USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 773 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0.866 (180deg=-0.0714) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 142:sc= -2.81! (180deg=-5.71!) USER MOD Single : A 21 ASN : amide:sc= -0.96 K(o=-0.96,f=-5.8!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 37:sc= 0.936 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 56:sc= -1.16! USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 150:sc= -1.63 USER MOD Single : A 56 THR OG1 : rot 170:sc= -0.323 USER MOD Single : A 59 TYR OH : rot -110:sc= -0.394 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -54:sc= 0.842 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -147:sc= -0.0403 (180deg=-1.07) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -172:sc= -0.24 (180deg=-0.419) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.648 0.642 -0.084 1.00 0.00 N ATOM 2 CA MET A 1 2.403 0.603 -1.331 1.00 0.00 C ATOM 3 C MET A 1 3.530 -0.422 -1.253 1.00 0.00 C ATOM 4 O MET A 1 4.147 -0.602 -0.202 1.00 0.00 O ATOM 5 CB MET A 1 2.976 1.986 -1.648 1.00 0.00 C ATOM 6 CG MET A 1 3.912 2.516 -0.574 1.00 0.00 C ATOM 7 SD MET A 1 3.049 3.479 0.684 1.00 0.00 S ATOM 8 CE MET A 1 4.172 4.860 0.882 1.00 0.00 C ATOM 0 H1 MET A 1 0.630 0.620 -0.294 1.00 0.00 H new ATOM 0 H2 MET A 1 1.899 -0.181 0.500 1.00 0.00 H new ATOM 0 H3 MET A 1 1.876 1.515 0.433 1.00 0.00 H new ATOM 0 HA MET A 1 1.723 0.308 -2.130 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.513 1.940 -2.596 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.154 2.689 -1.781 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.424 1.680 -0.098 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.678 3.136 -1.039 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.776 5.547 1.630 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.146 4.493 1.206 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.279 5.382 -0.069 1.00 0.00 H new ATOM 18 N VAL A 2 3.793 -1.092 -2.370 1.00 0.00 N ATOM 19 CA VAL A 2 4.846 -2.099 -2.427 1.00 0.00 C ATOM 20 C VAL A 2 5.404 -2.230 -3.840 1.00 0.00 C ATOM 21 O VAL A 2 4.677 -2.084 -4.822 1.00 0.00 O ATOM 22 CB VAL A 2 4.335 -3.474 -1.959 1.00 0.00 C ATOM 23 CG1 VAL A 2 4.159 -3.493 -0.448 1.00 0.00 C ATOM 24 CG2 VAL A 2 3.031 -3.824 -2.660 1.00 0.00 C ATOM 0 H VAL A 2 3.292 -0.956 -3.248 1.00 0.00 H new ATOM 0 HA VAL A 2 5.638 -1.767 -1.755 1.00 0.00 H new ATOM 0 HB VAL A 2 5.077 -4.227 -2.224 1.00 0.00 H new ATOM 0 HG11 VAL A 2 3.797 -4.473 -0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 2 5.116 -3.290 0.032 1.00 0.00 H new ATOM 0 HG13 VAL A 2 3.437 -2.730 -0.156 1.00 0.00 H new ATOM 0 HG21 VAL A 2 2.684 -4.799 -2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 2 2.279 -3.069 -2.428 1.00 0.00 H new ATOM 0 HG23 VAL A 2 3.194 -3.855 -3.737 1.00 0.00 H new ATOM 34 N PHE A 3 6.700 -2.508 -3.935 1.00 0.00 N ATOM 35 CA PHE A 3 7.357 -2.660 -5.228 1.00 0.00 C ATOM 36 C PHE A 3 7.799 -4.103 -5.448 1.00 0.00 C ATOM 37 O PHE A 3 8.547 -4.664 -4.646 1.00 0.00 O ATOM 38 CB PHE A 3 8.565 -1.724 -5.323 1.00 0.00 C ATOM 39 