USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1145 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 Single : A 4 SER OG : rot 180:sc= 0.0727 USER MOD Single : A 6 SER OG : rot 180:sc= 0.04 USER MOD Single : A 9 LYS NZ :NH3+ -106:sc= 1.2 (180deg=-0.345) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0.006 K(o=0.006,f=-0.97) USER MOD Single : A 22 LYS NZ :NH3+ 144:sc= 1.1 (180deg=0.292) USER MOD Single : A 25 GLN : amide:sc= 1 K(o=1,f=-0.26) USER MOD Single : A 26 LYS NZ :NH3+ -162:sc= 1.27 (180deg=0.0552) USER MOD Single : A 27 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.12) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.00997 USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 GLN :FLIP amide:sc= 0 F(o=-0.57!,f=0) USER MOD Single : A 56 ASN : amide:sc= 0.523 K(o=0.52,f=-0.029) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.00991 USER MOD Single : A 68 MET CE :methyl 180:sc= -0.137 (180deg=-0.137) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 167:sc= -0.0445 (180deg=-0.306) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -83:sc= 0.13 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 165:sc= -0.391 (180deg=-0.96) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HE2:sc= -1.82 K(o=-1.8,f=-3.4) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HE2:sc= -1.69 K(o=-1.7,f=-5.7!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 HIS :FLIP no HD1:sc= -0.527 F(o=-1,f=-0.53) USER MOD Single : A 132 HIS : no HE2:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 35.621 66.588 40.045 1.00 0.00 N ATOM 2 CA PRO A 1 36.176 65.658 39.046 1.00 0.00 C ATOM 3 C PRO A 1 35.089 64.746 38.463 1.00 0.00 C ATOM 4 O PRO A 1 33.963 64.724 38.954 1.00 0.00 O ATOM 5 CB PRO A 1 37.253 64.850 39.787 1.00 0.00 C ATOM 6 CG PRO A 1 36.734 64.810 41.231 1.00 0.00 C ATOM 7 CD PRO A 1 36.050 66.171 41.390 1.00 0.00 C ATOM 0 H2 PRO A 1 34.603 66.597 39.989 1.00 0.00 H new ATOM 0 H3 PRO A 1 35.939 67.538 39.854 1.00 0.00 H new ATOM 0 HA PRO A 1 36.596 66.192 38.194 1.00 0.00 H new ATOM 0 HB2 PRO A 1 37.362 63.848 39.371 1.00 0.00 H new ATOM 0 HB3 PRO A 1 38.230 65.329 39.724 1.00 0.00 H new ATOM 0 HG2 PRO A 1 36.036 63.987 41.386 1.00 0.00 H new ATOM 0 HG3 PRO A 1 37.545 64.680 41.948 1.00 0.00 H new ATOM 0 HD2 PRO A 1 35.196 66.099 42.064 1.00 0.00 H new ATOM 0 HD3 PRO A 1 36.735 66.901 41.821 1.00 0.00 H new ATOM 15 N ALA A 2 35.424 64.019 37.395 1.00 0.00 N ATOM 16 CA ALA A 2 34.565 63.077 36.689 1.00 0.00 C ATOM 17 C ALA A 2 35.446 61.903 36.247 1.00 0.00 C ATOM 18 O ALA A 2 36.657 61.930 36.483 1.00 0.00 O ATOM 19 CB ALA A 2 33.900 63.775 35.495 1.00 0.00 C ATOM 0 H ALA A 2 36.354 64.078 36.980 1.00 0.00 H new ATOM 0 HA ALA A 2 33.762 62.709 37.328 1.00 0.00 H new ATOM 0 HB1 ALA A 2 33.259 63.067 34.970 1.00 0.00 H new ATOM 0 HB2 ALA A 2 33.300 64.613 35.851 1.00 0.00 H new ATOM 0 HB3 ALA A 2 34.668 64.142 34.814 1.00 0.00 H new ATOM 25 N ALA A 3 34.851 60.874 35.646 1.00 0.00 N ATOM 26 CA ALA A 3 35.534 59.686 35.156 1.00 0.00 C ATOM 27 C ALA A 3 34.848 59.218 33.871 1.00 0.00 C ATOM 28 O ALA A 3 33.787 59.730 33.508 1.00 0.00 O ATOM 29 CB ALA A 3 35.497 58.590 36.230 1.00 0.00 C ATOM 0 H ALA A 3 33.844 60.847 35.483 1.00 0.00 H new ATOM 0 HA ALA A 3 36.578 59.912 34.938 1.00 0.00 H new ATOM 0 HB1 ALA A 3 36.009 57.701 35.861 1.00 0.00 H new ATOM 0 HB2 ALA A 3 35.995 58.947 37.132 1.00 0.00 H new ATOM 0 HB3 ALA A 3 34.461 58.342 36.461 1.00 0.00 H new ATOM 35 N SER A 4 35.477 58.282 33.166 1.00 0.00 N ATOM 36 CA SER A 4 34.969 57.709 31.930 1.00 0.00 C ATOM 37 C SER A 4 33.822 56.729 32.226 1.00 0.00 C ATOM 38 O SER A 4 33.756 56.197 33.338 1.00 0.00 O ATOM 39 CB SER A 4 36.136 56.984 31.240 1.00 0.00 C ATOM 40 OG SER A 4 36.908 56.243 32.174 1.00 0.00 O ATOM 0 H SER A 4 36.377 57.893 33.448 1.00 0.00 H new ATOM 0 HA SER A 4 34.573 58.490 31.281 1.00 0.00 H new ATOM 0 HB2 SER A 4 35.748 56.314 30.473 1.00 0.00 H new ATOM 0 HB3 SER A 4 36.772 57.712 30.736 1.00 0.00 H new ATOM 0 HG SER A 4 37.642 55.791 31.707 1.00 0.00 H new ATOM 46 N PRO A 5 32.938 56.455 31.251 1.00 0.00 N ATOM 47 CA PRO A 5 31.838 55.520 31.435 1.00 0.00 C ATOM 48 C PRO A 5 32.368 54.076 31.418 1.00 0.00 C ATOM 49 O PRO A 5 33.562 53.829 31.223 1.00 0.00 O ATOM 50 CB PRO A 5 30.887 55.799 30.264 1.00 0.00 C ATOM 51 CG PRO A 5 31.839 56.235 29.151 1.00 0.00 C ATOM 52 CD PRO A 5 32.908 57.020 29.909 1.00 0.00 C ATOM 0 HA PRO A 5 31.328 55.641 32.391 1.00 0.00 H new ATOM 0 HB2 PRO A 5 30.318 54.912 29.985 1.00 0.00 H new ATOM 0 HB3 PRO A 5 30.164 56.578 30.507 1.00 0.00 H new ATOM 0 HG2 PRO A 5 32.263 55.381 28.623 1.00 0.00 H new ATOM 0 HG3 PRO A 5 31.336 56.852 28.407 1.00 0.00 H new ATOM 0 HD2 PRO A 5 33.879 56.927 29.424 1.00 0.00 H new ATOM 0 HD3 PRO A 5 32.667 58.083 29.937 1.00 0.00 H new ATOM 60 N SER A 6 31.472 53.113 31.638 1.00 0.00 N ATOM 61 CA SER A 6 31.796 51.695 31.638 1.00 0.00 C ATOM 62 C SER A 6 32.245 51.243 30.240 1.00 0.00 C ATOM 63 O SER A 6 32.005 51.935 29.246 1.00 0.00 O ATOM 64 CB SER A 6 30.553 50.924 32.106 1.00 0.00 C ATOM 65 OG SER A 6 29.387 51.375 31.432 1.00 0.00 O ATOM 0 H SER A 6 30.487 53.304 31.823 1.00 0.00 H new ATOM 0 HA SER A 6 32.625 51.495 32.316 1.00 0.00 H new ATOM 0 HB2 SER A 6 30.693 49.858 31.924 1.00 0.00 H new ATOM 0 HB3 SER A 6 30.427 51.050 33.181 1.00 0.00 H new ATOM 0 HG SER A 6 28.610 50.867 31.747 1.00 0.00 H new ATOM 71 N ALA A 7 32.854 50.054 30.158 1.00 0.00 N ATOM 72 CA ALA A 7 33.321 49.500 28.895 1.00 0.00 C ATOM 73 C ALA A 7 32.164 49.367 27.900 1.00 0.00 C ATOM 74 O ALA A 7 31.007 49.158 28.276 1.00 0.00 O ATOM 75 CB ALA A 7 33.999 48.146 29.122 1.00 0.00 C ATOM 0 H ALA A 7 33.033 49.456 30.965 1.00 0.00 H new ATOM 0 HA ALA A 7 34.055 50.185 28.471 1.00 0.00 H new ATOM 0 HB1 ALA A 7 34.342 47.746 28.168 1.00 0.00 H new ATOM 0 HB2 ALA A 7 34.851 48.273 29.789 1.00 0.00 H new ATOM 0 HB3 ALA A 7 33.287 47.453 29.571 1.00 0.00 H new ATOM 81 N LEU A 8 32.498 49.492 26.617 1.00 0.00 N ATOM 82 CA LEU A 8 31.538 49.404 25.528 1.00 0.00 C ATOM 83 C LEU A 8 31.231 47.943 25.205 1.00 0.00 C ATOM 84 O LEU A 8 31.962 47.032 25.584 1.00 0.00 O ATOM 85 CB LEU A 8 32.088 50.125 24.282 1.00 0.00 C ATOM 86 CG LEU A 8 32.496 51.595 24.512 1.00 0.00 C ATOM 87 CD1 LEU A 8 33.039 52.185 23.206 1.00 0.00 C ATOM 88 CD2 LEU A 8 31.328 52.457 25.010 1.00 0.00 C ATOM 0 H LEU A 8 33.455 49.659 26.305 1.00 0.00 H new ATOM 0 HA LEU A 8 30.612 49.890 25.836 1.00 0.00 H new ATOM 0 HB2 LEU A 8 32.955 49.575 23.915 1.00 0.00 H new ATOM 0 HB3 LEU A 8 31.333 50.091 23.497 1.00 0.00 H new ATOM 0 HG LEU A 8 33.264 51.602 25.286 1.00 0.00 H new ATOM 0 HD11 LEU A 8 33.327 53.224 23.368 1.00 0.00 H new ATOM 0 HD12 LEU A 8 33.909 51.613 22.882 1.00 0.00 H new ATOM 0 HD13 LEU A 8 32.268 52.138 22.437 1.00 0.00 H new ATOM 0 HD21 LEU A 8 31.669 53.482 25.156 1.00 0.00 H new ATOM 0 HD22 LEU A 8 30.525 52.443 24.273 1.00 0.00 H new ATOM 0 HD23 LEU A 8 30.959 52.059 25.955 1.00 0.00 H new ATOM 100 N LYS A 9 30.135 47.726 24.477 1.00 0.00 N ATOM 101 CA LYS A 9 29.652 46.423 24.030 1.00 0.00 C ATOM 102 C LYS A 9 29.029 46.636 22.656 1.00 0.00 C ATOM 103 O LYS A 9 28.464 47.714 22.416 1.00 0.00 O ATOM 104 CB LYS A 9 28.685 45.812 25.071 1.00 0.00 C ATOM 105 CG LYS A 9 27.362 46.576 25.286 1.00 0.00 C ATOM 106 CD LYS A 9 26.246 46.139 24.313 1.00 0.00 C ATOM 107 CE LYS A 9 25.248 47.254 23.965 1.00 0.00 C ATOM 108 NZ LYS A 9 25.896 48.404 23.289 1.00 0.00 N ATOM 0 H LYS A 9 29.534 48.490 24.170 1.00 0.00 H new ATOM 0 HA LYS A 9 30.457 45.693 23.941 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.449 44.793 24.766 1.00 0.00 H new ATOM 0 HB3 LYS A 9 29.204 45.746 26.027 1.00 0.00 H new ATOM 0 HG2 LYS A 9 27.023 46.423 26.311 1.00 0.00 H new ATOM 0 HG3 LYS A 9 27.543 47.644 25.166 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.703 45.774 23.393 1.00 0.00 H new ATOM 0 HD3 LYS A 9 25.702 45.303 24.752 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.467 46.850 23.320 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.761 47.600 24.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.967 49.202 23.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.848 48.130 22.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.327 48.688 22.466 1.00 0.00 H new ATOM 122 N GLY A 10 29.113 45.648 21.771 1.00 0.00 N ATOM 123 CA GLY A 10 28.581 45.688 20.430 1.00 0.00 C ATOM 124 C GLY A 10 27.646 44.504 20.335 1.00 0.00 C ATOM 125 O GLY A 10 26.933 44.204 21.295 1.00 0.00 O ATOM 0 H GLY A 10 29.575 44.764 21.986 1.00 0.00 H new ATOM 0 HA2 GLY A 10 28.052 46.623 20.245 1.00 0.00 H new ATOM 0 HA3 GLY A 10 29.377 45.620 19.689 1.00 0.00 H new ATOM 129 N VAL A 11 27.603 43.876 19.170 1.00 0.00 N ATOM 130 CA VAL A 11 26.778 42.721 18.883 1.00 0.00 C ATOM 131 C VAL A 11 27.397 42.037 17.658 1.00 0.00 C ATOM 132 O VAL A 11 28.363 42.554 17.094 1.00 0.00 O ATOM 133 CB VAL A 11 25.320 43.208 18.747 1.00 0.00 C ATOM 134 CG1 VAL A 11 25.070 44.071 17.500 1.00 0.00 C ATOM 135 CG2 VAL A 11 24.299 42.063 18.803 1.00 0.00 C ATOM 0 H VAL A 11 28.164 44.171 18.371 1.00 0.00 H new ATOM 0 HA VAL A 11 26.746 41.963 19.666 1.00 0.00 H new ATOM 0 HB VAL A 11 25.171 43.844 19.620 1.00 0.00 H new ATOM 0 HG11 VAL A 11 24.024 44.376 17.472 1.00 0.00 H new ATOM 0 HG12 VAL A 11 25.705 44.956 17.537 1.00 0.00 H new ATOM 0 HG13 VAL A 11 25.304 43.494 16.605 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.292 42.468 18.702 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.492 41.363 17.990 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.387 41.543 19.757 1.00 0.00 H new ATOM 145 N SER A 12 26.913 40.849 17.294 1.00 0.00 N ATOM 146 CA SER A 12 27.383 40.057 16.160 1.00 0.00 C ATOM 147 C SER A 12 28.873 39.679 16.191 1.00 0.00 C ATOM 148 O SER A 12 29.379 39.093 15.241 1.00 0.00 O ATOM 149 CB SER A 12 26.933 40.735 14.865 1.00 0.00 C ATOM 150 OG SER A 12 25.524 40.903 14.893 1.00 0.00 O ATOM 0 H SER A 12 26.153 40.396 17.802 1.00 0.00 H new ATOM 0 HA SER A 12 26.914 39.075 16.227 1.00 0.00 H new ATOM 0 HB2 SER A 12 27.425 41.702 14.756 1.00 0.00 H new ATOM 0 HB3 SER A 12 27.223 40.132 14.005 1.00 0.00 H new ATOM 0 HG SER A 12 25.230 41.339 14.066 1.00 0.00 H new ATOM 156 N GLN A 13 29.548 39.906 17.318 1.00 0.00 N ATOM 157 CA GLN A 13 30.963 39.608 17.525 1.00 0.00 C ATOM 158 C GLN A 13 31.211 38.117 17.248 1.00 0.00 C ATOM 159 O GLN A 13 31.930 37.771 16.316 1.00 0.00 O ATOM 160 CB GLN A 13 31.371 40.072 18.938 1.00 0.00 C ATOM 161 CG GLN A 13 31.371 41.615 19.044 1.00 0.00 C ATOM 162 CD GLN A 13 31.374 42.144 20.483 1.00 0.00 C ATOM 163 OE1 GLN A 13 30.491 42.901 20.882 1.00 0.00 O ATOM 164 NE2 GLN A 13 32.353 41.771 21.293 1.00 0.00 N ATOM 0 H GLN A 13 29.107 40.317 18.141 1.00 0.00 H new ATOM 0 HA GLN A 13 31.599 40.154 16.828 1.00 0.00 H new ATOM 0 HB2 GLN A 13 30.683 39.655 19.673 1.00 0.00 H new ATOM 0 HB3 GLN A 13 32.363 39.689 19.177 1.00 0.00 H new ATOM 0 HG2 GLN A 13 32.246 42.004 18.524 1.00 0.00 H new ATOM 0 HG3 GLN A 13 30.494 42.004 18.527 1.00 0.00 H new ATOM 0 HE21 GLN A 13 33.082 41.143 20.956 1.00 0.00 H new ATOM 0 HE22 GLN A 13 32.378 42.112 22.254 1.00 0.00 H new ATOM 173 N ALA A 14 30.552 37.222 17.992 1.00 0.00 N ATOM 174 CA ALA A 14 30.683 35.770 17.819 1.00 0.00 C ATOM 175 C ALA A 14 30.067 35.267 16.497 1.00 0.00 C ATOM 176 O ALA A 14 30.154 34.079 16.183 1.00 0.00 O ATOM 177 CB ALA A 14 30.052 35.052 19.016 1.00 0.00 C ATOM 0 H ALA A 14 29.908 37.486 18.737 1.00 0.00 H new ATOM 0 HA ALA A 14 31.747 35.540 17.769 1.00 0.00 H new ATOM 0 HB1 ALA A 14 30.150 33.974 18.887 1.00 0.00 H new ATOM 0 HB2 ALA A 14 30.560 35.355 19.931 1.00 0.00 H new ATOM 0 HB3 ALA A 14 28.996 35.315 19.083 1.00 0.00 H new ATOM 183 N LEU A 15 29.343 36.109 15.751 1.00 0.00 N ATOM 184 CA LEU A 15 28.755 35.703 14.479 1.00 0.00 C ATOM 185 C LEU A 15 29.867 35.724 13.431 1.00 0.00 C ATOM 186 O LEU A 15 29.837 34.896 12.524 1.00 0.00 O ATOM 187 CB LEU A 15 27.556 36.579 14.061 1.00 0.00 C ATOM 188 CG LEU A 15 26.200 36.270 14.733 1.00 0.00 C ATOM 189 CD1 LEU A 15 25.563 34.998 14.159 1.00 0.00 C ATOM 190 CD2 LEU A 15 26.267 36.135 16.262 1.00 0.00 C ATOM 0 H LEU A 15 29.153 37.077 16.011 1.00 0.00 H new ATOM 0 HA LEU A 15 28.342 34.699 14.578 1.00 0.00 H new ATOM 0 HB2 LEU A 15 27.808 37.620 14.266 1.00 0.00 H new ATOM 0 HB3 LEU A 15 27.429 36.489 12.982 1.00 0.00 H new ATOM 0 HG LEU A 15 25.585 37.141 14.507 1.00 0.00 H new ATOM 0 HD11 LEU A 15 24.611 34.812 14.656 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.396 35.126 13.089 1.00 0.00 H new ATOM 0 HD13 LEU A 15 26.229 34.151 14.324 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.273 35.918 16.652 1.00 0.00 H new ATOM 0 HD22 LEU A 15 26.945 35.324 16.526 1.00 0.00 H new ATOM 0 HD23 LEU A 15 26.631 37.067 16.694 1.00 0.00 H new ATOM 202 N LEU A 16 30.869 36.605 13.571 1.00 0.00 N ATOM 203 CA LEU A 16 31.994 36.710 12.638 1.00 0.00 C ATOM 204 C LEU A 16 32.800 35.409 12.602 1.00 0.00 C ATOM 205 O LEU A 16 33.323 35.042 11.551 1.00 0.00 O ATOM 206 CB LEU A 16 32.912 37.891 13.002 1.00 0.00 C ATOM 207 CG LEU A 16 32.252 39.276 12.849 1.00 0.00 C ATOM 208 CD1 LEU A 16 33.146 40.352 13.474 1.00 0.00 C ATOM 209 CD2 LEU A 16 31.986 39.632 11.379 1.00 0.00 C ATOM 0 H LEU A 16 30.919 37.269 14.343 1.00 0.00 H new ATOM 0 HA LEU A 16 31.580 36.890 11.646 1.00 0.00 H new ATOM 0 HB2 LEU A 16 33.246 37.772 14.033 1.00 0.00 H new ATOM 0 HB3 LEU A 16 33.801 37.853 12.372 1.00 0.00 H new ATOM 0 HG LEU A 16 31.292 39.235 13.364 1.00 0.00 H new ATOM 0 HD11 LEU A 16 32.673 41.328 13.362 1.00 0.00 H new ATOM 0 HD12 LEU A 16 33.288 40.137 14.533 1.00 0.00 H new ATOM 0 HD13 LEU A 16 34.114 40.358 12.972 1.00 0.00 H new ATOM 0 HD21 LEU A 16 31.521 40.616 11.321 1.00 0.00 H new ATOM 0 HD22 LEU A 16 32.928 39.644 10.831 1.00 0.00 H new ATOM 0 HD23 LEU A 16 31.320 38.889 10.940 1.00 0.00 H new ATOM 221 N GLU A 17 32.863 34.659 13.710 1.00 0.00 N ATOM 222 CA GLU A 17 33.595 33.392 13.753 1.00 0.00 C ATOM 223 C GLU A 17 33.014 32.379 12.756 1.00 0.00 C ATOM 224 O GLU A 17 33.679 31.420 12.366 1.00 0.00 O ATOM 225 CB GLU A 17 33.573 32.790 15.162 1.00 0.00 C ATOM 226 CG GLU A 17 34.563 33.477 16.109 1.00 0.00 C ATOM 227 CD GLU A 17 35.087 32.461 17.117 1.00 0.00 C ATOM 228 OE1 GLU A 17 35.975 31.694 16.701 1.00 0.00 O ATOM 229 OE2 GLU A 17 34.582 32.405 18.253 1.00 0.00 O ATOM 0 H GLU A 17 32.413 34.911 14.590 1.00 0.00 H new ATOM 0 HA GLU A 17 34.626 33.608 13.475 1.00 0.00 H new ATOM 0 HB2 GLU A 17 32.567 32.871 15.573 1.00 0.00 H new ATOM 0 HB3 GLU A 17 33.809 31.727 15.103 1.00 0.00 H new ATOM 0 HG2 GLU A 17 35.390 33.903 15.541 1.00 0.00 H new ATOM 0 HG3 GLU A 17 34.074 34.302 16.628 1.00 0.00 H new ATOM 236 N ARG A 18 31.777 32.579 12.293 1.00 0.00 N ATOM 237 CA ARG A 18 31.128 31.690 11.331 1.00 0.00 C ATOM 238 C ARG A 18 31.810 31.780 9.962 1.00 0.00 C ATOM 239 O ARG A 18 31.439 31.033 9.057 1.00 0.00 O ATOM 240 CB ARG A 18 29.605 31.869 11.362 1.00 0.00 C ATOM 241 CG ARG A 18 29.103 31.448 12.762 1.00 0.00 C ATOM 242 CD ARG A 18 27.727 31.995 13.128 1.00 0.00 C ATOM 243 NE ARG A 18 27.461 31.743 14.559 1.00 0.00 N ATOM 244 CZ ARG A 18 26.777 30.723 15.099 1.00 0.00 C ATOM 245 NH1 ARG A 18 26.143 29.840 14.327 1.00 0.00 N ATOM 246 NH2 ARG A 18 26.737 30.589 16.423 1.00 0.00 N ATOM 0 H ARG A 18 31.196 33.367 12.578 1.00 0.00 H new ATOM 0 HA ARG A 18 31.266 30.647 11.617 1.00 0.00 H new ATOM 0 HB2 ARG A 18 29.339 32.906 11.158 1.00 0.00 H new ATOM 0 HB3 ARG A 18 29.134 31.261 10.590 1.00 0.00 H new ATOM 0 HG2 ARG A 18 29.073 30.360 12.812 1.00 0.00 H new ATOM 0 HG3 ARG A 18 29.824 31.782 13.509 1.00 0.00 H new ATOM 0 HD2 ARG A 18 27.682 33.064 12.922 1.00 0.00 H new ATOM 0 HD3 ARG A 18 26.960 31.520 12.516 1.00 0.00 H new ATOM 0 HE ARG A 18 27.843 32.425 15.214 1.00 0.00 H new ATOM 0 HH11 ARG A 18 26.174 29.935 13.312 1.00 0.00 H new ATOM 0 HH12 ARG A 18 25.627 29.069 14.751 1.00 0.00 H new ATOM 0 HH21 ARG A 18 27.224 31.259 17.018 1.00 0.00 H new ATOM 0 HH22 ARG A 18 26.219 29.816 16.842 1.00 0.00 H new ATOM 260 N ILE A 19 32.725 32.733 9.765 1.00 0.00 N ATOM 261 CA ILE A 19 33.523 32.908 8.557 1.00 0.00 C ATOM 262 C ILE A 19 34.646 31.875 8.735 1.00 0.00 C ATOM 263 O ILE A 19 34.826 31.027 7.870 1.00 0.00 O ATOM 264 CB ILE A 19 34.040 34.361 8.423 1.00 0.00 C ATOM 265 CG1 ILE A 19 32.862 35.362 8.327 1.00 0.00 C ATOM 266 CG2 ILE A 19 34.952 34.493 7.188 1.00 0.00 C ATOM 267 CD1 ILE A 19 33.284 36.827 8.503 1.00 0.00 C ATOM 0 H ILE A 19 32.936 33.432 10.477 1.00 0.00 H new ATOM 0 HA ILE A 19 32.966 32.751 7.634 1.00 0.00 H new ATOM 0 HB ILE A 19 34.618 34.599 9.316 1.00 0.00 H new ATOM 0 HG12 ILE A 19 32.376 35.247 7.358 1.00 0.00 H new ATOM 0 HG13 ILE A 19 32.121 35.112 9.087 1.00 0.00 H new ATOM 0 HG21 ILE A 19 35.308 35.520 7.107 1.00 0.00 H new ATOM 0 HG22 ILE A 19 35.804 33.821 7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 19 34.390 34.232 6.291 1.00 0.00 H new ATOM 0 HD11 ILE A 19 32.408 37.470 8.424 1.00 0.00 H new ATOM 0 HD12 ILE A 19 33.743 36.958 9.483 1.00 0.00 H new ATOM 0 HD13 ILE A 19 34.002 37.095 7.728 1.00 0.00 H new ATOM 279 N ARG A 20 35.360 31.889 9.870 1.00 0.00 N ATOM 280 CA ARG A 20 36.438 30.945 10.189 1.00 0.00 C ATOM 281 C ARG A 20 35.904 29.510 10.088 1.00 0.00 C ATOM 282 O ARG A 20 36.571 28.640 9.538 1.00 0.00 O ATOM 283 CB ARG A 20 37.022 31.336 11.563 1.00 0.00 C ATOM 284 CG ARG A 20 38.067 30.397 12.187 1.00 0.00 C ATOM 285 CD ARG A 20 37.438 29.270 13.026 1.00 0.00 C ATOM 286 NE ARG A 20 38.388 28.750 14.029 1.00 0.00 N ATOM 287 CZ ARG A 20 38.460 29.083 15.327 1.00 0.00 C ATOM 288 NH1 ARG A 20 37.611 29.930 15.871 1.00 0.00 N ATOM 289 NH2 ARG A 20 39.403 28.559 16.102 1.00 0.00 N ATOM 0 H ARG A 20 35.199 32.574 10.608 1.00 0.00 H new ATOM 0 HA ARG A 20 37.263 30.990 9.478 1.00 0.00 H new ATOM 0 HB2 ARG A 20 37.473 32.324 11.467 1.00 0.00 H new ATOM 0 HB3 ARG A 20 36.194 31.430 12.265 1.00 0.00 H new ATOM 0 HG2 ARG A 20 38.672 29.958 11.394 1.00 0.00 H new ATOM 0 HG3 ARG A 20 38.740 30.979 12.817 1.00 0.00 H new ATOM 0 HD2 ARG A 20 36.545 29.643 13.528 1.00 0.00 H new ATOM 0 HD3 ARG A 20 37.120 28.460 12.370 1.00 0.00 H new ATOM 0 HE ARG A 20 39.064 28.062 13.699 1.00 0.00 H new ATOM 0 HH11 ARG A 20 36.876 30.351 15.303 1.00 0.00 H new ATOM 0 HH12 ARG A 20 37.689 30.165 16.860 1.00 0.00 H new ATOM 0 HH21 ARG A 20 40.077 27.900 15.711 1.00 0.00 H new ATOM 0 HH22 ARG A 20 39.454 28.815 17.088 1.00 0.00 H new ATOM 303 N ALA A 21 34.679 29.263 10.555 1.00 0.00 N ATOM 304 CA ALA A 21 33.985 27.997 10.523 1.00 0.00 C ATOM 305 C ALA A 21 33.703 27.507 9.096 1.00 0.00 C ATOM 306 O ALA A 21 33.063 26.471 8.984 1.00 0.00 O ATOM 307 CB ALA A 21 32.683 28.102 11.325 1.00 0.00 C ATOM 0 H ALA A 21 34.119 29.996 10.991 1.00 0.00 H new ATOM 0 HA ALA A 21 34.640 27.255 10.979 1.00 0.00 H new ATOM 0 HB1 ALA A 21 32.161 27.145 11.299 1.00 0.00 H new ATOM 0 HB2 ALA A 21 32.912 28.362 12.358 1.00 0.00 H new ATOM 0 HB3 ALA A 21 32.048 28.873 10.889 1.00 0.00 H new ATOM 313 N LYS A 22 33.988 28.232 7.999 1.00 0.00 N ATOM 314 CA LYS A 22 33.714 27.699 6.662 1.00 0.00 C ATOM 315 C LYS A 22 34.491 26.406 6.506 1.00 0.00 C ATOM 316 O LYS A 22 33.972 25.469 5.917 1.00 0.00 O ATOM 317 CB LYS A 22 34.020 28.725 5.554 1.00 0.00 C ATOM 318 CG LYS A 22 32.758 29.396 4.990 1.00 0.00 C ATOM 319 CD LYS A 22 31.902 30.011 6.102 1.00 0.00 C ATOM 320 CE LYS A 22 30.788 30.914 5.575 1.00 0.00 C ATOM 321 NZ LYS A 22 29.881 31.283 6.682 1.00 0.00 N ATOM 0 H LYS A 22 34.398 29.166 8.014 1.00 0.00 H new ATOM 0 HA LYS A 22 32.650 27.489 6.555 1.00 0.00 H new ATOM 0 HB2 LYS A 22 34.686 29.492 5.951 1.00 0.00 H new ATOM 0 HB3 LYS A 22 34.553 28.228 4.744 1.00 0.00 H new ATOM 0 HG2 LYS A 22 33.044 30.171 4.279 1.00 0.00 H new ATOM 0 HG3 LYS A 22 32.169 28.661 4.441 1.00 0.00 H new ATOM 0 HD2 LYS A 22 31.461 29.211 6.697 1.00 0.00 H new ATOM 0 HD3 LYS A 22 32.543 30.588 6.768 1.00 0.00 H new ATOM 0 HE2 LYS A 22 31.215 31.811 5.127 1.00 0.00 H new ATOM 0 HE3 LYS A 22 30.231 30.401 4.