N ATOM 1091 CA ILE B 236 12.627 -6.017 -7.040 1.00 0.00 C ATOM 1092 C ILE B 236 13.389 -5.005 -7.917 1.00 0.00 C ATOM 1093 O ILE B 236 14.320 -4.372 -7.460 1.00 0.00 O ATOM 1094 CB ILE B 236 11.791 -5.264 -6.005 1.00 0.00 C ATOM 1095 CG1 ILE B 236 11.158 -6.268 -5.038 1.00 0.00 C ATOM 1096 CG2 ILE B 236 10.684 -4.481 -6.716 1.00 0.00 C ATOM 1097 CD1 ILE B 236 10.594 -5.528 -3.822 1.00 0.00 C ATOM 0 H ILE B 236 14.082 -6.478 -5.544 1.00 0.00 H new ATOM 0 HA ILE B 236 11.974 -6.622 -7.669 1.00 0.00 H new ATOM 0 HB ILE B 236 12.430 -4.574 -5.453 1.00 0.00 H new ATOM 0 HG12 ILE B 236 10.364 -6.820 -5.540 1.00 0.00 H new ATOM 0 HG13 ILE B 236 11.901 -6.998 -4.719 1.00 0.00 H new ATOM 0 HG21 ILE B 236 10.087 -3.944 -5.979 1.00 0.00 H new ATOM 0 HG22 ILE B 236 11.130 -3.769 -7.410 1.00 0.00 H new ATOM 0 HG23 ILE B 236 10.045 -5.172 -7.266 1.00 0.00 H new ATOM 0 HD11 ILE B 236 10.144 -6.246 -3.136 1.00 0.00 H new ATOM 0 HD12 ILE B 236 11.399 -4.996 -3.315 1.00 0.00 H new ATOM 0 HD13 ILE B 236 9.837 -4.815 -4.149 1.00 0.00 H new ATOM 1109 N PRO B 237 13.005 -4.844 -9.168 1.00 0.00 N ATOM 1110 CA PRO B 237 13.681 -3.884 -10.091 1.00 0.00 C ATOM 1111 C PRO B 237 13.316 -2.425 -9.782 1.00 0.00 C ATOM 1112 O PRO B 237 12.291 -2.148 -9.192 1.00 0.00 O ATOM 1113 CB PRO B 237 13.167 -4.282 -11.474 1.00 0.00 C ATOM 1114 CG PRO B 237 11.839 -4.915 -11.232 1.00 0.00 C ATOM 1115 CD PRO B 237 11.899 -5.549 -9.842 1.00 0.00 C ATOM 0 HA PRO B 237 14.766 -3.934 -10.000 1.00 0.00 H new ATOM 0 HB2 PRO B 237 13.076 -3.413 -12.125 1.00 0.00 H new ATOM 0 HB3 PRO B 237 13.850 -4.976 -11.963 1.00 0.00 H new ATOM 0 HG2 PRO B 237 11.042 -4.173 -11.285 1.00 0.00 H new ATOM 0 HG3 PRO B 237 11.625 -5.667 -11.991 1.00 0.00 H new ATOM 0 HD2 PRO B 237 10.959 -5.420 -9.305 1.00 0.00 H new ATOM 0 HD3 PRO B 237 12.088 -6.621 -9.901 1.00 0.00 H new ATOM 1123 N PRO B 238 14.156 -1.500 -10.172 1.00 0.00 N ATOM 1124 CA PRO B 238 13.931 -0.043 -9.927 1.00 0.00 C ATOM 1125 C PRO B 238 12.810 0.553 -10.787 1.00 0.00 C ATOM 1126 O PRO B 238 12.098 1.440 -10.362 1.00 0.00 O ATOM 1127 CB PRO B 238 15.268 0.599 -10.297 1.00 0.00 C ATOM 1128 CG PRO B 238 15.903 -0.342 -11.265 1.00 0.00 C ATOM 1129 CD PRO B 238 15.421 -1.742 -10.889 1.00 0.00 C ATOM 0 HA PRO B 238 13.618 0.134 -8.898 1.00 0.00 H new ATOM 0 HB2 PRO B 238 15.122 1.583 -10.743 1.00 0.00 H new ATOM 0 HB3 PRO B 238 15.894 0.739 -9.416 1.00 0.00 H new ATOM 0 HG2 PRO B 238 15.619 -0.096 -12.288 1.00 0.00 H new ATOM 0 HG3 PRO B 238 16.990 -0.279 -11.212 1.00 0.00 H new ATOM 0 HD2 PRO B 238 15.268 -2.362 -11.772 1.00 0.00 H new ATOM 0 HD3 PRO B 238 16.145 -2.258 -10.259 1.00 0.00 H new ATOM 1137 N ASP B 239 12.658 0.087 -11.995 1.00 0.00 N ATOM 1138 CA ASP B 239 11.596 0.644 -12.880 1.00 0.00 C ATOM 1139 C ASP B 239 10.209 0.327 -12.308 1.00 0.00 C ATOM 1140 O ASP B 239 9.202 0.790 -12.819 1.00 0.00 O ATOM 1141 CB ASP B 239 11.726 0.026 -14.274 1.00 0.00 C ATOM 1142 CG ASP B 239 11.276 -1.435 -14.229 1.00 0.00 C ATOM 1143 OD1 ASP B 239 10.106 -1.666 -13.979 1.00 0.00 O ATOM 1144 OD2 ASP B 239 12.111 -2.298 -14.445 1.00 0.00 O ATOM 0 H ASP B 239 13.223 -0.655 -12.408 1.00 0.00 H new ATOM 0 HA ASP B 239 11.714 1.726 -12.941 1.00 0.00 H new ATOM 0 HB2 ASP B 239 11.119 0.583 -14.988 1.00 0.00 H new ATOM 0 HB3 ASP B 239 12.759 0.089 -14.616 1.00 0.00 H new ATOM 1149 N GLN B 240 10.146 -0.464 -11.263 1.00 0.00 N ATOM 1150 CA GLN B 240 8.818 -0.815 -10.676 1.00 0.00 C ATOM 1151 C GLN B 240 8.808 -0.560 -9.162 1.00 0.00 C ATOM 1152 O GLN B 240 7.761 -0.415 -8.564 1.00 0.00 O ATOM 1153 CB GLN B 240 8.510 -2.291 -10.975 1.00 0.00 C ATOM 1154 CG GLN B 240 8.261 -3.074 -9.679 1.00 0.00 C ATOM 1155 CD GLN B 240 7.951 -4.533 -10.023 1.00 0.00 C ATOM 1156 OE1 GLN B 240 8.645 -5.135 -10.951 1.00 0.00 O flip ATOM 1157 NE2 GLN B 240 7.068 -5.131 -9.442 1.00 0.00 N flip ATOM 0 H GLN B 240 10.952 -0.878 -10.795 1.00 0.00 H new ATOM 0 HA GLN B 240 8.050 -0.185 -11.125 1.00 0.00 H new ATOM 0 HB2 GLN B 240 7.634 -2.360 -11.620 1.00 0.00 H new ATOM 0 HB3 GLN B 240 9.342 -2.737 -11.519 1.00 0.00 H new ATOM 0 HG2 GLN B 240 9.137 -3.019 -9.033 1.00 0.00 H new ATOM 0 HG3 GLN B 240 7.430 -2.633 -9.128 1.00 0.00 H new ATOM 0 HE21 GLN B 240 6.526 -4.661 -8.717 1.00 0.00 H new ATOM 0 HE22 GLN B 240 6.869 -6.103 -9.679 1.00 0.00 H new ATOM 1166 N GLN B 241 9.946 -0.505 -8.530 1.00 0.00 N ATOM 1167 CA GLN B 241 9.946 -0.259 -7.058 1.00 0.00 C ATOM 1168 C GLN B 241 10.022 1.248 -6.798 1.00 0.00 C ATOM 1169 O GLN B 241 10.771 1.958 -7.440 1.00 0.00 O ATOM 1170 CB GLN B 241 11.134 -0.985 -6.411 1.00 0.00 C ATOM 1171 CG GLN B 241 