CG PHE A 3 9.474 -1.796 -4.130 1.00 0.00 C ATOM 40 CD1 PHE A 3 9.237 -1.011 -3.013 1.00 0.00 C ATOM 41 CD2 PHE A 3 10.566 -2.649 -4.125 1.00 0.00 C ATOM 42 CE1 PHE A 3 10.072 -1.075 -1.914 1.00 0.00 C ATOM 43 CE2 PHE A 3 11.404 -2.718 -3.028 1.00 0.00 C ATOM 44 CZ PHE A 3 11.157 -1.929 -1.921 1.00 0.00 C ATOM 0 H PHE A 3 7.316 -2.633 -3.132 1.00 0.00 H new ATOM 0 HA PHE A 3 6.639 -2.397 -6.005 1.00 0.00 H new ATOM 0 HB2 PHE A 3 9.135 -1.969 -6.219 1.00 0.00 H new ATOM 0 HB3 PHE A 3 8.212 -0.699 -5.440 1.00 0.00 H new ATOM 0 HD1 PHE A 3 8.390 -0.341 -3.001 1.00 0.00 H new ATOM 0 HD2 PHE A 3 10.765 -3.267 -4.988 1.00 0.00 H new ATOM 0 HE1 PHE A 3 9.876 -0.457 -1.050 1.00 0.00 H new ATOM 0 HE2 PHE A 3 12.251 -3.388 -3.036 1.00 0.00 H new ATOM 0 HZ PHE A 3 11.811 -1.980 -1.063 1.00 0.00 H new ATOM 54 N TYR A 4 7.332 -4.699 -6.539 1.00 0.00 N ATOM 55 CA TYR A 4 7.676 -6.078 -6.863 1.00 0.00 C ATOM 56 C TYR A 4 8.743 -6.132 -7.952 1.00 0.00 C ATOM 57 O TYR A 4 8.536 -5.647 -9.066 1.00 0.00 O ATOM 58 CB TYR A 4 6.431 -6.844 -7.316 1.00 0.00 C ATOM 59 CG TYR A 4 6.413 -8.288 -6.871 1.00 0.00 C ATOM 60 CD1 TYR A 4 6.562 -8.624 -5.530 1.00 0.00 C ATOM 61 CD2 TYR A 4 6.248 -9.317 -7.789 1.00 0.00 C ATOM 62 CE1 TYR A 4 6.547 -9.943 -5.119 1.00 0.00 C ATOM 63 CE2 TYR A 4 6.231 -10.639 -7.387 1.00 0.00 C ATOM 64 CZ TYR A 4 6.381 -10.947 -6.050 1.00 0.00 C ATOM 65 OH TYR A 4 6.365 -12.262 -5.645 1.00 0.00 O ATOM 0 H TYR A 4 6.714 -4.249 -7.214 1.00 0.00 H new ATOM 0 HA TYR A 4 8.076 -6.546 -5.964 1.00 0.00 H new ATOM 0 HB2 TYR A 4 5.545 -6.342 -6.928 1.00 0.00 H new ATOM 0 HB3 TYR A 4 6.368 -6.807 -8.404 1.00 0.00 H new ATOM 0 HD1 TYR A 4 6.692 -7.841 -4.798 1.00 0.00 H new ATOM 0 HD2 TYR A 4 6.131 -9.080 -8.836 1.00 0.00 H new ATOM 0 HE1 TYR A 4 6.665 -10.187 -4.073 1.00 0.00 H new ATOM 0 HE2 TYR A 4 6.101 -11.426 -8.115 1.00 0.00 H new ATOM 0 HH TYR A 4 6.238 -12.843 -6.424 1.00 0.00 H new ATOM 75 N LEU A 5 9.885 -6.726 -7.624 1.00 0.00 N ATOM 76 CA LEU A 5 10.986 -6.845 -8.573 1.00 0.00 C ATOM 77 C LEU A 5 11.393 -8.303 -8.755 1.00 0.00 C ATOM 78 O LEU A 5 11.395 -9.082 -7.801 1.00 0.00 O ATOM 79 CB LEU A 5 12.186 -6.024 -8.097 1.00 0.00 C ATOM 80 CG LEU A 5 12.151 -4.531 -8.424 1.00 0.00 C ATOM 81 CD1 LEU A 5 11.122 -3.819 -7.559 1.00 0.00 C ATOM 82 CD2 LEU A 5 13.528 -3.911 -8.237 1.00 0.00 C ATOM 0 H LEU A 5 10.073 -7.133 -6.708 1.00 0.00 H new ATOM 0 HA LEU A 5 10.648 -6.459 -9.535 1.00 0.00 H new ATOM 0 HB2 LEU A 5 12.272 -6.137 -7.016 1.00 0.00 H new ATOM 0 HB3 LEU A 5 13.089 -6.450 -8.535 1.00 0.00 H new ATOM 0 HG LEU A 5 11.861 -4.414 -9.468 1.00 0.00 H new ATOM 0 HD11 LEU A 5 11.111 -2.757 -7.806 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.135 -4.244 -7.743 1.00 0.00 H new ATOM 0 HD13 LEU A 5 11.381 -3.945 -6.508 1.00 0.00 H new ATOM 0 HD21 LEU A 5 13.484 -2.848 -8.474 1.00 0.00 H new ATOM 0 HD22 LEU A 5 13.847 -4.039 -7.203 1.00 0.00 H new ATOM 0 HD23 LEU A 5 14.241 -4.401 -8.900 1.00 0.00 H new ATOM 94 N LYS A 6 11.740 -8.666 -9.985 1.00 0.00 N ATOM 95 CA LYS A 6 12.153 -10.030 -10.293 1.00 0.00 C ATOM 96 C LYS A 6 13.521 -10.046 -10.967 1.00 0.00 C ATOM 97 O LYS A 6 13.873 -9.121 -11.699 1.00 0.00 O ATOM 98 CB LYS A 6 11.119 -10.706 -11.197 1.00 0.00 C ATOM 99 CG LYS A 6 11.196 -10.261 -12.647 1.00 0.00 C ATOM 100 CD LYS A 6 9.825 -10.262 -13.304 1.00 0.00 C ATOM 101 CE LYS A 6 9.143 -8.909 -13.172 1.00 0.00 C ATOM 102 NZ LYS A 6 9.640 -7.937 -14.184 1.00 0.00 N ATOM 0 H LYS A 6 11.743 -8.034 -10.786 1.00 0.00 H new ATOM 0 HA LYS A 6 12.223 -10.582 -9.356 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.258 -11.786 -11.149 1.00 0.00 H new ATOM 0 HB3 LYS A 6 10.121 -10.496 -10.814 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.625 -9.260 -12.699 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.865 -10.923 -13.197 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.926 -10.518 -14.359 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.202 -11.031 -12.847 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.066 -9.033 -13.285 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.315 -8.512 -12.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.151 -7.027 -14.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.663 -7.800 -14.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 9.453 -8.304 -15.139 1.00 0.00 H new ATOM 116 N VAL A 7 14.287 -11.103 -10.717 1.00 0.00 N ATOM 117 CA VAL A 7 15.616 -11.239 -11.303 1.00 0.00 C ATOM 118 C VAL A 7 15.672 -12.417 -12.269 1.00 0.00 C ATOM 119 O VAL A 7 15.350 -13.549 -11.905 1.00 0.00 O ATOM 120 CB VAL A 7 16.691 -11.429 -10.216 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.831 -10.167 -9.378 1.00 0.00 C ATOM 122 CG2 VAL A 7 16.357 -12.627 -9.340 1.00 0.00 C ATOM 0 H VAL A 7 14.011 -11.877 -10.113 1.00 0.00 H new ATOM 0 HA VAL A 7 15.819 -10.317 -11.847 1.00 0.00 H new ATOM 0 HB VAL A 7 17.647 -11.620 -10.704 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.595 -10.320 -8.615 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.120 -9.334 -10.019 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.879 -9.942 -8.898 1.00 0.00 H new ATOM 0 HG21 VAL A 7 17.127 -12.746 -8.578 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.392 -12.468 -8.859 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.313 -13.526 -9.955 1.00 0.00 H new ATOM 132 N LYS A 8 16.083 -12.144 -13.502 1.00 0.00 N ATOM 133 CA LYS A 8 16.184 -13.181 -14.523 1.00 0.00 C ATOM 134 C LYS A 8 17.491 -13.055 -15.299 1.00 0.00 C ATOM 135 O LYS A 8 18.070 -11.972 -15.387 1.00 0.00 O ATOM 136 CB LYS A 8 14.997 -13.096 -15.485 1.00 0.00 C ATOM 137 CG LYS A 8 14.921 -11.781 -16.242 1.00 0.00 C ATOM 138 CD LYS A 8 13.987 -10.797 -15.559 1.00 0.00 C ATOM 139 CE LYS A 8 12.572 -10.899 -16.106 1.00 0.00 C ATOM 140 NZ LYS A 8 11.941 -9.559 -16.267 1.00 0.00 N ATOM 0 H LYS A 8 16.352 -11.213 -13.819 1.00 0.00 H new ATOM 0 HA LYS A 8 16.170 -14.150 -14.024 1.00 0.00 H new ATOM 0 HB2 LYS A 8 15.061 -13.915 -16.201 1.00 0.00 H new ATOM 0 HB3 LYS A 8 14.074 -13.236 -14.923 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.917 -11.346 -16.317 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.576 -11.965 -17.259 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.978 -10.988 -14.486 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.360 -9.782 -15.699 1.00 0.00 H new ATOM 0 HE2 LYS A 8 12.591 -11.409 -17.069 1.00 0.00 H new ATOM 0 HE3 LYS A 8 11.966 -11.507 -15.