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 29.551 32.260 6.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 29.064 30.640 6.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 30.389 31.208 7.586 1.00 0.00 H new ATOM 335 N GLU A 23 35.667 26.316 7.131 1.00 0.00 N ATOM 336 CA GLU A 23 36.493 25.124 7.081 1.00 0.00 C ATOM 337 C GLU A 23 35.812 23.907 7.704 1.00 0.00 C ATOM 338 O GLU A 23 36.275 22.785 7.500 1.00 0.00 O ATOM 339 CB GLU A 23 37.859 25.425 7.707 1.00 0.00 C ATOM 340 CG GLU A 23 38.743 26.095 6.653 1.00 0.00 C ATOM 341 CD GLU A 23 39.210 25.052 5.619 1.00 0.00 C ATOM 342 OE1 GLU A 23 40.269 24.425 5.827 1.00 0.00 O ATOM 343 OE2 GLU A 23 38.459 24.716 4.671 1.00 0.00 O ATOM 0 H GLU A 23 36.067 27.073 7.685 1.00 0.00 H new ATOM 0 HA GLU A 23 36.645 24.853 6.036 1.00 0.00 H new ATOM 0 HB2 GLU A 23 37.743 26.077 8.573 1.00 0.00 H new ATOM 0 HB3 GLU A 23 38.324 24.505 8.061 1.00 0.00 H new ATOM 0 HG2 GLU A 23 38.190 26.891 6.155 1.00 0.00 H new ATOM 0 HG3 GLU A 23 39.606 26.558 7.131 1.00 0.00 H new ATOM 350 N VAL A 24 34.710 24.083 8.440 1.00 0.00 N ATOM 351 CA VAL A 24 33.988 22.968 9.028 1.00 0.00 C ATOM 352 C VAL A 24 33.434 22.078 7.882 1.00 0.00 C ATOM 353 O VAL A 24 33.204 20.888 8.089 1.00 0.00 O ATOM 354 CB VAL A 24 32.947 23.530 10.036 1.00 0.00 C ATOM 355 CG1 VAL A 24 31.557 23.771 9.425 1.00 0.00 C ATOM 356 CG2 VAL A 24 32.803 22.579 11.231 1.00 0.00 C ATOM 0 H VAL A 24 34.302 24.997 8.639 1.00 0.00 H new ATOM 0 HA VAL A 24 34.620 22.304 9.618 1.00 0.00 H new ATOM 0 HB VAL A 24 33.333 24.500 10.350 1.00 0.00 H new ATOM 0 HG11 VAL A 24 30.886 24.163 10.190 1.00 0.00 H new ATOM 0 HG12 VAL A 24 31.638 24.490 8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 24 31.160 22.831 9.042 1.00 0.00 H new ATOM 0 HG21 VAL A 24 32.071 22.982 11.931 1.00 0.00 H new ATOM 0 HG22 VAL A 24 32.470 21.602 10.881 1.00 0.00 H new ATOM 0 HG23 VAL A 24 33.766 22.476 11.732 1.00 0.00 H new ATOM 366 N GLN A 25 33.307 22.633 6.662 1.00 0.00 N ATOM 367 CA GLN A 25 32.826 22.030 5.421 1.00 0.00 C ATOM 368 C GLN A 25 33.383 20.635 5.132 1.00 0.00 C ATOM 369 O GLN A 25 32.651 19.790 4.612 1.00 0.00 O ATOM 370 CB GLN A 25 33.129 22.979 4.241 1.00 0.00 C ATOM 371 CG GLN A 25 34.642 23.203 3.957 1.00 0.00 C ATOM 372 CD GLN A 25 34.914 24.465 3.124 1.00 0.00 C ATOM 373 OE1 GLN A 25 34.067 24.939 2.377 1.00 0.00 O ATOM 374 NE2 GLN A 25 36.099 25.058 3.215 1.00 0.00 N ATOM 0 H GLN A 25 33.566 23.609 6.515 1.00 0.00 H new ATOM 0 HA GLN A 25 31.752 21.891 5.546 1.00 0.00 H new ATOM 0 HB2 GLN A 25 32.660 22.579 3.342 1.00 0.00 H new ATOM 0 HB3 GLN A 25 32.664 23.944 4.441 1.00 0.00 H new ATOM 0 HG2 GLN A 25 35.177 23.276 4.904 1.00 0.00 H new ATOM 0 HG3 GLN A 25 35.040 22.335 3.432 1.00 0.00 H new ATOM 0 HE21 GLN A 25 36.815 24.675 3.833 1.00 0.00 H new ATOM 0 HE22 GLN A 25 36.293 25.896 2.667 1.00 0.00 H new ATOM 383 N LYS A 26 34.670 20.391 5.415 1.00 0.00 N ATOM 384 CA LYS A 26 35.277 19.094 5.167 1.00 0.00 C ATOM 385 C LYS A 26 34.711 18.059 6.138 1.00 0.00 C ATOM 386 O LYS A 26 34.164 17.064 5.683 1.00 0.00 O ATOM 387 CB LYS A 26 36.806 19.196 5.076 1.00 0.00 C ATOM 388 CG LYS A 26 37.566 19.899 6.219 1.00 0.00 C ATOM 389 CD LYS A 26 38.201 21.238 5.788 1.00 0.00 C ATOM 390 CE LYS A 26 39.392 21.056 4.833 1.00 0.00 C ATOM 391 NZ LYS A 26 39.799 22.336 4.209 1.00 0.00 N ATOM 0 H LYS A 26 35.304 21.082 5.816 1.00 0.00 H new ATOM 0 HA LYS A 26 35.002 18.722 4.180 1.00 0.00 H new ATOM 0 HB2 LYS A 26 37.201 18.184 4.989 1.00 0.00 H new ATOM 0 HB3 LYS A 26 37.049 19.714 4.148 1.00 0.00 H new ATOM 0 HG2 LYS A 26 36.880 20.078 7.047 1.00 0.00 H new ATOM 0 HG3 LYS A 26 38.347 19.236 6.590 1.00 0.00 H new ATOM 0 HD2 LYS A 26 37.444 21.854 5.303 1.00 0.00 H new ATOM 0 HD3 LYS A 26 38.532 21.779 6.674 1.00 0.00 H new ATOM 0 HE2 LYS A 26 40.235 20.634 5.380 1.00 0.00 H new ATOM 0 HE3 LYS A 26 39.127 20.340 4.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 40.378 22.143 3.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 38.952 22.872 3.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 40.353 22.893 4.890 1.00 0.00 H new ATOM 405 N GLN A 27 34.786 18.285 7.453 1.00 0.00 N ATOM 406 CA GLN A 27 34.245 17.344 8.432 1.00 0.00 C ATOM 407 C GLN A 27 32.733 17.167 8.244 1.00 0.00 C ATOM 408 O GLN A 27 32.217 16.065 8.409 1.00 0.00 O ATOM 409 CB GLN A 27 34.562 17.819 9.866 1.00 0.00 C ATOM 410 CG GLN A 27 35.452 16.827 10.623 1.00 0.00 C ATOM 411 CD GLN A 27 34.799 15.451 10.774 1.00 0.00 C ATOM 412 OE1 GLN A 27 33.897 15.268 11.583 1.00 0.00 O ATOM 413 NE2 GLN A 27 35.219 14.475 9.985 1.00 0.00 N ATOM 0 H GLN A 27 35.217 19.114 7.862 1.00 0.00 H new ATOM 0 HA GLN A 27 34.720 16.376 8.274 1.00 0.00 H new ATOM 0 HB2 GLN A 27 35.057 18.789 9.824 1.00 0.00 H new ATOM 0 HB3 GLN A 27 33.630 17.960 10.414 1.00 0.00 H new ATOM 0 HG2 GLN A 27 36.400 16.720 10.097 1.00 0.00 H new ATOM 0 HG3 GLN A 27 35.679 17.228 11.611 1.00 0.00 H new ATOM 0 HE21 GLN A 27 35.971 14.647 9.318 1.00 0.00 H new ATOM 0 HE22 GLN A 27 34.791 13.551 10.044 1.00 0.00 H new ATOM 422 N LEU A 28 32.041 18.237 7.848 1.00 0.00 N ATOM 423 CA LEU A 28 30.601 18.282 7.616 1.00 0.00 C ATOM 424 C LEU A 28 30.133 17.345 6.491 1.00 0.00 C ATOM 425 O LEU A 28 28.928 17.194 6.293 1.00 0.00 O ATOM 426 CB LEU A 28 30.217 19.746 7.340 1.00 0.00 C ATOM 427 CG LEU A 28 28.713 20.064 7.398 1.00 0.00 C ATOM 428 CD1 LEU A 28 28.118 19.693 8.762 1.00 0.00 C ATOM 429 CD2 LEU A 28 28.524 21.564 7.146 1.00 0.00 C ATOM 0 H LEU A 28 32.492 19.135 7.673 1.00 0.00 H new ATOM 0 HA LEU A 28 30.089 17.914 8.505 1.00 0.00 H new ATOM 0 HB2 LEU A 28 30.732 20.380 8.062 1.00 0.00 H new ATOM 0 HB3 LEU A 28 30.590 20.020 6.353 1.00 0.00 H new ATOM 0 HG LEU A 28 28.197 19.478 6.638 1.00 0.00 H new ATOM 0 HD11 LEU A 28 27.054 19.930 8.771 1.00 0.00 H new ATOM 0 HD12 LEU A 28 28.254 18.626 8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 28 28.622 20.259 9.545 1.00 0.00 H new ATOM 0 HD21 LEU A 28 27.462 21.808 7.183 1.00 0.00 H new ATOM 0 HD22 LEU A 28 29.054 22.131 7.911 1.00 0.00 H new ATOM 0 HD23 LEU A 28 28.921 21.821 6.164 1.00 0.00 H new ATOM 441 N ALA A 29 31.056 16.764 5.713 1.00 0.00 N ATOM 442 CA ALA A 29 30.731 15.835 4.639 1.00 0.00 C ATOM 443 C ALA A 29 29.952 14.674 5.258 1.00 0.00 C ATOM 444 O ALA A 29 30.401 14.069 6.232 1.00 0.00 O ATOM 445 CB ALA A 29 32.010 15.334 3.957 1.00 0.00 C ATOM 0 H ALA A 29 32.057 16.932 5.818 1.00 0.00 H new ATOM 0 HA ALA A 29 30.130 16.327 3.874 1.00 0.00 H new ATOM 0 HB1 ALA A 29 31.748 14.641 3.157 1.00 0.00 H new ATOM 0 HB2 ALA A 29 32.555 16.181 3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 29 32.637 14.824 4.689 1.00 0.00 H new ATOM 451 N ARG A 30 28.781 14.369 4.711 1.00 0.00 N ATOM 452 CA ARG A 30 27.893 13.310 5.175 1.00 0.00 C ATOM 453 C ARG A 30 27.297 12.595 3.969 1.00 0.00 C ATOM 454 O ARG A 30 27.758 12.804 2.845 1.00 0.00 O ATOM 455 CB ARG A 30 26.834 13.937 6.101 1.00 0.00 C ATOM 456 CG ARG A 30 25.894 14.904 5.366 1.00 0.00 C ATOM 457 CD ARG A 30 24.914 15.540 6.343 1.00 0.00 C ATOM 458 NE ARG A 30 23.981 16.446 5.658 1.00 0.00 N ATOM 459 CZ ARG A 30 22.899 16.978 6.235 1.00 0.00 C ATOM 460 NH1 ARG A 30 22.671 16.779 7.528 1.00 0.00 N ATOM 461 NH2 ARG A 30 22.039 17.702 5.527 1.00 0.00 N ATOM 0 H ARG A 30 28.411 14.870 3.903 1.00 0.00 H new ATOM 0 HA ARG A 30 28.427 12.555 5.753 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.244 13.143 6.560 1.00 0.00 H new ATOM 0 HB3 ARG A 30 27.335 14.470 6.909 1.00 0.00 H new ATOM 0 HG2 ARG A 30 26.477 15.680 4.869 1.00 0.00 H new ATOM 0 HG3 ARG A 30 25.347 14.369 4.589 1.00 0.00 H new ATOM 0 HD2 ARG A 30 24.353 14.759 6.857 1.00 0.00 H new ATOM 0 HD3 ARG A 30 25.465 16.091 7.105 1.00 0.00 H new ATOM 0 HE ARG A 30 24.171 16.683 4.684 1.00 0.00 H new ATOM 0 HH11 ARG A 30 23.321 16.220 8.080 1.00 0.00 H new ATOM 0 HH12 ARG A 30 21.845 17.185 7.969 1.00 0.00 H new ATOM 0 HH21 ARG A 30 22.201 17.857 4.532 1.00 0.00 H new ATOM 0 HH22 ARG A 30 21.217 18.103 5.979 1.00 0.00 H new ATOM 475 N MET A 31 26.301 11.744 4.182 1.00 0.00 N ATOM 476 CA MET A 31 25.622 11.001 3.126 1.00 0.00 C ATOM 477 C MET A 31 24.112 11.197 3.245 1.00 0.00 C ATOM 478 O MET A 31 23.649 11.985 4.063 1.00 0.00 O ATOM 479 CB MET A 31 26.045 9.529 3.167 1.00 0.00 C ATOM 480 CG MET A 31 25.725 8.873 4.512 1.00 0.00 C ATOM 481 SD MET A 31 25.827 7.076 4.472 1.00 0.00 S ATOM 482 CE MET A 31 25.437 6.760 6.212 1.00 0.00 C ATOM 0 H MET A 31 25.934 11.546 5.113 1.00 0.00 H new ATOM 0 HA MET A 31 25.914 11.383 2.148 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.539 8.985 2.370 1.00 0.00 H new ATOM 0 HB3 MET A 31 27.115 9.455 2.974 1.00 0.00 H new ATOM 0 HG2 MET A 31 26.415 9.252 5.266 1.00 0.00 H new ATOM 0 HG3 MET A 31 24.722 9.166 4.821 1.00 0.00 H new ATOM 0 HE1 MET A 31 25.449 5.686 6.398 1.00 0.00 H new ATOM 0 HE2 MET A 31 26.179 7.246 6.845 1.00 0.00 H new ATOM 0 HE3 MET A 31 24.448 7.157 6.441 1.00 0.00 H new ATOM 492 N THR A 32 23.343 10.524 2.399 1.00 0.00 N ATOM 493 CA THR A 32 21.907 10.520 2.303 1.00 0.00 C ATOM 494 C THR A 32 21.584 9.242 1.516 1.00 0.00 C ATOM 495 O THR A 32 22.480 8.490 1.112 1.00 0.00 O ATOM 496 CB THR A 32 21.422 11.813 1.609 1.00 0.00 C ATOM 497 OG1 THR A 32 20.025 11.939 1.790 1.00 0.00 O ATOM 498 CG2 THR A 32 21.788 11.892 0.118 1.00 0.00 C ATOM 0 H THR A 32 23.760 9.911 1.699 1.00 0.00 H new ATOM 0 HA THR A 32 21.397 10.513 3.266 1.00 0.00 H new ATOM 0 HB THR A 32 21.944 12.646 2.079 1.00 0.00 H new ATOM 0 HG1 THR A 32 19.711 12.758 1.353 1.00 0.00 H new ATOM 0 HG21 THR A 32 21.414 12.827 -0.299 1.00 0.00 H new ATOM 0 HG22 THR A 32 22.872 11.853 0.007 1.00 0.00 H new ATOM 0 HG23 THR A 32 21.338 11.053 -0.412 1.00 0.00 H new ATOM 506 N ARG A 33 20.300 9.001 1.302 1.00 0.00 N ATOM 507 CA ARG A 33 19.714 7.878 0.580 1.00 0.00 C ATOM 508 C ARG A 33 18.928 8.472 -0.583 1.00 0.00 C ATOM 509 O ARG A 33 18.577 9.650 -0.521 1.00 0.00 O ATOM 510 CB ARG A 33 18.851 7.055 1.550 1.00 0.00 C ATOM 511 CG ARG A 33 17.849 7.902 2.359 1.00 0.00 C ATOM 512 CD ARG A 33 17.200 7.147 3.526 1.00 0.00 C ATOM 513 NE ARG A 33 16.728 5.807 3.144 1.00 0.00 N ATOM 514 CZ ARG A 33 15.605 5.179 3.500 1.00 0.00 C ATOM 515 NH1 ARG A 33 14.669 5.785 4.219 1.00 0.00 N ATOM 516 NH2 ARG A 33 15.466 3.914 3.141 1.00 0.00 N ATOM 0 H ARG A 33 19.583 9.634 1.656 1.00 0.00 H new ATOM 0 HA ARG A 33 20.458 7.190 0.180 1.00 0.00 H new ATOM 0 HB2 ARG A 33 18.303 6.301 0.985 1.00 0.00 H new ATOM 0 HB3 ARG A 33 19.504 6.522 2.241 1.00 0.00 H new ATOM 0 HG2 ARG A 33 18.362 8.781 2.748 1.00 0.00 H new ATOM 0 HG3 ARG A 33 17.066 8.260 1.690 1.00 0.00 H new ATOM 0 HD2 ARG A 33 17.920 7.056 4.339 1.00 0.00 H new ATOM 0 HD3 ARG A 33 16.360 7.728 3.907 1.00 0.00 H new ATOM 0 HE ARG A 33 17.344 5.285 2.521 1.00 0.00 H new ATOM 0 HH11 ARG A 33 14.799 6.753 4.513 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.820 5.283 4.478 1.00 0.00 H new ATOM 0 HH21 ARG A 33 16.203 3.451 2.610 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.621 3.402 3.395 1.00 0.00 H new ATOM 530 N CYS A 34 18.622 7.707 -1.633 1.00 0.00 N ATOM 531 CA CYS A 34 17.888 8.262 -2.768 1.00 0.00 C ATOM 532 C CYS A 34 17.045 7.191 -3.459 1.00 0.00 C ATOM 533 O CYS A 34 15.820 7.276 -3.331 1.00 0.00 O ATOM 534 CB CYS A 34 18.842 9.024 -3.706 1.00 0.00 C ATOM 535 SG CYS A 34 17.957 9.671 -5.150 1.00 0.00 S ATOM 0 H CYS A 34 18.866 6.720 -1.720 1.00 0.00 H new ATOM 0 HA CYS A 34 17.170 9.000 -2.410 1.00 0.00 H new ATOM 0 HB2 CYS A 34 19.310 9.846 -3.164 1.00 0.00 H new ATOM 0 HB3 CYS A 34 19.642 8.360 -4.033 1.00 0.00 H new ATOM 0 HG CYS A 34 18.789 10.309 -5.919 1.00 0.00 H new ATOM 541 N PRO A 35 17.626 6.174 -4.130 1.00 0.00 N ATOM 542 CA PRO A 35 16.843 5.149 -4.810 1.00 0.00 C ATOM 543 C PRO A 35 15.935 4.410 -3.837 1.00 0.00 C ATOM 544 O PRO A 35 14.813 4.069 -4.198 1.00 0.00 O ATOM 545 CB PRO A 35 17.852 4.209 -5.480 1.00 0.00 C ATOM 546 CG PRO A 35 19.153 4.459 -4.722 1.00 0.00 C ATOM 547 CD PRO A 35 19.041 5.932 -4.351 1.00 0.00 C ATOM 0 HA PRO A 35 16.178 5.589 -5.553 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.539 3.168 -5.403 1.00 0.00 H new ATOM 0 HB3 PRO A 35 17.960 4.431 -6.542 1.00 0.00 H new ATOM 0 HG2 PRO A 35 19.237 3.824 -3.840 1.00 0.00 H new ATOM 0 HG3 PRO A 35 20.028 4.262 -5.342 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.621 6.156 -3.456 1.00 0.00 H new ATOM 0 HD3 PRO A 35 19.427 6.567 -5.148 1.00 0.00 H new ATOM 555 N GLU A 36 16.374 4.278 -2.582 1.00 0.00 N ATOM 556 CA GLU A 36 15.687 3.602 -1.490 1.00 0.00 C ATOM 557 C GLU A 36 14.233 4.040 -1.297 1.00 0.00 C ATOM 558 O GLU A 36 13.435 3.260 -0.768 1.00 0.00 O ATOM 559 CB GLU A 36 16.460 3.793 -0.187 1.00 0.00 C ATOM 560 CG GLU A 36 17.853 3.163 -0.253 1.00 0.00 C ATOM 561 CD GLU A 36 18.650 3.361 1.033 1.00 0.00 C ATOM 562 OE1 GLU A 36 18.053 3.602 2.109 1.00 0.00 O ATOM 563 OE2 GLU A 36 19.898 3.338 0.951 1.00 0.00 O ATOM 0 H GLU A 36 17.271 4.665 -2.289 1.00 0.00 H new ATOM 0 HA GLU A 36 15.653 2.548 -1.766 1.00 0.00 H new ATOM 0 HB2 GLU A 36 16.553 4.858 0.027 1.00 0.00 H new ATOM 0 HB3 GLU A 36 15.900 3.350 0.636 1.00 0.00 H new ATOM 0 HG2 GLU A 36 17.756 2.096 -0.455 1.00 0.00 H new ATOM 0 HG3 GLU A 36 18.404 3.596 -1.088 1.00 0.00 H new ATOM 570 N GLN A 37 13.874 5.269 -1.698 1.00 0.00 N ATOM 571 CA GLN A 37 12.496 5.754 -1.583 1.00 0.00 C ATOM 572 C GLN A 37 11.542 4.894 -2.425 1.00 0.00 C ATOM 573 O GLN A 37 10.325 4.968 -2.245 1.00 0.00 O ATOM 574 CB GLN A 37 12.402 7.234 -1.963 1.00 0.00 C ATOM 575 CG GLN A 37 12.874 8.105 -0.793 1.00 0.00 C ATOM 576 CD GLN A 37 12.861 9.582 -1.172 1.00 0.00 C ATOM 577 OE1 GLN A 37 11.872 10.114 -1.654 1.00 0.00 O ATOM 578 NE2 GLN A 37 13.966 10.287 -1.013 1.00 0.00 N ATOM 0 H GLN A 37 14.522 5.944 -2.105 1.00 0.00 H new ATOM 0 HA GLN A 37 12.189 5.664 -0.541 1.00 0.00 H new ATOM 0 HB2 GLN A 37 13.013 7.432 -2.844 1.00 0.00 H new ATOM 0 HB3 GLN A 37 11.374 7.487 -2.224 1.00 0.00 H new ATOM 0 HG2 GLN A 37 12.229 7.942 0.070 1.00 0.00 H new ATOM 0 HG3 GLN A 37 13.881 7.810 -0.499 1.00 0.00 H new ATOM 0 HE21 GLN A 37 14.796 9.851 -0.611 1.00 0.00 H new ATOM 0 HE22 GLN A 37 13.990 11.268 -1.292 1.00 0.00 H new ATOM 587 N GLU A 38 12.085 4.029 -3.286 1.00 0.00 N ATOM 588 CA GLU A 38 11.360 3.114 -4.134 1.00 0.00 C ATOM 589 C GLU A 38 10.407 2.277 -3.310 1.00 0.00 C ATOM 590 O GLU A 38 9.380 1.873 -3.826 1.00 0.00 O ATOM 591 CB GLU A 38 12.328 2.148 -4.850 1.00 0.00 C ATOM 592 CG GLU A 38 13.129 1.209 -3.914 1.00 0.00 C ATOM 593 CD GLU A 38 13.834 0.104 -4.694 1.00 0.00 C ATOM 594 OE1 GLU A 38 14.797 0.394 -5.434 1.00 0.00 O ATOM 595 OE2 GLU A 38 13.416 -1.071 -4.566 1.00 0.00 O ATOM 0 H GLU A 38 13.095 3.954 -3.407 1.00 0.00 H new ATOM 0 HA GLU A 38 10.814 3.710 -4.865 1.00 0.00 H new ATOM 0 HB2 GLU A 38 11.757 1.538 -5.549 1.00 0.00 H new ATOM 0 HB3 GLU A 38 13.032 2.735 -5.440 1.00 0.00 H new ATOM 0 HG2 GLU A 38 13.866 1.790 -3.359 1.00 0.00 H new ATOM 0 HG3 GLU A 38 12.456 0.765 -3.181 1.00 0.00 H new ATOM 602 N LEU A 39 10.723 1.977 -2.049 1.00 0.00 N ATOM 603 CA LEU A 39 9.874 1.156 -1.215 1.00 0.00 