12.273 -0.011 -6.113 1.00 0.00 C ATOM 1172 CD GLN B 241 13.495 -0.807 -5.651 1.00 0.00 C ATOM 1173 OE1 GLN B 241 13.899 -0.712 -4.509 1.00 0.00 O ATOM 1174 NE2 GLN B 241 14.107 -1.592 -6.495 1.00 0.00 N ATOM 0 H GLN B 241 10.865 -0.618 -8.959 1.00 0.00 H new ATOM 0 HA GLN B 241 9.027 -0.646 -6.617 1.00 0.00 H new ATOM 0 HB2 GLN B 241 10.812 -1.467 -5.488 1.00 0.00 H new ATOM 0 HB3 GLN B 241 11.489 -1.773 -7.075 1.00 0.00 H new ATOM 0 HG2 GLN B 241 12.515 0.570 -7.003 1.00 0.00 H new ATOM 0 HG3 GLN B 241 11.971 0.698 -5.342 1.00 0.00 H new ATOM 0 HE21 GLN B 241 13.769 -1.673 -7.454 1.00 0.00 H new ATOM 0 HE22 GLN B 241 14.924 -2.125 -6.196 1.00 0.00 H new ATOM 1183 N ARG B 242 9.241 1.744 -5.873 1.00 0.00 N ATOM 1184 CA ARG B 242 9.256 3.209 -5.585 1.00 0.00 C ATOM 1185 C ARG B 242 9.508 3.449 -4.096 1.00 0.00 C ATOM 1186 O ARG B 242 8.927 2.803 -3.246 1.00 0.00 O ATOM 1187 CB ARG B 242 7.900 3.811 -5.963 1.00 0.00 C ATOM 1188 CG ARG B 242 7.812 3.965 -7.482 1.00 0.00 C ATOM 1189 CD ARG B 242 6.402 4.420 -7.867 1.00 0.00 C ATOM 1190 NE ARG B 242 6.407 4.900 -9.278 1.00 0.00 N ATOM 1191 CZ ARG B 242 6.742 6.132 -9.549 1.00 0.00 C ATOM 1192 NH1 ARG B 242 7.065 6.950 -8.585 1.00 0.00 N ATOM 1193 NH2 ARG B 242 6.755 6.547 -10.786 1.00 0.00 N ATOM 0 H ARG B 242 8.594 1.198 -5.305 1.00 0.00 H new ATOM 0 HA ARG B 242 10.051 3.678 -6.166 1.00 0.00 H new ATOM 0 HB2 ARG B 242 7.094 3.170 -5.605 1.00 0.00 H new ATOM 0 HB3 ARG B 242 7.774 4.781 -5.481 1.00 0.00 H new ATOM 0 HG2 ARG B 242 8.547 4.691 -7.828 1.00 0.00 H new ATOM 0 HG3 ARG B 242 8.046 3.018 -7.969 1.00 0.00 H new ATOM 0 HD2 ARG B 242 5.698 3.596 -7.754 1.00 0.00 H new ATOM 0 HD3 ARG B 242 6.070 5.216 -7.201 1.00 0.00 H new ATOM 0 HE ARG B 242 6.148 4.265 -10.033 1.00 0.00 H new ATOM 0 HH11 ARG B 242 7.056 6.627 -7.618 1.00 0.00 H new ATOM 0 HH12 ARG B 242 7.327 7.912 -8.799 1.00 0.00 H new ATOM 0 HH21 ARG B 242 6.503 5.909 -11.541 1.00 0.00 H new ATOM 0 HH22 ARG B 242 7.017 7.510 -10.998 1.00 0.00 H new ATOM 1207 N LEU B 243 10.364 4.383 -3.774 1.00 0.00 N ATOM 1208 CA LEU B 243 10.646 4.676 -2.339 1.00 0.00 C ATOM 1209 C LEU B 243 9.971 5.996 -1.953 1.00 0.00 C ATOM 1210 O LEU B 243 10.157 7.015 -2.595 1.00 0.00 O ATOM 1211 CB LEU B 243 12.157 4.785 -2.118 1.00 0.00 C ATOM 1212 CG LEU B 243 12.761 3.384 -2.013 1.00 0.00 C ATOM 1213 CD1 LEU B 243 14.220 3.420 -2.473 1.00 0.00 C ATOM 1214 CD2 LEU B 243 12.700 2.909 -0.559 1.00 0.00 C ATOM 0 H LEU B 243 10.880 4.955 -4.443 1.00 0.00 H new ATOM 0 HA LEU B 243 10.255 3.869 -1.719 1.00 0.00 H new ATOM 0 HB2 LEU B 243 12.617 5.330 -2.942 1.00 0.00 H new ATOM 0 HB3 LEU B 243 12.362 5.350 -1.209 1.00 0.00 H new ATOM 0 HG LEU B 243 12.196 2.699 -2.645 1.00 0.00 H new ATOM 0 HD11 LEU B 243 14.650 2.421 -2.398 1.00 0.00 H new ATOM 0 HD12 LEU B 243 14.267 3.758 -3.508 1.00 0.00 H new ATOM 0 HD13 LEU B 243 14.784 4.106 -1.841 1.00 0.00 H new ATOM 0 HD21 LEU B 243 13.130 1.910 -0.484 1.00 0.00 H new ATOM 0 HD22 LEU B 243 13.264 3.596 0.072 1.00 0.00 H new ATOM 0 HD23 LEU B 243 11.662 2.882 -0.228 1.00 0.00 H new ATOM 1226 N ILE B 244 9.183 5.979 -0.910 1.00 0.00 N ATOM 1227 CA ILE B 244 8.481 7.219 -0.471 1.00 0.00 C ATOM 1228 C ILE B 244 8.900 7.564 0.961 1.00 0.00 C ATOM 1229 O ILE B 244 8.985 6.705 1.817 1.00 0.00 O ATOM 1230 CB ILE B 244 6.968 6.987 -0.515 1.00 0.00 C ATOM 1231 CG1 ILE B 244 6.511 6.875 -1.972 1.00 0.00 C ATOM 1232 CG2 ILE B 244 6.252 8.160 0.156 1.00 0.00 C ATOM 1233 CD1 ILE B 244 5.034 6.478 -2.017 1.00 0.00 C ATOM 0 H ILE B 244 8.995 5.154 -0.341 1.00 0.00 H new ATOM 0 HA ILE B 244 8.745 8.042 -1.135 1.00 0.00 H new ATOM 0 HB ILE B 244 6.726 6.065 0.013 1.00 0.00 H new ATOM 0 HG12 ILE B 244 6.658 7.826 -2.484 1.00 0.00 H new ATOM 0 HG13 ILE B 244 7.114 6.134 -2.497 1.00 0.00 H new ATOM 0 HG21 ILE B 244 5.175 7.995 0.125 1.00 0.00 H new ATOM 0 HG22 ILE B 244 6.577 8.239 1.193 1.00 0.00 H new ATOM 0 HG23 ILE B 244 6.493 9.083 -0.371 1.00 0.00 H new ATOM 0 HD11 ILE B 244 4.710 6.399 -3.055 1.00 0.00 H new ATOM 0 HD12 ILE B 244 4.900 5.517 -1.521 1.00 0.00 H new ATOM 0 HD13 ILE B 244 4.438 7.235 -1.508 1.00 0.00 H new ATOM 1245 N PHE B 245 9.165 8.815 1.226 1.00 0.00 N ATOM 1246 CA PHE B 245 9.583 9.223 2.600 1.00 0.00 C ATOM 1247 C PHE B 245 8.727 10.405 3.063 1.00 0.00 C ATOM 1248 O PHE B 245 8.813 11.492 2.529 1.00 0.00 O ATOM 1249 CB PHE B 245 11.058 9.636 2.568 1.00 0.00 C ATOM 1250 CG PHE B 245 11.552 9.915 3.967 1.00 0.00 C ATOM 1251 CD1 PHE B 245 11.552 8.899 4.932 1.00 0.00 C ATOM 1252 CD2 PHE B 245 12.023 11.192 4.298 1.00 0.00 C ATOM 1253 CE1 PHE B 245 12.021 9.161 6.224 1.00 0.00 