USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 797 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 ASN :FLIP amide:sc= -0.314 F(o=-0.9,f=-0.31) USER MOD Set 1.2: A 22 ASN :FLIP amide:sc= 0 F(o=-0.9,f=-0.31) USER MOD Single : A 1 MET CE :methyl -154:sc= 0 (180deg=-0.281) USER MOD Single : A 1 MET N :NH3+ 134:sc= 0.124 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= -0.886 USER MOD Single : A 8 SER OG : rot 60:sc= 1.62 USER MOD Single : A 12 LYS NZ :NH3+ 152:sc= 2.23 (180deg=1.58) USER MOD Single : A 14 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.15) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 152:sc= 1.28 (180deg=1.02) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -106:sc= 0.509 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 29 THR OG1 : rot 103:sc= 1.3 USER MOD Single : A 33 SER OG : rot 70:sc= 1.33 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc=-0.00315 K(o=-0.0031,f=-1.2) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 68:sc= 1.24 USER MOD Single : A 74 MET CE :methyl 145:sc= -1.6! (180deg=-3.78!) USER MOD Single : A 80 ASN : amide:sc= 0.0742 X(o=0.074,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 165:sc= -0.0564 (180deg=-0.283) USER MOD Single : A 92 ASN : amide:sc=-0.00673 X(o=-0.0067,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 110 SER OG : rot 59:sc= 1.09 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.169 -10.756 -10.244 1.00 0.00 N ATOM 2 CA MET A 1 0.892 -11.056 -8.849 1.00 0.00 C ATOM 3 C MET A 1 -0.344 -10.282 -8.451 1.00 0.00 C ATOM 4 O MET A 1 -0.584 -9.183 -8.984 1.00 0.00 O ATOM 5 CB MET A 1 2.090 -10.644 -7.975 1.00 0.00 C ATOM 6 CG MET A 1 1.980 -11.048 -6.510 1.00 0.00 C ATOM 7 SD MET A 1 3.393 -10.503 -5.532 1.00 0.00 S ATOM 8 CE MET A 1 3.007 -11.244 -3.945 1.00 0.00 C ATOM 0 H1 MET A 1 2.182 -10.551 -10.361 1.00 0.00 H new ATOM 0 H2 MET A 1 0.911 -11.574 -10.833 1.00 0.00 H new ATOM 0 H3 MET A 1 0.613 -9.928 -10.538 1.00 0.00 H new ATOM 0 HA MET A 1 0.728 -12.125 -8.710 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.995 -11.085 -8.392 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.208 -9.562 -8.031 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.067 -10.627 -6.089 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.892 -12.132 -6.442 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.478 -10.666 -3.150 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.927 -11.250 -3.799 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.382 -12.267 -3.920 1.00 0.00 H new ATOM 20 N PHE A 2 -1.135 -10.833 -7.562 1.00 0.00 N ATOM 21 CA PHE A 2 -2.325 -10.167 -7.112 1.00 0.00 C ATOM 22 C PHE A 2 -1.990 -9.270 -5.946 1.00 0.00 C ATOM 23 O PHE A 2 -1.086 -9.569 -5.158 1.00 0.00 O ATOM 24 CB PHE A 2 -3.410 -11.170 -6.686 1.00 0.00 C ATOM 25 CG PHE A 2 -3.931 -12.050 -7.790 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.745 -11.526 -8.774 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.613 -13.397 -7.837 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.235 -12.322 -9.786 1.00 0.00 C ATOM 29 CE2 PHE A 2 -4.102 -14.199 -8.849 1.00 0.00 C ATOM 30 CZ PHE A 2 -4.913 -13.659 -9.825 1.00 0.00 C ATOM 0 H PHE A 2 -0.972 -11.745 -7.136 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.714 -9.579 -7.943 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.008 -11.804 -5.896 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.246 -10.618 -6.257 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.001 -10.477 -8.750 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.977 -13.824 -7.076 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -5.871 -11.897 -10.548 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -3.849 -15.249 -8.876 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.295 -14.284 -10.618 1.00 0.00 H new ATOM 40 N ALA A 3 -2.682 -8.182 -5.858 1.00 0.00 N ATOM 41 CA ALA A 3 -2.543 -7.263 -4.777 1.00 0.00 C ATOM 42 C ALA A 3 -3.907 -7.031 -4.189 1.00 0.00 C ATOM 43 O ALA A 3 -4.769 -6.441 -4.823 1.00 0.00 O ATOM 44 CB ALA A 3 -1.922 -5.957 -5.251 1.00 0.00 C ATOM 0 H ALA A 3 -3.375 -7.901 -6.551 1.00 0.00 H new ATOM 0 HA ALA A 3 -1.876 -7.674 -4.019 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.826 -5.273 -4.408 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.936 -6.155 -5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.558 -5.507 -6.013 1.00 0.00 H new ATOM 50 N VAL A 4 -4.109 -7.506 -3.006 1.00 0.00 N ATOM 51 CA VAL A 4 -5.391 -7.400 -2.367 1.00 0.00 C ATOM 52 C VAL A 4 -5.427 -6.132 -1.541 1.00 0.00 C ATOM 53 O VAL A 4 -4.533 -5.870 -0.727 1.00 0.00 O ATOM 54 CB VAL A 4 -5.707 -8.639 -1.478 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.096 -8.530 -0.847 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.600 -9.922 -2.292 1.00 0.00 C ATOM 0 H VAL A 4 -3.396 -7.979 -2.450 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.158 -7.363 -3.141 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.971 -8.667 -0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.287 -9.410 -0.233 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.144 -7.636 -0.225 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.849 -8.466 -1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.824 -10.777 -1.654 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.310 -9.889 -3.118 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.589 -10.019 -2.687 1.00 0.00 H new ATOM 66 N ILE A 5 -6.417 -5.342 -1.790 1.00 0.00 N ATOM 67 CA ILE A 5 -6.586 -4.090 -1.129 1.00 0.00 C ATOM 68 C ILE A 5 -7.481 -4.290 0.081 1.00 0.00 C ATOM 69 O ILE A 5 -8.563 -4.856 -0.032 1.00 0.00 O ATOM 70 CB ILE A 5 -7.248 -3.057 -2.086 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.436 -2.943 -3.389 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.350 -1.694 -1.408 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.060 -2.039 -4.433 1.00 0.00 C ATOM 0 H ILE A 5 -7.146 -5.552 -2.472 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.610 -3.713 -0.822 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.253 -3.401 -2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.439 -2.571 -3.151 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.311 -3.939 -3.815 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.815 -0.982 -2.090 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.955 -1.781 -0.506 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.352 -1.344 -1.143 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.425 -2.014 -5.319 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.045 -2.420 -4.703 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.159 -1.031 -4.029 1.00 0.00 H new ATOM 85 N SER A 6 -7.018 -3.887 1.226 1.00 0.00 N ATOM 86 CA SER A 6 -7.827 -3.943 2.407 1.00 0.00 C ATOM 87 C SER A 6 -8.599 -2.629 2.524 1.00 0.00 C ATOM 88 O SER A 6 -8.137 -1.605 2.004 1.00 0.00 O ATOM 89 CB SER A 6 -6.923 -4.133 3.621 1.00 0.00 C ATOM 90 OG SER A 6 -6.082 -5.246 3.428 1.00 0.00 O ATOM 0 H SER A 6 -6.079 -3.514 1.368 1.00 0.00 H new ATOM 0 HA SER A 6 -8.528 -4.776 2.355 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.323 -3.237 3.781 1.00 0.00 H new ATOM 0 HB3 SER A 6 -7.528 -4.275 4.516 1.00 0.00 H new ATOM 0 HG SER A 6 -5.504 -5.359 4.211 1.00 0.00 H new ATOM 96 N PRO A 7 -9.792 -2.629 3.165 1.00 0.00 N ATOM 97 CA PRO A 7 -10.569 -1.398 3.446 1.00 0.00 C ATOM 98 C PRO A 7 -9.702 -0.320 4.123 1.00 0.00 C ATOM 99 O PRO A 7 -9.958 0.887 4.000 1.00 0.00 O ATOM 100 CB PRO A 7 -11.653 -1.887 4.399 1.00 0.00 C ATOM 101 CG PRO A 7 -11.865 -3.303 4.006 1.00 0.00 C ATOM 102 CD PRO A 7 -10.511 -3.833 3.628 1.00 0.00 C ATOM 0 HA PRO A 7 -10.958 -0.931 2.541 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.337 -1.804 5.439 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.568 -1.303 4.296 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.293 -3.876 4.828 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.560 -3.376 3.170 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -10.010 -4.299 4.477 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.579 -4.587 2.844 1.00 0.00 H new ATOM 110 N SER A 8 -8.697 -0.778 4.840 1.00 0.00 N ATOM 111 CA SER A 8 -7.671 0.043 5.445 1.00 0.00 C ATOM 112 C SER A 8 -7.028 1.004 4.416 1.00 0.00 C ATOM 113 O SER A 8 -6.736 2.159 4.727 1.00 0.00 O ATOM 114 CB SER A 8 -6.591 -0.888 6.017 1.00 0.00 C ATOM 115 OG SER A 8 -5.626 -0.174 6.740 1.00 0.00 O ATOM 0 H SER A 8 -8.568 -1.773 5.024 1.00 0.00 H new ATOM 0 HA SER A 8 -8.122 0.652 6.228 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.056 -1.631 6.665 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.109 -1.431 5.204 1.00 0.00 H new ATOM 0 HG SER A 8 -6.057 0.296 7.484 1.00 0.00 H new ATOM 121 N ALA A 9 -6.872 0.534 3.190 1.00 0.00 N ATOM 122 CA ALA A 9 -6.193 1.281 2.148 1.00 0.00 C ATOM 123 C ALA A 9 -7.165 2.158 1.359 1.00 0.00 C ATOM 124 O ALA A 9 -6.803 2.772 0.349 1.00 0.00 O ATOM 125 CB ALA A 9 -5.467 0.315 1.225 1.00 0.00 C ATOM 0 H ALA A 9 -7.214 -0.379 2.890 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.469 1.947 2.616 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.956 0.875 0.441 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.736 -0.256 1.798 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.187 -0.367 0.773 1.00 0.00 H new ATOM 131 N PHE A 10 -8.393 2.214 1.805 1.00 0.00 N ATOM 132 CA PHE A 10 -9.369 3.043 1.168 1.00 0.00 C ATOM 133 C PHE A 10 -9.217 4.483 1.580 1.00 0.00 C ATOM 134 O PHE A 10 -9.032 4.796 2.760 1.00 0.00 O ATOM 135 CB PHE A 10 -10.778 2.548 1.407 1.00 0.00 C ATOM 136 CG PHE A 10 -11.170 1.459 0.463 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.489 0.272 0.445 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.205 1.645 -0.429 1.00 0.00 C ATOM 139 CE1 PHE A 10 -10.830 -0.722 -0.433 1.00 0.00 C ATOM 140 CE2 PHE A 10 -12.555 0.655 -1.317 1.00 0.00 C ATOM 141 CZ PHE A 10 -11.870 -0.532 -1.318 1.00 0.00 C ATOM 0 H PHE A 10 -8.737 1.691 2.610 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.188 2.982 0.095 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.863 2.185 2.431 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.474 3.381 1.305 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.671 0.117 1.133 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -12.747 2.579 -0.430 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.285 -1.654 -0.432 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -13.367 0.812 -2.011 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.144 -1.315 -2.009 1.00 0.00 H new ATOM 151 N GLY A 11 -9.273 5.329 0.600 1.00 0.00 N ATOM 152 CA GLY A 11 -9.104 6.753 0.763 1.00 0.00 C ATOM 153 C GLY A 11 -7.884 7.202 0.001 1.00 0.00 C ATOM 154 O GLY A 11 -7.895 8.231 -0.655 1.00 0.00 O ATOM 0 H GLY A 11 -9.442 5.048 -0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -9.987 7.279 0.400 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -8.998 6.999 1.819 1.00 0.00 H new ATOM 158 N LYS A 12 -6.871 6.354 -0.001 1.00 0.00 N ATOM 159 CA LYS A 12 -5.679 6.553 -0.815 1.00 0.00 C ATOM 160 C LYS A 12 -5.677 5.503 -1.912 1.00 0.00 C ATOM 161 O LYS A 12 -4.677 5.258 -2.589 1.00 0.00 O ATOM 162 CB LYS A 12 -4.447 6.435 0.054 1.00 0.00 C ATOM 163 CG LYS A 12 -4.368 7.503 1.117 1.00 0.00 C ATOM 164 CD LYS A 12 -3.329 7.187 2.161 1.00 0.00 C ATOM 165 CE LYS A 12 -1.885 7.251 1.643 1.00 0.00 C ATOM 166 NZ LYS A 12 -1.493 8.596 1.160 1.00 0.00 N ATOM 0 H LYS A 12 -6.849 5.504 0.563 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.677 7.546 -1.265 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -4.439 5.455 0.531 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.559 6.491 -0.576 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.134 8.461 0.652 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.341 7.610 1.596 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -3.438 7.885 2.991 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.518 6.189 2.557 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -1.207 6.947 2.440 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.765 6.533 0.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.467 8.720 1.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -1.745 8.691 0.