C ATOM 604 C LEU A 39 8.523 1.834 -1.047 1.00 0.00 C ATOM 605 O LEU A 39 7.479 1.192 -1.111 1.00 0.00 O ATOM 606 CB LEU A 39 10.608 0.913 0.106 1.00 0.00 C ATOM 607 CG LEU A 39 9.852 -0.038 1.034 1.00 0.00 C ATOM 608 CD1 LEU A 39 9.662 -1.438 0.439 1.00 0.00 C ATOM 609 CD2 LEU A 39 10.596 -0.145 2.371 1.00 0.00 C ATOM 0 H LEU A 39 11.574 2.300 -1.588 1.00 0.00 H new ATOM 0 HA LEU A 39 9.671 0.185 -1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 39 11.596 0.502 -0.102 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.759 1.866 0.614 1.00 0.00 H new ATOM 0 HG LEU A 39 8.856 0.382 1.178 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.119 -2.064 1.147 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.096 -1.365 -0.489 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.636 -1.882 0.236 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.058 -0.823 3.034 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.601 -0.529 2.198 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.658 0.840 2.833 1.00 0.00 H new ATOM 621 N ARG A 40 8.550 3.146 -0.831 1.00 0.00 N ATOM 622 CA ARG A 40 7.362 3.955 -0.657 1.00 0.00 C ATOM 623 C ARG A 40 6.595 3.949 -1.965 1.00 0.00 C ATOM 624 O ARG A 40 5.451 3.516 -2.000 1.00 0.00 O ATOM 625 CB ARG A 40 7.753 5.389 -0.244 1.00 0.00 C ATOM 626 CG ARG A 40 8.844 5.451 0.840 1.00 0.00 C ATOM 627 CD ARG A 40 8.426 4.770 2.151 1.00 0.00 C ATOM 628 NE ARG A 40 7.313 5.476 2.802 1.00 0.00 N ATOM 629 CZ ARG A 40 7.306 6.744 3.224 1.00 0.00 C ATOM 630 NH1 ARG A 40 8.442 7.413 3.374 1.00 0.00 N ATOM 631 NH2 ARG A 40 6.149 7.338 3.476 1.00 0.00 N ATOM 0 H ARG A 40 9.417 3.680 -0.772 1.00 0.00 H new ATOM 0 HA ARG A 40 6.733 3.549 0.135 1.00 0.00 H new ATOM 0 HB2 ARG A 40 8.099 5.929 -1.125 1.00 0.00 H new ATOM 0 HB3 ARG A 40 6.865 5.907 0.118 1.00 0.00 H new ATOM 0 HG2 ARG A 40 9.750 4.977 0.463 1.00 0.00 H new ATOM 0 HG3 ARG A 40 9.090 6.494 1.041 1.00 0.00 H new ATOM 0 HD2 ARG A 40 8.134 3.740 1.948 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.279 4.732 2.829 1.00 0.00 H new ATOM 0 HE ARG A 40 6.456 4.942 2.947 1.00 0.00 H new ATOM 0 HH11 ARG A 40 9.332 6.960 3.167 1.00 0.00 H new ATOM 0 HH12 ARG A 40 8.425 8.380 3.697 1.00 0.00 H new ATOM 0 HH21 ARG A 40 5.275 6.828 3.348 1.00 0.00 H new ATOM 0 HH22 ARG A 40 6.132 8.306 3.799 1.00 0.00 H new ATOM 645 N LEU A 41 7.245 4.359 -3.054 1.00 0.00 N ATOM 646 CA LEU A 41 6.603 4.440 -4.365 1.00 0.00 C ATOM 647 C LEU A 41 6.022 3.099 -4.823 1.00 0.00 C ATOM 648 O LEU A 41 4.897 3.066 -5.322 1.00 0.00 O ATOM 649 CB LEU A 41 7.541 5.088 -5.397 1.00 0.00 C ATOM 650 CG LEU A 41 8.194 6.408 -4.914 1.00 0.00 C ATOM 651 CD1 LEU A 41 8.862 7.119 -6.090 1.00 0.00 C ATOM 652 CD2 LEU A 41 7.224 7.404 -4.261 1.00 0.00 C ATOM 0 H LEU A 41 8.225 4.643 -3.053 1.00 0.00 H new ATOM 0 HA LEU A 41 5.739 5.098 -4.270 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.327 4.378 -5.654 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.979 5.285 -6.310 1.00 0.00 H new ATOM 0 HG LEU A 41 8.910 6.103 -4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 41 9.319 8.046 -5.743 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.630 6.474 -6.517 1.00 0.00 H new ATOM 0 HD13 LEU A 41 8.115 7.345 -6.850 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.770 8.296 -3.955 1.00 0.00 H new ATOM 0 HD22 LEU A 41 6.450 7.680 -4.977 1.00 0.00 H new ATOM 0 HD23 LEU A 41 6.763 6.943 -3.387 1.00 0.00 H new ATOM 664 N GLN A 42 6.748 1.996 -4.618 1.00 0.00 N ATOM 665 CA GLN A 42 6.339 0.638 -4.976 1.00 0.00 C ATOM 666 C GLN A 42 5.079 0.254 -4.206 1.00 0.00 C ATOM 667 O GLN A 42 4.226 -0.439 -4.758 1.00 0.00 O ATOM 668 CB GLN A 42 7.453 -0.376 -4.650 1.00 0.00 C ATOM 669 CG GLN A 42 8.529 -0.434 -5.747 1.00 0.00 C ATOM 670 CD GLN A 42 9.788 -1.189 -5.319 1.00 0.00 C ATOM 671 OE1 GLN A 42 10.466 -0.720 -4.293 1.00 0.00 O flip ATOM 672 NE2 GLN A 42 10.202 -2.176 -5.919 1.00 0.00 N flip ATOM 0 H GLN A 42 7.670 2.027 -4.182 1.00 0.00 H new ATOM 0 HA GLN A 42 6.142 0.617 -6.048 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.919 -0.108 -3.701 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.014 -1.366 -4.522 1.00 0.00 H new ATOM 0 HG2 GLN A 42 8.110 -0.912 -6.632 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.802 0.582 -6.033 1.00 0.00 H new ATOM 0 HE21 GLN A 42 9.681 -2.545 -6.715 1.00 0.00 H new ATOM 0 HE22 GLN A 42 11.067 -2.628 -5.622 1.00 0.00 H new ATOM 681 N ARG A 43 4.968 0.629 -2.927 1.00 0.00 N ATOM 682 CA ARG A 43 3.783 0.310 -2.135 1.00 0.00 C ATOM 683 C ARG A 43 2.632 1.231 -2.528 1.00 0.00 C ATOM 684 O ARG A 43 1.520 0.758 -2.734 1.00 0.00 O ATOM 685 CB ARG A 43 4.091 0.422 -0.633 1.00 0.00 C ATOM 686 CG ARG A 43 5.086 -0.638 -0.138 1.00 0.00 C ATOM 687 CD ARG A 43 4.491 -2.047 -0.074 1.00 0.00 C ATOM 688 NE ARG A 43 5.580 -3.036 -0.084 1.00 0.00 N ATOM 689 CZ ARG A 43 5.713 -4.086 -0.898 1.00 0.00 C ATOM 690 NH1 ARG A 43 4.666 -4.524 -1.588 1.00 0.00 N ATOM 691 NH2 ARG A 43 6.880 -4.706 -1.005 1.00 0.00 N ATOM 0 H ARG A 43 5.684 1.152 -2.423 1.00 0.00 H new ATOM 0 HA ARG A 43 3.487 -0.719 -2.339 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.493 1.414 -0.424 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.162 0.330 -0.070 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.954 -0.648 -0.798 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.442 -0.357 0.853 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.890 -2.160 0.829 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.826 -2.212 -0.922 1.00 0.00 H new ATOM 0 HE ARG A 43 6.317 -2.905 0.609 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.763 -4.058 -1.495 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.765 -5.326 -2.211 1.00 0.00 H new ATOM 0 HH21 ARG A 43 7.681 -4.381 -0.464 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.976 -5.508 -1.628 1.00 0.00 H new ATOM 705 N LEU A 44 2.895 2.527 -2.691 1.00 0.00 N ATOM 706 CA LEU A 44 1.891 3.520 -3.052 1.00 0.00 C ATOM 707 C LEU A 44 1.226 3.197 -4.394 1.00 0.00 C ATOM 708 O LEU A 44 0.016 3.369 -4.519 1.00 0.00 O ATOM 709 CB LEU A 44 2.516 4.924 -3.071 1.00 0.00 C ATOM 710 CG LEU A 44 2.945 5.454 -1.686 1.00 0.00 C ATOM 711 CD1 LEU A 44 3.929 6.612 -1.869 1.00 0.00 C ATOM 712 CD2 LEU A 44 1.760 5.924 -0.840 1.00 0.00 C ATOM 0 H LEU A 44 3.829 2.920 -2.573 1.00 0.00 H new ATOM 0 HA LEU A 44 1.108 3.495 -2.294 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.387 4.911 -3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.800 5.621 -3.506 1.00 0.00 H new ATOM 0 HG LEU A 44 3.415 4.627 -1.154 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.234 6.988 -0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.806 6.262 -2.413 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.449 7.412 -2.432 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.121 6.286 0.123 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.239 6.729 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.074 5.092 -0.681 1.00 0.00 H new ATOM 724 N GLU A 45 1.966 2.700 -5.395 1.00 0.00 N ATOM 725 CA GLU A 45 1.430 2.357 -6.704 1.00 0.00 C ATOM 726 C GLU A 45 0.579 1.089 -6.633 1.00 0.00 C ATOM 727 O GLU A 45 0.008 0.688 -7.646 1.00 0.00 O ATOM 728 CB GLU A 45 2.521 2.328 -7.794 1.00 0.00 C ATOM 729 CG GLU A 45 3.506 1.147 -7.753 1.00 0.00 C ATOM 730 CD GLU A 45 4.560 1.201 -8.872 1.00 0.00 C ATOM 731 OE1 GLU A 45 4.813 2.283 -9.453 1.00 0.00 O ATOM 732 OE2 GLU A 45 5.113 0.137 -9.237 1.00 0.00 O ATOM 0 H GLU A 45 2.967 2.525 -5.309 1.00 0.00 H new ATOM 0 HA GLU A 45 0.755 3.154 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.030 2.328 -8.767 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.095 3.252 -7.726 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.011 1.136 -6.787 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.948 0.214 -7.832 1.00 0.00 H new ATOM 739 N ARG A 46 0.506 0.418 -5.470 1.00 0.00 N ATOM 740 CA ARG A 46 -0.335 -0.764 -5.312 1.00 0.00 C ATOM 741 C ARG A 46 -1.758 -0.336 -4.981 1.00 0.00 C ATOM 742 O ARG A 46 -2.582 -1.218 -4.764 1.00 0.00 O ATOM 743 CB ARG A 46 0.221 -1.794 -4.316 1.00 0.00 C ATOM 744 CG ARG A 46 1.491 -2.519 -4.775 1.00 0.00 C ATOM 745 CD ARG A 46 1.679 -2.629 -6.294 1.00 0.00 C ATOM 746 NE ARG A 46 2.876 -3.401 -6.666 1.00 0.00 N ATOM 747 CZ ARG A 46 3.549 -3.313 -7.822 1.00 0.00 C ATOM 748 NH1 ARG A 46 3.153 -2.487 -8.781 1.00 0.00 N ATOM 749 NH2 ARG A 46 4.633 -4.056 -8.024 1.00 0.00 N ATOM 0 H ARG A 46 1.022 0.680 -4.630 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.339 -1.294 -6.265 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.430 -1.289 -3.373 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.551 -2.537 -4.116 1.00 0.00 H new ATOM 0 HG2 ARG A 46 2.354 -2.002 -4.357 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.486 -3.524 -4.354 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.798 -3.099 -6.731 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.751 -1.628 -6.720 1.00 0.00 H new ATOM 0 HE ARG A 46 3.227 -4.067 -5.978 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.325 -1.907 -8.645 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.676 -2.432 -9.655 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.955 -4.696 -7.298 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.142 -3.986 -8.905 1.00 0.00 H new ATOM 763 N LEU A 47 -2.059 0.970 -4.998 1.00 0.00 N ATOM 764 CA LEU A 47 -3.383 1.540 -4.770 1.00 0.00 C ATOM 765 C LEU A 47 -4.411 0.669 -5.519 1.00 0.00 C ATOM 766 O LEU A 47 -5.282 0.093 -4.871 1.00 0.00 O ATOM 767 CB LEU A 47 -3.462 2.996 -5.298 1.00 0.00 C ATOM 768 CG LEU A 47 -3.220 4.157 -4.328 1.00 0.00 C ATOM 769 CD1 LEU A 47 -3.358 5.470 -5.104 1.00 0.00 C ATOM 770 CD2 LEU A 47 -4.199 4.152 -3.163 1.00 0.00 C ATOM 0 H LEU A 47 -1.353 1.683 -5.179 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.589 1.558 -3.700 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.740 3.090 -6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.451 3.134 -5.734 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.220 4.049 -3.908 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.189 6.310 -4.430 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.623 5.496 -5.908 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.360 5.539 -5.526 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.986 4.994 -2.505 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.217 4.237 -3.543 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.097 3.221 -2.606 1.00 0.00 H new ATOM 782 N PRO A 48 -4.305 0.501 -6.856 1.00 0.00 N ATOM 783 CA PRO A 48 -5.262 -0.320 -7.593 1.00 0.00 C ATOM 784 C PRO A 48 -5.057 -1.829 -7.389 1.00 0.00 C ATOM 785 O PRO A 48 -6.003 -2.589 -7.570 1.00 0.00 O ATOM 786 CB PRO A 48 -5.074 0.074 -9.055 1.00 0.00 C ATOM 787 CG PRO A 48 -3.594 0.450 -9.128 1.00 0.00 C ATOM 788 CD PRO A 48 -3.340 1.110 -7.777 1.00 0.00 C ATOM 0 HA PRO A 48 -6.276 -0.140 -7.236 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.314 -0.749 -9.728 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.716 0.910 -9.332 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.962 -0.426 -9.274 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.391 1.131 -9.954 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.317 0.939 -7.443 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.480 2.189 -7.835 1.00 0.00 H new ATOM 796 N GLU A 49 -3.847 -2.286 -7.049 1.00 0.00 N ATOM 797 CA GLU A 49 -3.531 -3.697 -6.821 1.00 0.00 C ATOM 798 C GLU A 49 -4.416 -4.214 -5.680 1.00 0.00 C ATOM 799 O GLU A 49 -5.101 -5.228 -5.840 1.00 0.00 O ATOM 800 CB GLU A 49 -2.024 -3.874 -6.509 1.00 0.00 C ATOM 801 CG GLU A 49 -1.488 -5.284 -6.809 1.00 0.00 C ATOM 802 CD GLU A 49 -0.424 -5.295 -7.917 1.00 0.00 C ATOM 803 OE1 GLU A 49 -0.717 -4.884 -9.069 1.00 0.00 O ATOM 804 OE2 GLU A 49 0.725 -5.694 -7.632 1.00 0.00 O ATOM 0 H GLU A 49 -3.044 -1.670 -6.922 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.736 -4.280 -7.719 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.455 -3.148 -7.090 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.851 -3.646 -5.457 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.062 -5.707 -5.899 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.317 -5.928 -7.102 1.00 0.00 H new ATOM 811 N LEU A 50 -4.397 -3.504 -4.545 1.00 0.00 N ATOM 812 CA LEU A 50 -5.168 -3.802 -3.342 1.00 0.00 C ATOM 813 C LEU A 50 -6.654 -3.662 -3.667 1.00 0.00 C ATOM 814 O LEU A 50 -7.428 -4.590 -3.447 1.00 0.00 O ATOM 815 CB LEU A 50 -4.823 -2.814 -2.205 1.00 0.00 C ATOM 816 CG LEU A 50 -3.643 -3.100 -1.258 1.00 0.00 C ATOM 817 CD1 LEU A 50 -3.787 -4.467 -0.586 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.283 -3.028 -1.968 1.00 0.00 C ATOM 0 H LEU A 50 -3.817 -2.671 -4.440 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.928 -4.814 -3.016 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.639 -1.843 -2.666 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.715 -2.709 -1.587 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.673 -2.316 -0.501 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.938 -4.638 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.710 -4.492 -0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.816 -5.246 -1.348 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.488 -3.238 -1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.252 -3.764 -2.771 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.142 -2.031 -2.385 1.00 0.00 H new ATOM 830 N ALA A 51 -7.058 -2.528 -4.246 1.00 0.00 N ATOM 831 CA ALA A 51 -8.446 -2.259 -4.603 1.00 0.00 C ATOM 832 C ALA A 51 -9.046 -3.389 -5.458 1.00 0.00 C ATOM 833 O ALA A 51 -10.198 -3.797 -5.258 1.00 0.00 O ATOM 834 CB ALA A 51 -8.506 -0.904 -5.302 1.00 0.00 C ATOM 0 H ALA A 51 -6.422 -1.766 -4.481 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.058 -2.223 -3.702 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.537 -0.682 -5.578 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.137 -0.131 -4.629 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -7.887 -0.930 -6.199 1.00 0.00 H new ATOM 840 N ARG A 52 -8.271 -3.921 -6.409 1.00 0.00 N ATOM 841 CA ARG A 52 -8.708 -5.016 -7.268 1.00 0.00 C ATOM 842 C ARG A 52 -8.814 -6.300 -6.454 1.00 0.00 C ATOM 843 O ARG A 52 -9.730 -7.085 -6.708 1.00 0.00 O ATOM 844 CB ARG A 52 -7.747 -5.177 -8.448 1.00 0.00 C ATOM 845 CG ARG A 52 -8.053 -4.155 -9.544 1.00 0.00 C ATOM 846 CD ARG A 52 -7.003 -4.181 -10.657 1.00 0.00 C ATOM 847 NE ARG A 52 -7.620 -4.036 -11.986 1.00 0.00 N ATOM 848 CZ ARG A 52 -7.510 -4.876 -13.024 1.00 0.00 C ATOM 849 NH1 ARG A 52 -6.811 -6.007 -12.948 1.00 0.00 N ATOM 850 NH2 ARG A 52 -8.104 -4.556 -14.165 1.00 0.00 N ATOM 0 H ARG A 52 -7.322 -3.601 -6.602 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.694 -4.789 -7.673 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.720 -5.052 -8.105 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.828 -6.186 -8.853 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.036 -4.360 -9.967 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.096 -3.157 -9.108 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.284 -3.377 -10.499 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.448 -5.118 -10.613 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.194 -3.205 -12.132 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.338 -6.257 -12.079 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -6.749 -6.623 -13.758 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.631 -3.686 -14.239 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.034 -5.180 -14.969 1.00 0.00 H new ATOM 864 N VAL A 53 -7.900 -6.563 -5.512 1.00 0.00 N ATOM 865 CA VAL A 53 -7.982 -7.761 -4.680 1.00 0.00 C ATOM 866 C VAL A 53 -9.284 -7.665 -3.891 1.00 0.00 C ATOM 867 O VAL A 53 -10.053 -8.615 -3.930 1.00 0.00 O ATOM 868 CB VAL A 53 -6.757 -7.936 -3.761 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.989 -8.994 -2.667 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.534 -8.393 -4.559 1.00 0.00 C ATOM 0 H VAL A 53 -7.100 -5.963 -5.310 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.979 -8.651 -5.309 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.593 -6.959 -3.305 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.096 -9.078 -2.047 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.834 -8.697 -2.047 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.201 -9.957 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.684 -8.509 -3.887 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.749 -9.347 -5.040 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.297 -7.649 -5.319 1.00 0.00 H new ATOM 880 N LEU A 54 -9.591 -6.529 -3.253 1.00 0.00 N ATOM 881 CA LEU A 54 -10.821 -6.348 -2.482 1.00 0.00 C ATOM 882 C LEU A 54 -12.047 -6.762 -3.306 1.00 0.00 C ATOM 883 O LEU A 54 -12.808 -7.635 -2.873 1.00 0.00 O ATOM 884 CB LEU A 54 -10.899 -4.909 -1.945 1.00 0.00 C ATOM 885 CG LEU A 54 -12.283 -4.508 -1.396 1.00 0.00 C ATOM 886 CD1 LEU A 54 -12.839 -5.483 -0.358 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.188 -3.130 -0.745 1.00 0.00 C ATOM 0 H LEU A 54 -8.988 -5.707 -3.259 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.810 -7.007 -1.613 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.159 -4.789 -1.154 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.625 -4.220 -2.744 1.00 0.00 H new ATOM 0 HG LEU A 54 -12.962 -4.513 -2.249 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.814 -5.135 -0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.942 -6.471 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.157 -5.538 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.165 -2.843 -0.356 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.467 -3.162 0.072 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.864 -2.399 -1.486 1.00 0.00 H new ATOM 899 N ARG A 55 -12.245 -6.208 -4.510 1.00 0.00 N ATOM 900 CA ARG A 55 -13.412 -6.620 -5.305 1.00 0.00 C ATOM 901 C ARG A 55 -13.395 -8.134 -5.576 1.00 0.00 C ATOM 902 O ARG A 55 -14.459 -8.761 -5.599 1.00 0.00 O ATOM 903 CB ARG A 55 -13.518 -5.824 -6.612 1.00 0.00 C ATOM 904 CG ARG A 55 -14.968 -5.869 -7.123 1.00 0.00 C ATOM 905 CD ARG A 55 -15.197 -5.041 -8.386 1.00 0.00 C ATOM 906 NE ARG A 55 -14.547 -5.577 -9.593 1.00 0.00 N ATOM 907 CZ ARG A 55 -14.872 -5.246 -10.851 1.00 0.00 C ATOM 908 NH1 ARG A 55 -15.928 -4.476 -11.116 1.00 0.00 N ATOM 909 NH2 ARG A 55 -14.116 -5.652 -11.862 1.00 0.00 N ATOM 0 H ARG A 55 -11.644 -5.505 -4.941 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.301 -6.396 -4.715 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.211 -4.791 -6.447 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.844 -6.241 -7.360 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.242 -6.905 -7.323 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.633 -5.510 -6.337 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -16.269 -4.968 -8.568 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.834 -4.028 -8.212 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.793 -6.251 -9.463 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.508 -4.126 -10.354 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -16.156 -4.237 -12.081 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -13.286 -6.217 -11.683 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.365 -5.399 -12.818 1.00 0.00 H new ATOM 923 N ASN A 56 -12.214 -8.724 -5.783 1.00 0.00 N ATOM 924 CA ASN A 56 -12.063 -10.155 -6.027 1.00 0.00 C ATOM 925 C ASN A 56 -12.449 -10.961 -4.783 1.00 0.00 C ATOM 926 O ASN A 56 -13.063 -12.018 -4.914 1.00 0.00 O ATOM 927 CB ASN A 56 -10.650 -10.521 -6.498 1.00 0.00 C ATOM 928 CG ASN A 56 -10.513 -10.338 -7.996 1.00 0.00 C ATOM 929 OD1 ASN A 56 -11.104 -11.092 -8.766 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.795 -9.328 -8.447 1.00 0.00 N ATOM 0 H ASN A 56 -11.330 -8.214 -5.785 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.745 -10.415 -6.837 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -9.918 -9.898 -5.983 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.431 -11.555 -6.233 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.723 -9.162 -9.451 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.312 -8.713 -7.792 1.00 0.00 H new ATOM 937 N VAL A 57 -12.134 -10.478 -3.581 1.00 0.00 N ATOM 938 CA VAL A 57 -12.466 -11.153 -2.330 1.00 0.00 C ATOM 939 C VAL A 57 -13.989 -11.244 -2.226 1.00 0.00 C ATOM 940 O VAL A 57 -14.539 -12.330 -2.085 1.00 0.00 O ATOM 941 CB VAL A 57 -11.832 -10.404 -1.128 1.00 0.00 C ATOM 942 CG1 VAL A 57 -12.319 -10.902 0.241 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.301 -10.509 -1.149 1.00 0.00 C ATOM 0 H VAL A 57 -11.636 -9.598 -3.449 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.056 -12.163 -2.314 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.153 -9.370 -1.250 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.831 -10.330 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.399 -10.772 0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.073 -11.958 0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.888 -9.974 -0.294 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.007 -11.557 -1.097 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.919 -10.070 -2.071 1.00 0.00 H new ATOM 953 N PHE A 58 -14.695 -10.120 -2.375 1.00 0.00 N ATOM 954 CA PHE A 58 -16.152 -10.071 -2.260 1.00 0.00 C ATOM 955 C PHE A 58 -16.858 -10.945 -3.281 1.00 0.00 C ATOM 956 O PHE A 58 -17.910 -11.520 -2.983 1.00 0.00 O ATOM 957 CB PHE A 58 -16.641 -8.625 -2.370 1.00 0.00 C ATOM 958 CG PHE A 58 -16.551 -7.863 -1.070 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.360 -7.861 -0.323 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.678 -7.170 -0.589 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.305 -7.198 0.904 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.602 -6.452 0.614 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.421 -6.500 1.375 1.00 0.00 C ATOM 0 H PHE A 58 -14.269 -9.216 -2.579 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.405 -10.471 -1.278 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -16.054 -8.107 -3.128 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.676 -8.624 -2.713 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.487 -8.373 -0.699 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.603 -7.191 -1.147 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.399 -7.224 1.491 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.444 -5.867 0.953 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.376 -5.995 2.329 1.00 0.00 H new ATOM 973 N VAL A 59 -16.320 -11.015 -4.497 1.00 0.00 N ATOM 974 CA VAL A 59 -16.950 -11.851 -5.511 1.00 0.00 C ATOM 975 C VAL A 59 -16.686 -13.335 -5.198 1.00 0.00 C ATOM 976 O VAL A 59 -17.590 -14.153 -5.352 1.00 0.00 O ATOM 977 CB VAL A 59 -16.576 -11.377 -6.931 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.252 -11.913 -7.467 1.00 0.00 C ATOM 979 CG2 VAL A 59 -17.692 -11.719 -7.916 1.00 0.00 C ATOM 0 H VAL A 59 -15.479 -10.521 -4.796 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.034 -11.744 -5.484 1.00 0.00 H new ATOM 0 HB VAL A 59 -16.447 -10.299 -6.838 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.081 -11.522 -8.470 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.440 -11.599 -6.811 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.288 -13.002 -7.503 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.414 -11.379 -8.913 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -17.846 -12.798 -7.931 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.613 -11.225 -7.608 1.00 0.00 H new ATOM 989 N SER A 60 -15.487 -13.685 -4.714 1.00 0.00 N ATOM 990 CA SER A 60 -15.109 -15.056 -4.380 1.00 0.00 C ATOM 991 C SER A 60 -15.952 -15.540 -3.203 1.00 0.00 C ATOM 992 O SER A 60 -16.457 -16.663 -3.201 1.00 0.00 O ATOM 993 CB SER A 60 -13.612 -15.100 -4.034 1.00 0.00 C ATOM 994 OG SER A 60 -13.166 -16.428 -3.832 1.00 0.00 O ATOM 0 H SER A 60 -14.743 -13.009 -4.542 1.00 0.00 H new ATOM 0 HA SER A 60 -15.290 -15.713 -5.231 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.038 -14.640 -4.838 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.428 -14.512 -3.135 1.00 0.00 H new ATOM 0 HG SER A 60 -12.210 -16.423 -3.615 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.171 -14.657 -2.228 1.00 0.00 N ATOM 1001 CA GLU A 61 -16.938 -14.939 -1.030 1.00 0.00 C ATOM 1002 C GLU A 61 -18.418 -15.182 -1.330 1.00 0.00 C ATOM 1003 O GLU A 61 -19.166 -15.590 -0.442 1.00 0.00 O ATOM 1004 CB GLU A 61 -16.777 -13.761 -0.056 1.00 0.00 C ATOM 1005 CG GLU A 61 -16.814 -14.219 1.409 1.00 0.00 C ATOM 1006 CD GLU A 61 -15.717 -15.249 1.696 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -14.512 -14.909 1.614 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -16.073 -16.423 1.952 1.00 0.00 O ATOM 0 H GLU A 61 -15.808 -13.704 -2.257 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.556 -15.858 -0.585 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.833 -13.253 -0.254 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.572 -13.035 -0.230 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.688 -13.358 2.065 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -17.789 -14.651 1.633 1.00 0.00 H new ATOM 1015 N ARG A 62 -18.872 -14.894 -2.560 1.00 0.00 N ATOM 1016 CA ARG A 62 -20.252 -15.077 -3.011 1.00 0.00 C ATOM 1017 C ARG A 62 -21.273 -14.303 -2.160 1.00 0.00 C ATOM 1018 O ARG A 62 -22.471 -14.447 -2.387 1.00 0.00 O ATOM 1019 CB ARG A 62 -20.498 -16.598 -3.105 1.00 0.00 C ATOM 1020 CG ARG A 62 -21.701 -17.060 -3.940 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.514 -18.558 -4.218 1.00 0.00 C ATOM 1022 NE ARG A 62 -22.649 -19.171 -4.928 1.00 0.00 N ATOM 1023 CZ ARG A 62 -22.672 -20.438 -5.371 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -21.624 -21.243 -5.206 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -23.759 -20.902 -5.987 1.00 0.00 N ATOM 0 H ARG A 62 -18.266 -14.516 -3.288 1.00 0.00 H new ATOM 0 HA ARG A 62 -20.400 -14.637 -3.997 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -19.602 -17.061 -3.517 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.620 -16.985 -2.093 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.633 -16.882 -3.403 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -21.759 -16.500 -4.873 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -20.608 -18.699 -4.807 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -21.364 -19.079 -3.272 1.00 0.00 H new ATOM 0 HE ARG A 62 -23.473 -18.594 -5.094 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -20.786 -20.900 -4.736 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -21.659 -22.203 -5.549 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -24.568 -20.295 -6.120 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -23.782 -21.864 -6.326 1.00 0.00 H new ATOM 1039 N LYS A 63 -20.840 -13.439 -1.230 1.00 0.00 N ATOM 1040 CA LYS A 63 -21.690 -12.646 -0.358 1.00 0.00 C ATOM 1041 C LYS A 63 -21.377 -11.186 -0.625 1.00 0.00 C ATOM 1042 O LYS A 63 -20.209 -10.804 -0.595 1.00 0.00 O ATOM 1043 CB LYS A 63 -21.633 -13.088 1.113 1.00 0.00 C ATOM 1044 CG LYS A 63 -20.292 -12.879 1.826 1.00 0.00 C ATOM 1045 CD LYS A 63 -20.224 -13.539 3.214 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.427 -13.212 4.116 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.447 -14.045 5.334 1.00 0.00 N ATOM 0 H LYS A 63 -19.847 -13.274 -1.066 1.00 0.00 H new ATOM 0 HA LYS A 63 -22.743 -12.810 -0.588 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -22.403 -12.548 1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -21.888 -14.147 1.164 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -19.492 -13.279 1.203 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.109 -11.810 1.932 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.158 -14.620 3.089 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -19.309 -13.220 3.714 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -21.394 -12.159 4.397 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.351 -13.364 3.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -22.273 -13.793 5.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -21.505 -15.049 5.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -20.578 -13.881 5.881 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.388 -10.364 -0.944 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.164 -8.961 -1.235 1.00 0.00 C ATOM 1063 C PRO A 64 -21.904 -8.118 0.017 1.00 0.00 C ATOM 1064 O PRO A 64 -21.579 -6.933 -0.118 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.452 -8.509 -1.928 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.527 -9.369 -1.264 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.807 -10.691 -1.023 1.00 0.00 C ATOM 0 HA PRO A 64 -21.271 -8.829 -1.846 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.638 -7.445 -1.778 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.410 -8.677 -3.004 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.880 -8.926 -0.333 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.398 -9.495 -1.907 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.151 -11.161 -0.102 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.001 -11.395 -1.832 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.108 -8.683 1.207 1.00 0.00 N ATOM 1076 CA ALA A 65 -21.909 -8.035 2.488 1.00 0.00 C ATOM 1077 C ALA A 65 -21.116 -9.002 3.361 1.00 0.00 C ATOM 1078 O ALA A 65 -21.381 -10.204 3.328 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.262 -7.664 3.100 1.00 0.00 C ATOM 0 H ALA A 65 -22.430 -9.646 1.300 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.352 -7.103 2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.105 -7.177 4.063 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.790 -6.984 2.431 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -23.857 -8.566 3.242 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.115 -8.499 4.081 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.225 -9.276 4.946 1.00 0.00 C ATOM 1087 C LEU A 66 -19.203 -8.659 6.344 1.00 0.00 C ATOM 1088 O LEU A 66 -19.574 -7.498 6.504 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.789 -9.249 4.370 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.468 -10.243 3.231 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -18.094 -9.919 1.866 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -15.950 -10.288 3.032 1.00 0.00 C ATOM 0 H LEU A 66 -19.892 -7.504 4.079 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.586 -10.303 4.998 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.590 -8.241 4.006 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.093 -9.436 5.188 1.00 0.00 H new ATOM 0 HG LEU A 66 -17.900 -11.190 3.554 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.803 -10.681 1.142 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.180 -9.902 1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.744 -8.944 1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.709 -10.986 2.230 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.588 -9.294 2.769 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.472 -10.616 3.955 1.00 0.00 H new ATOM 1104 N THR A 67 -18.802 -9.425 7.358 1.00 0.00 N ATOM 1105 CA THR A 67 -18.703 -8.935 8.733 1.00 0.00 C ATOM 1106 C THR A 67 -17.445 -8.071 8.793 1.00 0.00 C ATOM 1107 O THR A 67 -16.475 -8.381 8.097 1.00 0.00 O ATOM 1108 CB THR A 67 -18.570 -10.097 9.735 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.212 -11.265 9.252 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.161 -9.731 11.094 1.00 0.00 C ATOM 0 H THR A 67 -18.536 -10.404 7.249 1.00 0.00 H new ATOM 0 HA THR A 67 -19.601 -8.377 8.999 1.00 0.00 H new ATOM 0 HB THR A 67 -17.504 -10.293 9.851 1.00 0.00 H new ATOM 0 HG1 THR A 67 -19.111 -11.988 9.906 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.051 -10.573 11.777 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.636 -8.865 11.498 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.219 -9.493 10.979 1.00 0.00 H new ATOM 1118 N MET A 68 -17.439 -7.031 9.630 1.00 0.00 N ATOM 1119 CA MET A 68 -16.292 -6.142 9.775 1.00 0.00 C ATOM 1120 C MET A 68 -15.050 -6.942 10.168 1.00 0.00 C ATOM 1121 O MET A 68 -14.010 -6.807 9.529 1.00 0.00 O ATOM 1122 CB MET A 68 -16.617 -5.048 10.802 1.00 0.00 C ATOM 1123 CG MET A 68 -15.501 -4.010 10.979 1.00 0.00 C ATOM 1124 SD MET A 68 -15.064 -3.050 9.500 1.00 0.00 S ATOM 1125 CE MET A 68 -16.565 -2.071 9.240 1.00 0.00 C ATOM 0 H MET A 68 -18.230 -6.784 10.224 1.00 0.00 H new ATOM 0 HA MET A 68 -16.078 -5.658 8.822 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.530 -4.537 10.497 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.820 -5.516 11.765 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.800 -3.315 11.764 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.607 -4.524 11.332 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.437 -1.435 8.364 1.00 0.00 H new ATOM 0 HE2 MET A 68 -17.412 -2.739 9.083 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.750 -1.449 10.116 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.165 -7.836 11.154 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.015 -8.613 11.572 1.00 0.00 C ATOM 1137 C GLU A 69 -13.563 -9.581 10.489 1.00 0.00 C ATOM 1138 O GLU A 69 -12.368 -9.715 10.251 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.315 -9.397 12.858 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.014 -9.989 13.412 1.00 0.00 C ATOM 1141 CD GLU A 69 -11.984 -8.896 13.747 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -12.406 -7.769 14.107 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -10.761 -9.152 13.645 1.00 0.00 O ATOM 0 H GLU A 69 -16.027 -8.031 11.663 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.210 -7.902 11.762 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -14.772 -8.741 13.598 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.031 -10.193 12.653 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.232 -10.570 14.308 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.588 -10.678 12.682 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.505 -10.269 9.846 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.196 -11.239 8.810 1.00 0.00 C ATOM 1152 C VAL A 70 -13.405 -10.571 7.690 1.00 0.00 C ATOM 1153 O VAL A 70 -12.347 -11.091 7.344 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.484 -11.945 8.347 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.266 -12.891 7.161 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.050 -12.780 9.509 1.00 0.00 C ATOM 0 H VAL A 70 -15.503 -10.166 10.032 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.551 -12.026 9.201 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.169 -11.158 8.031 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.213 -13.355 6.887 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.879 -12.327 