C ATOM 1254 CE2 PHE B 245 12.491 11.452 5.591 1.00 0.00 C ATOM 1255 CZ PHE B 245 12.491 10.437 6.555 1.00 0.00 C ATOM 0 H PHE B 245 9.110 9.575 0.548 1.00 0.00 H new ATOM 0 HA PHE B 245 9.449 8.391 3.292 1.00 0.00 H new ATOM 0 HB2 PHE B 245 11.655 8.845 2.115 1.00 0.00 H new ATOM 0 HB3 PHE B 245 11.181 10.523 1.947 1.00 0.00 H new ATOM 0 HD1 PHE B 245 11.190 7.914 4.679 1.00 0.00 H new ATOM 0 HD2 PHE B 245 12.025 11.976 3.555 1.00 0.00 H new ATOM 0 HE1 PHE B 245 12.020 8.377 6.967 1.00 0.00 H new ATOM 0 HE2 PHE B 245 12.853 12.437 5.845 1.00 0.00 H new ATOM 0 HZ PHE B 245 12.853 10.638 7.552 1.00 0.00 H new ATOM 1265 N ALA B 246 7.900 10.209 4.051 1.00 0.00 N ATOM 1266 CA ALA B 246 7.049 11.335 4.530 1.00 0.00 C ATOM 1267 C ALA B 246 6.072 11.744 3.423 1.00 0.00 C ATOM 1268 O ALA B 246 5.858 12.912 3.167 1.00 0.00 O ATOM 1269 CB ALA B 246 7.935 12.525 4.903 1.00 0.00 C ATOM 0 H ALA B 246 7.776 9.325 4.545 1.00 0.00 H new ATOM 0 HA ALA B 246 6.487 11.017 5.408 1.00 0.00 H new ATOM 0 HB1 ALA B 246 7.311 13.347 5.253 1.00 0.00 H new ATOM 0 HB2 ALA B 246 8.625 12.231 5.694 1.00 0.00 H new ATOM 0 HB3 ALA B 246 8.501 12.846 4.028 1.00 0.00 H new ATOM 1275 N GLY B 247 5.461 10.784 2.784 1.00 0.00 N ATOM 1276 CA GLY B 247 4.472 11.098 1.713 1.00 0.00 C ATOM 1277 C GLY B 247 5.158 11.751 0.511 1.00 0.00 C ATOM 1278 O GLY B 247 4.538 11.985 -0.508 1.00 0.00 O ATOM 0 H GLY B 247 5.605 9.789 2.959 1.00 0.00 H new ATOM 0 HA2 GLY B 247 3.969 10.184 1.397 1.00 0.00 H new ATOM 0 HA3 GLY B 247 3.704 11.765 2.105 1.00 0.00 H new ATOM 1282 N LYS B 248 6.424 12.054 0.608 1.00 0.00 N ATOM 1283 CA LYS B 248 7.110 12.693 -0.550 1.00 0.00 C ATOM 1284 C LYS B 248 7.787 11.613 -1.404 1.00 0.00 C ATOM 1285 O LYS B 248 8.368 10.674 -0.898 1.00 0.00 O ATOM 1286 CB LYS B 248 8.132 13.724 -0.041 1.00 0.00 C ATOM 1287 CG LYS B 248 9.529 13.104 0.070 1.00 0.00 C ATOM 1288 CD LYS B 248 10.380 13.937 1.032 1.00 0.00 C ATOM 1289 CE LYS B 248 10.315 15.416 0.641 1.00 0.00 C ATOM 1290 NZ LYS B 248 10.652 15.564 -0.803 1.00 0.00 N ATOM 0 H LYS B 248 7.007 11.889 1.429 1.00 0.00 H new ATOM 0 HA LYS B 248 6.382 13.215 -1.172 1.00 0.00 H new ATOM 0 HB2 LYS B 248 8.162 14.577 -0.719 1.00 0.00 H new ATOM 0 HB3 LYS B 248 7.819 14.101 0.933 1.00 0.00 H new ATOM 0 HG2 LYS B 248 9.456 12.077 0.428 1.00 0.00 H new ATOM 0 HG3 LYS B 248 10.001 13.067 -0.912 1.00 0.00 H new ATOM 0 HD2 LYS B 248 10.023 13.806 2.053 1.00 0.00 H new ATOM 0 HD3 LYS B 248 11.413 13.591 1.009 1.00 0.00 H new ATOM 0 HE2 LYS B 248 9.318 15.811 0.835 1.00 0.00 H new ATOM 0 HE3 LYS B 248 11.011 15.995 1.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 10.874 16.559 -1.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 11.477 14.972 -1.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 9.841 15.264 -1.381 1.00 0.00 H new ATOM 1304 N GLN B 249 7.687 11.724 -2.699 1.00 0.00 N ATOM 1305 CA GLN B 249 8.300 10.695 -3.587 1.00 0.00 C ATOM 1306 C GLN B 249 9.780 11.018 -3.814 1.00 0.00 C ATOM 1307 O GLN B 249 10.140 12.138 -4.118 1.00 0.00 O ATOM 1308 CB GLN B 249 7.567 10.686 -4.932 1.00 0.00 C ATOM 1309 CG GLN B 249 8.005 9.470 -5.749 1.00 0.00 C ATOM 1310 CD GLN B 249 7.386 9.546 -7.146 1.00 0.00 C ATOM 1311 OE1 GLN B 249 8.047 9.909 -8.098 1.00 0.00 O ATOM 1312 NE2 GLN B 249 6.133 9.216 -7.309 1.00 0.00 N ATOM 0 H GLN B 249 7.207 12.483 -3.182 1.00 0.00 H new ATOM 0 HA GLN B 249 8.216 9.716 -3.116 1.00 0.00 H new ATOM 0 HB2 GLN B 249 6.489 10.658 -4.770 1.00 0.00 H new ATOM 0 HB3 GLN B 249 7.783 11.602 -5.481 1.00 0.00 H new ATOM 0 HG2 GLN B 249 9.092 9.440 -5.822 1.00 0.00 H new ATOM 0 HG3 GLN B 249 7.693 8.552 -5.251 1.00 0.00 H new ATOM 0 HE21 GLN B 249 5.578 8.911 -6.510 1.00 0.00 H new ATOM 0 HE22 GLN B 249 5.710 9.263 -8.236 1.00 0.00 H new ATOM 1321 N LEU B 250 10.641 10.044 -3.675 1.00 0.00 N ATOM 1322 CA LEU B 250 12.094 10.300 -3.893 1.00 0.00 C ATOM 1323 C LEU B 250 12.399 10.210 -5.390 1.00 0.00 C ATOM 1324 O LEU B 250 11.795 9.440 -6.108 1.00 0.00 O ATOM 1325 CB LEU B 250 12.920 9.258 -3.136 1.00 0.00 C ATOM 1326 CG LEU B 250 12.388 9.121 -1.710 1.00 0.00 C ATOM 1327 CD1 LEU B 250 13.220 8.081 -0.957 1.00 0.00 C ATOM 1328 CD2 LEU B 250 12.495 10.472 -0.998 1.00 0.00 C ATOM 0 H LEU B 250 10.401 9.086 -3.421 1.00 0.00 H new ATOM 0 HA LEU B 250 12.350 11.294 -3.525 1.00 0.00 H new ATOM 0 HB2 LEU B 250 12.869 8.297 -3.648 1.00 0.00 H new ATOM 0 HB3 LEU B 250 13.969 9.554 -3.117 1.00 0.00 H new ATOM 0 HG LEU B 250 11.345 8.804 -1.736 1.00 0.00 H new ATOM 0 HD11 LEU B 250 12.843 7.981 0.061 1.00 0.00 H new ATOM 0 HD12 LEU B 250 13.149 7.120 -1.466 1.00 0.00 