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -1.992 9.322 1.712 1.00 0.00 H new ATOM 180 N LEU A 13 -6.850 4.911 -2.078 1.00 0.00 N ATOM 181 CA LEU A 13 -7.160 3.896 -3.070 1.00 0.00 C ATOM 182 C LEU A 13 -6.773 4.369 -4.474 1.00 0.00 C ATOM 183 O LEU A 13 -6.248 3.608 -5.281 1.00 0.00 O ATOM 184 CB LEU A 13 -8.669 3.647 -3.017 1.00 0.00 C ATOM 185 CG LEU A 13 -9.221 2.547 -3.907 1.00 0.00 C ATOM 186 CD1 LEU A 13 -8.712 1.199 -3.451 1.00 0.00 C ATOM 187 CD2 LEU A 13 -10.736 2.586 -3.912 1.00 0.00 C ATOM 0 H LEU A 13 -7.653 5.139 -1.492 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.600 2.986 -2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.937 3.415 -1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.175 4.577 -3.276 1.00 0.00 H new ATOM 0 HG LEU A 13 -8.875 2.711 -4.928 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.116 0.420 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.623 1.185 -3.502 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -9.030 1.019 -2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.118 1.792 -4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -11.107 2.442 -2.897 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.074 3.551 -4.289 1.00 0.00 H new ATOM 199 N LYS A 14 -7.016 5.642 -4.729 1.00 0.00 N ATOM 200 CA LYS A 14 -6.733 6.247 -6.013 1.00 0.00 C ATOM 201 C LYS A 14 -5.226 6.252 -6.292 1.00 0.00 C ATOM 202 O LYS A 14 -4.798 6.010 -7.431 1.00 0.00 O ATOM 203 CB LYS A 14 -7.308 7.673 -6.066 1.00 0.00 C ATOM 204 CG LYS A 14 -8.825 7.743 -5.870 1.00 0.00 C ATOM 205 CD LYS A 14 -9.335 9.181 -5.902 1.00 0.00 C ATOM 206 CE LYS A 14 -10.849 9.266 -5.647 1.00 0.00 C ATOM 207 NZ LYS A 14 -11.660 8.618 -6.709 1.00 0.00 N ATOM 0 H LYS A 14 -7.417 6.286 -4.047 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.213 5.653 -6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.825 8.277 -5.298 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.056 8.119 -7.028 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.319 7.165 -6.650 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.090 7.285 -4.917 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -8.808 9.768 -5.150 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.106 9.624 -6.871 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -11.076 8.798 -4.689 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.139 10.314 -5.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -12.671 8.768 -6.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.420 9.034 -7.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.459 7.598 -6.726 1.00 0.00 H new ATOM 221 N GLU A 15 -4.433 6.451 -5.237 1.00 0.00 N ATOM 222 CA GLU A 15 -2.987 6.514 -5.352 1.00 0.00 C ATOM 223 C GLU A 15 -2.418 5.151 -5.705 1.00 0.00 C ATOM 224 O GLU A 15 -1.722 5.012 -6.687 1.00 0.00 O ATOM 225 CB GLU A 15 -2.343 7.037 -4.056 1.00 0.00 C ATOM 226 CG GLU A 15 -2.825 8.415 -3.639 1.00 0.00 C ATOM 227 CD GLU A 15 -2.101 8.966 -2.433 1.00 0.00 C ATOM 228 OE1 GLU A 15 -1.013 9.541 -2.602 1.00 0.00 O ATOM 229 OE2 GLU A 15 -2.623 8.880 -1.302 1.00 0.00 O ATOM 0 H GLU A 15 -4.780 6.572 -4.285 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.751 7.214 -6.154 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.549 6.332 -3.250 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.261 7.066 -4.186 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.699 9.104 -4.475 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.892 8.368 -3.422 1.00 0.00 H new ATOM 236 N ILE A 16 -2.759 4.139 -4.928 1.00 0.00 N ATOM 237 CA ILE A 16 -2.220 2.794 -5.162 1.00 0.00 C ATOM 238 C ILE A 16 -2.598 2.253 -6.527 1.00 0.00 C ATOM 239 O ILE A 16 -1.766 1.690 -7.241 1.00 0.00 O ATOM 240 CB ILE A 16 -2.619 1.780 -4.056 1.00 0.00 C ATOM 241 CG1 ILE A 16 -4.148 1.691 -3.884 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.978 2.188 -2.771 1.00 0.00 C ATOM 243 CD1 ILE A 16 -4.610 0.711 -2.825 1.00 0.00 C ATOM 0 H ILE A 16 -3.398 4.211 -4.136 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.137 2.910 -5.127 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.271 0.791 -4.352 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.530 2.681 -3.635 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.592 1.409 -4.839 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -2.252 1.482 -1.987 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.895 2.195 -2.891 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.319 3.186 -2.495 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.699 0.716 -2.775 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -4.263 -0.290 -3.080 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -4.201 1.001 -1.857 1.00 0.00 H new ATOM 255 N LEU A 17 -3.823 2.493 -6.902 1.00 0.00 N ATOM 256 CA LEU A 17 -4.354 2.004 -8.132 1.00 0.00 C ATOM 257 C LEU A 17 -3.719 2.700 -9.335 1.00 0.00 C ATOM 258 O LEU A 17 -3.122 2.039 -10.199 1.00 0.00 O ATOM 259 CB LEU A 17 -5.866 2.203 -8.113 1.00 0.00 C ATOM 260 CG LEU A 17 -6.653 1.767 -9.338 1.00 0.00 C ATOM 261 CD1 LEU A 17 -6.439 0.294 -9.627 1.00 0.00 C ATOM 262 CD2 LEU A 17 -8.117 2.049 -9.108 1.00 0.00 C ATOM 0 H LEU A 17 -4.484 3.041 -6.352 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.122 0.944 -8.232 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -6.264 1.667 -7.251 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -6.062 3.262 -7.948 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.302 2.328 -10.204 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.014 0.009 -10.508 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.380 0.109 -9.809 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -6.769 -0.296 -8.772 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.689 1.739 -9.983 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.461 1.496 -8.234 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -8.260 3.117 -8.941 1.00 0.00 H new ATOM 274 N GLY A 18 -3.782 4.017 -9.355 1.00 0.00 N ATOM 275 CA GLY A 18 -3.339 4.735 -10.520 1.00 0.00 C ATOM 276 C GLY A 18 -1.865 5.044 -10.546 1.00 0.00 C ATOM 277 O GLY A 18 -1.245 4.980 -11.611 1.00 0.00 O ATOM 0 H GLY A 18 -4.129 4.597 -8.591 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.590 4.152 -11.406 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.894 5.671 -10.586 1.00 0.00 H new ATOM 281 N SER A 19 -1.277 5.295 -9.406 1.00 0.00 N ATOM 282 CA SER A 19 0.111 5.698 -9.379 1.00 0.00 C ATOM 283 C SER A 19 1.055 4.500 -9.410 1.00 0.00 C ATOM 284 O SER A 19 2.198 4.614 -9.867 1.00 0.00 O ATOM 285 CB SER A 19 0.386 6.582 -8.166 1.00 0.00 C ATOM 286 OG SER A 19 -0.503 7.701 -8.137 1.00 0.00 O ATOM 0 H SER A 19 -1.727 5.230 -8.493 1.00 0.00 H new ATOM 0 HA SER A 19 0.304 6.277 -10.282 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.272 5.998 -7.253 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.418 6.933 -8.193 1.00 0.00 H new ATOM 0 HG SER A 19 -0.309 8.252 -7.350 1.00 0.00 H new ATOM 292 N ASN A 20 0.597 3.348 -8.940 1.00 0.00 N ATOM 293 CA ASN A 20 1.459 2.179 -8.965 1.00 0.00 C ATOM 294 C ASN A 20 1.181 1.302 -10.160 1.00 0.00 C ATOM 295 O ASN A 20 2.056 1.140 -11.009 1.00 0.00 O ATOM 296 CB ASN A 20 1.359 1.340 -7.683 1.00 0.00 C ATOM 297 CG ASN A 20 2.227 0.068 -7.733 1.00 0.00 C ATOM 298 OD1 ASN A 20 1.768 -0.982 -7.117 1.00 0.00 O flip ATOM 299 ND2 ASN A 20 3.279 0.031 -8.341 1.00 0.00 N flip ATOM 0 H ASN A 20 -0.334 3.200 -8.550 1.00 0.00 H new ATOM 0 HA ASN A 20 2.475 2.568 -9.037 1.00 0.00 H new ATOM 0 HB2 ASN A 20 1.663 1.949 -6.831 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.319 1.058 -7.519 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.622 0.865 -8.818 1.00 0.00 H new ATOM 0 HD22 ASN A 20 3.819 -0.834 -8.375 1.00 0.00 H new ATOM 306 N LYS A 21 -0.066 0.803 -10.275 1.00 0.00 N ATOM 307 CA LYS A 21 -0.403 -0.232 -11.266 1.00 0.00 C ATOM 308 C LYS A 21 0.506 -1.463 -10.994 1.00 0.00 C ATOM 309 O LYS A 21 0.697 -1.821 -9.838 1.00 0.00 O ATOM 310 CB LYS A 21 -0.247 0.288 -12.717 1.00 0.00 C ATOM 311 CG LYS A 21 -1.067 1.534 -13.032 1.00 0.00 C ATOM 312 CD LYS A 21 -0.986 1.873 -14.509 1.00 0.00 C ATOM 313 CE LYS A 21 -1.697 3.182 -14.844 1.00 0.00 C ATOM 314 NZ LYS A 21 -1.030 4.357 -14.247 1.00 0.00 N ATOM 0 H LYS A 21 -0.851 1.100 -9.696 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.451 -0.515 -11.165 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.805 0.505 -12.901 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.535 -0.505 -13.407 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.107 1.372 -12.748 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.702 2.374 -12.441 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.060 1.944 -14.806 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.428 1.063 -15.090 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.738 3.303 -15.927 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.727 3.134 -14.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.212 5.195 -14.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.402 4.518 -13.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.005 4.186 -14.196 1.00 0.00 H new ATOM 328 N ASN A 22 0.998 -2.130 -12.044 1.00 0.00 N ATOM 329 CA ASN A 22 1.970 -3.284 -11.952 1.00 0.00 C ATOM 330 C ASN A 22 1.387 -4.564 -11.356 1.00 0.00 C ATOM 331 O ASN A 22 1.983 -5.642 -11.495 1.00 0.00 O ATOM 332 CB ASN A 22 3.255 -2.958 -11.132 1.00 0.00 C ATOM 333 CG ASN A 22 4.201 -1.955 -11.745 1.00 0.00 C ATOM 334 OD1 ASN A 22 4.131 -0.731 -11.308 1.00 0.00 O flip ATOM 335 ND2 ASN A 22 5.046 -2.311 -12.563 1.00 0.00 N flip ATOM 0 H ASN A 22 0.744 -1.900 -13.005 1.00 0.00 H new ATOM 0 HA ASN A 22 2.216 -3.449 -13.001 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.952 -2.588 -10.153 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.801 -3.887 -10.967 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.070 -3.279 -12.883 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.723 -1.638 -12.922 1.00 0.00 H new ATOM 342 N TYR A 23 0.255 -4.478 -10.727 1.00 0.00 N ATOM 343 CA TYR A 23 -0.330 -5.611 -10.054 1.00 0.00 C ATOM 344 C TYR A 23 -1.790 -5.686 -10.362 1.00 0.00 C ATOM 345 O TYR A 23 -2.385 -4.702 -10.823 1.00 0.00 O ATOM 346 CB TYR A 23 -0.149 -5.496 -8.519 1.00 0.00 C ATOM 347 CG TYR A 23 1.290 -5.498 -8.035 1.00 0.00 C ATOM 348 CD1 TYR A 23 2.024 -4.320 -7.960 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.912 -6.680 -7.666 1.00 0.00 C ATOM 350 CE1 TYR A 23 3.336 -4.319 -7.539 1.00 0.00 C ATOM 351 CE2 TYR A 23 3.224 -6.687 -7.234 1.00 0.00 C ATOM 352 CZ TYR A 23 3.932 -5.504 -7.176 1.00 0.00 C ATOM 353 OH TYR A 23 5.251 -5.511 -6.775 1.00 0.00 O ATOM 0 H TYR A 23 -0.295 -3.621 -10.662 1.00 0.00 H new ATOM 0 HA TYR A 23 0.175 -6.510 -10.407 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.628 -4.577 -8.181 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.676 -6.324 -8.044 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.557 -3.387 -8.237 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.363 -7.609 -7.717 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.892 -3.394 -7.494 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.694 -7.615 -6.943 1.00 0.00 H new ATOM 0 HH TYR A 23 5.520 -6.426 -6.551 1.00 0.00 H new ATOM 363 N LYS A 24 -2.365 -6.832 -10.127 1.00 0.00 N ATOM 364 CA LYS A 24 -3.775 -7.002 -10.280 1.00 0.00 C ATOM 365 C LYS A 24 -4.417 -6.763 -8.941 1.00 0.00 C ATOM 366 O LYS A 24 -4.252 -7.556 -8.010 1.00 0.00 O ATOM 367 CB LYS A 24 -4.117 -8.394 -10.840 1.00 0.00 C ATOM 368 CG LYS A 24 -5.619 -8.724 -10.878 1.00 0.00 C ATOM 369 CD LYS A 24 -6.454 -7.685 -11.630 1.00 0.00 C ATOM 370 CE LYS A 24 -6.068 -7.570 -13.089 1.00 0.00 C ATOM 371 NZ LYS A 24 -6.898 -6.577 -13.784 1.00 0.00 N ATOM 0 H LYS A 24 -1.868 -7.670 -9.825 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.162 -6.285 -11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.717 -8.472 -11.851 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.609 -9.147 -10.237 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.757 -9.698 -11.347 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.991 -8.807 -9.857 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.509 -7.951 -11.557 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.336 -6.714 -11.150 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -5.018 -7.289 -13.168 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.176 -8.540 -13.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.583 -7.064 -14.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.407 -6.000 -13.