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 10.978 -9.672 -16.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 11.900 -9.082 -15.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.505 -8.987 -16.928 1.00 0.00 H new ATOM 154 N VAL A 9 17.950 -14.169 -15.861 1.00 0.00 N ATOM 155 CA VAL A 9 19.187 -14.182 -16.632 1.00 0.00 C ATOM 156 C VAL A 9 18.974 -13.595 -18.023 1.00 0.00 C ATOM 157 O VAL A 9 18.053 -13.987 -18.738 1.00 0.00 O ATOM 158 CB VAL A 9 19.747 -15.611 -16.770 1.00 0.00 C ATOM 159 CG1 VAL A 9 21.072 -15.595 -17.518 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.905 -16.255 -15.401 1.00 0.00 C ATOM 0 H VAL A 9 17.484 -15.074 -15.797 1.00 0.00 H new ATOM 0 HA VAL A 9 19.906 -13.569 -16.088 1.00 0.00 H new ATOM 0 HB VAL A 9 19.039 -16.207 -17.347 1.00 0.00 H new ATOM 0 HG11 VAL A 9 21.452 -16.613 -17.606 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.923 -15.176 -18.513 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.791 -14.985 -16.971 1.00 0.00 H new ATOM 0 HG21 VAL A 9 20.301 -17.264 -15.517 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.592 -15.662 -14.797 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.935 -16.301 -14.906 1.00 0.00 H new ATOM 170 N GLU A 10 19.833 -12.653 -18.399 1.00 0.00 N ATOM 171 CA GLU A 10 19.738 -12.011 -19.705 1.00 0.00 C ATOM 172 C GLU A 10 20.835 -12.515 -20.640 1.00 0.00 C ATOM 173 O GLU A 10 20.632 -12.625 -21.849 1.00 0.00 O ATOM 174 CB GLU A 10 19.836 -10.491 -19.560 1.00 0.00 C ATOM 175 CG GLU A 10 21.235 -10.000 -19.229 1.00 0.00 C ATOM 176 CD GLU A 10 21.330 -8.487 -19.200 1.00 0.00 C ATOM 177 OE1 GLU A 10 20.499 -7.852 -18.518 1.00 0.00 O ATOM 178 OE2 GLU A 10 22.237 -7.937 -19.860 1.00 0.00 O ATOM 0 H GLU A 10 20.602 -12.318 -17.819 1.00 0.00 H new ATOM 0 HA GLU A 10 18.770 -12.266 -20.137 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.506 -10.024 -20.488 1.00 0.00 H new ATOM 0 HB3 GLU A 10 19.151 -10.164 -18.778 1.00 0.00 H new ATOM 0 HG2 GLU A 10 21.536 -10.398 -18.260 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.937 -10.390 -19.966 1.00 0.00 H new ATOM 185 N ASP A 11 21.996 -12.819 -20.070 1.00 0.00 N ATOM 186 CA ASP A 11 23.125 -13.311 -20.851 1.00 0.00 C ATOM 187 C ASP A 11 24.207 -13.883 -19.941 1.00 0.00 C ATOM 188 O ASP A 11 24.860 -13.149 -19.198 1.00 0.00 O ATOM 189 CB ASP A 11 23.705 -12.188 -21.712 1.00 0.00 C ATOM 190 CG ASP A 11 24.635 -12.708 -22.791 1.00 0.00 C ATOM 191 OD1 ASP A 11 25.829 -12.919 -22.494 1.00 0.00 O ATOM 192 OD2 ASP A 11 24.169 -12.902 -23.933 1.00 0.00 O ATOM 0 H ASP A 11 22.180 -12.733 -19.070 1.00 0.00 H new ATOM 0 HA ASP A 11 22.765 -14.108 -21.502 1.00 0.00 H new ATOM 0 HB2 ASP A 11 22.890 -11.632 -22.176 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.247 -11.489 -21.075 1.00 0.00 H new ATOM 197 N PHE A 12 24.391 -15.197 -20.002 1.00 0.00 N ATOM 198 CA