H new ATOM 0 HD13 LEU B 250 14.262 8.400 -0.928 1.00 0.00 H new ATOM 0 HD21 LEU B 250 12.116 10.378 0.020 1.00 0.00 H new ATOM 0 HD22 LEU B 250 13.538 10.787 -0.969 1.00 0.00 H new ATOM 0 HD23 LEU B 250 11.907 11.215 -1.537 1.00 0.00 H new ATOM 1340 N GLU B 251 13.327 10.997 -5.867 1.00 0.00 N ATOM 1341 CA GLU B 251 13.658 10.961 -7.322 1.00 0.00 C ATOM 1342 C GLU B 251 14.991 10.244 -7.539 1.00 0.00 C ATOM 1343 O GLU B 251 15.884 10.299 -6.718 1.00 0.00 O ATOM 1344 CB GLU B 251 13.761 12.389 -7.856 1.00 0.00 C ATOM 1345 CG GLU B 251 14.126 12.354 -9.343 1.00 0.00 C ATOM 1346 CD GLU B 251 13.300 13.397 -10.098 1.00 0.00 C ATOM 1347 OE1 GLU B 251 12.130 13.143 -10.328 1.00 0.00 O ATOM 1348 OE2 GLU B 251 13.853 14.430 -10.433 1.00 0.00 O ATOM 0 H GLU B 251 13.869 11.661 -5.314 1.00 0.00 H new ATOM 0 HA GLU B 251 12.871 10.424 -7.852 1.00 0.00 H new ATOM 0 HB2 GLU B 251 12.814 12.910 -7.715 1.00 0.00 H new ATOM 0 HB3 GLU B 251 14.516 12.943 -7.298 1.00 0.00 H new ATOM 0 HG2 GLU B 251 15.190 12.555 -9.472 1.00 0.00 H new ATOM 0 HG3 GLU B 251 13.937 11.361 -9.751 1.00 0.00 H new ATOM 1355 N ASP B 252 15.126 9.574 -8.650 1.00 0.00 N ATOM 1356 CA ASP B 252 16.391 8.846 -8.948 1.00 0.00 C ATOM 1357 C ASP B 252 17.506 9.847 -9.271 1.00 0.00 C ATOM 1358 O ASP B 252 18.605 9.466 -9.623 1.00 0.00 O ATOM 1359 CB ASP B 252 16.167 7.929 -10.152 1.00 0.00 C ATOM 1360 CG ASP B 252 14.780 7.291 -10.051 1.00 0.00 C ATOM 1361 OD1 ASP B 252 13.807 7.998 -10.264 1.00 0.00 O ATOM 1362 OD2 ASP B 252 14.712 6.108 -9.762 1.00 0.00 O ATOM 0 H ASP B 252 14.408 9.499 -9.370 1.00 0.00 H new ATOM 0 HA ASP B 252 16.683 8.255 -8.080 1.00 0.00 H new ATOM 0 HB2 ASP B 252 16.251 8.498 -11.078 1.00 0.00 H new ATOM 0 HB3 ASP B 252 16.934 7.155 -10.182 1.00 0.00 H new ATOM 1367 N GLY B 253 17.229 11.123 -9.167 1.00 0.00 N ATOM 1368 CA GLY B 253 18.271 12.146 -9.487 1.00 0.00 C ATOM 1369 C GLY B 253 18.553 13.039 -8.270 1.00 0.00 C ATOM 1370 O GLY B 253 18.643 14.244 -8.391 1.00 0.00 O ATOM 0 H GLY B 253 16.327 11.500 -8.875 1.00 0.00 H new ATOM 0 HA2 GLY B 253 19.190 11.650 -9.800 1.00 0.00 H new ATOM 0 HA3 GLY B 253 17.939 12.760 -10.324 1.00 0.00 H new ATOM 1374 N ARG B 254 18.708 12.466 -7.105 1.00 0.00 N ATOM 1375 CA ARG B 254 19.002 13.296 -5.893 1.00 0.00 C ATOM 1376 C ARG B 254 19.697 12.425 -4.840 1.00 0.00 C ATOM 1377 O ARG B 254 19.813 11.224 -4.993 1.00 0.00 O ATOM 1378 CB ARG B 254 17.693 13.857 -5.312 1.00 0.00 C ATOM 1379 CG ARG B 254 17.384 15.257 -5.876 1.00 0.00 C ATOM 1380 CD ARG B 254 16.019 15.241 -6.565 1.00 0.00 C ATOM 1381 NE ARG B 254 15.670 16.622 -7.002 1.00 0.00 N ATOM 1382 CZ ARG B 254 15.316 17.518 -6.123 1.00 0.00 C ATOM 1383 NH1 ARG B 254 15.238 17.198 -4.860 1.00 0.00 N ATOM 1384 NH2 ARG B 254 15.034 18.733 -6.507 1.00 0.00 N ATOM 0 H ARG B 254 18.644 11.462 -6.938 1.00 0.00 H new ATOM 0 HA ARG B 254 19.652 14.125 -6.173 1.00 0.00 H new ATOM 0 HB2 ARG B 254 16.871 13.180 -5.543 1.00 0.00 H new ATOM 0 HB3 ARG B 254 17.768 13.909 -4.226 1.00 0.00 H new ATOM 0 HG2 ARG B 254 17.389 15.993 -5.072 1.00 0.00 H new ATOM 0 HG3 ARG B 254 18.157 15.554 -6.585 1.00 0.00 H new ATOM 0 HD2 ARG B 254 16.041 14.570 -7.424 1.00 0.00 H new ATOM 0 HD3 ARG B 254 15.259 14.861 -5.882 1.00 0.00 H new ATOM 0 HE ARG B 254 15.708 16.867 -7.991 1.00 0.00 H new ATOM 0 HH11 ARG B 254 15.454 16.247 -4.561 1.00 0.00 H new ATOM 0 HH12 ARG B 254 14.961 17.899 -4.172 1.00 0.00 H new ATOM 0 HH21 ARG B 254 15.090 18.982 -7.495 1.00 0.00 H new ATOM 0 HH22 ARG B 254 14.757 19.434 -5.820 1.00 0.00 H new ATOM 1398 N THR B 255 20.165 13.025 -3.773 1.00 0.00 N ATOM 1399 CA THR B 255 20.859 12.237 -2.709 1.00 0.00 C ATOM 1400 C THR B 255 19.988 12.176 -1.450 1.00 0.00 C ATOM 1401 O THR B 255 19.086 12.967 -1.267 1.00 0.00 O ATOM 1402 CB THR B 255 22.194 12.903 -2.365 1.00 0.00 C ATOM 1403 OG1 THR B 255 21.964 14.244 -1.961 1.00 0.00 O ATOM 1404 CG2 THR B 255 23.109 12.884 -3.589 1.00 0.00 C ATOM 0 H THR B 255 20.096 14.027 -3.593 1.00 0.00 H new ATOM 0 HA THR B 255 21.035 11.226 -3.076 1.00 0.00 H new ATOM 0 HB THR B 255 22.672 12.357 -1.552 1.00 0.00 H new ATOM 0 HG1 THR B 255 22.217 14.350 -1.020 1.00 0.00 H new ATOM 0 HG21 THR B 255 24.058 13.359 -3.341 1.00 0.00 H new ATOM 0 HG22 THR B 255 23.288 11.853 -3.894 1.00 0.00 H new ATOM 0 HG23 THR B 255 22.635 13.427 -4.406 1.00 0.00 H new ATOM 1412 N LEU B 256 20.256 11.236 -0.582 1.00 0.00 N ATOM 1413 CA LEU B 256 19.450 11.111 0.668 1.00 0.00 C ATOM 1414 C LEU B 256 19.519 12.415 1.466 1.00 0.00 C ATOM 1415 O LEU B 256 18.539 12.862 2.029 1.00 0.00 O ATOM 1416 CB LEU B 256 20.008 9.969 1.523 1.00 