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.292 -5.963 -14.364 1.00 0.00 H new ATOM 385 N PHE A 25 -5.091 -5.661 -8.836 1.00 0.00 N ATOM 386 CA PHE A 25 -5.699 -5.264 -7.605 1.00 0.00 C ATOM 387 C PHE A 25 -6.996 -6.013 -7.378 1.00 0.00 C ATOM 388 O PHE A 25 -7.880 -6.045 -8.241 1.00 0.00 O ATOM 389 CB PHE A 25 -5.910 -3.759 -7.578 1.00 0.00 C ATOM 390 CG PHE A 25 -4.631 -2.964 -7.647 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.866 -2.751 -6.516 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.198 -2.433 -8.845 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.690 -2.024 -6.586 1.00 0.00 C ATOM 394 CE2 PHE A 25 -3.031 -1.709 -8.920 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.274 -1.504 -7.790 1.00 0.00 C ATOM 0 H PHE A 25 -5.236 -5.008 -9.606 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.027 -5.521 -6.786 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.548 -3.476 -8.415 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.444 -3.493 -6.666 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.189 -3.156 -5.568 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.785 -2.588 -9.738 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -2.099 -1.865 -5.696 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.709 -1.301 -9.867 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.357 -0.937 -7.848 1.00 0.00 H new ATOM 405 N VAL A 26 -7.083 -6.636 -6.244 1.00 0.00 N ATOM 406 CA VAL A 26 -8.220 -7.425 -5.864 1.00 0.00 C ATOM 407 C VAL A 26 -8.859 -6.814 -4.629 1.00 0.00 C ATOM 408 O VAL A 26 -8.161 -6.424 -3.691 1.00 0.00 O ATOM 409 CB VAL A 26 -7.800 -8.896 -5.543 1.00 0.00 C ATOM 410 CG1 VAL A 26 -9.005 -9.765 -5.206 1.00 0.00 C ATOM 411 CG2 VAL A 26 -7.007 -9.507 -6.687 1.00 0.00 C ATOM 0 H VAL A 26 -6.348 -6.611 -5.537 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.926 -7.437 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.158 -8.859 -4.663 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.672 -10.780 -4.989 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.516 -9.356 -4.334 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.690 -9.781 -6.054 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.730 -10.530 -6.432 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.616 -9.510 -7.591 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.105 -8.919 -6.859 1.00 0.00 H new ATOM 421 N ILE A 27 -10.150 -6.705 -4.643 1.00 0.00 N ATOM 422 CA ILE A 27 -10.888 -6.214 -3.518 1.00 0.00 C ATOM 423 C ILE A 27 -11.874 -7.306 -3.098 1.00 0.00 C ATOM 424 O ILE A 27 -12.243 -8.151 -3.920 1.00 0.00 O ATOM 425 CB ILE A 27 -11.624 -4.870 -3.853 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.288 -4.258 -2.614 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.656 -5.067 -4.952 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.332 -3.988 -1.478 1.00 0.00 C ATOM 0 H ILE A 27 -10.729 -6.957 -5.444 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.209 -5.987 -2.696 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.863 -4.175 -4.207 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.773 -3.324 -2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.072 -4.930 -2.264 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.149 -4.118 -5.162 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.162 -5.427 -5.855 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.397 -5.798 -4.628 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.877 -3.556 -0.639 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.865 -4.922 -1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.562 -3.291 -1.808 1.00 0.00 H new ATOM 440 N THR A 28 -12.251 -7.320 -1.856 1.00 0.00 N ATOM 441 CA THR A 28 -13.114 -8.335 -1.341 1.00 0.00 C ATOM 442 C THR A 28 -14.580 -7.878 -1.306 1.00 0.00 C ATOM 443 O THR A 28 -14.898 -6.710 -1.619 1.00 0.00 O ATOM 444 CB THR A 28 -12.649 -8.712 0.060 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.598 -7.529 0.879 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.275 -9.345 0.015 1.00 0.00 C ATOM 0 H THR A 28 -11.966 -6.623 -1.168 1.00 0.00 H new ATOM 0 HA THR A 28 -13.063 -9.200 -2.002 1.00 0.00 H new ATOM 0 HB THR A 28 -13.353 -9.430 0.480 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.301 -7.769 1.782 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.962 -9.607 1.026 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.309 -10.245 -0.599 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.563 -8.640 -0.414 1.00 0.00 H new ATOM 454 N THR A 29 -15.458 -8.776 -0.906 1.00 0.00 N ATOM 455 CA THR A 29 -16.869 -8.526 -0.818 1.00 0.00 C ATOM 456 C THR A 29 -17.205 -7.504 0.265 1.00 0.00 C ATOM 457 O THR A 29 -18.019 -6.588 0.057 1.00 0.00 O ATOM 458 CB THR A 29 -17.584 -9.840 -0.548 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.580 -10.865 -0.279 1.00 0.00 O ATOM 460 CG2 THR A 29 -18.412 -10.229 -1.759 1.00 0.00 C ATOM 0 H THR A 29 -15.196 -9.722 -0.628 1.00 0.00 H new ATOM 0 HA THR A 29 -17.204 -8.103 -1.765 1.00 0.00 H new ATOM 0 HB THR A 29 -18.248 -9.738 0.310 1.00 0.00 H new ATOM 0 HG1 THR A 29 -16.536 -11.035 0.685 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.923 -11.171 -1.563 1.00 0.00 H new ATOM 0 HG22 THR A 29 -19.149 -9.452 -1.961 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.759 -10.344 -2.624 1.00 0.00 H new ATOM 468 N LEU A 30 -16.566 -7.625 1.402 1.00 0.00 N ATOM 469 CA LEU A 30 -16.776 -6.688 2.472 1.00 0.00 C ATOM 470 C LEU A 30 -16.052 -5.393 2.142 1.00 0.00 C ATOM 471 O LEU A 30 -16.445 -4.321 2.589 1.00 0.00 O ATOM 472 CB LEU A 30 -16.307 -7.262 3.811 1.00 0.00 C ATOM 473 CG LEU A 30 -16.988 -8.563 4.267 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.406 -9.035 5.586 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.492 -8.375 4.396 1.00 0.00 C ATOM 0 H LEU A 30 -15.895 -8.365 1.608 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.843 -6.487 2.571 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.233 -7.440 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.462 -6.506 4.581 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.801 -9.323 3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.900 -9.957 5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.338 -9.218 5.468 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.561 -8.270 6.347 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -18.949 -9.310 4.720 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.700 -7.596 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.906 -8.084 3.431 1.00 0.00 H new ATOM 487 N GLY A 31 -15.025 -5.508 1.306 1.00 0.00 N ATOM 488 CA GLY A 31 -14.277 -4.360 0.848 1.00 0.00 C ATOM 489 C GLY A 31 -15.132 -3.450 -0.008 1.00 0.00 C ATOM 490 O GLY A 31 -15.199 -2.240 0.229 1.00 0.00 O ATOM 0 H GLY A 31 -14.695 -6.398 0.933 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -13.898 -3.805 1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.411 -4.693 0.276 1.00 0.00 H new ATOM 494 N VAL A 32 -15.817 -4.031 -0.992 1.00 0.00 N ATOM 495 CA VAL A 32 -16.711 -3.249 -1.838 1.00 0.00 C ATOM 496 C VAL A 32 -17.906 -2.729 -1.039 1.00 0.00 C ATOM 497 O VAL A 32 -18.398 -1.639 -1.292 1.00 0.00 O ATOM 498 CB VAL A 32 -17.190 -3.997 -3.128 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.019 -4.346 -4.015 1.00 0.00 C ATOM 500 CG2 VAL A 32 -17.990 -5.245 -2.806 1.00 0.00 C ATOM 0 H VAL A 32 -15.771 -5.024 -1.219 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.117 -2.405 -2.188 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.849 -3.312 -3.661 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.378 -4.865 -4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.502 -3.433 -4.311 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.330 -4.992 -3.471 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.299 -5.728 -3.733 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.374 -5.933 -2.226 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -18.872 -4.972 -2.227 1.00 0.00 H new ATOM 510 N SER A 33 -18.336 -3.497 -0.041 1.00 0.00 N ATOM 511 CA SER A 33 -19.429 -3.077 0.823 1.00 0.00 C ATOM 512 C SER A 33 -19.002 -1.851 1.642 1.00 0.00 C ATOM 513 O SER A 33 -19.773 -0.895 1.801 1.00 0.00 O ATOM 514 CB SER A 33 -19.855 -4.229 1.745 1.00 0.00 C ATOM 515 OG SER A 33 -20.257 -5.381 0.984 1.00 0.00 O ATOM 0 H SER A 33 -17.944 -4.411 0.187 1.00 0.00 H new ATOM 0 HA SER A 33 -20.286 -2.803 0.207 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.029 -4.495 2.404 1.00 0.00 H new ATOM 0 HB3 SER A 33 -20.679 -3.904 2.381 1.00 0.00 H new ATOM 0 HG SER A 33 -19.471 -5.781 0.556 1.00 0.00 H new ATOM 521 N PHE A 34 -17.751 -1.879 2.114 1.00 0.00 N ATOM 522 CA PHE A 34 -17.156 -0.784 2.865 1.00 0.00 C ATOM 523 C PHE A 34 -17.154 0.479 2.017 1.00 0.00 C ATOM 524 O PHE A 34 -17.523 1.558 2.484 1.00 0.00 O ATOM 525 CB PHE A 34 -15.718 -1.156 3.276 1.00 0.00 C ATOM 526 CG PHE A 34 -14.984 -0.094 4.047 1.00 0.00 C ATOM 527 CD1 PHE A 34 -15.137 0.006 5.414 1.00 0.00 C ATOM 528 CD2 PHE A 34 -14.138 0.801 3.401 1.00 0.00 C ATOM 529 CE1 PHE A 34 -14.465 0.973 6.128 1.00 0.00 C ATOM 530 CE2 PHE A 34 -13.463 1.771 4.111 1.00 0.00 C ATOM 531 CZ PHE A 34 -13.627 1.858 5.477 1.00 0.00 C ATOM 0 H PHE A 34 -17.123 -2.672 1.981 1.00 0.00 H new ATOM 0 HA PHE A 34 -17.742 -0.601 3.765 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -15.751 -2.064 3.878 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.148 -1.391 2.377 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -15.791 -0.681 5.930 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.008 0.735 2.331 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -14.593 1.040 7.198 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -12.808 2.460 3.599 1.00 0.00 H new ATOM 0 HZ PHE A 34 -13.101 2.617 6.038 1.00 0.00 H new ATOM 541 N ALA A 35 -16.770 0.325 0.766 1.00 0.00 N ATOM 542 CA ALA A 35 -16.718 1.424 -0.170 1.00 0.00 C ATOM 543 C ALA A 35 -18.093 2.037 -0.389 1.00 0.00 C ATOM 544 O ALA A 35 -18.229 3.253 -0.415 1.00 0.00 O ATOM 545 CB ALA A 35 -16.127 0.972 -1.481 1.00 0.00 C ATOM 0 H ALA A 35 -16.484 -0.571 0.371 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.077 2.194 0.258 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.095 1.812 -2.175 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.116 0.600 -1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.742 0.177 -1.902 1.00 0.00 H new ATOM 551 N ILE A 36 -19.104 1.189 -0.513 1.00 0.00 N ATOM 552 CA ILE A 36 -20.484 1.641 -0.725 1.00 0.00 C ATOM 553 C ILE A 36 -20.993 2.437 0.480 1.00 0.00 C ATOM 554 O ILE A 36 -21.521 3.534 0.329 1.00 0.00 O ATOM 555 CB ILE A 36 -21.459 0.443 -0.997 1.00 0.00 C ATOM 556 CG1 ILE A 36 -21.046 -0.345 -2.251 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.915 0.915 -1.117 1.00 0.00 C ATOM 558 CD1 ILE A 36 -21.050 0.454 -3.540 1.00 0.00 C ATOM 0 H ILE A 36 -18.999 0.175 -0.471 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.468 2.283 -1.606 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.390 -0.224 -0.137 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -20.046 -0.749 -2.095 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.719 -1.195 -2.366 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.561 0.058 -1.305 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.218 1.401 -0.189 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -23.001 1.622 -1.942 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.745 -0.188 -4.367 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -22.053 0.836 -3.728 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.354 1.289 -3.453 1.00 0.00 H new ATOM 570 N LYS A 37 -20.800 1.900 1.668 1.00 0.00 N ATOM 571 CA LYS A 37 -21.318 2.538 2.875 1.00 0.00 C ATOM 572 C LYS A 37 -20.547 3.811 3.230 1.00 0.00 C ATOM 573 O LYS A 37 -21.110 4.744 3.814 1.00 0.00 O ATOM 574 CB LYS A 37 -21.342 1.559 4.060 1.00 0.00 C ATOM 575 CG LYS A 37 -19.972 1.040 4.487 1.00 0.00 C ATOM 576 CD LYS A 37 -20.067 0.037 5.625 1.00 0.00 C ATOM 577 CE LYS A 37 -20.693 0.646 6.868 1.00 0.00 C ATOM 578 NZ LYS A 37 -20.797 -0.329 7.964 1.00 0.00 N ATOM 0 H LYS A 37 -20.293 1.030 1.830 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.345 2.833 2.660 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -21.810 2.052 4.912 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -21.972 0.709 3.798 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.480 0.573 3.634 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -19.348 1.879 4.795 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -20.658 -0.821 5.304 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -19.071 -0.334 5.865 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.096 1.497 7.195 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -21.685 1.027 6.