6.312 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.551 -13.665 7.440 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -16.962 -13.282 9.186 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.315 -13.525 9.814 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.275 -12.126 10.351 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.879 -9.449 7.137 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.178 -8.766 6.050 1.00 0.00 C ATOM 1168 C VAL A 71 -11.809 -8.256 6.518 1.00 0.00 C ATOM 1169 O VAL A 71 -10.845 -8.295 5.752 1.00 0.00 O ATOM 1170 CB VAL A 71 -14.069 -7.681 5.399 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.361 -6.448 6.263 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.463 -7.201 4.076 1.00 0.00 C ATOM 0 H VAL A 71 -14.746 -8.996 7.426 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.972 -9.483 5.256 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.022 -8.189 5.252 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.993 -5.755 5.707 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.874 -6.755 7.174 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.424 -5.956 6.523 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.106 -6.439 3.636 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.475 -6.780 4.260 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.376 -8.043 3.389 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.712 -7.813 7.771 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.488 -7.304 8.360 1.00 0.00 C ATOM 1184 C CYS A 72 -9.459 -8.436 8.412 1.00 0.00 C ATOM 1185 O CYS A 72 -8.373 -8.320 7.840 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.815 -6.703 9.740 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.361 -5.886 10.452 1.00 0.00 S ATOM 0 H CYS A 72 -12.504 -7.801 8.414 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.050 -6.505 7.762 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.630 -5.985 9.645 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.160 -7.490 10.411 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.668 -5.388 11.613 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.821 -9.541 9.066 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.005 -10.731 9.237 1.00 0.00 C ATOM 1195 C ALA A 73 -8.587 -11.313 7.878 1.00 0.00 C ATOM 1196 O ALA A 73 -7.443 -11.733 7.695 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.794 -11.747 10.072 1.00 0.00 C ATOM 0 H ALA A 73 -10.735 -9.629 9.510 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.084 -10.476 9.761 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.196 -12.647 10.210 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.029 -11.315 11.045 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.719 -12.002 9.555 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.498 -11.328 6.906 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.303 -11.834 5.575 1.00 0.00 C ATOM 1205 C ARG A 74 -8.273 -11.016 4.814 1.00 0.00 C ATOM 1206 O ARG A 74 -7.487 -11.597 4.068 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.704 -11.716 4.978 1.00 0.00 C ATOM 1208 CG ARG A 74 -10.871 -11.943 3.500 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.553 -13.380 3.069 1.00 0.00 C ATOM 1210 NE ARG A 74 -9.146 -13.519 2.648 1.00 0.00 N ATOM 1211 CZ ARG A 74 -8.702 -13.579 1.387 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -9.550 -13.687 0.370 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -7.403 -13.527 1.150 1.00 0.00 N ATOM 0 H ARG A 74 -10.440 -10.964 7.048 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.909 -12.850 5.539 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.348 -12.425 5.498 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -11.079 -10.718 5.206 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.896 -11.704 3.216 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -10.221 -11.256 2.958 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.756 -14.062 3.895 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -11.210 -13.669 2.248 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.446 -13.575 3.388 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.554 -13.725 0.545 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.197 -13.732 -0.586 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.746 -13.442 1.926 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -7.057 -13.572 0.191 1.00 0.00 H new ATOM 1227 N MET A 75 -8.300 -9.690 4.955 1.00 0.00 N ATOM 1228 CA MET A 75 -7.366 -8.830 4.252 1.00 0.00 C ATOM 1229 C MET A 75 -6.012 -8.862 4.934 1.00 0.00 C ATOM 1230 O MET A 75 -4.999 -8.931 4.241 1.00 0.00 O ATOM 1231 CB MET A 75 -7.886 -7.385 4.161 1.00 0.00 C ATOM 1232 CG MET A 75 -7.775 -6.863 2.725 1.00 0.00 C ATOM 1233 SD MET A 75 -8.817 -7.695 1.484 1.00 0.00 S ATOM 1234 CE MET A 75 -10.474 -7.409 2.161 1.00 0.00 C ATOM 0 H MET A 75 -8.962 -9.194 5.552 1.00 0.00 H new ATOM 0 HA MET A 75 -7.263 -9.208 3.235 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.925 -7.345 4.489 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.315 -6.744 4.832 1.00 0.00 H new ATOM 0 HG2 MET A 75 -8.024 -5.802 2.726 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.735 -6.946 2.410 1.00 0.00 H new ATOM 0 HE1 MET A 75 -11.222 -7.652 1.407 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.623 -8.040 3.037 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.574 -6.362 2.447 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.974 -8.824 6.268 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.712 -8.838 6.984 1.00 0.00 C ATOM 1246 C VAL A 76 -3.974 -10.158 6.740 1.00 0.00 C ATOM 1247 O VAL A 76 -2.754 -10.138 6.617 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.915 -8.420 8.453 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.382 -9.546 9.372 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.628 -7.805 8.990 1.00 0.00 C ATOM 0 H VAL A 76 -6.801 -8.784 6.864 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.034 -8.080 6.592 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.724 -7.689 8.452 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.499 -9.163 10.386 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.338 -9.932 9.017 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.643 -10.347 9.370 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.772 -7.509 10.029 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.822 -8.536 8.929 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.368 -6.929 8.396 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.669 -11.291 6.578 1.00 0.00 N ATOM 1261 CA ASP A 77 -3.991 -12.569 6.307 1.00 0.00 C ATOM 1262 C ASP A 77 -3.276 -12.503 4.954 1.00 0.00 C ATOM 1263 O ASP A 77 -2.246 -13.139 4.746 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.001 -13.714 6.245 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.364 -15.052 5.847 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -3.369 -15.475 6.479 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -4.897 -15.709 4.920 1.00 0.00 O ATOM 0 H ASP A 77 -5.686 -11.352 6.628 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.278 -12.745 7.112 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.481 -13.821 7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.784 -13.463 5.529 1.00 0.00 H new ATOM 1272 N SER A 78 -3.811 -11.703 4.031 1.00 0.00 N ATOM 1273 CA SER A 78 -3.285 -11.500 2.696 1.00 0.00 C ATOM 1274 C SER A 78 -1.990 -10.669 2.746 1.00 0.00 C ATOM 1275 O SER A 78 -1.364 -10.446 1.704 1.00 0.00 O ATOM 1276 CB SER A 78 -4.402 -10.876 1.838 1.00 0.00 C ATOM 1277 OG SER A 78 -4.261 -11.180 0.459 1.00 0.00 O ATOM 0 H SER A 78 -4.656 -11.160 4.208 1.00 0.00 H new ATOM 0 HA SER A 78 -2.996 -12.443 2.231 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.369 -11.235 2.189 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.397 -9.794 1.971 1.00 0.00 H new ATOM 0 HG SER A 78 -4.992 -10.764 -0.044 1.00 0.00 H new ATOM 1283 N CYS A 79 -1.550 -10.199 3.925 1.00 0.00 N ATOM 1284 CA CYS A 79 -0.327 -9.415 4.056 1.00 0.00 C ATOM 1285 C CYS A 79 0.936 -10.244 3.793 1.00 0.00 C ATOM 1286 O CYS A 79 2.014 -9.660 3.659 1.00 0.00 O ATOM 1287 CB CYS A 79 -0.283 -8.679 5.405 1.00 0.00 C ATOM 1288 SG CYS A 79 0.221 -9.750 6.783 1.00 0.00 S ATOM 0 H CYS A 79 -2.036 -10.356 4.808 1.00 0.00 H new ATOM 0 HA CYS A 79 -0.344 -8.655 3.275 1.00 0.00 H new ATOM 0 HB2 CYS A 79 0.409 -7.840 5.332 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -1.268 -8.262 5.617 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.810 -10.410 7.219 1.00 0.00 H new ATOM 1294 N GLN A 80 0.795 -11.573 3.682 1.00 0.00 N ATOM 1295 CA GLN A 80 1.842 -12.565 3.430 1.00 0.00 C ATOM 1296 C GLN A 80 2.543 -12.415 2.060 1.00 0.00 C ATOM 1297 O GLN A 80 2.604 -13.363 1.275 1.00 0.00 O ATOM 1298 CB GLN A 80 1.231 -13.969 3.622 1.00 0.00 C ATOM 1299 CG GLN A 80 0.050 -14.301 2.685 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.419 -15.742 2.846 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -0.375 -16.510 1.891 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -0.871 -16.138 4.022 1.00 0.00 N ATOM 0 H GLN A 80 -0.122 -12.011 3.773 1.00 0.00 H new ATOM 0 HA GLN A 80 2.644 -12.400 4.149 1.00 0.00 H new ATOM 0 HB2 GLN A 80 2.014 -14.713 3.473 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.894 -14.064 4.654 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.779 -13.625 2.893 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.349 -14.130 1.651 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.900 -15.484 4.804 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.192 -17.098 4.148 1.00 0.00 H new ATOM 1311 N THR A 81 3.070 -11.240 1.734 1.00 0.00 N ATOM 1312 CA THR A 81 3.754 -10.955 0.485 1.00 0.00 C ATOM 1313 C THR A 81 5.042 -10.184 0.793 1.00 0.00 C ATOM 1314 O THR A 81 6.134 -10.761 0.740 1.00 0.00 O ATOM 1315 CB THR A 81 2.755 -10.311 -0.509 1.00 0.00 C ATOM 1316 OG1 THR A 81 3.369 -10.010 -1.744 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.021 -9.049 -0.036 1.00 0.00 C ATOM 0 H THR A 81 3.029 -10.433 2.357 1.00 0.00 H new ATOM 0 HA THR A 81 4.095 -11.850 -0.035 1.00 0.00 H new ATOM 0 HB THR A 81 1.999 -11.090 -0.603 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.710 -9.607 -2.347 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.353 -8.700 -0.824 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.440 -9.279 0.857 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.748 -8.270 0.195 1.00 0.00 H new ATOM 1325 N ALA A 82 4.934 -8.899 1.147 1.00 0.00 N ATOM 1326 CA ALA A 82 6.071 -8.041 1.453 1.00 0.00 C ATOM 1327 C ALA A 82 5.643 -6.728 2.116 1.00 0.00 C ATOM 1328 O ALA A 82 6.271 -5.690 1.913 1.00 0.00 O ATOM 1329 CB ALA A 82 6.796 -7.736 0.138 1.00 0.00 C ATOM 0 H ALA A 82 4.036 -8.423 1.229 1.00 0.00 H new ATOM 0 HA ALA A 82 6.722 -8.559 2.158 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.654 -7.094 0.336 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.137 -8.667 -0.314 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.114 -7.230 -0.545 1.00 0.00 H new ATOM 1335 N LEU A 83 4.539 -6.716 2.854 1.00 0.00 N ATOM 1336 CA LEU A 83 4.041 -5.507 3.504 1.00 0.00 C ATOM 1337 C LEU A 83 3.526 -5.806 4.902 1.00 0.00 C ATOM 1338 O LEU A 83 3.346 -6.965 5.286 1.00 0.00 O ATOM 1339 CB LEU A 83 3.015 -4.781 2.608 1.00 0.00 C ATOM 1340 CG LEU A 83 1.979 -5.668 1.897 1.00 0.00 C ATOM 1341 CD1 LEU A 83 0.996 -6.331 2.859 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.185 -4.877 0.864 1.00 0.00 C ATOM 0 H LEU A 83 3.964 -7.542 3.019 1.00 0.00 H new ATOM 0 HA LEU A 83 4.871 -4.813 3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.480 -4.055 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.561 -4.219 1.850 1.00 0.00 H new ATOM 0 HG LEU A 83 2.559 -6.450 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.292 -6.943 2.295 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.543 -6.961 3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.451 -5.563 3.408 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.462 -5.534 0.380 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.659 -4.059 1.357 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.865 -4.472 0.115 1.00 0.00 H new ATOM 1354 N SER A 84 3.334 -4.740 5.669 1.00 0.00 N ATOM 1355 CA SER A 84 2.862 -4.797 7.036 1.00 0.00 C ATOM 1356 C SER A 84 1.333 -4.721 7.117 1.00 0.00 C ATOM 1357 O SER A 84 0.685 -4.175 6.221 1.00 0.00 O ATOM 1358 CB SER A 84 3.526 -3.647 7.791 1.00 0.00 C ATOM 1359 OG SER A 84 4.879 -3.973 8.041 1.00 0.00 O ATOM 0 H SER A 84 3.509 -3.789 5.343 1.00 0.00 H new ATOM 0 HA SER A 84 3.130 -5.752 7.487 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.463 -2.729 7.207 1.00 0.00 H new ATOM 0 HB3 SER A 84 3.004 -3.464 8.730 1.00 0.00 H new ATOM 0 HG SER A 84 5.309 -3.237 8.524 1.00 0.00 H new ATOM 1365 N PRO A 85 0.743 -5.223 8.216 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.700 -5.200 8.412 1.00 0.00 C ATOM 1367 C PRO A 85 -1.227 -3.770 8.581 1.00 0.00 C ATOM 1368 O PRO A 85 -2.367 -3.502 8.213 1.00 0.00 O ATOM 1369 CB PRO A 85 -0.945 -6.067 9.650 1.00 0.00 C ATOM 1370 CG PRO A 85 0.356 -5.980 10.438 1.00 0.00 C ATOM 1371 CD PRO A 85 1.402 -5.892 9.332 1.00 0.00 C ATOM 0 HA PRO A 85 -1.238 -5.587 7.546 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.788 -5.697 10.233 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -1.175 -7.096 9.375 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.379 -5.106 11.090 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.507 -6.854 11.071 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.276 -5.331 9.664 1.00 0.00 H new ATOM 0 HD3 PRO A 85 1.750 -6.884 9.043 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.409 -2.841 9.088 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.813 -1.460 9.278 1.00 0.00 C ATOM 1381 C GLY A 86 -1.137 -0.802 7.945 1.00 0.00 C ATOM 1382 O GLY A 86 -2.158 -0.123 7.837 1.00 0.00 O ATOM 0 H GLY A 86 0.550 -3.034 9.376 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.685 -1.418 9.930 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.016 -0.909 9.776 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.318 -1.040 6.915 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.532 -0.466 5.594 1.00 0.00 C ATOM 1388 C GLU A 87 -1.777 -1.073 4.941 1.00 0.00 C ATOM 1389 O GLU A 87 -2.481 -0.385 4.204 1.00 0.00 O ATOM 1390 CB GLU A 87 0.748 -0.547 4.746 1.00 0.00 C ATOM 1391 CG GLU A 87 0.901 -1.690 3.740 1.00 0.00 C ATOM 1392 CD GLU A 87 2.010 -1.293 2.767 1.00 0.00 C ATOM 1393 OE1 GLU A 87 3.205 -1.322 3.148 1.00 0.00 O ATOM 1394 OE2 GLU A 87 1.670 -0.827 1.659 1.00 0.00 O ATOM 0 H GLU A 87 0.508 -1.635 6.979 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.742 0.600 5.683 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.838 0.390 4.196 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.594 -0.597 5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 87 1.152 -2.620 4.250 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.035 -1.861 3.207 1.00 0.00 H new ATOM 1401 N MET A 88 -2.061 -2.355 5.217 1.00 0.00 N ATOM 1402 CA MET A 88 -3.236 -3.045 4.688 1.00 0.00 C ATOM 1403 C MET A 88 -4.460 -2.275 5.187 1.00 0.00 C ATOM 1404 O MET A 88 -5.325 -1.884 4.401 1.00 0.00 O ATOM 1405 CB MET A 88 -3.271 -4.502 5.191 1.00 0.00 C ATOM 1406 CG MET A 88 -4.348 -5.355 4.510 1.00 0.00 C ATOM 1407 SD MET A 88 -3.971 -5.876 2.821 1.00 0.00 S ATOM 1408 CE MET A 88 -2.586 -6.986 3.180 1.00 0.00 C ATOM 0 H MET A 88 -1.477 -2.939 5.816 1.00 0.00 H new ATOM 0 HA MET A 88 -3.216 -3.078 3.599 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.296 -4.960 5.024 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.444 -4.503 6.267 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.521 -6.244 5.116 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.281 -4.791 4.499 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.384 -7.609 2.309 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.700 -6.397 3.419 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.839 -7.621 4.029 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.504 -2.042 6.500 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.571 -1.331 7.174 1.00 0.00 C ATOM 1420 C GLU A 89 -5.708 0.079 6.614 1.00 0.00 C ATOM 1421 O GLU A 89 -6.770 0.436 6.118 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.274 -1.293 8.678 1.00 0.00 C ATOM 1423 CG GLU A 89 -6.478 -0.819 9.500 1.00 0.00 C ATOM 1424 CD GLU A 89 -7.430 -1.970 9.818 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -8.232 -2.371 8.944 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -7.384 -2.498 10.955 1.00 0.00 O ATOM 0 H GLU A 89 -3.771 -2.356 7.136 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.516 -1.848 7.008 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.978 -2.287 9.012 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.428 -0.630 8.862 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.130 -0.367 10.429 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.013 -0.045 8.950 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.632 0.871 6.669 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.587 2.256 6.197 1.00 0.00 C ATOM 1435 C LYS A 90 -5.120 2.399 4.772 1.00 0.00 C ATOM 1436 O LYS A 90 -5.703 3.438 4.455 1.00 0.00 O ATOM 1437 CB LYS A 90 -3.143 2.786 6.284 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.621 2.972 7.727 1.00 0.00 C ATOM 1439 CD LYS A 90 -2.783 4.415 8.227 1.00 0.00 C ATOM 1440 CE LYS A 90 -2.609 4.545 9.745 1.00 0.00 C ATOM 1441 NZ LYS A 90 -1.197 4.442 10.168 1.00 0.00 N ATOM 0 H LYS A 90 -3.742 0.555 7.055 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.236 2.848 6.842 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.483 2.097 5.757 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.087 3.742 5.764 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.157 2.297 8.394 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.568 2.692 7.769 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.053 5.051 7.727 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.770 4.782 7.947 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.013 5.503 10.072 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.190 3.768 10.