0.00 C ATOM 1417 CG LEU B 256 20.428 8.808 0.621 1.00 0.00 C ATOM 1418 CD1 LEU B 256 20.703 7.567 1.475 1.00 0.00 C ATOM 1419 CD2 LEU B 256 19.305 8.505 -0.373 1.00 0.00 C ATOM 0 H LEU B 256 21.001 10.547 -0.686 1.00 0.00 H new ATOM 0 HA LEU B 256 18.413 10.903 0.404 1.00 0.00 H new ATOM 0 HB2 LEU B 256 20.862 10.319 2.102 1.00 0.00 H new ATOM 0 HB3 LEU B 256 19.255 9.634 2.236 1.00 0.00 H new ATOM 0 HG LEU B 256 21.333 9.080 0.078 1.00 0.00 H new ATOM 0 HD11 LEU B 256 21.002 6.741 0.830 1.00 0.00 H new ATOM 0 HD12 LEU B 256 21.503 7.783 2.183 1.00 0.00 H new ATOM 0 HD13 LEU B 256 19.800 7.293 2.020 1.00 0.00 H new ATOM 0 HD21 LEU B 256 19.603 7.677 -1.017 1.00 0.00 H new ATOM 0 HD22 LEU B 256 18.400 8.234 0.171 1.00 0.00 H new ATOM 0 HD23 LEU B 256 19.111 9.387 -0.983 1.00 0.00 H new ATOM 1431 N SER B 257 20.670 13.026 1.528 1.00 0.00 N ATOM 1432 CA SER B 257 20.797 14.296 2.300 1.00 0.00 C ATOM 1433 C SER B 257 19.901 15.372 1.684 1.00 0.00 C ATOM 1434 O SER B 257 19.443 16.271 2.360 1.00 0.00 O ATOM 1435 CB SER B 257 22.249 14.768 2.271 1.00 0.00 C ATOM 1436 OG SER B 257 22.612 15.081 0.934 1.00 0.00 O ATOM 0 H SER B 257 21.527 12.702 1.079 1.00 0.00 H new ATOM 0 HA SER B 257 20.490 14.119 3.331 1.00 0.00 H new ATOM 0 HB2 SER B 257 22.372 15.644 2.908 1.00 0.00 H new ATOM 0 HB3 SER B 257 22.904 13.992 2.666 1.00 0.00 H new ATOM 0 HG SER B 257 23.543 15.386 0.911 1.00 0.00 H new ATOM 1442 N ASP B 258 19.645 15.291 0.407 1.00 0.00 N ATOM 1443 CA ASP B 258 18.776 16.315 -0.239 1.00 0.00 C ATOM 1444 C ASP B 258 17.332 16.115 0.223 1.00 0.00 C ATOM 1445 O ASP B 258 16.496 16.983 0.071 1.00 0.00 O ATOM 1446 CB ASP B 258 18.852 16.170 -1.761 1.00 0.00 C ATOM 1447 CG ASP B 258 20.140 16.816 -2.273 1.00 0.00 C ATOM 1448 OD1 ASP B 258 20.853 17.393 -1.467 1.00 0.00 O ATOM 1449 OD2 ASP B 258 20.393 16.725 -3.464 1.00 0.00 O ATOM 0 H ASP B 258 19.998 14.564 -0.215 1.00 0.00 H new ATOM 0 HA ASP B 258 19.116 17.311 0.043 1.00 0.00 H new ATOM 0 HB2 ASP B 258 18.827 15.116 -2.038 1.00 0.00 H new ATOM 0 HB3 ASP B 258 17.986 16.643 -2.225 1.00 0.00 H new ATOM 1454 N TYR B 259 17.035 14.978 0.792 1.00 0.00 N ATOM 1455 CA TYR B 259 15.646 14.722 1.272 1.00 0.00 C ATOM 1456 C TYR B 259 15.616 14.833 2.797 1.00 0.00 C ATOM 1457 O TYR B 259 14.595 14.639 3.427 1.00 0.00 O ATOM 1458 CB TYR B 259 15.211 13.317 0.852 1.00 0.00 C ATOM 1459 CG TYR B 259 14.779 13.339 -0.595 1.00 0.00 C ATOM 1460 CD1 TYR B 259 13.630 14.044 -0.972 1.00 0.00 C ATOM 1461 CD2 TYR B 259 15.527 12.653 -1.559 1.00 0.00 C ATOM 1462 CE1 TYR B 259 13.228 14.064 -2.312 1.00 0.00 C ATOM 1463 CE2 TYR B 259 15.126 12.674 -2.901 1.00 0.00 C ATOM 1464 CZ TYR B 259 13.976 13.380 -3.277 1.00 0.00 C ATOM 1465 OH TYR B 259 13.579 13.399 -4.599 1.00 0.00 O ATOM 0 H TYR B 259 17.694 14.215 0.945 1.00 0.00 H new ATOM 0 HA TYR B 259 14.965 15.454 0.837 1.00 0.00 H new ATOM 0 HB2 TYR B 259 16.033 12.614 0.987 1.00 0.00 H new ATOM 0 HB3 TYR B 259 14.391 12.974 1.483 1.00 0.00 H new ATOM 0 HD1 TYR B 259 13.053 14.573 -0.228 1.00 0.00 H new ATOM 0 HD2 TYR B 259 16.413 12.108 -1.268 1.00 0.00 H new ATOM 0 HE1 TYR B 259 12.341 14.607 -2.602 1.00 0.00 H new ATOM 0 HE2 TYR B 259 15.703 12.146 -3.646 1.00 0.00 H new ATOM 0 HH TYR B 259 13.112 14.240 -4.788 1.00 0.00 H new ATOM 1475 N ASN B 260 16.733 15.150 3.391 1.00 0.00 N ATOM 1476 CA ASN B 260 16.787 15.283 4.873 1.00 0.00 C ATOM 1477 C ASN B 260 16.638 13.906 5.523 1.00 0.00 C ATOM 1478 O ASN B 260 15.982 13.753 6.535 1.00 0.00 O ATOM 1479 CB ASN B 260 15.660 16.204 5.341 1.00 0.00 C ATOM 1480 CG ASN B 260 15.378 17.246 4.259 1.00 0.00 C ATOM 1481 OD1 ASN B 260 16.288 17.750 3.632 1.00 0.00 O ATOM 1482 ND2 ASN B 260 14.145 17.592 4.008 1.00 0.00 N ATOM 0 H ASN B 260 17.616 15.324 2.910 1.00 0.00 H new ATOM 0 HA ASN B 260 17.747 15.709 5.164 1.00 0.00 H new ATOM 0 HB2 ASN B 260 14.761 15.623 5.546 1.00 0.00 H new ATOM 0 HB3 ASN B 260 15.940 16.696 6.272 1.00 0.00 H new ATOM 0 HD21 ASN B 260 13.947 18.285 3.286 1.00 0.00 H new ATOM 0 HD22 ASN B 260 13.380 17.170 4.534 1.00 0.00 H new ATOM 1489 N ILE B 261 17.248 12.905 4.954 1.00 0.00 N ATOM 1490 CA ILE B 261 17.151 11.539 5.541 1.00 0.00 C ATOM 1491 C ILE B 261 18.335 11.316 6.485 1.00 0.00 C ATOM 1492 O ILE B 261 19.464 11.621 6.157 1.00 0.00 O ATOM 1493 CB ILE B 261 17.178 10.501 4.419 1.00 0.00 C ATOM 1494 CG1 ILE B 261 15.842 10.529 3.671 1.00 0.00 C ATOM 1495 CG2 ILE B 261 17.402 9.109 5.013 1.00 0.00 C ATOM 1496 CD1 ILE B 261 15.989 9.810 2.329 1.00 0.00 C ATOM 0 H ILE B 261 17.811 12.973 4.106 1.00 0.00 H new ATOM 0 HA ILE B 261 16.219 11.439 6.097 1.00 0.00 