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.229 0.126 8.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -21.388 -1.130 7.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -19.848 -0.674 8.213 1.00 0.00 H new ATOM 592 N SER A 38 -19.277 3.848 2.883 1.00 0.00 N ATOM 593 CA SER A 38 -18.464 5.000 3.166 1.00 0.00 C ATOM 594 C SER A 38 -18.639 6.056 2.060 1.00 0.00 C ATOM 595 O SER A 38 -18.530 7.254 2.307 1.00 0.00 O ATOM 596 CB SER A 38 -16.990 4.585 3.339 1.00 0.00 C ATOM 597 OG SER A 38 -16.177 5.670 3.756 1.00 0.00 O ATOM 0 H SER A 38 -18.790 3.090 2.404 1.00 0.00 H new ATOM 0 HA SER A 38 -18.788 5.449 4.105 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.924 3.780 4.071 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.612 4.190 2.396 1.00 0.00 H new ATOM 0 HG SER A 38 -15.251 5.365 3.856 1.00 0.00 H new ATOM 603 N GLY A 39 -18.954 5.609 0.857 1.00 0.00 N ATOM 604 CA GLY A 39 -19.161 6.523 -0.237 1.00 0.00 C ATOM 605 C GLY A 39 -17.903 6.756 -1.027 1.00 0.00 C ATOM 606 O GLY A 39 -17.669 7.857 -1.543 1.00 0.00 O ATOM 0 H GLY A 39 -19.070 4.624 0.620 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.934 6.129 -0.896 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.526 7.474 0.150 1.00 0.00 H new ATOM 610 N ILE A 40 -17.107 5.731 -1.137 1.00 0.00 N ATOM 611 CA ILE A 40 -15.848 5.804 -1.836 1.00 0.00 C ATOM 612 C ILE A 40 -16.050 5.273 -3.255 1.00 0.00 C ATOM 613 O ILE A 40 -16.942 4.428 -3.484 1.00 0.00 O ATOM 614 CB ILE A 40 -14.753 4.976 -1.082 1.00 0.00 C ATOM 615 CG1 ILE A 40 -14.676 5.451 0.379 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.383 5.124 -1.761 1.00 0.00 C ATOM 617 CD1 ILE A 40 -13.706 4.686 1.244 1.00 0.00 C ATOM 0 H ILE A 40 -17.311 4.813 -0.743 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.506 6.838 -1.878 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.027 3.921 -1.112 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.397 6.505 0.389 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -15.669 5.380 0.822 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.642 4.539 -1.217 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.445 4.765 -2.788 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -13.088 6.173 -1.761 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -13.721 5.093 2.255 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -13.993 3.635 1.271 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -12.701 4.777 0.832 1.00 0.00 H new ATOM 629 N ASP A 41 -15.272 5.791 -4.204 1.00 0.00 N ATOM 630 CA ASP A 41 -15.374 5.384 -5.610 1.00 0.00 C ATOM 631 C ASP A 41 -14.849 3.981 -5.818 1.00 0.00 C ATOM 632 O ASP A 41 -13.657 3.782 -6.100 1.00 0.00 O ATOM 633 CB ASP A 41 -14.604 6.314 -6.566 1.00 0.00 C ATOM 634 CG ASP A 41 -15.051 7.743 -6.566 1.00 0.00 C ATOM 635 OD1 ASP A 41 -16.114 8.057 -7.130 1.00 0.00 O ATOM 636 OD2 ASP A 41 -14.298 8.594 -6.037 1.00 0.00 O ATOM 0 H ASP A 41 -14.559 6.498 -4.026 1.00 0.00 H new ATOM 0 HA ASP A 41 -16.438 5.438 -5.842 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -13.546 6.281 -6.305 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -14.694 5.922 -7.579 1.00 0.00 H new ATOM 641 N ILE A 42 -15.700 3.014 -5.653 1.00 0.00 N ATOM 642 CA ILE A 42 -15.318 1.644 -5.887 1.00 0.00 C ATOM 643 C ILE A 42 -15.504 1.331 -7.368 1.00 0.00 C ATOM 644 O ILE A 42 -14.788 0.511 -7.947 1.00 0.00 O ATOM 645 CB ILE A 42 -16.117 0.639 -4.990 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.626 -0.804 -5.181 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.624 0.729 -5.216 1.00 0.00 C ATOM 648 CD1 ILE A 42 -14.182 -1.024 -4.766 1.00 0.00 C ATOM 0 H ILE A 42 -16.667 3.143 -5.357 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.270 1.523 -5.611 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.925 0.931 -3.958 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -16.265 -1.474 -4.605 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.738 -1.079 -6.230 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -18.132 0.012 -4.571 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.968 1.736 -4.981 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.850 0.503 -6.258 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.911 -2.067 -4.931 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.531 -0.381 -5.359 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -14.066 -0.782 -3.710 1.00 0.00 H new ATOM 660 N ASP A 43 -16.427 2.049 -7.988 1.00 0.00 N ATOM 661 CA ASP A 43 -16.724 1.882 -9.402 1.00 0.00 C ATOM 662 C ASP A 43 -15.510 2.215 -10.250 1.00 0.00 C ATOM 663 O ASP A 43 -15.146 1.458 -11.154 1.00 0.00 O ATOM 664 CB ASP A 43 -17.909 2.747 -9.810 1.00 0.00 C ATOM 665 CG ASP A 43 -18.237 2.615 -11.272 1.00 0.00 C ATOM 666 OD1 ASP A 43 -18.612 1.512 -11.708 1.00 0.00 O ATOM 667 OD2 ASP A 43 -18.106 3.604 -12.016 1.00 0.00 O ATOM 0 H ASP A 43 -16.991 2.763 -7.526 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.986 0.837 -9.571 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -18.781 2.468 -9.218 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -17.690 3.790 -9.582 1.00 0.00 H new ATOM 672 N SER A 44 -14.862 3.320 -9.924 1.00 0.00 N ATOM 673 CA SER A 44 -13.666 3.756 -10.619 1.00 0.00 C ATOM 674 C SER A 44 -12.508 2.776 -10.379 1.00 0.00 C ATOM 675 O SER A 44 -11.654 2.582 -11.242 1.00 0.00 O ATOM 676 CB SER A 44 -13.297 5.159 -10.152 1.00 0.00 C ATOM 677 OG SER A 44 -14.406 6.033 -10.312 1.00 0.00 O ATOM 0 H SER A 44 -15.152 3.941 -9.168 1.00 0.00 H new ATOM 0 HA SER A 44 -13.861 3.777 -11.691 1.00 0.00 H new ATOM 0 HB2 SER A 44 -12.991 5.134 -9.106 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.446 5.529 -10.724 1.00 0.00 H new ATOM 0 HG SER A 44 -14.161 6.932 -10.008 1.00 0.00 H new ATOM 683 N ALA A 45 -12.514 2.127 -9.220 1.00 0.00 N ATOM 684 CA ALA A 45 -11.501 1.150 -8.904 1.00 0.00 C ATOM 685 C ALA A 45 -11.672 -0.063 -9.819 1.00 0.00 C ATOM 686 O ALA A 45 -10.726 -0.480 -10.533 1.00 0.00 O ATOM 687 CB ALA A 45 -11.569 0.760 -7.425 1.00 0.00 C ATOM 0 H ALA A 45 -13.212 2.266 -8.490 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.513 1.577 -9.075 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.797 0.022 -7.207 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.410 1.644 -6.808 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.549 0.335 -7.205 1.00 0.00 H new ATOM 693 N LEU A 46 -12.898 -0.573 -9.860 1.00 0.00 N ATOM 694 CA LEU A 46 -13.253 -1.711 -10.707 1.00 0.00 C ATOM 695 C LEU A 46 -12.963 -1.385 -12.174 1.00 0.00 C ATOM 696 O LEU A 46 -12.436 -2.211 -12.921 1.00 0.00 O ATOM 697 CB LEU A 46 -14.740 -2.053 -10.534 1.00 0.00 C ATOM 698 CG LEU A 46 -15.202 -2.436 -9.116 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.701 -2.685 -9.090 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.455 -3.661 -8.600 1.00 0.00 C ATOM 0 H LEU A 46 -13.675 -0.211 -9.308 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.653 -2.571 -10.409 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.327 -1.195 -10.863 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -14.979 -2.879 -11.204 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.973 -1.599 -8.457 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -17.008 -2.954 -8.079 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -17.225 -1.781 -9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.947 -3.499 -9.773 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.805 -3.905 -7.597 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.639 -4.506 -9.264 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.386 -3.449 -8.570 1.00 0.00 H new ATOM 712 N ASP A 47 -13.269 -0.159 -12.547 1.00 0.00 N ATOM 713 CA ASP A 47 -13.049 0.358 -13.906 1.00 0.00 C ATOM 714 C ASP A 47 -11.570 0.357 -14.291 1.00 0.00 C ATOM 715 O ASP A 47 -11.218 0.040 -15.425 1.00 0.00 O ATOM 716 CB ASP A 47 -13.610 1.780 -14.029 1.00 0.00 C ATOM 717 CG ASP A 47 -13.334 2.430 -15.367 1.00 0.00 C ATOM 718 OD1 ASP A 47 -13.983 2.071 -16.370 1.00 0.00 O ATOM 719 OD2 ASP A 47 -12.455 3.320 -15.437 1.00 0.00 O ATOM 0 H ASP A 47 -13.684 0.525 -11.915 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.573 -0.308 -14.592 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.687 1.751 -13.864 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.183 2.399 -13.240 1.00 0.00 H new ATOM 724 N ARG A 48 -10.707 0.691 -13.349 1.00 0.00 N ATOM 725 CA ARG A 48 -9.280 0.774 -13.635 1.00 0.00 C ATOM 726 C ARG A 48 -8.555 -0.551 -13.460 1.00 0.00 C ATOM 727 O ARG A 48 -7.319 -0.630 -13.621 1.00 0.00 O ATOM 728 CB ARG A 48 -8.625 1.887 -12.854 1.00 0.00 C ATOM 729 CG ARG A 48 -9.202 3.235 -13.196 1.00 0.00 C ATOM 730 CD ARG A 48 -8.557 4.342 -12.424 1.00 0.00 C ATOM 731 NE ARG A 48 -9.223 5.615 -12.695 1.00 0.00 N ATOM 732 CZ ARG A 48 -8.651 6.820 -12.673 1.00 0.00 C ATOM 733 NH1 ARG A 48 -7.342 6.946 -12.445 1.00 0.00 N ATOM 734 NH2 ARG A 48 -9.385 7.893 -12.921 1.00 0.00 N ATOM 0 H ARG A 48 -10.963 0.908 -12.386 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.193 1.018 -14.694 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.747 1.701 -11.787 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.554 1.890 -13.056 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -9.079 3.420 -14.263 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.273 3.231 -12.994 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.601 4.122 -11.357 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.503 4.413 -12.692 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.217 5.578 -12.922 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.770 6.117 -12.286 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -6.914 7.872 -12.430 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -10.379 7.794 -13.127 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.957 8.819 -12.906 1.00 0.00 H new ATOM 748 N GLY A 49 -9.301 -1.588 -13.140 1.00 0.00 N ATOM 749 CA GLY A 49 -8.717 -2.908 -13.148 1.00 0.00 C ATOM 750 C GLY A 49 -8.868 -3.689 -11.871 1.00 0.00 C ATOM 751 O GLY A 49 -8.458 -4.848 -11.822 1.00 0.00 O ATOM 0 H GLY A 49 -10.286 -1.545 -12.878 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.166 -3.481 -13.959 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.655 -2.815 -13.374 1.00 0.00 H new ATOM 755 N VAL A 50 -9.464 -3.096 -10.854 1.00 0.00 N ATOM 756 CA VAL A 50 -9.666 -3.813 -9.602 1.00 0.00 C ATOM 757 C VAL A 50 -10.769 -4.865 -9.782 1.00 0.00 C ATOM 758 O VAL A 50 -11.817 -4.590 -10.394 1.00 0.00 O ATOM 759 CB VAL A 50 -10.017 -2.857 -8.418 1.00 0.00 C ATOM 760 CG1 VAL A 50 -10.238 -3.628 -7.131 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.918 -1.836 -8.209 1.00 0.00 C ATOM 0 H VAL A 50 -9.812 -2.137 -10.864 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.726 -4.302 -9.347 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.942 -2.344 -8.681 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.480 -2.933 -6.327 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -11.061 -4.330 -7.264 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.331 -4.176 -6.875 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.183 -1.180 -7.380 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.983 -2.349 -7.982 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.795 -1.243 -9.115 1.00 0.00 H new ATOM 771 N ILE A 51 -10.511 -6.061 -9.328 1.00 0.00 N ATOM 772 CA ILE A 51 -11.472 -7.135 -9.410 1.00 0.00 C ATOM 773 C ILE A 51 -11.968 -7.499 -8.032 1.00 0.00 C ATOM 774 O ILE A 51 -11.215 -7.459 -7.063 1.00 0.00 O ATOM 775 CB ILE A 51 -10.907 -8.393 -10.127 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.600 -8.878 -9.465 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.710 -8.111 -11.609 1.00 0.00 C ATOM 778 CD1 ILE A 51 -9.008 -10.127 -10.090 1.00 0.00 C ATOM 0 H ILE A 51 -9.628 -6.322 -8.889 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.303 -6.771 -10.014 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.633 -9.200 -10.028 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.863 -8.077 -9.515 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -9.791 -9.070 -8.409 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.314 -9.000 -12.099 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.666 -7.844 -12.059 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.008 -7.286 -11.732 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.092 -10.398 -9.564 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.724 -10.945 -10.016 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.781 -9.937 -11.139 1.00 0.00 H new ATOM 790 N VAL A 52 -13.223 -7.824 -7.932 1.00 0.00 N ATOM 791 CA VAL A 52 -13.792 -8.180 -6.657 1.00 0.00 C ATOM 792 C VAL A 52 -13.859 -9.689 -6.502 1.00 0.00 C ATOM 793 O VAL A 52 -14.537 -10.388 -7.273 1.00 0.00 O ATOM 794 CB VAL A 52 -15.186 -7.507 -6.389 1.00 0.00 C ATOM 795 CG1 VAL A 52 -16.184 -7.781 -7.506 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.759 -7.945 -5.036 1.00 0.00 C ATOM 0 H VAL A 52 -13.876 -7.851 -8.715 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.123 -7.783 -5.894 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.015 -6.431 -6.363 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -17.132 -7.295 -7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.795 -7.389 -8.446 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -16.341 -8.856 -7.599 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.724 -7.464 -4.877 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -15.887 -9.027 -5.028 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.073 -7.655 -4.240 1.00 0.00 H new ATOM 806 N ARG A 53 -13.145 -10.192 -5.553 1.00 0.00 N ATOM 807 CA ARG A 53 -13.143 -11.589 -5.300 1.00 0.00 C ATOM 808 C ARG A 53 -13.655 -11.811 -3.915 1.00 0.00 C ATOM 809 O ARG A 53 -13.162 -11.216 -2.959 1.00 0.00 O ATOM 810 CB ARG A 53 -11.757 -12.186 -5.481 1.00 0.00 C ATOM 811 CG ARG A 53 -11.748 -13.703 -5.416 1.00 0.00 C ATOM 812 CD ARG A 53 -10.389 -14.259 -5.761 1.00 0.00 C ATOM 813 NE ARG A 53 -9.978 -13.905 -7.137 1.00 0.00 N ATOM 814 CZ ARG A 53 -9.121 -14.598 -7.906 1.00 0.00 C ATOM 815 NH1 ARG A 53 -8.645 -15.771 -7.506 1.00 0.00 N ATOM 816 NH2 ARG A 53 -8.781 -14.131 -9.103 1.00 0.00 N ATOM 0 H ARG A 53 -12.548 -9.646 -4.932 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.790 -12.093 -6.018 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.353 -11.867 -6.442 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.095 -11.791 -4.710 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -12.033 -14.028 -4.415 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.492 -14.103 -6.105 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.652 -13.879 -5.054 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.404 -15.344 -5.655 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.381 -13.059 -7.538 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.929 -16.156 -6.605 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.995 -16.287 -8.099 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -9.170 -13.249 -9.436 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.131 -14.655 -9.689 1.00 0.00 H new ATOM 830 N ALA A 54 -14.639 -12.632 -3.814 1.00 0.00 N ATOM 831 CA ALA A 54 -15.283 -12.883 -2.575 1.00 0.00 C ATOM 832 C ALA A 54 -14.638 -14.042 -1.887 1.00 0.00 C ATOM 833 O ALA A 54 -14.080 -14.938 -2.535 1.00 0.00 O ATOM 834 CB ALA A 54 -16.744 -13.177 -2.813 1.00 0.00 C ATOM 0 H ALA A 54 -15.024 -13.155 -4.600 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.191 -12.001 -1.941 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.236 -13.369 -1.860 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -17.213 -12.321 -3.297 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.839 -14.054 -3.454 1.00 0.00 H new ATOM 998 N LEU A 65 -9.087 -7.318 14.932 1.00 0.00 N ATOM 999 CA LEU A 65 -9.193 -6.617 13.668 1.00 0.00 C ATOM 1000 C LEU A 65 -10.629 -6.651 13.163 1.00 0.00 C ATOM 1001 O LEU A 65 -11.360 -7.587 13.454 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.273 -7.262 12.624 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.784 -7.322 12.971 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.020 -8.022 11.873 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.228 -5.928 13.195 1.00 0.00 C ATOM 0 HA LEU A 65 -8.891 -5.581 13.825 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.622 -8.278 12.443 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.383 -6.715 11.688 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.669 -7.888 13.895 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.962 -8.058 12.132 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.400 -9.037 11.756 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.146 -7.477 10.938 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.168 -5.994 13.440 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.354 -5.336 12.289 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -6.762 -5.451 14.017 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.071 -5.627 12.428 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.404 -5.623 11.822 1.00 0.00 C ATOM 1019 C PRO A 66 -12.533 -6.752 10.791 1.00 0.00 C ATOM 1020 O PRO A 66 -11.553 -7.083 10.092 1.00 0.00 O ATOM 1021 CB PRO A 66 -12.485 -4.261 11.125 1.00 0.00 C ATOM 1022 CG PRO A 66 -11.429 -3.435 11.767 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.336 -4.383 12.146 1.00 0.00 C ATOM 0 HA PRO A 66 -13.197 -5.777 12.553 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.314 -4.356 10.053 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.470 -3.811 11.252 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.062 -2.670 11.082 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.818 -2.918 12.644 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -9.615 -4.513 11.339 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.781 -4.034 13.017 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.720 -7.326 10.683 1.00 0.00 N ATOM 1032 CA GLN A 67 -13.974 -8.449 9.788 1.00 0.00 C ATOM 1033 C GLN A 67 -13.691 -8.083 8.332 1.00 0.00 C ATOM 1034 O GLN A 67 -13.172 -8.900 7.586 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.404 -8.949 9.931 1.00 0.00 C ATOM 1036 CG GLN A 67 -15.720 -10.192 9.102 1.00 0.00 C ATOM 1037 CD GLN A 67 -17.178 -10.556 9.161 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -18.026 -9.690 9.325 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -17.491 -11.821 9.035 1.00 0.00 N ATOM 0 H GLN A 67 -14.538 -7.027 11.214 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.292 -9.249 10.076 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.597 -9.168 10.981 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.087 -8.150 9.642 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -15.432 -10.019 8.065 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -15.123 -11.029 9.463 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -16.758 -12.517 8.899 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -18.468 -12.111 9.072 1.00 0.00 H new ATOM 1048 N TYR A 68 -14.003 -6.853 7.932 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.728 -6.441 6.555 1.00 0.00 C ATOM 1050 C TYR A 68 -12.228 -6.418 6.227 1.00 0.00 C ATOM 1051 O TYR A 68 -11.826 -6.755 5.110 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.481 -5.155 6.115 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.464 -3.971 7.068 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.287 -3.345 7.450 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.656 -3.484 7.580 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.302 -2.266 8.317 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.681 -2.414 8.441 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.507 -1.806 8.809 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.535 -0.743 9.687 1.00 0.00 O ATOM 0 H TYR A 68 -14.434 -6.141 8.521 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.155 -7.227 5.932 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.060 -4.828 5.164 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.521 -5.422 5.928 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.344 -3.705 7.065 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.585 -3.956 7.296 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.378 -1.788 8.606 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.622 -2.052 8.827 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.463 -0.547 9.934 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.410 -6.084 7.217 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.959 -6.100 7.052 1.00 0.00 C ATOM 1071 C GLU A 69 -9.515 -7.566 7.052 1.00 0.00 C ATOM 1072 O GLU A 69 -8.649 -7.980 6.292 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.284 -5.366 8.227 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.747 -3.922 8.452 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.216 -2.899 7.456 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -9.027 -3.215 6.270 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -9.020 -1.729 7.867 1.00 0.00 O ATOM 0 H GLU A 69 -11.725 -5.798 8.144 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.677 -5.602 6.124 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.464 -5.934 9.140 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.207 -5.363 8.061 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.836 -3.900 8.423 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.449 -3.616 9.455 1.00 0.00 H new ATOM 1084 N SER A 70 -10.184 -8.352 7.890 1.00 0.00 N ATOM 1085 CA SER A 70 -9.898 -9.765 8.052 1.00 0.00 C ATOM 1086 C SER A 70 -10.182 -10.552 6.757 1.00 0.00 C ATOM 1087 O SER A 70 -9.415 -11.445 6.396 1.00 0.00 O ATOM 1088 CB SER A 70 -10.707 -10.335 9.224 1.00 0.00 C ATOM 1089 OG SER A 70 -10.460 -9.601 10.428 1.00 0.00 O ATOM 0 H SER A 70 -10.947 -8.018 8.479 1.00 0.00 H new ATOM 0 HA SER A 70 -8.836 -9.872 8.271 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.770 -10.302 8.986 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.447 -11.383 9.374 1.00 0.00 H new ATOM 0 HG SER A 70 -10.834 -8.699 10.344 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.276 -10.213 6.056 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.607 -10.874 4.794 1.00 0.00 C ATOM 1097 C GLU A 71 -10.515 -10.593 3.765 1.00 0.00 C ATOM 1098 O GLU A 71 -10.090 -11.499 3.037 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.981 -10.435 4.251 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.368 -11.140 2.945 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.662 -10.646 2.337 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -14.743 -9.458 1.994 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -15.608 -11.446 2.167 1.00 0.00 O ATOM 0 H GLU A 71 -11.938 -9.491 6.342 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.665 -11.946 4.984 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.743 -10.636 5.004 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.972 -9.358 4.086 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.564 -11.007 2.221 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.453 -12.210 3.134 1.00 0.00 H new ATOM 1110 N ALA A 72 -10.029 -9.351 3.755 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.962 -8.950 2.854 1.00 0.00 C ATOM 1112 C ALA A 72 -7.710 -9.771 3.130 1.00 0.00 C ATOM 1113 O ALA A 72 -7.092 -10.298 2.205 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.681 -7.466 2.987 1.00 0.00 C ATOM 0 H ALA A 72 -10.363 -8.606 4.366 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.277 -9.139 1.828 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.879 -7.185 2.304 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.581 -6.902 2.742 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.381 -7.243 4.011 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.377 -9.913 4.411 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.247 -10.737 4.836 1.00 0.00 C ATOM 1122 C ILE A 73 -6.448 -12.186 4.381 1.00 0.00 C ATOM 1123 O ILE A 73 -5.541 -12.797 3.838 1.00 0.00 O ATOM 1124 CB ILE A 73 -6.056 -10.724 6.385 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.792 -9.306 6.898 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.912 -11.655 6.798 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.663 -9.224 8.407 1.00 