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.137 4.536 11.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.815 3.518 9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.644 5.199 9.718 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.932 1.388 3.920 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.401 1.447 2.550 1.00 0.00 C ATOM 1457 C HIS A 91 -6.907 1.224 2.515 1.00 0.00 C ATOM 1458 O HIS A 91 -7.604 1.912 1.771 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.634 0.450 1.684 1.00 0.00 C ATOM 1460 CG HIS A 91 -5.117 0.460 0.261 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -4.847 1.426 -0.681 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -5.998 -0.426 -0.290 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -5.551 1.123 -1.784 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -6.241 -0.006 -1.600 1.00 0.00 N ATOM 0 H HIS A 91 -4.456 0.520 4.164 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.209 2.435 2.132 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -3.571 0.690 1.709 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -4.745 -0.552 2.098 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -4.226 2.226 -0.563 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -6.427 -1.290 0.196 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -5.558 1.709 -2.691 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.430 0.298 3.327 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.868 0.035 3.378 1.00 0.00 C ATOM 1474 C LEU A 92 -9.609 1.315 3.772 1.00 0.00 C ATOM 1475 O LEU A 92 -10.724 1.559 3.288 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.200 -1.120 4.337 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.618 -2.455 3.844 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -8.544 -3.481 4.976 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.422 -3.033 2.671 1.00 0.00 C ATOM 0 H LEU A 92 -6.876 -0.281 3.958 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.199 -0.275 2.387 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.805 -0.895 5.328 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.282 -1.210 4.438 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.608 -2.243 3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.128 -4.414 4.595 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.906 -3.098 5.773 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.545 -3.663 5.368 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -8.976 -3.976 2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.451 -3.206 2.985 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.410 -2.328 1.839 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.978 2.137 4.615 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.520 3.410 5.065 1.00 0.00 C ATOM 1493 C VAL A 93 -9.593 4.360 3.872 1.00 0.00 C ATOM 1494 O VAL A 93 -10.678 4.816 3.527 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.688 4.022 6.208 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -9.402 5.250 6.786 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -8.415 3.011 7.326 1.00 0.00 C ATOM 0 H VAL A 93 -8.060 1.927 5.007 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.519 3.243 5.468 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.728 4.319 5.785 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.803 5.673 7.593 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -9.534 5.996 6.003 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.377 4.955 7.174 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.826 3.486 8.110 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.361 2.665 7.742 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.864 2.162 6.922 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.452 4.636 3.228 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.362 5.547 2.083 1.00 0.00 C ATOM 1509 C LEU A 94 -9.341 5.150 0.978 1.00 0.00 C ATOM 1510 O LEU A 94 -9.936 6.002 0.313 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.903 5.684 1.609 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.452 4.894 0.368 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.802 5.593 -0.955 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.920 4.775 0.415 1.00 0.00 C ATOM 0 H LEU A 94 -7.555 4.227 3.492 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.671 6.544 2.397 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.717 6.740 1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.258 5.394 2.438 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.965 3.933 0.394 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.457 4.984 -1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.882 5.724 -1.023 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.316 6.568 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.571 4.218 -0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.477 5.771 0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.623 4.251 1.324 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.530 3.844 0.784 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.432 3.322 -0.220 1.00 0.00 C ATOM 1528 C LEU A 95 -11.847 3.805 0.068 1.00 0.00 C ATOM 1529 O LEU A 95 -12.476 4.413 -0.800 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.372 1.791 -0.258 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.336 1.210 -1.227 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.346 -0.314 -1.053 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.635 1.564 -2.692 1.00 0.00 C ATOM 0 H LEU A 95 -9.055 3.122 1.326 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.127 3.689 -1.200 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.155 1.425 0.746 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.356 1.410 -0.530 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.360 1.637 -0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.618 -0.762 -1.729 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.087 -0.564 -0.024 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.339 -0.700 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.871 1.128 -3.335 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.612 1.168 -2.970 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.635 2.647 -2.812 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.345 3.531 1.273 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.678 3.932 1.695 1.00 0.00 C ATOM 1547 C ALA A 96 -13.823 5.450 1.816 1.00 0.00 C ATOM 1548 O ALA A 96 -14.929 5.958 1.627 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.949 3.301 3.058 1.00 0.00 C ATOM 0 H ALA A 96 -11.826 3.020 1.987 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.390 3.597 0.941 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.944 3.586 3.399 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.891 2.216 2.975 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -13.206 3.650 3.775 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.727 6.162 2.092 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.703 7.607 2.264 1.00 0.00 C ATOM 1557 C GLU A 97 -13.040 8.344 0.972 1.00 0.00 C ATOM 1558 O GLU A 97 -13.809 9.307 0.977 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.313 8.026 2.779 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.226 9.495 3.206 1.00 0.00 C ATOM 1561 CD GLU A 97 -12.141 9.774 4.395 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -13.346 10.027 4.186 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -11.653 9.643 5.542 1.00 0.00 O ATOM 0 H GLU A 97 -11.809 5.732 2.204 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.468 7.881 2.990 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -11.045 7.395 3.626 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.576 7.841 1.998 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.197 9.741 3.469 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.504 10.137 2.370 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.469 7.920 -0.157 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.728 8.578 -1.435 1.00 0.00 C ATOM 1572 C LEU A 98 -13.879 7.882 -2.171 1.00 0.00 C ATOM 1573 O LEU A 98 -14.429 8.472 -3.103 1.00 0.00 O ATOM 1574 CB LEU A 98 -11.461 8.651 -2.322 1.00 0.00 C ATOM 1575 CG LEU A 98 -10.109 8.906 -1.604 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.921 8.451 -2.462 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.947 10.376 -1.209 1.00 0.00 C ATOM 0 H LEU A 98 -11.828 7.128 -0.211 1.00 0.00 H new ATOM 0 HA LEU A 98 -13.022 9.606 -1.222 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.380 7.714 -2.873 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.608 9.442 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.120 8.309 -0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.991 8.645 -1.928 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.007 7.384 -2.666 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.920 9.001 -3.403 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.988 10.515 -0.709 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.984 10.999 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.753 10.662 -0.534 1.00 0.00 H new ATOM 1589 N LEU A 99 -14.301 6.679 -1.743 1.00 0.00 N ATOM 1590 CA LEU A 99 -15.364 5.914 -2.401 1.00 0.00 C ATOM 1591 C LEU A 99 -16.501 5.458 -1.464 1.00 0.00 C ATOM 1592 O LEU A 99 -16.692 4.248 -1.280 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.738 4.704 -3.121 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.533 4.990 -4.027 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.784 3.690 -4.337 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -13.981 5.658 -5.319 1.00 0.00 C ATOM 0 H LEU A 99 -13.909 6.211 -0.926 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.840 6.589 -3.112 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.432 3.980 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.512 4.229 -3.724 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.860 5.669 -3.502 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -11.931 3.906 -4.981 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.433 3.242 -3.407 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.454 2.996 -4.844 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.112 5.853 -5.948 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.672 5.001 -5.848 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -14.480 6.599 -5.088 1.00 0.00 H new ATOM 1608 N PRO A 100 -17.320 6.373 -0.915 1.00 0.00 N ATOM 1609 CA PRO A 100 -18.427 5.993 -0.036 1.00 0.00 C ATOM 1610 C PRO A 100 -19.523 5.229 -0.798 1.00 0.00 C ATOM 1611 O PRO A 100 -20.241 4.413 -0.211 1.00 0.00 O ATOM 1612 CB PRO A 100 -18.935 7.305 0.569 1.00 0.00 C ATOM 1613 CG PRO A 100 -18.553 8.356 -0.472 1.00 0.00 C ATOM 1614 CD PRO A 100 -17.235 7.821 -1.035 1.00 0.00 C ATOM 0 HA PRO A 100 -18.106 5.303 0.745 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -20.012 7.279 0.735 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -18.469 7.508 1.533 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -19.314 8.451 -1.247 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -18.430 9.342 -0.024 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -17.101 8.121 -2.074 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -16.383 8.212 -0.478 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.631 5.442 -2.113 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.608 4.788 -2.986 1.00 0.00 C ATOM 1624 C ASP A 101 -20.055 3.475 -3.550 1.00 0.00 C ATOM 1625 O ASP A 101 -20.598 2.923 -4.506 1.00 0.00 O ATOM 1626 CB ASP A 101 -21.108 5.744 -4.072 1.00 0.00 C ATOM 1627 CG ASP A 101 -22.057 6.766 -3.471 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -23.218 6.407 -3.156 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -21.605 7.906 -3.258 1.00 0.00 O ATOM 0 H ASP A 101 -19.024 6.092 -2.612 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.480 4.522 -2.388 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.263 6.251 -4.538 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -21.615 5.182 -4.856 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.925 2.999 -3.023 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.296 1.755 -3.408 1.00 0.00 C ATOM 1636 C TRP A 102 -18.293 0.885 -2.167 1.00 0.00 C ATOM 1637 O TRP A 102 -18.836 -0.211 -2.219 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.879 1.942 -3.952 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.274 0.696 -4.515 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -16.899 -0.107 -5.397 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -14.997 0.047 -4.225 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.069 -1.150 -5.744 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -14.876 -1.101 -5.065 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -13.936 0.283 -3.326 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -13.744 -1.928 -5.072 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.838 -0.596 -3.260 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -12.730 -1.691 -4.133 1.00 0.00 C ATOM 0 H TRP A 102 -18.413 3.493 -2.292 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.850 1.296 -4.227 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.897 2.707 -4.728 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.240 2.314 -3.151 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -17.899 0.044 -5.775 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.311 -1.872 -6.423 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.966 1.148 -2.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -13.655 -2.732 -5.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.065 -0.425 -2.525 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -11.872 -2.345 -4.081 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.696 1.368 -1.071 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.605 0.672 0.202 1.00 0.00 C ATOM 1660 C LEU A 103 -18.436 1.419 1.230 1.00 0.00 C ATOM 1661 O LEU A 103 -18.276 2.628 1.411 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.149 0.638 0.681 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.898 -0.086 2.016 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -16.578 -1.447 2.157 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -14.398 -0.351 2.134 1.00 0.00 C ATOM 0 H LEU A 103 -17.250 2.285 -1.053 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.970 -0.348 0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.544 0.159 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -15.793 1.664 0.774 1.00 0.00 H new ATOM 0 HG LEU A 103 -16.310 0.568 2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -16.339 -1.874 3.131 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -17.658 -1.325 2.069 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -16.223 -2.114 1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.192 -0.864 3.073 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -14.072 -0.974 1.301 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.858 0.596 2.112 1.00 0.00 H new ATOM 1677 N SER A 104 -19.304 0.680 1.900 1.00 0.00 N ATOM 1678 CA SER A 104 -20.185 1.172 2.945 1.00 0.00 C ATOM 1679 C SER A 104 -20.152 0.194 4.114 1.00 0.00 C ATOM 1680 O SER A 104 -19.690 -0.944 3.981 1.00 0.00 O ATOM 1681 CB SER A 104 -21.603 1.358 2.401 1.00 0.00 C ATOM 1682 OG SER A 104 -22.298 2.347 3.140 1.00 0.00 O ATOM 0 H SER A 104 -19.419 -0.318 1.724 1.00 0.00 H new ATOM 0 HA SER A 104 -19.846 2.147 3.295 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.560 1.645 1.350 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.144 0.413 2.451 1.00 0.00 H new ATOM 0 HG SER A 104 -23.202 2.453 2.776 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.623 0.648 5.271 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.678 -0.122 6.500 1.00 0.00 C ATOM 1690 C LEU A 105 -22.001 0.098 7.216 1.00 0.00 C ATOM 1691 O LEU A 105 -22.723 1.075 6.985 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.429 0.074 7.378 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.839 1.488 7.474 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -19.797 2.516 8.072 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.553 1.432 8.306 1.00 0.00 C ATOM 0 H LEU A 105 -20.988 1.594 5.378 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.650 -1.181 6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -19.673 -0.257 8.387 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -18.649 -0.590 7.005 1.00 0.00 H new ATOM 0 HG LEU A 105 -18.637 1.820 6.456 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -19.309 3.490 8.107 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.693 2.581 7.455 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -20.073 