H new ATOM 0 HB ILE B 261 17.989 10.733 3.728 1.00 0.00 H new ATOM 0 HG12 ILE B 261 15.069 10.048 4.270 1.00 0.00 H new ATOM 0 HG13 ILE B 261 15.526 11.560 3.510 1.00 0.00 H new ATOM 0 HG21 ILE B 261 17.421 8.370 4.212 1.00 0.00 H new ATOM 0 HG22 ILE B 261 18.352 9.090 5.547 1.00 0.00 H new ATOM 0 HG23 ILE B 261 16.593 8.874 5.704 1.00 0.00 H new ATOM 0 HD11 ILE B 261 15.037 9.831 1.799 1.00 0.00 H new ATOM 0 HD12 ILE B 261 16.750 10.310 1.730 1.00 0.00 H new ATOM 0 HD13 ILE B 261 16.285 8.775 2.501 1.00 0.00 H new ATOM 1508 N GLN B 262 18.084 10.792 7.656 1.00 0.00 N ATOM 1509 CA GLN B 262 19.195 10.557 8.625 1.00 0.00 C ATOM 1510 C GLN B 262 19.230 9.084 9.026 1.00 0.00 C ATOM 1511 O GLN B 262 18.384 8.300 8.645 1.00 0.00 O ATOM 1512 CB GLN B 262 18.979 11.413 9.874 1.00 0.00 C ATOM 1513 CG GLN B 262 18.988 12.893 9.488 1.00 0.00 C ATOM 1514 CD GLN B 262 20.064 13.625 10.290 1.00 0.00 C ATOM 1515 OE1 GLN B 262 19.759 14.454 11.123 1.00 0.00 O ATOM 1516 NE2 GLN B 262 21.322 13.352 10.072 1.00 0.00 N ATOM 0 H GLN B 262 17.158 10.517 7.983 1.00 0.00 H new ATOM 0 HA GLN B 262 20.140 10.828 8.154 1.00 0.00 H new ATOM 0 HB2 GLN B 262 18.030 11.155 10.345 1.00 0.00 H new ATOM 0 HB3 GLN B 262 19.762 11.212 10.605 1.00 0.00 H new ATOM 0 HG2 GLN B 262 19.180 13.000 8.420 1.00 0.00 H new ATOM 0 HG3 GLN B 262 18.011 13.336 9.682 1.00 0.00 H new ATOM 0 HE21 GLN B 262 21.579 12.656 9.372 1.00 0.00 H new ATOM 0 HE22 GLN B 262 22.048 13.835 10.601 1.00 0.00 H new ATOM 1525 N LYS B 263 20.218 8.706 9.786 1.00 0.00 N ATOM 1526 CA LYS B 263 20.346 7.296 10.218 1.00 0.00 C ATOM 1527 C LYS B 263 19.053 6.812 10.871 1.00 0.00 C ATOM 1528 O LYS B 263 18.253 7.584 11.360 1.00 0.00 O ATOM 1529 CB LYS B 263 21.518 7.178 11.213 1.00 0.00 C ATOM 1530 CG LYS B 263 21.132 7.699 12.615 1.00 0.00 C ATOM 1531 CD LYS B 263 20.909 9.212 12.604 1.00 0.00 C ATOM 1532 CE LYS B 263 22.183 9.921 12.142 1.00 0.00 C ATOM 1533 NZ LYS B 263 22.283 11.248 12.815 1.00 0.00 N ATOM 0 H LYS B 263 20.951 9.327 10.129 1.00 0.00 H new ATOM 0 HA LYS B 263 20.539 6.672 9.346 1.00 0.00 H new ATOM 0 HB2 LYS B 263 21.830 6.136 11.285 1.00 0.00 H new ATOM 0 HB3 LYS B 263 22.372 7.742 10.838 1.00 0.00 H new ATOM 0 HG2 LYS B 263 20.225 7.198 12.954 1.00 0.00 H new ATOM 0 HG3 LYS B 263 21.919 7.450 13.327 1.00 0.00 H new ATOM 0 HD2 LYS B 263 20.082 9.462 11.940 1.00 0.00 H new ATOM 0 HD3 LYS B 263 20.632 9.555 13.601 1.00 0.00 H new ATOM 0 HE2 LYS B 263 23.057 9.314 12.379 1.00 0.00 H new ATOM 0 HE3 LYS B 263 22.169 10.050 11.060 1.00 0.00 H new ATOM 0 HZ1 LYS B 263 23.149 11.732 12.502 1.00 0.00 H new ATOM 0 HZ2 LYS B 263 21.455 11.826 12.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 263 22.315 11.113 13.846 1.00 0.00 H new ATOM 1547 N GLU B 264 18.871 5.524 10.889 1.00 0.00 N ATOM 1548 CA GLU B 264 17.662 4.926 11.524 1.00 0.00 C ATOM 1549 C GLU B 264 16.379 5.467 10.883 1.00 0.00 C ATOM 1550 O GLU B 264 15.299 5.293 11.408 1.00 0.00 O ATOM 1551 CB GLU B 264 17.661 5.246 13.023 1.00 0.00 C ATOM 1552 CG GLU B 264 18.849 4.552 13.691 1.00 0.00 C ATOM 1553 CD GLU B 264 18.733 4.690 15.211 1.00 0.00 C ATOM 1554 OE1 GLU B 264 17.946 5.508 15.654 1.00 0.00 O ATOM 1555 OE2 GLU B 264 19.436 3.972 15.905 1.00 0.00 O ATOM 0 H GLU B 264 19.518 4.847 10.484 1.00 0.00 H new ATOM 0 HA GLU B 264 17.692 3.847 11.374 1.00 0.00 H new ATOM 0 HB2 GLU B 264 17.722 6.323 13.176 1.00 0.00 H new ATOM 0 HB3 GLU B 264 16.728 4.912 13.477 1.00 0.00 H new ATOM 0 HG2 GLU B 264 18.872 3.499 13.412 1.00 0.00 H new ATOM 0 HG3 GLU B 264 19.783 4.994 13.345 1.00 0.00 H new ATOM 1562 N SER B 265 16.479 6.104 9.748 1.00 0.00 N ATOM 1563 CA SER B 265 15.249 6.627 9.085 1.00 0.00 C ATOM 1564 C SER B 265 14.532 5.467 8.391 1.00 0.00 C ATOM 1565 O SER B 265 15.151 4.508 7.977 1.00 0.00 O ATOM 1566 CB SER B 265 15.625 7.694 8.057 1.00 0.00 C ATOM 1567 OG SER B 265 16.523 7.136 7.109 1.00 0.00 O ATOM 0 H SER B 265 17.353 6.284 9.253 1.00 0.00 H new ATOM 0 HA SER B 265 14.592 7.076 9.830 1.00 0.00 H new ATOM 0 HB2 SER B 265 14.731 8.063 7.555 1.00 0.00 H new ATOM 0 HB3 SER B 265 16.086 8.547 8.554 1.00 0.00 H new ATOM 0 HG SER B 265 17.425 7.486 7.267 1.00 0.00 H new ATOM 1573 N THR B 266 13.229 5.541 8.275 1.00 0.00 N ATOM 1574 CA THR B 266 12.470 4.432 7.621 1.00 0.00 C ATOM 1575 C THR B 266 11.817 4.928 6.327 1.00 0.00 C ATOM 1576 O THR B 266 11.284 6.018 6.266 1.00 0.00 O ATOM 1577 CB THR B 266 11.387 3.925 8.575 1.00 0.00 C ATOM 1578 OG1 THR B 266 11.937 3.780 9.878 1.00 0.00 O ATOM 1579 CG2 THR B 266 10.868 2.574 8.085 1.00 0.00 C ATOM 0 H THR B 266 12.659 6.320 8.605 1.00 0.00 H