0.00 C ATOM 0 H ILE A 73 -7.878 -9.464 5.178 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.356 -10.311 4.375 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.981 -11.084 6.835 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.877 -8.927 6.442 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.603 -8.654 6.574 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.796 -11.631 7.882 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.138 -12.673 6.480 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.986 -11.325 6.327 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.477 -8.191 8.701 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.586 -9.572 8.871 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.833 -9.850 8.736 1.00 0.00 H new ATOM 1139 N MET A 74 -7.653 -12.707 4.583 1.00 0.00 N ATOM 1140 CA MET A 74 -7.977 -14.089 4.225 1.00 0.00 C ATOM 1141 C MET A 74 -7.811 -14.347 2.743 1.00 0.00 C ATOM 1142 O MET A 74 -7.182 -15.320 2.359 1.00 0.00 O ATOM 1143 CB MET A 74 -9.384 -14.491 4.681 1.00 0.00 C ATOM 1144 CG MET A 74 -9.608 -14.589 6.198 1.00 0.00 C ATOM 1145 SD MET A 74 -8.939 -16.089 7.014 1.00 0.00 S ATOM 1146 CE MET A 74 -7.155 -15.890 6.912 1.00 0.00 C ATOM 0 H MET A 74 -8.430 -12.191 4.996 1.00 0.00 H new ATOM 0 HA MET A 74 -7.260 -14.713 4.759 1.00 0.00 H new ATOM 0 HB2 MET A 74 -10.094 -13.769 4.277 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.624 -15.457 4.237 1.00 0.00 H new ATOM 0 HG2 MET A 74 -9.161 -13.713 6.669 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.680 -14.542 6.391 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.691 -16.303 7.808 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.780 -16.416 6.034 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.911 -14.831 6.832 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.343 -13.466 1.914 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.230 -13.629 0.467 1.00 0.00 C ATOM 1158 C VAL A 75 -6.769 -13.482 0.025 1.00 0.00 C ATOM 1159 O VAL A 75 -6.282 -14.234 -0.829 1.00 0.00 O ATOM 1160 CB VAL A 75 -9.165 -12.649 -0.311 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.988 -12.782 -1.824 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.617 -12.916 0.059 1.00 0.00 C ATOM 0 H VAL A 75 -8.855 -12.635 2.210 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.564 -14.637 0.220 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.891 -11.633 -0.027 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.655 -12.085 -2.331 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.956 -12.556 -2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.227 -13.800 -2.130 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.264 -12.229 -0.487 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.876 -13.942 -0.201 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.753 -12.768 1.130 1.00 0.00 H new ATOM 1172 N ALA A 76 -6.057 -12.563 0.657 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.644 -12.355 0.370 1.00 0.00 C ATOM 1174 C ALA A 76 -3.815 -13.551 0.810 1.00 0.00 C ATOM 1175 O ALA A 76 -2.791 -13.837 0.231 1.00 0.00 O ATOM 1176 CB ALA A 76 -4.140 -11.097 1.039 1.00 0.00 C ATOM 0 H ALA A 76 -6.435 -11.946 1.376 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.538 -12.242 -0.709 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.083 -10.962 0.811 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.703 -10.239 0.672 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.270 -11.181 2.118 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.274 -14.234 1.831 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.618 -15.418 2.352 1.00 0.00 C ATOM 1184 C PHE A 77 -3.962 -16.644 1.499 1.00 0.00 C ATOM 1185 O PHE A 77 -3.140 -17.544 1.313 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.026 -15.622 3.822 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.465 -16.850 4.476 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.108 -16.964 4.725 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.301 -17.881 4.853 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -1.599 -18.091 5.333 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -3.799 -19.005 5.460 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.446 -19.115 5.702 1.00 0.00 C ATOM 0 H PHE A 77 -5.126 -13.983 2.333 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.537 -15.285 2.307 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.711 -14.749 4.394 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.114 -15.665 3.878 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.442 -16.163 4.440 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.362 -17.803 4.668 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.538 -18.172 5.520 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.465 -19.805 5.749 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.051 -20.000 6.179 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.173 -16.664 0.984 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.648 -17.739 0.130 1.00 0.00 C ATOM 1204 C GLU A 78 -4.909 -17.689 -1.214 1.00 0.00 C ATOM 1205 O GLU A 78 -4.385 -18.701 -1.686 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.189 -17.615 -0.010 1.00 0.00 C ATOM 1207 CG GLU A 78 -7.928 -18.764 -0.707 1.00 0.00 C ATOM 1208 CD GLU A 78 -7.917 -18.701 -2.214 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.763 -17.985 -2.783 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -7.108 -19.401 -2.853 1.00 0.00 O ATOM 0 H GLU A 78 -5.863 -15.930 1.146 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.437 -18.716 0.564 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.610 -17.500 0.989 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.405 -16.696 -0.555 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.481 -19.708 -0.394 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.963 -18.772 -0.365 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.810 -16.498 -1.781 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.111 -16.303 -3.053 1.00 0.00 C ATOM 1219 C LEU A 79 -2.601 -16.236 -2.837 1.00 0.00 C ATOM 1220 O LEU A 79 -1.818 -16.469 -3.766 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.559 -14.986 -3.705 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.041 -14.846 -4.047 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.324 -13.464 -4.615 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.458 -15.909 -5.036 1.00 0.00 C ATOM 0 H LEU A 79 -5.204 -15.645 -1.384 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.353 -17.148 -3.697 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.288 -14.169 -3.037 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.986 -14.851 -4.623 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.619 -14.975 -3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.384 -13.379 -4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.056 -12.706 -3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.735 -13.315 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.517 -15.794 -5.268 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.873 -15.806 -5.950 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.286 -16.895 -4.604 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.220 -15.929 -1.601 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.838 -15.634 -1.197 1.00 0.00 C ATOM 1238 C ASN A 80 -0.360 -14.479 -2.056 1.00 0.00 C ATOM 1239 O ASN A 80 0.506 -14.610 -2.943 1.00 0.00 O ATOM 1240 CB ASN A 80 0.109 -16.843 -1.273 1.00 0.00 C ATOM 1241 CG ASN A 80 1.422 -16.613 -0.517 1.00 0.00 C ATOM 1242 OD1 ASN A 80 1.541 -16.952 0.663 1.00 0.00 O ATOM 1243 ND2 ASN A 80 2.394 -16.027 -1.167 1.00 0.00 N ATOM 0 H ASN A 80 -2.880 -15.875 -0.825 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.827 -15.367 -0.140 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.393 -17.719 -0.863 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.329 -17.062 -2.318 1.00 0.00 H new ATOM 0 HD21 ASN A 80 3.280 -15.839 -0.698 1.00 0.00 H new ATOM 0 HD22 ASN A 80 2.266 -15.758 -2.143 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.020 -13.382 -1.848 1.00 0.00 N ATOM 1251 CA ALA A 81 -0.871 -12.201 -2.645 1.00 0.00 C ATOM 1252 C ALA A 81 -0.196 -11.085 -1.876 1.00 0.00 C ATOM 1253 O ALA A 81 0.214 -11.258 -0.724 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.249 -11.760 -3.118 1.00 0.00 C ATOM 0 H ALA A 81 -1.700 -13.279 -1.094 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.233 -12.430 -3.498 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.154 -10.861 -3.727 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.701 -12.554 -3.712 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.880 -11.548 -2.254 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.088 -9.958 -2.524 1.00 0.00 N ATOM 1261 CA LEU A 82 0.493 -8.774 -1.971 1.00 0.00 C ATOM 1262 C LEU A 82 -0.657 -8.067 -1.258 1.00 0.00 C ATOM 1263 O LEU A 82 -1.706 -7.877 -1.854 1.00 0.00 O ATOM 1264 CB LEU A 82 1.031 -7.928 -3.167 1.00 0.00 C ATOM 1265 CG LEU A 82 2.048 -6.796 -2.912 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.501 -5.700 -2.025 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.340 -7.351 -2.353 1.00 0.00 C ATOM 0 H LEU A 82 -0.414 -9.839 -3.483 1.00 0.00 H new ATOM 0 HA LEU A 82 1.316 -8.953 -1.279 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.486 -8.620 -3.875 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.169 -7.484 -3.664 1.00 0.00 H new ATOM 0 HG LEU A 82 2.252 -6.336 -3.879 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.262 -4.933 -1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.623 -5.257 -2.494 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.223 -6.119 -1.058 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.042 -6.535 -2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.139 -7.862 -1.411 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.771 -8.056 -3.064 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.503 -7.734 -0.011 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.589 -7.101 0.707 1.00 0.00 C ATOM 1281 C LEU A 83 -1.286 -5.636 0.945 1.00 0.00 C ATOM 1282 O LEU A 83 -0.217 -5.283 1.455 1.00 0.00 O ATOM 1283 CB LEU A 83 -1.884 -7.817 2.031 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.103 -7.303 2.816 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.386 -7.546 2.047 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.182 -7.951 4.178 1.00 0.00 C ATOM 0 H LEU A 83 0.348 -7.884 0.531 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.483 -7.175 0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.030 -8.877 1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.004 -7.736 2.670 1.00 0.00 H new ATOM 0 HG LEU A 83 -2.979 -6.229 2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.232 -7.173 2.624 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.341 -7.025 1.091 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.509 -8.615 1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.052 -7.570 4.712 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.271 -9.031 4.062 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.279 -7.720 4.744 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.209 -4.799 0.561 1.00 0.00 N ATOM 1299 CA ILE A 84 -2.061 -3.376 0.715 1.00 0.00 C ATOM 1300 C ILE A 84 -2.965 -2.914 1.849 1.00 0.00 C ATOM 1301 O ILE A 84 -4.204 -3.020 1.748 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.473 -2.636 -0.580 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.774 -3.259 -1.797 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.121 -1.151 -0.464 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -2.218 -2.681 -3.121 1.00 0.00 C ATOM 0 H ILE A 84 -3.089 -5.084 0.131 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.016 -3.151 0.931 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.550 -2.734 -0.716 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.697 -3.122 -1.695 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.960 -4.333 -1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.413 -0.635 -1.379 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.652 -0.716 0.383 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.047 -1.042 -0.314 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.679 -3.172 -3.931 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.289 -2.841 -3.247 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.007 -1.612 -3.140 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.371 -2.428 2.911 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.117 -1.970 4.063 1.00 0.00 C ATOM 1319 C ALA A 85 -2.375 -0.829 4.723 1.00 0.00 C ATOM 1320 O ALA A 85 -1.172 -0.720 4.584 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.320 -3.112 5.056 1.00 0.00 C ATOM 0 H ALA A 85 -1.359 -2.338 3.004 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.097 -1.622 3.737 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.883 -2.750 5.916 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.872 -3.919 4.574 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.350 -3.483 5.387 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.085 0.005 5.425 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.491 1.127 6.114 1.00 0.00 C ATOM 1329 C GLU A 86 -2.342 0.848 7.586 1.00 0.00 C ATOM 1330 O GLU A 86 -1.364 1.274 8.215 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.316 2.387 5.894 1.00 0.00 C ATOM 1332 CG GLU A 86 -2.968 3.119 4.626 1.00 0.00 C ATOM 1333 CD GLU A 86 -1.542 3.622 4.660 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -1.265 4.598 5.398 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -0.674 3.042 3.996 1.00 0.00 O ATOM 0 H GLU A 86 -4.096 -0.069 5.540 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.495 1.283 5.699 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.373 2.121 5.872 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.174 3.057 6.742 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.102 2.456 3.771 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.650 3.958 4.489 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.297 0.134 8.124 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.321 -0.194 9.531 1.00 0.00 C ATOM 1344 C ASP A 87 -2.206 -1.152 9.843 1.00 0.00 C ATOM 1345 O ASP A 87 -2.155 -2.268 9.314 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.658 -0.789 9.929 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.778 -0.998 11.412 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.404 -2.063 11.904 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -5.262 -0.096 12.106 1.00 0.00 O ATOM 0 H ASP A 87 -4.086 -0.240 7.597 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.181 0.722 10.105 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.459 -0.131 9.592 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.793 -1.743 9.419 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.324 -0.725 10.699 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.117 -1.459 10.992 1.00 0.00 C ATOM 1356 C LYS A 88 -0.382 -2.673 11.855 1.00 0.00 C ATOM 1357 O LYS A 88 0.442 -3.590 11.925 1.00 0.00 O ATOM 1358 CB LYS A 88 0.923 -0.534 11.610 1.00 0.00 C ATOM 1359 CG LYS A 88 1.305 0.610 10.684 1.00 0.00 C ATOM 1360 CD LYS A 88 2.321 1.544 11.307 1.00 0.00 C ATOM 1361 CE LYS A 88 2.674 2.677 10.354 1.00 0.00 C ATOM 1362 NZ LYS A 88 1.500 3.517 10.016 1.00 0.00 N ATOM 0 H LYS A 88 -1.418 0.147 11.219 1.00 0.00 H new ATOM 0 HA LYS A 88 0.283 -1.840 10.052 1.00 0.00 H new ATOM 0 HB2 LYS A 88 0.535 -0.128 12.544 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.815 -1.109 11.859 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.710 0.204 9.757 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.411 1.174 10.421 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.922 1.955 12.235 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.222 0.987 11.566 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.446 3.301 10.805 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.095 2.261 9.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 1.822 4.406 9.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 0.889 3.007 9.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.964 3.729 10.882 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.521 -2.699 12.492 1.00 0.00 N ATOM 1377 CA ASP A 89 -1.885 -3.819 13.314 1.00 0.00 C ATOM 1378 C ASP A 89 -2.444 -4.919 12.401 1.00 0.00 C ATOM 1379 O ASP A 89 -2.155 -6.114 12.579 1.00 0.00 O ATOM 1380 CB ASP A 89 -2.883 -3.384 14.381 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.088 -4.410 15.448 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.244 -4.507 16.366 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.095 -5.089 15.435 1.00 0.00 O ATOM 0 H ASP A 89 -2.216 -1.953 12.457 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.018 -4.214 13.843 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.535 -2.458 14.839 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -3.840 -3.166 13.907 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.218 -4.492 11.394 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.699 -5.374 10.315 1.00 0.00 C ATOM 1390 C VAL A 90 -2.500 -5.979 9.572 1.00 0.00 C ATOM 1391 O VAL A 90 -2.402 -7.210 9.422 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.617 -4.604 9.292 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.964 -5.467 8.082 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.904 -4.154 9.958 1.00 0.00 C ATOM 0 H VAL A 90 -3.530 -3.525 11.302 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.296 -6.163 10.772 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.052 -3.736 8.953 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.598 -4.900 7.400 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.048 -5.758 7.568 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.494 -6.360 8.412 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.523 -3.624 9.234 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.445 -5.024 10.330 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.670 -3.490 10.790 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.572 -5.102 9.140 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.340 -5.511 8.440 1.00 0.00 C ATOM 1406 C ILE A 91 0.424 -6.545 9.265 1.00 0.00 C ATOM 1407 O ILE A 91 0.869 -7.573 8.739 1.00 0.00 O ATOM 1408 CB ILE A 91 0.588 -4.283 8.162 1.00 0.00 C ATOM 1409 CG1 ILE A 91 -0.097 -3.302 7.206 1.00 0.00 C ATOM 1410 CG2 ILE A 91 1.951 -4.718 7.604 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.670 -2.017 6.998 1.00 0.00 C ATOM 0 H ILE A 91 -1.656 -4.093 9.266 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.634 -5.950 7.487 1.00 0.00 H new ATOM 0 HB ILE A 91 0.768 -3.781 9.113 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.240 -3.789 6.241 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.088 -3.064 7.593 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.568 -3.838 7.423 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.448 -5.368 8.324 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.806 -5.257 6.668 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.122 -1.374 6.309 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.790 -1.506 7.953 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.651 -2.243 6.581 1.00 0.00 H new ATOM 1423 N ASN A 92 0.535 -6.270 10.557 1.00 0.00 N ATOM 1424 CA ASN A 92 1.226 -7.141 11.502 1.00 0.00 C ATOM 1425 C ASN A 92 0.683 -8.565 11.459 1.00 0.00 C ATOM 1426 O ASN A 92 1.444 -9.512 11.256 1.00 0.00 O ATOM 1427 CB ASN A 92 1.116 -6.575 12.926 1.00 0.00 C ATOM 1428 CG ASN A 92 1.758 -7.457 13.986 1.00 0.00 C ATOM 1429 OD1 ASN A 92 2.958 -7.346 14.258 1.00 0.00 O ATOM 1430 ND2 ASN A 92 0.974 -8.289 14.622 1.00 0.00 N ATOM 0 H ASN A 92 0.145 -5.430 10.984 1.00 0.00 H new ATOM 0 HA ASN A 92 2.275 -7.177 11.210 1.00 0.00 H new ATOM 0 HB2 ASN A 92 1.583 -5.591 12.953 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.063 -6.435 13.171 1.00 0.00 H new ATOM 0 HD21 ASN A 92 1.349 -8.873 15.370 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -0.012 -8.354 14.370 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.632 -8.695 11.589 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.293 -10.000 11.632 1.00 0.00 C ATOM 1439 C LYS A 93 -1.107 -10.743 10.315 1.00 0.00 C ATOM 1440 O LYS A 93 -0.794 -11.935 10.296 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.791 -9.829 11.919 1.00 0.00 C ATOM 1442 CG LYS A 93 -3.562 -11.133 12.128 1.00 0.00 C ATOM 1443 CD LYS A 93 -3.066 -11.877 13.359 1.00 0.00 C ATOM 1444 CE LYS A 93 -3.880 -13.128 13.625 1.00 0.00 C ATOM 1445 NZ LYS A 93 -3.454 -13.811 14.868 1.00 0.00 N ATOM 0 H LYS A 93 -1.271 -7.904 11.668 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.838 -10.583 12.432 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.907 -9.210 12.808 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.245 -9.285 11.090 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.625 -10.916 12.235 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.453 -11.767 11.248 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.019 -12.147 13.224 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.116 -11.219 14.227 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.935 -12.865 13.699 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -3.780 -13.812 12.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.035 -14.661 15.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.454 -14.085 14.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -3.574 -13.167 15.676 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.272 -10.022 9.224 1.00 0.00 N ATOM 1460 CA ALA A 94 -1.146 -10.590 7.897 1.00 0.00 C ATOM 1461 C ALA A 94 0.264 -11.110 7.657 1.00 0.00 C ATOM 1462 O ALA A 94 0.456 -12.195 7.099 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.511 -9.558 6.853 1.00 0.00 C ATOM 0 H ALA A 94 -1.497 -9.027 9.232 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.834 -11.432 7.819 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.413 -9.995 5.859 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.540 -9.233 7.007 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.843 -8.701 6.940 1.00 0.00 H new ATOM 1469 N LYS A 95 1.243 -10.363 8.117 1.00 0.00 N ATOM 1470 CA LYS A 95 2.621 -10.736 7.940 1.00 0.00 C ATOM 1471 C LYS A 95 2.978 -11.947 8.813 1.00 0.00 C ATOM 1472 O LYS A 95 3.812 -12.767 8.431 1.00 0.00 O ATOM 1473 CB LYS A 95 3.538 -9.532 8.180 1.00 0.00 C ATOM 1474 CG LYS A 95 4.999 -9.768 7.803 1.00 0.00 C ATOM 1475 CD LYS A 95 5.799 -8.463 7.759 1.00 0.00 C ATOM 1476 CE LYS A 95 5.242 -7.507 6.703 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.081 -6.311 6.524 1.00 0.00 N ATOM 0 H LYS A 95 1.104 -9.487 8.620 1.00 0.00 H new ATOM 0 HA LYS A 95 2.776 -11.048 6.907 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.160 -8.683 7.609 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.487 -9.256 9.233 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.454 -10.448 8.523 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.048 -10.256 6.830 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.772 -7.984 8.738 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.844 -8.682 7.540 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.157 -8.032 5.752 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.236 -7.201 6.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.660 -5.697 5.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.143 -5.792 7.