2.212 9.082 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -17.124 2.431 8.381 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -17.782 1.059 9.304 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -16.837 0.766 7.825 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.318 -0.863 8.077 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.542 -0.906 8.842 1.00 0.00 C ATOM 1709 C HIS A 106 -23.316 -1.472 10.230 1.00 0.00 C ATOM 1710 O HIS A 106 -23.000 -2.657 10.381 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.561 -1.797 8.116 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.642 -1.563 6.636 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.427 -0.643 5.983 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.798 -2.125 5.721 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.032 -0.627 4.703 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.077 -1.542 4.492 1.00 0.00 N ATOM 0 H HIS A 106 -21.704 -1.656 8.262 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.911 0.115 8.938 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -24.304 -2.841 8.293 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.546 -1.632 8.553 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -26.170 -0.079 6.395 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -23.053 -2.882 5.917 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -25.429 0.033 3.946 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.477 -0.642 11.257 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.329 -1.108 12.623 1.00 0.00 C ATOM 1726 C ARG A 107 -24.679 -1.711 12.966 1.00 0.00 C ATOM 1727 O ARG A 107 -25.686 -0.994 12.946 1.00 0.00 O ATOM 1728 CB ARG A 107 -22.963 0.035 13.573 1.00 0.00 C ATOM 1729 CG ARG A 107 -22.425 -0.491 14.912 1.00 0.00 C ATOM 1730 CD ARG A 107 -23.477 -1.207 15.764 1.00 0.00 C ATOM 1731 NE ARG A 107 -23.420 -0.808 17.170 1.00 0.00 N ATOM 1732 CZ ARG A 107 -24.029 0.257 17.693 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -24.513 1.219 16.912 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -24.163 0.342 19.004 1.00 0.00 N ATOM 0 H ARG A 107 -23.708 0.347 11.166 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.519 -1.830 12.725 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.213 0.672 13.104 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.841 0.655 13.752 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.601 -1.177 14.717 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -22.017 0.344 15.482 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -24.469 -0.992 15.368 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -23.330 -2.284 15.688 1.00 0.00 H new ATOM 0 HE ARG A 107 -22.870 -1.391 17.801 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -24.421 1.148 15.899 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -24.976 2.028 17.327 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -23.803 -0.401 19.603 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -24.627 1.151 19.418 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.729 -3.007 13.224 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.955 -3.705 13.582 1.00 0.00 C ATOM 1750 C ILE A 108 -25.765 -4.080 15.044 1.00 0.00 C ATOM 1751 O ILE A 108 -24.656 -4.384 15.469 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.201 -4.958 12.701 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.860 -4.772 11.208 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.644 -5.469 12.855 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.657 -3.690 10.474 1.00 0.00 C ATOM 0 H ILE A 108 -23.909 -3.613 13.191 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.834 -3.080 13.422 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.502 -5.705 13.077 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.799 -4.536 11.123 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -26.017 -5.722 10.697 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.788 -6.348 12.226 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.827 -5.734 13.896 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.341 -4.688 12.552 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.337 -3.645 9.433 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.720 -3.929 10.517 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.483 -2.725 10.949 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.854 -4.127 15.808 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.837 -4.483 17.227 1.00 0.00 C ATOM 1769 C ARG A 109 -25.992 -5.737 17.506 1.00 0.00 C ATOM 1770 O ARG A 109 -25.238 -5.779 18.478 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.293 -4.603 17.714 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.132 -5.675 17.002 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.616 -5.482 17.312 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.429 -6.442 16.558 1.00 0.00 N ATOM 1775 CZ ARG A 109 -31.987 -6.307 15.351 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -31.933 -5.161 14.678 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -32.593 -7.360 14.819 1.00 0.00 N ATOM 0 H ARG A 109 -27.787 -3.916 15.455 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.344 -3.696 17.798 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.286 -4.820 18.782 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.783 -3.637 17.588 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -28.968 -5.619 15.926 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.813 -6.667 17.321 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.790 -5.610 18.380 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.917 -4.465 17.060 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.591 -7.337 17.019 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -31.456 -4.355 15.081 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.368 -5.089 13.758 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -32.624 -8.242 15.330 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -33.028 -7.287 13.899 1.00 0.00 H new ATOM 1791 N THR A 110 -26.086 -6.733 16.625 1.00 0.00 N ATOM 1792 CA THR A 110 -25.366 -7.985 16.735 1.00 0.00 C ATOM 1793 C THR A 110 -23.880 -7.824 16.377 1.00 0.00 C ATOM 1794 O THR A 110 -23.038 -8.439 17.034 1.00 0.00 O ATOM 1795 CB THR A 110 -26.129 -9.039 15.906 1.00 0.00 C ATOM 1796 OG1 THR A 110 -25.744 -10.370 16.174 1.00 0.00 O ATOM 1797 CG2 THR A 110 -26.054 -8.840 14.388 1.00 0.00 C ATOM 0 H THR A 110 -26.681 -6.682 15.798 1.00 0.00 H new ATOM 0 HA THR A 110 -25.336 -8.334 17.767 1.00 0.00 H new ATOM 0 HB THR A 110 -27.155 -8.875 16.237 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.269 -10.981 15.616 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.619 -9.628 13.889 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.476 -7.870 14.127 1.00 0.00 H new ATOM 0 HG23 THR A 110 -25.013 -8.881 14.067 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.515 -7.034 15.362 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.129 -6.817 14.932 1.00 0.00 C ATOM 1807 C ASP A 111 -22.101 -5.834 13.760 1.00 0.00 C ATOM 1808 O ASP A 111 -23.148 -5.489 13.213 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.499 -8.134 14.427 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.975 -8.188 14.544 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.321 -7.196 14.957 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.447 -9.288 14.277 1.00 0.00 O ATOM 0 H ASP A 111 -24.192 -6.515 14.803 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.574 -6.434 15.788 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -21.925 -8.965 14.989 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.777 -8.279 13.383 1.00 0.00 H new ATOM 1817 N THR A 112 -20.920 -5.390 13.347 1.00 0.00 N ATOM 1818 CA THR A 112 -20.755 -4.479 12.231 1.00 0.00 C ATOM 1819 C THR A 112 -20.554 -5.309 10.963 1.00 0.00 C ATOM 1820 O THR A 112 -19.926 -6.373 10.984 1.00 0.00 O ATOM 1821 CB THR A 112 -19.557 -3.555 12.488 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.750 -2.840 13.690 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.391 -2.523 11.371 1.00 0.00 C ATOM 0 H THR A 112 -20.040 -5.659 13.787 1.00 0.00 H new ATOM 0 HA THR A 112 -21.637 -3.850 12.112 1.00 0.00 H new ATOM 0 HB THR A 112 -18.672 -4.189 12.539 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.981 -2.254 13.849 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.533 -1.887 11.588 1.00 0.00 H new ATOM 0 HG22 THR A 112 -19.232 -3.036 10.422 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.290 -1.910 11.306 1.00 0.00 H new ATOM 1831 N TYR A 113 -21.083 -4.815 9.847 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.979 -5.442 8.540 1.00 0.00 C ATOM 1833 C TYR A 113 -20.590 -4.357 7.544 1.00 0.00 C ATOM 1834 O TYR A 113 -20.672 -3.161 7.836 1.00 0.00 O ATOM 1835 CB TYR A 113 -22.284 -6.153 8.142 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.641 -7.333 9.028 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -23.252 -7.104 10.270 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.334 -8.652 8.639 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.543 -8.167 11.136 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.611 -9.729 9.504 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.205 -9.487 10.766 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.427 -10.503 11.646 1.00 0.00 O ATOM 0 H TYR A 113 -21.610 -3.942 9.830 1.00 0.00 H new ATOM 0 HA TYR A 113 -20.218 -6.222 8.555 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -23.101 -5.432 8.169 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -22.197 -6.499 7.112 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -23.502 -6.095 10.563 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.885 -8.838 7.675 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -24.025 -7.977 12.084 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.370 -10.738 9.205 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.143 -11.351 11.245 1.00 0.00 H new ATOM 1852 N VAL A 114 -20.197 -4.780 6.356 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.767 -3.959 5.246 1.00 0.00 C ATOM 1854 C VAL A 114 -20.553 -4.408 4.014 1.00 0.00 C ATOM 1855 O VAL A 114 -20.995 -5.554 3.945 1.00 0.00 O ATOM 1856 CB VAL A 114 -18.227 -4.109 5.142 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.707 -4.298 3.722 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.515 -2.920 5.793 1.00 0.00 C ATOM 0 H VAL A 114 -20.169 -5.774 6.129 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.969 -2.894 5.363 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.998 -5.028 5.681 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.621 -4.394 3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -18.144 -5.199 3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.984 -3.436 3.115 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.436 -3.050 5.706 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.811 -1.999 5.291 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.790 -2.863 6.846 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.729 -3.514 3.045 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.417 -3.689 1.768 1.00 0.00 C ATOM 1870 C LYS A 115 -20.482 -3.096 0.731 1.00 0.00 C ATOM 1871 O LYS A 115 -19.885 -2.047 0.982 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.728 -2.884 1.757 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.957 -3.699 2.194 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.640 -4.483 1.067 1.00 0.00 C ATOM 1875 CE LYS A 115 -25.127 -3.593 -0.089 1.00 0.00 C ATOM 1876 NZ LYS A 115 -26.054 -2.518 0.330 1.00 0.00 N ATOM 0 H LYS A 115 -20.363 -2.567 3.141 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.655 -4.736 1.582 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.621 -2.023 2.416 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.898 -2.497 0.752 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.654 -4.399 2.973 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.685 -3.022 2.640 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -23.943 -5.224 0.676 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.489 -5.029 1.478 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -24.262 -3.144 -0.577 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -25.623 -4.218 -0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -26.338 -1.961 -0.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.897 -2.939 0.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.579 -1.898 1.016 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.356 -3.759 -0.416 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.503 -3.265 -1.491 1.00 0.00 C ATOM 1892 C LEU A 116 -20.177 -3.444 -2.841 1.00 0.00 C ATOM 1893 O LEU A 116 -20.629 -4.550 -3.156 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.129 -3.933 -1.478 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.164 -3.206 -2.435 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -15.948 -2.690 -1.671 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.788 -4.079 -3.637 1.00 0.00 C ATOM 0 H LEU A 116 -20.832 -4.637 -0.624 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.349 -2.199 -1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.723 -3.923 -0.466 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.224 -4.978 -1.773 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.677 -2.339 -2.851 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.275 -2.179 -2.360 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.273 -1.994 -0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -15.426 -3.528 -1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.107 -3.530 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.301 -4.989 -3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.688 -4.340 -4.193 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.265 -2.379 -3.633 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.877 -2.397 -4.954 1.00 0.00 C ATOM 1911 C ASP A 117 -19.878 -2.999 -5.932 1.00 0.00 C ATOM 1912 O ASP A 117 -19.028 -2.312 -6.502 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.306 -0.983 -5.379 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.584 -0.563 -4.668 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.692 -0.983 -5.079 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -22.492 0.138 -3.641 1.00 0.00 O ATOM 0 H ASP A 117 -19.905 -1.462 -3.367 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.781 -3.005 -4.941 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.510 -0.274 -5.152 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.460 -0.955 -6.458 1.00 0.00 H new ATOM 1921 N LYS A 118 -19.974 -4.305 -6.180 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.067 -4.977 -7.115 1.00 0.00 C ATOM 1923 C LYS A 118 -19.369 -4.585 -8.564 1.00 0.00 C ATOM 1924 O LYS A 118 -18.570 -4.892 -9.451 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.190 -6.496 -6.982 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.965 -7.023 -5.555 1.00 0.00 C ATOM 1927 CD LYS A 118 -18.984 -8.557 -5.518 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.209 -9.183 -6.199 1.00 0.00 C ATOM 1929 NZ LYS A 118 -21.488 -8.781 -5.576 1.00 0.00 N ATOM 0 H LYS A 118 -20.667 -4.918 -5.750 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.054 -4.662 -6.865 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.182 -6.800 -7.318 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.469 -6.968 -7.650 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -18.009 -6.660 -5.177 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.738 -6.631 -4.894 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -18.082 -8.933 -6.000 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.951 -8.886 -4.479 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.218 -8.897 -7.251 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.121 -10.269 -6.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -22.277 -9.235 -6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -21.497 -9.077 -4.