new ATOM 0 HA THR B 266 13.160 3.623 7.382 1.00 0.00 H new ATOM 0 HB THR B 266 10.564 4.639 8.605 1.00 0.00 H new ATOM 0 HG1 THR B 266 11.244 3.457 10.491 1.00 0.00 H new ATOM 0 HG21 THR B 266 10.096 2.212 8.765 1.00 0.00 H new ATOM 0 HG22 THR B 266 10.448 2.686 7.086 1.00 0.00 H new ATOM 0 HG23 THR B 266 11.689 1.858 8.055 1.00 0.00 H new ATOM 1587 N LEU B 267 11.858 4.127 5.292 1.00 0.00 N ATOM 1588 CA LEU B 267 11.247 4.537 3.994 1.00 0.00 C ATOM 1589 C LEU B 267 10.234 3.478 3.544 1.00 0.00 C ATOM 1590 O LEU B 267 10.452 2.291 3.699 1.00 0.00 O ATOM 1591 CB LEU B 267 12.345 4.666 2.937 1.00 0.00 C ATOM 1592 CG LEU B 267 13.002 6.043 3.043 1.00 0.00 C ATOM 1593 CD1 LEU B 267 13.738 6.163 4.381 1.00 0.00 C ATOM 1594 CD2 LEU B 267 14.001 6.222 1.899 1.00 0.00 C ATOM 0 H LEU B 267 12.291 3.203 5.292 1.00 0.00 H new ATOM 0 HA LEU B 267 10.740 5.494 4.119 1.00 0.00 H new ATOM 0 HB2 LEU B 267 13.092 3.884 3.077 1.00 0.00 H new ATOM 0 HB3 LEU B 267 11.923 4.529 1.941 1.00 0.00 H new ATOM 0 HG LEU B 267 12.233 6.813 2.982 1.00 0.00 H new ATOM 0 HD11 LEU B 267 14.205 7.145 4.453 1.00 0.00 H new ATOM 0 HD12 LEU B 267 13.029 6.038 5.199 1.00 0.00 H new ATOM 0 HD13 LEU B 267 14.505 5.391 4.445 1.00 0.00 H new ATOM 0 HD21 LEU B 267 14.469 7.203 1.975 1.00 0.00 H new ATOM 0 HD22 LEU B 267 14.767 5.449 1.961 1.00 0.00 H new ATOM 0 HD23 LEU B 267 13.480 6.141 0.945 1.00 0.00 H new ATOM 1606 N HIS B 268 9.127 3.898 2.989 1.00 0.00 N ATOM 1607 CA HIS B 268 8.102 2.917 2.531 1.00 0.00 C ATOM 1608 C HIS B 268 8.372 2.527 1.076 1.00 0.00 C ATOM 1609 O HIS B 268 8.750 3.347 0.264 1.00 0.00 O ATOM 1610 CB HIS B 268 6.707 3.540 2.631 1.00 0.00 C ATOM 1611 CG HIS B 268 6.457 4.016 4.036 1.00 0.00 C ATOM 1612 ND1 HIS B 268 6.934 5.233 4.502 1.00 0.00 N ATOM 1613 CD2 HIS B 268 5.767 3.457 5.084 1.00 0.00 C ATOM 1614 CE1 HIS B 268 6.527 5.366 5.779 1.00 0.00 C ATOM 1615 NE2 HIS B 268 5.812 4.312 6.177 1.00 0.00 N ATOM 0 H HIS B 268 8.890 4.878 2.834 1.00 0.00 H new ATOM 0 HA HIS B 268 8.154 2.031 3.164 1.00 0.00 H new ATOM 0 HB2 HIS B 268 6.621 4.374 1.935 1.00 0.00 H new ATOM 0 HB3 HIS B 268 5.951 2.808 2.346 1.00 0.00 H new ATOM 0 HD2 HIS B 268 5.267 2.500 5.061 1.00 0.00 H new ATOM 0 HE1 HIS B 268 6.751 6.219 6.403 1.00 0.00 H new ATOM 0 HE2 HIS B 268 5.387 4.165 7.093 1.00 0.00 H new ATOM 1624 N LEU B 269 8.172 1.278 0.744 1.00 0.00 N ATOM 1625 CA LEU B 269 8.409 0.826 -0.657 1.00 0.00 C ATOM 1626 C LEU B 269 7.067 0.528 -1.328 1.00 0.00 C ATOM 1627 O LEU B 269 6.268 -0.236 -0.824 1.00 0.00 O ATOM 1628 CB LEU B 269 9.265 -0.442 -0.647 1.00 0.00 C ATOM 1629 CG LEU B 269 9.693 -0.780 -2.077 1.00 0.00 C ATOM 1630 CD1 LEU B 269 10.880 0.095 -2.483 1.00 0.00 C ATOM 1631 CD2 LEU B 269 10.100 -2.252 -2.152 1.00 0.00 C ATOM 0 H LEU B 269 7.854 0.551 1.385 1.00 0.00 H new ATOM 0 HA LEU B 269 8.928 1.610 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU B 269 10.143 -0.296 -0.018 1.00 0.00 H new ATOM 0 HB3 LEU B 269 8.701 -1.271 -0.219 1.00 0.00 H new ATOM 0 HG LEU B 269 8.860 -0.594 -2.754 1.00 0.00 H new ATOM 0 HD11 LEU B 269 11.181 -0.150 -3.502 1.00 0.00 H new ATOM 0 HD12 LEU B 269 10.592 1.145 -2.432 1.00 0.00 H new ATOM 0 HD13 LEU B 269 11.714 -0.086 -1.805 1.00 0.00 H new ATOM 0 HD21 LEU B 269 10.405 -2.494 -3.170 1.00 0.00 H new ATOM 0 HD22 LEU B 269 10.931 -2.435 -1.471 1.00 0.00 H new ATOM 0 HD23 LEU B 269 9.254 -2.878 -1.868 1.00 0.00 H new ATOM 1643 N VAL B 270 6.815 1.127 -2.462 1.00 0.00 N ATOM 1644 CA VAL B 270 5.526 0.886 -3.171 1.00 0.00 C ATOM 1645 C VAL B 270 5.793 0.136 -4.478 1.00 0.00 C ATOM 1646 O VAL B 270 6.615 0.539 -5.278 1.00 0.00 O ATOM 1647 CB VAL B 270 4.863 2.229 -3.485 1.00 0.00 C ATOM 1648 CG1 VAL B 270 3.716 2.017 -4.474 1.00 0.00 C ATOM 1649 CG2 VAL B 270 4.312 2.837 -2.193 1.00 0.00 C ATOM 0 H VAL B 270 7.450 1.775 -2.929 1.00 0.00 H new ATOM 0 HA VAL B 270 4.869 0.290 -2.538 1.00 0.00 H new ATOM 0 HB VAL B 270 5.599 2.903 -3.923 1.00 0.00 H new ATOM 0 HG11 VAL B 270 3.245 2.975 -4.696 1.00 0.00 H new ATOM 0 HG12 VAL B 270 4.105 1.582 -5.394 1.00 0.00 H new ATOM 0 HG13 VAL B 270 2.979 1.343 -4.037 1.00 0.00 H new ATOM 0 HG21 VAL B 270 3.839 3.794 -2.414 1.00 0.00 H new ATOM 0 HG22 VAL B 270 3.576 2.161 -1.757 1.00 0.00 H new ATOM 0 HG23 VAL B 270 5.128 2.990 -1.486 1.00 0.00 H new ATOM 1659 N LEU B 271 5.110 -0.953 -4.706 1.00 0.00 N ATOM 1660 CA LEU B 271 5.334 -1.715 -5.966 1.00 0.00 C ATOM 1661 C LEU B 271 4.521 -1.085 -7.096 1.00 0.00 C ATOM 1662 O LEU B 271 3.426 -0.597 -6.894 1.00 0.00 O ATOM 1663 CB LEU B 271 4.913 -3.175 -5.776 1.00 0.00 C ATOM 1664 CG LEU B 271 5.987 -3.916 -4.975 1.00 0.00 C ATOM 1665 CD1 LEU B 271 5.492 -5.321 -4.631 1.00 0.00 C ATOM 1666 CD2 LEU B 271 7.272 -4.019 -5.806 1.00 0.00 C ATOM 0 H LEU B 271 4.410 -1.346 -4.077 1.00 0.00 H new ATOM 0 HA LEU B 271 6.393 -1.682 -6.221 1.00 0.00 H new ATOM 0 HB2 LEU B 271 3.957 -3.224 -5.255 1.00 0.00 H new ATOM 0 HB3 LEU B 271 4.772 -3.653 -6.745 1.00 0.00 H new ATOM 0 HG LEU B 271 6.192 -3.367 -4.056 1.00 0.00 H new ATOM 0 HD11 LEU B 271 6.258 -5.847 -4.061 1.00 0.00 H new ATOM 0 HD12 LEU B 271 4.581 -5.250 -4.036 1.00 0.00 H new ATOM 0 HD13 LEU B 271 5.284 -5.869 -5.550 1.00 0.00 H new ATOM 0 HD21 LEU B 271 8.034 -4.547 -5.233 1.00 0.00 H new ATOM 0 HD22 LEU B 271 7.067 -4.565 -6.727 1.00 0.00 H new ATOM 0 HD23 LEU B 271 7.629 -3.018 -6.049 1.00 0.00 H new ATOM 1678 N ARG B 272 5.060 -1.080 -8.281 1.00 0.00 N ATOM 1679 CA ARG B 272 4.343 -0.471 -9.436 1.00 0.00 C ATOM 1680 C ARG B 272 3.588 -1.577 -10.184 1.00 0.00 C ATOM 1681 O ARG B 272 2.979 -2.434 -9.576 1.00 0.00 O ATOM 1682 CB ARG B 272 5.389 0.174 -10.346 1.00 0.00 C ATOM 1683 CG ARG B 272 4.777 1.222 -11.276 1.00 0.00 C ATOM 1684 CD ARG B 272 5.926 2.056 -11.840 1.00 0.00 C ATOM 1685 NE ARG B 272 5.486 2.797 -13.052 1.00 0.00 N ATOM 1686 CZ ARG B 272 6.364 3.102 -13.969 1.00 0.00 C ATOM 1687 NH1 ARG B 272 7.624 2.808 -13.794 1.00 0.00 N ATOM 1688 NH2 ARG B 272 5.990 3.709 -15.057 1.00 0.00 N ATOM 0 H ARG B 272 5.974 -1.475 -8.502 1.00 0.00 H new ATOM 0 HA ARG B 272 3.627 0.283 -9.109 1.00 0.00 H new ATOM 0 HB2 ARG B 272 6.162 0.640 -9.735 1.00 0.00 H new ATOM 0 HB3 ARG B 272 5.876 -0.598 -10.942 1.00 0.00 H new ATOM 0 HG2 ARG B 272 4.219 0.743 -12.081 1.00 0.00 H new ATOM 0 HG3 ARG B 272 4.074 1.854 -10.733 1.00 0.00 H new ATOM 0 HD2 ARG B 272 6.278 2.759 -11.085 1.00 0.00 H new ATOM 0 HD3 ARG B 272 6.766 1.407 -12.088 1.00 0.00 H new ATOM 0 HE ARG B 272 4.508 3.064 -13.166 1.00 0.00 H new ATOM 0 HH11 ARG B 272 7.924 2.339 -12.939 1.00 0.00 H new ATOM 0 HH12 ARG B 272 8.308 3.047 -14.512 1.00 0.00 H new ATOM 0 HH21 ARG B 272 5.008 3.948 -15.196 1.00 0.00 H new ATOM 0 HH22 ARG B 272 6.679 3.946 -15.771 1.00 0.00 H new ATOM 1702 N LEU B 273 3.619 -1.564 -11.489 1.00 0.00 N ATOM 1703 CA LEU B 273 2.897 -2.611 -12.268 1.00 0.00 C ATOM 1704 C LEU B 273 3.882 -3.313 -13.204 1.00 0.00 C ATOM 1705 O LEU B 273 3.719 -4.471 -13.537 1.00 0.00 O ATOM 1706 CB LEU B 273 1.789 -1.955 -13.094 1.00 0.00 C ATOM 1707 CG LEU B 273 0.902 -1.101 -12.186 1.00 0.00 C ATOM 1708 CD1 LEU B 273 -0.138 -0.367 -13.034 1.00 0.00 C ATOM 1709 CD2 LEU B 273 0.186 -1.996 -11.171 1.00 0.00 C ATOM 0 H LEU B 273 4.114 -0.872 -12.051 1.00 0.00 H new ATOM 0 HA LEU B 273 2.459 -3.339 -11.585 1.00 0.00 H new ATOM 0 HB2 LEU B 273 2.225 -1.336 -13.878 1.00 0.00 H new ATOM 0 HB3 LEU B 273 1.190 -2.720 -13.588 1.00 0.00 H new ATOM 0 HG LEU B 273 1.522 -0.377 -11.657 1.00 0.00 H new ATOM 0 HD11 LEU B 273 -0.770 0.242 -12.388 1.00 0.00 H new ATOM 0 HD12 LEU B 273 0.368 0.275 -13.755 1.00 0.00 H new ATOM 0 HD13 LEU B 273 -0.754 -1.094 -13.564 1.00 0.00 H new ATOM 0 HD21 LEU B 273 -0.444 -1.383 -10.527 1.00 0.00 H new ATOM 0 HD22 LEU B 273 -0.432 -2.722 -11.699 1.00 0.00 H new ATOM 0 HD23 LEU B 273 0.924 -2.520 -10.564 1.00 0.00 H new ATOM 1721 N ARG B 274 4.901 -2.621 -13.632 1.00 0.00 N ATOM 1722 CA ARG B 274 5.897 -3.244 -14.549 1.00 0.00 C ATOM 1723 C ARG B 274 6.876 -4.096 -13.737 1.00 0.00 C ATOM 1724 O ARG B 274 6.882 -5.308 -13.828 1.00 0.00 O ATOM 1725 CB ARG B 274 6.666 -2.143 -15.285 1.00 0.00 C ATOM 1726 CG ARG B 274 6.691 -2.447 -16.784 1.00 0.00 C ATOM 1727 CD ARG B 274 7.462 -1.346 -17.515 1.00 0.00 C ATOM 1728 NE ARG B 274 8.903 -1.417 -17.141 1.00 0.00 N ATOM 1729 CZ ARG B 274 9.810 -0.923 -17.939 1.00 0.00 C ATOM 1730 NH1 ARG B 274 9.456 -0.366 -19.064 1.00 0.00 N ATOM 1731 NH2 ARG B 274 11.072 -0.986 -17.611 1.00 0.00 N ATOM 0 H ARG B 274 5.088 -1.649 -13.386 1.00 0.00 H new ATOM 0 HA ARG B 274 5.382 -3.876 -15.273 1.00 0.00 H new ATOM 0 HB2 ARG B 274 6.195 -1.176 -15.108 1.00 0.00 H new ATOM 0 HB3 ARG B 274 7.684 -2.077 -14.900 1.00 0.00 H new ATOM 0 HG2 ARG B 274 7.161 -3.414 -16.962 1.00 0.00 H new ATOM 0 HG3 ARG B 274 5.674 -2.511 -17.170 1.00 0.00 H new ATOM 0 HD2 ARG B 274 7.349 -1.462 -18.593 1.00 0.00 H new ATOM 0 HD3 ARG B 274 7.055 -0.369 -17.255 1.00 0.00 H new ATOM 0 HE ARG B 274 9.180 -1.852 -16.261 1.00 0.00 H new ATOM 0 HH11 ARG B 274 8.470 -0.316 -19.320 1.00 0.00 H new ATOM 0 HH12 ARG B 274 10.165 0.020 -19.687 1.00 0.00 H new ATOM 0 HH21 ARG B 274 11.349 -1.421 -16.731 1.00 0.00 H new ATOM 0 HH22 ARG B 274 11.781 -0.600 -18.235 1.00 0.00 H new TER 1745 ARG B 274