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.035 -6.598 6.224 1.00 0.00 H new ATOM 1491 N GLU A 96 2.282 -12.099 9.948 1.00 0.00 N ATOM 1492 CA GLU A 96 2.477 -13.267 10.823 1.00 0.00 C ATOM 1493 C GLU A 96 1.963 -14.523 10.130 1.00 0.00 C ATOM 1494 O GLU A 96 2.442 -15.628 10.379 1.00 0.00 O ATOM 1495 CB GLU A 96 1.736 -13.126 12.154 1.00 0.00 C ATOM 1496 CG GLU A 96 2.136 -11.946 13.006 1.00 0.00 C ATOM 1497 CD GLU A 96 1.440 -11.966 14.340 1.00 0.00 C ATOM 1498 OE1 GLU A 96 0.198 -11.923 14.376 1.00 0.00 O ATOM 1499 OE2 GLU A 96 2.125 -12.049 15.387 1.00 0.00 O ATOM 0 H GLU A 96 1.584 -11.434 10.281 1.00 0.00 H new ATOM 0 HA GLU A 96 3.546 -13.336 11.024 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.668 -13.056 11.948 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.890 -14.037 12.733 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.215 -11.955 13.158 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.895 -11.020 12.483 1.00 0.00 H new ATOM 1506 N LEU A 97 0.974 -14.341 9.271 1.00 0.00 N ATOM 1507 CA LEU A 97 0.385 -15.442 8.527 1.00 0.00 C ATOM 1508 C LEU A 97 1.232 -15.779 7.304 1.00 0.00 C ATOM 1509 O LEU A 97 1.039 -16.818 6.664 1.00 0.00 O ATOM 1510 CB LEU A 97 -1.052 -15.106 8.108 1.00 0.00 C ATOM 1511 CG LEU A 97 -2.040 -14.813 9.247 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.403 -14.461 8.688 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -2.153 -16.001 10.192 1.00 0.00 C ATOM 0 H LEU A 97 0.559 -13.431 9.070 1.00 0.00 H new ATOM 0 HA LEU A 97 0.357 -16.316 9.178 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.023 -14.239 7.449 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.442 -15.939 7.522 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.659 -13.962 9.811 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.091 -14.256 9.508 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.320 -13.577 8.055 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.781 -15.296 8.097 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.859 -15.766 10.989 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.505 -16.873 9.640 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.176 -16.216 10.625 1.00 0.00 H new ATOM 1525 N GLY A 98 2.169 -14.905 6.994 1.00 0.00 N ATOM 1526 CA GLY A 98 3.052 -15.124 5.876 1.00 0.00 C ATOM 1527 C GLY A 98 2.641 -14.355 4.643 1.00 0.00 C ATOM 1528 O GLY A 98 3.127 -14.616 3.550 1.00 0.00 O ATOM 0 H GLY A 98 2.335 -14.037 7.504 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.065 -14.835 6.157 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.077 -16.188 5.643 1.00 0.00 H new ATOM 1532 N VAL A 99 1.759 -13.404 4.807 1.00 0.00 N ATOM 1533 CA VAL A 99 1.316 -12.591 3.698 1.00 0.00 C ATOM 1534 C VAL A 99 2.230 -11.378 3.611 1.00 0.00 C ATOM 1535 O VAL A 99 2.672 -10.849 4.647 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.157 -12.121 3.895 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.661 -11.327 2.697 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -1.071 -13.304 4.168 1.00 0.00 C ATOM 0 H VAL A 99 1.329 -13.170 5.702 1.00 0.00 H new ATOM 0 HA VAL A 99 1.357 -13.179 2.781 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.172 -11.461 4.762 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.691 -11.017 2.873 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.036 -10.445 2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.617 -11.949 1.803 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.093 -12.951 4.302 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.033 -13.995 3.326 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.743 -13.816 5.072 1.00 0.00 H new ATOM 1548 N ASN A 100 2.571 -10.965 2.419 1.00 0.00 N ATOM 1549 CA ASN A 100 3.402 -9.792 2.268 1.00 0.00 C ATOM 1550 C ASN A 100 2.526 -8.564 2.245 1.00 0.00 C ATOM 1551 O ASN A 100 1.975 -8.185 1.210 1.00 0.00 O ATOM 1552 CB ASN A 100 4.316 -9.863 1.032 1.00 0.00 C ATOM 1553 CG ASN A 100 5.255 -8.660 0.933 1.00 0.00 C ATOM 1554 OD1 ASN A 100 5.611 -8.053 1.939 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.695 -8.344 -0.259 1.00 0.00 N ATOM 0 H ASN A 100 2.292 -11.414 1.547 1.00 0.00 H new ATOM 0 HA ASN A 100 4.075 -9.740 3.124 1.00 0.00 H new ATOM 0 HB2 ASN A 100 4.906 -10.779 1.071 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.703 -9.917 0.132 1.00 0.00 H new ATOM 0 HD21 ASN A 100 6.353 -7.573 -0.372 1.00 0.00 H new ATOM 0 HD22 ASN A 100 5.379 -8.869 -1.075 1.00 0.00 H new ATOM 1562 N ALA A 101 2.317 -8.024 3.416 1.00 0.00 N ATOM 1563 CA ALA A 101 1.509 -6.852 3.602 1.00 0.00 C ATOM 1564 C ALA A 101 2.401 -5.663 3.835 1.00 0.00 C ATOM 1565 O ALA A 101 3.346 -5.742 4.636 1.00 0.00 O ATOM 1566 CB ALA A 101 0.572 -7.044 4.785 1.00 0.00 C ATOM 0 H ALA A 101 2.711 -8.394 4.281 1.00 0.00 H new ATOM 0 HA ALA A 101 0.908 -6.682 2.708 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.036 -6.149 4.917 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.077 -7.900 4.600 1.00 0.00 H new ATOM 0 HB3 ALA A 101 1.157 -7.221 5.687 1.00 0.00 H new ATOM 1572 N ILE A 102 2.119 -4.592 3.142 1.00 0.00 N ATOM 1573 CA ILE A 102 2.879 -3.365 3.240 1.00 0.00 C ATOM 1574 C ILE A 102 1.956 -2.145 3.165 1.00 0.00 C ATOM 1575 O ILE A 102 0.814 -2.262 2.678 1.00 0.00 O ATOM 1576 CB ILE A 102 4.029 -3.275 2.158 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.585 -3.734 0.748 1.00 0.00 C ATOM 1578 CG2 ILE A 102 5.270 -4.017 2.595 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.611 -2.821 0.056 1.00 0.00 C ATOM 0 H ILE A 102 1.343 -4.542 2.482 1.00 0.00 H new ATOM 0 HA ILE A 102 3.367 -3.371 4.215 1.00 0.00 H new ATOM 0 HB ILE A 102 4.270 -2.215 2.080 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.471 -3.837 0.121 1.00 0.00 H new ATOM 0 HG13 ILE A 102 3.136 -4.724 0.830 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.036 -3.931 1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.642 -3.588 3.525 1.00 0.00 H new ATOM 0 HG23 ILE A 102 5.029 -5.069 2.751 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.362 -3.230 -0.923 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.704 -2.736 0.655 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.060 -1.835 -0.065 1.00 0.00 H new ATOM 1591 N PRO A 103 2.399 -0.984 3.680 1.00 0.00 N ATOM 1592 CA PRO A 103 1.631 0.262 3.600 1.00 0.00 C ATOM 1593 C PRO A 103 1.572 0.820 2.171 1.00 0.00 C ATOM 1594 O PRO A 103 2.388 0.454 1.291 1.00 0.00 O ATOM 1595 CB PRO A 103 2.399 1.229 4.512 1.00 0.00 C ATOM 1596 CG PRO A 103 3.306 0.363 5.313 1.00 0.00 C ATOM 1597 CD PRO A 103 3.646 -0.790 4.433 1.00 0.00 C ATOM 0 HA PRO A 103 0.593 0.111 3.897 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.962 1.958 3.929 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.720 1.790 5.154 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.203 0.906 5.611 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.819 0.026 6.228 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.487 -0.567 3.777 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.916 -1.676 5.008 1.00 0.00 H new ATOM 1605 N ILE A 104 0.658 1.741 1.967 1.00 0.00 N ATOM 1606 CA ILE A 104 0.376 2.338 0.671 1.00 0.00 C ATOM 1607 C ILE A 104 1.580 3.021 0.031 1.00 0.00 C ATOM 1608 O ILE A 104 1.880 2.799 -1.148 1.00 0.00 O ATOM 1609 CB ILE A 104 -0.828 3.312 0.778 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.121 2.505 0.952 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.903 4.312 -0.386 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.363 3.340 1.028 1.00 0.00 C ATOM 0 H ILE A 104 0.071 2.109 2.716 1.00 0.00 H new ATOM 0 HA ILE A 104 0.119 1.516 0.003 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.684 3.934 1.661 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.216 1.809 0.119 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.043 1.907 1.860 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.766 4.964 -0.251 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.006 4.914 -0.408 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.002 3.769 -1.326 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.230 2.692 1.151 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.294 4.018 1.878 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.469 3.918 0.110 1.00 0.00 H new ATOM 1624 N GLU A 105 2.280 3.811 0.781 1.00 0.00 N ATOM 1625 CA GLU A 105 3.385 4.538 0.228 1.00 0.00 C ATOM 1626 C GLU A 105 4.635 3.683 -0.005 1.00 0.00 C ATOM 1627 O GLU A 105 5.541 4.070 -0.763 1.00 0.00 O ATOM 1628 CB GLU A 105 3.577 5.887 0.912 1.00 0.00 C ATOM 1629 CG GLU A 105 2.391 6.800 0.586 1.00 0.00 C ATOM 1630 CD GLU A 105 2.374 8.133 1.276 1.00 0.00 C ATOM 1631 OE1 GLU A 105 3.385 8.858 1.252 1.00 0.00 O ATOM 1632 OE2 GLU A 105 1.297 8.527 1.784 1.00 0.00 O ATOM 0 H GLU A 105 2.110 3.971 1.774 1.00 0.00 H new ATOM 0 HA GLU A 105 3.128 4.809 -0.796 1.00 0.00 H new ATOM 0 HB2 GLU A 105 3.659 5.751 1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.507 6.347 0.577 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.375 6.971 -0.490 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.472 6.271 0.838 1.00 0.00 H new ATOM 1639 N GLU A 106 4.672 2.503 0.615 1.00 0.00 N ATOM 1640 CA GLU A 106 5.690 1.505 0.287 1.00 0.00 C ATOM 1641 C GLU A 106 5.275 0.781 -0.985 1.00 0.00 C ATOM 1642 O GLU A 106 6.111 0.426 -1.820 1.00 0.00 O ATOM 1643 CB GLU A 106 5.909 0.496 1.417 1.00 0.00 C ATOM 1644 CG GLU A 106 6.885 0.940 2.496 1.00 0.00 C ATOM 1645 CD GLU A 106 6.510 2.229 3.164 1.00 0.00 C ATOM 1646 OE1 GLU A 106 5.679 2.214 4.065 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.077 3.282 2.818 1.00 0.00 O ATOM 0 H GLU A 106 4.015 2.217 1.341 1.00 0.00 H new ATOM 0 HA GLU A 106 6.637 2.025 0.142 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.948 0.282 1.884 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.269 -0.438 0.985 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.956 0.158 3.252 1.00 0.00 H new ATOM 0 HG3 GLU A 106 7.876 1.046 2.054 1.00 0.00 H new ATOM 1654 N LEU A 107 3.971 0.591 -1.132 1.00 0.00 N ATOM 1655 CA LEU A 107 3.384 -0.009 -2.322 1.00 0.00 C ATOM 1656 C LEU A 107 3.720 0.865 -3.536 1.00 0.00 C ATOM 1657 O LEU A 107 4.121 0.365 -4.582 1.00 0.00 O ATOM 1658 CB LEU A 107 1.846 -0.186 -2.099 1.00 0.00 C ATOM 1659 CG LEU A 107 0.981 -0.854 -3.198 1.00 0.00 C ATOM 1660 CD1 LEU A 107 0.671 0.097 -4.331 1.00 0.00 C ATOM 1661 CD2 LEU A 107 1.645 -2.121 -3.731 1.00 0.00 C ATOM 0 H LEU A 107 3.285 0.851 -0.423 1.00 0.00 H new ATOM 0 HA LEU A 107 3.796 -1.000 -2.513 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.714 -0.765 -1.185 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.428 0.803 -1.913 1.00 0.00 H new ATOM 0 HG LEU A 107 0.036 -1.130 -2.731 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.063 -0.413 -5.078 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.125 0.957 -3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 107 1.601 0.433 -4.788 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.014 -2.566 -4.500 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.616 -1.871 -4.158 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.780 -2.832 -2.916 1.00 0.00 H new ATOM 1673 N LEU A 108 3.605 2.170 -3.364 1.00 0.00 N ATOM 1674 CA LEU A 108 3.960 3.122 -4.411 1.00 0.00 C ATOM 1675 C LEU A 108 5.467 3.076 -4.691 1.00 0.00 C ATOM 1676 O LEU A 108 5.905 3.188 -5.833 1.00 0.00 O ATOM 1677 CB LEU A 108 3.537 4.541 -4.018 1.00 0.00 C ATOM 1678 CG LEU A 108 2.040 4.759 -3.775 1.00 0.00 C ATOM 1679 CD1 LEU A 108 1.768 6.200 -3.389 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.231 4.376 -5.002 1.00 0.00 C ATOM 0 H LEU A 108 3.266 2.601 -2.504 1.00 0.00 H new ATOM 0 HA LEU A 108 3.428 2.842 -5.320 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.075 4.820 -3.112 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.859 5.224 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 108 1.733 4.115 -2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.700 6.336 -3.220 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.313 6.441 -2.476 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.095 6.860 -4.192 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.172 4.540 -4.805 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.541 4.989 -5.848 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.399 3.324 -5.235 1.00 0.00 H new ATOM 1692 N ALA A 109 6.248 2.843 -3.646 1.00 0.00 N ATOM 1693 CA ALA A 109 7.706 2.764 -3.757 1.00 0.00 C ATOM 1694 C ALA A 109 8.141 1.422 -4.356 1.00 0.00 C ATOM 1695 O ALA A 109 9.320 1.185 -4.604 1.00 0.00 O ATOM 1696 CB ALA A 109 8.361 2.978 -2.400 1.00 0.00 C ATOM 0 H ALA A 109 5.895 2.703 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 109 8.034 3.557 -4.429 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.444 2.915 -2.505 1.00 0.00 H new ATOM 0 HB2 ALA A 109 8.090 3.962 -2.016 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.019 2.211 -1.706 1.00 0.00 H new ATOM 1702 N SER A 110 7.185 0.547 -4.582 1.00 0.00 N ATOM 1703 CA SER A 110 7.463 -0.722 -5.191 1.00 0.00 C ATOM 1704 C SER A 110 7.467 -0.600 -6.728 1.00 0.00 C ATOM 1705 O SER A 110 7.763 -1.559 -7.434 1.00 0.00 O ATOM 1706 CB SER A 110 6.467 -1.774 -4.704 1.00 0.00 C ATOM 1707 OG SER A 110 6.527 -1.909 -3.278 1.00 0.00 O ATOM 0 H SER A 110 6.204 0.699 -4.349 1.00 0.00 H new ATOM 0 HA SER A 110 8.459 -1.047 -4.891 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.458 -1.493 -5.005 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.685 -2.733 -5.174 1.00 0.00 H new ATOM 0 HG SER A 110 6.323 -1.047 -2.859 1.00 0.00 H new