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -21.591 -7.748 -5.631 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.512 -3.941 -8.809 1.00 0.00 N ATOM 1944 CA ALA A 119 -20.933 -3.524 -10.136 1.00 0.00 C ATOM 1945 C ALA A 119 -20.181 -2.296 -10.646 1.00 0.00 C ATOM 1946 O ALA A 119 -20.078 -2.130 -11.864 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.434 -3.239 -10.116 1.00 0.00 C ATOM 0 H ALA A 119 -21.177 -3.694 -8.076 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.701 -4.339 -10.822 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.758 -2.925 -11.108 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -22.972 -4.142 -9.827 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.644 -2.446 -9.398 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.665 -1.439 -9.754 1.00 0.00 N ATOM 1954 CA VAL A 120 -18.938 -0.236 -10.154 1.00 0.00 C ATOM 1955 C VAL A 120 -17.766 -0.681 -11.031 1.00 0.00 C ATOM 1956 O VAL A 120 -17.022 -1.589 -10.645 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.505 0.619 -8.949 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.179 2.043 -9.394 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -19.579 0.732 -7.870 1.00 0.00 C ATOM 0 H VAL A 120 -19.741 -1.562 -8.744 1.00 0.00 H new ATOM 0 HA VAL A 120 -19.589 0.425 -10.726 1.00 0.00 H new ATOM 0 HB VAL A 120 -17.635 0.110 -8.535 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.875 2.634 -8.530 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.368 2.020 -10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.061 2.493 -9.849 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.208 1.348 -7.050 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.473 1.191 -8.293 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -19.824 -0.262 -7.495 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.653 -0.094 -12.221 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.621 -0.429 -13.192 1.00 0.00 C ATOM 1971 C ASP A 121 -15.231 -0.125 -12.668 1.00 0.00 C ATOM 1972 O ASP A 121 -14.886 1.028 -12.408 1.00 0.00 O ATOM 1973 CB ASP A 121 -16.904 0.202 -14.560 1.00 0.00 C ATOM 1974 CG ASP A 121 -16.707 -0.866 -15.628 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -17.502 -1.835 -15.628 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -15.747 -0.769 -16.427 1.00 0.00 O ATOM 0 H ASP A 121 -18.287 0.639 -12.540 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.651 -1.508 -13.346 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.921 0.592 -14.595 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.234 1.044 -14.736 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.420 -1.176 -12.533 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.062 -1.083 -12.022 1.00 0.00 C ATOM 1983 C LEU A 122 -12.206 -0.101 -12.808 1.00 0.00 C ATOM 1984 O LEU A 122 -11.355 0.553 -12.223 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.406 -2.469 -11.942 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.646 -2.710 -10.626 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.472 -1.757 -10.426 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.582 -2.672 -9.416 1.00 0.00 C ATOM 0 H LEU A 122 -14.697 -2.126 -12.780 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.131 -0.685 -11.010 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.175 -3.234 -12.054 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.716 -2.585 -12.778 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.228 -3.713 -10.709 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -9.979 -1.980 -9.480 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -9.761 -1.879 -11.243 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.836 -0.730 -10.412 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.008 -2.846 -8.506 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.064 -1.696 -9.359 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.342 -3.447 -9.519 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.414 0.041 -14.116 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.621 0.996 -14.887 1.00 0.00 C ATOM 2002 C ALA A 123 -11.861 2.412 -14.341 1.00 0.00 C ATOM 2003 O ALA A 123 -10.918 3.179 -14.155 1.00 0.00 O ATOM 2004 CB ALA A 123 -11.978 0.886 -16.364 1.00 0.00 C ATOM 0 H ALA A 123 -13.107 -0.479 -14.653 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.559 0.773 -14.789 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.385 1.600 -16.936 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.768 -0.124 -16.715 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.037 1.104 -16.499 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.123 2.750 -14.056 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.494 4.047 -13.519 1.00 0.00 C ATOM 2012 C GLY A 124 -13.017 4.193 -12.077 1.00 0.00 C ATOM 2013 O GLY A 124 -12.667 5.297 -11.657 1.00 0.00 O ATOM 0 H GLY A 124 -13.914 2.122 -14.195 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.060 4.837 -14.132 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.576 4.168 -13.563 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.007 3.093 -11.314 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.554 3.078 -9.927 1.00 0.00 C ATOM 2019 C LEU A 125 -11.055 3.335 -9.907 1.00 0.00 C ATOM 2020 O LEU A 125 -10.620 4.259 -9.232 1.00 0.00 O ATOM 2021 CB LEU A 125 -12.880 1.758 -9.224 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.372 1.593 -8.899 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.614 0.180 -8.381 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -14.840 2.619 -7.859 1.00 0.00 C ATOM 0 H LEU A 125 -13.317 2.181 -11.650 1.00 0.00 H new ATOM 0 HA LEU A 125 -13.082 3.859 -9.380 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.559 0.930 -9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.305 1.695 -8.300 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.946 1.763 -9.810 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.671 0.054 -8.148 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.322 -0.542 -9.144 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.022 0.016 -7.481 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -15.900 2.472 -7.654 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.271 2.489 -6.938 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.681 3.626 -8.245 1.00 0.00 H new ATOM 2036 N THR A 126 -10.262 2.575 -10.664 1.00 0.00 N ATOM 2037 CA THR A 126 -8.824 2.772 -10.726 1.00 0.00 C ATOM 2038 C THR A 126 -8.511 4.212 -11.132 1.00 0.00 C ATOM 2039 O THR A 126 -7.647 4.823 -10.515 1.00 0.00 O ATOM 2040 CB THR A 126 -8.203 1.770 -11.706 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.343 0.453 -11.216 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.716 2.054 -11.919 1.00 0.00 C ATOM 0 H THR A 126 -10.602 1.810 -11.247 1.00 0.00 H new ATOM 0 HA THR A 126 -8.390 2.597 -9.741 1.00 0.00 H new ATOM 0 HB THR A 126 -8.728 1.875 -12.655 1.00 0.00 H new ATOM 0 HG1 THR A 126 -7.944 -0.177 -11.852 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.303 1.327 -12.619 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.592 3.058 -12.324 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.191 1.979 -10.967 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.203 4.777 -12.126 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.957 6.143 -12.569 1.00 0.00 C ATOM 2052 C ALA A 127 -9.121 7.134 -11.407 1.00 0.00 C ATOM 2053 O ALA A 127 -8.169 7.836 -11.030 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.887 6.458 -13.742 1.00 0.00 C ATOM 0 H ALA A 127 -9.944 4.300 -12.640 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.927 6.244 -12.911 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.711 7.479 -14.082 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.689 5.764 -14.559 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.924 6.356 -13.422 1.00 0.00 H new ATOM 2060 N ARG A 128 -10.324 7.193 -10.825 1.00 0.00 N ATOM 2061 CA ARG A 128 -10.599 8.101 -9.715 1.00 0.00 C ATOM 2062 C ARG A 128 -9.668 7.809 -8.534 1.00 0.00 C ATOM 2063 O ARG A 128 -9.175 8.750 -7.938 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.091 8.107 -9.339 1.00 0.00 C ATOM 2065 CG ARG A 128 -12.566 6.809 -8.686 1.00 0.00 C ATOM 2066 CD ARG A 128 -14.077 6.737 -8.489 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.803 6.522 -9.748 1.00 0.00 N ATOM 2068 CZ ARG A 128 -16.083 6.140 -9.821 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -16.799 5.944 -8.719 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.634 5.926 -11.006 1.00 0.00 N ATOM 0 H ARG A 128 -11.120 6.621 -11.107 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.380 9.119 -10.036 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -12.282 8.937 -8.658 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -12.682 8.289 -10.237 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -12.248 5.967 -9.300 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -12.077 6.700 -7.718 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -14.311 5.928 -7.797 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -14.424 7.662 -8.028 1.00 0.00 H new ATOM 0 HE ARG A 128 -14.299 6.674 -10.622 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -16.374 6.085 -7.803 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -17.774 5.653 -8.789 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -16.083 6.053 -11.855 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.609 5.635 -11.070 1.00 0.00 H new ATOM 2084 N LEU A 129 -9.364 6.549 -8.223 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.474 6.188 -7.117 1.00 0.00 C ATOM 2086 C LEU A 129 -7.060 6.716 -7.378 1.00 0.00 C ATOM 2087 O LEU A 129 -6.431 7.275 -6.489 1.00 0.00 O ATOM 2088 CB LEU A 129 -8.466 4.657 -6.957 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.568 4.143 -5.816 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.050 4.647 -4.455 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -7.580 2.612 -5.820 1.00 0.00 C ATOM 0 H LEU A 129 -9.730 5.745 -8.733 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.834 6.641 -6.194 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.487 4.317 -6.782 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.136 4.207 -7.894 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.558 4.518 -5.979 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.394 4.266 -3.673 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.033 5.737 -4.444 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.067 4.298 -4.277 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.946 2.241 -5.015 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.600 2.256 -5.673 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.203 2.248 -6.776 1.00 0.00 H new ATOM 2103 N ALA A 130 -6.565 6.537 -8.604 1.00 0.00 N ATOM 2104 CA ALA A 130 -5.250 6.955 -9.061 1.00 0.00 C ATOM 2105 C ALA A 130 -5.151 8.457 -9.327 1.00 0.00 C ATOM 2106 O ALA A 130 -4.035 8.939 -9.510 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.909 6.191 -10.345 1.00 0.00 C ATOM 0 H ALA A 130 -7.102 6.073 -9.337 1.00 0.00 H new ATOM 0 HA ALA A 130 -4.543 6.730 -8.262 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.924 6.495 -10.699 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.906 5.120 -10.141 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.654 6.413 -11.109 1.00 0.00 H new ATOM 2113 N HIS A 131 -6.264 9.206 -9.321 1.00 0.00 N ATOM 2114 CA HIS A 131 -6.256 10.646 -9.575 1.00 0.00 C ATOM 2115 C HIS A 131 -5.218 11.468 -8.800 1.00 0.00 C ATOM 2116 O HIS A 131 -4.722 12.444 -9.367 1.00 0.00 O ATOM 2117 CB HIS A 131 -7.669 11.255 -9.444 1.00 0.00 C ATOM 2118 CG HIS A 131 -8.126 11.764 -8.088 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -8.088 11.099 -6.892 1.00 0.00 N flip ATOM 2120 CD2 HIS A 131 -8.784 12.956 -7.859 1.00 0.00 C flip ATOM 2121 CE1 HIS A 131 -8.740 11.891 -5.937 1.00 0.00 C flip ATOM 2122 NE2 HIS A 131 -9.117 13.017 -6.562 1.00 0.00 N flip ATOM 0 H HIS A 131 -7.193 8.826 -9.139 1.00 0.00 H new ATOM 0 HA HIS A 131 -5.925 10.720 -10.611 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -7.737 12.085 -10.147 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -8.385 10.501 -9.771 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -8.995 13.712 -8.600 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -8.907 11.643 -4.899 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -9.588 13.804 -6.116 1.00 0.00 H new ATOM 2130 N HIS A 132 -4.905 11.125 -7.546 1.00 0.00 N ATOM 2131 CA HIS A 132 -3.952 11.810 -6.662 1.00 0.00 C ATOM 2132 C HIS A 132 -4.188 13.321 -6.453 1.00 0.00 C ATOM 2133 O HIS A 132 -3.393 13.970 -5.773 1.00 0.00 O ATOM 2134 CB HIS A 132 -2.519 11.568 -7.142 1.00 0.00 C ATOM 2135 CG HIS A 132 -2.115 10.122 -7.293 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -1.347 9.616 -8.316 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -2.425 9.082 -6.454 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -1.230 8.296 -8.107 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -1.853 7.920 -6.984 1.00 0.00 N ATOM 0 H HIS A 132 -5.333 10.317 -7.094 1.00 0.00 H new ATOM 0 HA HIS A 132 -4.121 11.364 -5.682 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -2.389 12.065 -8.103 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -1.835 12.046 -6.441 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -0.942 10.145 -9.088 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -3.007 9.148 -5.546 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -0.700 7.621 -8.763 1.00 0.00 H new ATOM 2147 N VAL A 133 -5.251 13.916 -6.995 1.00 0.00 N ATOM 2148 CA VAL A 133 -5.538 15.341 -6.870 1.00 0.00 C ATOM 2149 C VAL A 133 -5.926 15.733 -5.436 1.00 0.00 C ATOM 2150 O VAL A 133 -5.770 16.898 -5.070 1.00 0.00 O ATOM 2151 CB VAL A 133 -6.645 15.737 -7.880 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -6.737 17.254 -8.064 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -6.440 15.145 -9.286 1.00 0.00 C ATOM 0 H VAL A 133 -5.947 13.410 -7.542 1.00 0.00 H new ATOM 0 HA VAL A 133 -4.627 15.892 -7.102 1.00 0.00 H new ATOM 0 HB VAL A 133 -7.555 15.331 -7.438 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -7.525 17.487 -8.780 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.966 17.723 -7.107 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.785 17.634 -8.436 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -7.253 15.465 -9.938 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -5.490 15.493 -9.693 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -6.431 14.057 -9.225 1.00 0.00 H new ATOM 2163 N HIS A 134 -6.424 14.803 -4.617 1.00 0.00 N ATOM 2164 CA HIS A 134 -6.851 15.082 -3.248 1.00 0.00 C ATOM 2165 C HIS A 134 -6.027 14.415 -2.148 1.00 0.00 C ATOM 2166 O HIS A 134 -5.945 14.966 -1.049 1.00 0.00 O ATOM 2167 CB HIS A 134 -8.318 14.641 -3.102 1.00 0.00 C ATOM 2168 CG HIS A 134 -9.074 15.439 -2.072 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -9.084 15.233 -0.710 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -9.834 16.546 -2.329 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -9.819 16.212 -0.157 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -10.308 17.032 -1.107 1.00 0.00 N ATOM 0 H HIS A 134 -6.542 13.827 -4.890 1.00 0.00 H new ATOM 0 HA HIS A 134 -6.708 16.153 -3.105 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -8.818 14.737 -4.066 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -8.349 13.586 -2.830 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -10.033 16.969 -3.302 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -9.994 16.326 0.903 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -10.906 17.846 -0.963 1.00 0.00 H new ATOM 2180 N ALA A 135 -5.436 13.252 -2.411 1.00 0.00 N ATOM 2181 CA ALA A 135 -4.675 12.448 -1.466 1.00 0.00 C ATOM 2182 C ALA A 135 -3.159 12.537 -1.640 1.00 0.00 C ATOM 2183 O ALA A 135 -2.642 13.340 -2.419 1.00 0.00 O ATOM 2184 CB ALA A 135 -5.204 11.010 -1.593 1.00 0.00 C ATOM 0 H ALA A 135 -5.479 12.826 -3.337 1.00 0.00 H new ATOM 0 HA ALA A 135 -4.824 12.835 -0.458 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -4.665 10.362 -0.902 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -6.267 10.991 -1.353 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -5.056 10.657 -2.613 1.00 0.00 H new ATOM 2190 N GLU A 136 -2.454 11.675 -0.906 1.00 0.00 N ATOM 2191 CA GLU A 136 -1.004 11.547 -0.866 1.00 0.00 C ATOM 2192 C GLU A 136 -0.594 10.073 -0.734 1.00 0.00 C ATOM 2193 O GLU A 136 -0.144 9.445 -1.696 1.00 0.00 O ATOM 2194 CB GLU A 136 -0.430 12.387 0.293 1.00 0.00 C ATOM 2195 CG GLU A 136 -1.253 12.465 1.593 1.00 0.00 C ATOM 2196 CD GLU A 136 -0.333 12.714 2.786 1.00 0.00 C ATOM 2197 OE1 GLU A 136 0.079 13.866 3.048 1.00 0.00 O ATOM 2198 OE2 GLU A 136 0.056 11.734 3.455 1.00 0.00 O ATOM 0 H GLU A 136 -2.913 11.008 -0.286 1.00 0.00 H new ATOM 0 HA GLU A 136 -0.592 11.925 -1.802 1.00 0.00 H new ATOM 0 HB2 GLU A 136 0.554 11.989 0.542 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -0.280 13.403 -0.071 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -1.989 13.266 1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -1.806 11.537 1.738 1.00 0.00 H new ATOM 2205 N GLY A 137 -0.783 9.501 0.455 1.00 0.00 N ATOM 2206 CA GLY A 137 -0.452 8.136 0.809 1.00 0.00 C ATOM 2207 C GLY A 137 -0.909 7.930 2.239 1.00 0.00 C ATOM 2208 O GLY A 137 -0.165 8.225 3.181 1.00 0.00 O ATOM 0 H GLY A 137 -1.195 10.013 1.235 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.947 7.432 0.140 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.620 7.962 0.717 1.00 0.00 H new ATOM 2212 N LEU A 138 -2.186 7.576 2.387 1.00 0.00 N ATOM 2213 CA LEU A 138 -2.808 7.315 3.681 1.00 0.00 C ATOM 2214 C LEU A 138 -2.097 6.124 4.298 1.00 0.00 C ATOM 2215 O LEU A 138 -1.525 6.278 5.401 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.332 7.085 3.555 1.00 0.00 C ATOM 2217 CG LEU A 138 -5.121 7.936 4.565 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -5.052 9.417 4.177 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -6.594 7.527 4.591 1.00 0.00 C ATOM 0 H LEU A 138 -2.824 7.462 1.600 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.703 8.185 4.329 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.654 7.329 2.543 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.555 6.030 3.715 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.675 7.776 5.547 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.614 10.009 4.899 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.012 9.744 4.171 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.481 9.553 3.184 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.130 8.143 5.313 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.028 7.667 3.601 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.675 6.479 4.878 1.00 0.00 H new TER 2231 LEU A 138