PHE A 12 25.393 -15.868 -19.181 1.00 0.00 C ATOM 199 C PHE A 12 26.385 -16.634 -20.052 1.00 0.00 C ATOM 200 O PHE A 12 26.183 -16.785 -21.256 1.00 0.00 O ATOM 201 CB PHE A 12 24.719 -16.824 -18.195 1.00 0.00 C ATOM 202 CG PHE A 12 24.181 -18.069 -18.841 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.988 -18.041 -19.545 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.868 -19.269 -18.742 1.00 0.00 C ATOM 205 CE1 PHE A 12 22.490 -19.185 -20.140 1.00 0.00 C ATOM 206 CE2 PHE A 12 24.375 -20.415 -19.336 1.00 0.00 C ATOM 207 CZ PHE A 12 23.185 -20.374 -20.034 1.00 0.00 C ATOM 0 H PHE A 12 23.860 -15.819 -20.611 1.00 0.00 H new ATOM 0 HA PHE A 12 25.938 -15.107 -18.623 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.437 -17.105 -17.425 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.903 -16.302 -17.695 1.00 0.00 H new ATOM 0 HD1 PHE A 12 22.440 -17.114 -19.630 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.798 -19.309 -18.195 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.559 -19.149 -20.687 1.00 0.00 H new ATOM 0 HE2 PHE A 12 24.921 -21.343 -19.254 1.00 0.00 H new ATOM 0 HZ PHE A 12 22.798 -21.270 -20.496 1.00 0.00 H new ATOM 217 N GLY A 13 27.459 -17.114 -19.432 1.00 0.00 N ATOM 218 CA GLY A 13 28.468 -17.858 -20.165 1.00 0.00 C ATOM 219 C GLY A 13 29.592 -18.344 -19.272 1.00 0.00 C ATOM 220 O GLY A 13 29.569 -18.129 -18.060 1.00 0.00 O ATOM 0 H GLY A 13 27.649 -17.001 -18.436 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.001 -18.713 -20.654 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.880 -17.227 -20.952 1.00 0.00 H new ATOM 224 N PHE A 14 30.578 -19.003 -19.872 1.00 0.00 N ATOM 225 CA PHE A 14 31.716 -19.523 -19.122 1.00 0.00 C ATOM 226 C PHE A 14 33.030 -19.006 -19.699 1.00 0.00 C ATOM 227 O PHE A 14 33.206 -18.946 -20.916 1.00 0.00 O ATOM 228 CB PHE A 14 31.707 -21.053 -19.138 1.00 0.00 C ATOM 229 CG PHE A 14 32.960 -21.666 -18.583 1.00 0.00 C ATOM 230 CD1 PHE A 14 33.218 -21.635 -17.221 1.00 0.00 C ATOM 231 CD2 PHE A 14 33.881 -22.273 -19.421 1.00 0.00 C ATOM 232 CE1 PHE A 14 34.372 -22.198 -16.708 1.00 0.00 C ATOM 233 CE2 PHE A 14 35.036 -22.838 -18.914 1.00 0.00 C ATOM 234 CZ PHE A 14 35.281 -22.801 -17.555 1.00 0.00 C ATOM 0 H PHE A 14 30.612 -19.190 -20.874 1.00 0.00 H new ATOM 0 HA PHE A 14 31.630 -19.176 -18.092 1.00 0.00 H new ATOM 0 HB2 PHE A 14 30.852 -21.409 -18.563 1.00 0.00 H new ATOM 0 HB3 PHE A 14 31.567 -21.397 -20.163 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.510 -21.166 -16.554 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.694 -22.305 -20.484 1.00 0.00 H new ATOM 0 HE1 PHE A 14 34.562 -22.166 -15.645 1.00 0.00 H new ATOM 0 HE2 PHE A 14 35.746 -23.308 -19.579 1.00 0.00 H new ATOM 0 HZ PHE A 14 36.182 -23.243 -17.156 1.00 0.00 H new ATOM 244 N ARG A 15 33.950 -18.631 -18.816 1.00 0.00 N ATOM 245 CA ARG A 15 35.248 -18.116 -19.236 1.00 0.00 C ATOM 246 C ARG A 15 36.364 -19.087 -18.864 1.00 0.00 C ATOM 247 O ARG A 15 36.579 -19.379 -17.688 1.00 0.00 O ATOM 248 CB ARG A 15 35.510 -16.751 -18.597 1.00 0.00 C ATOM 249 CG ARG A 15 36.056 -15.718 -19.570 1.00 0.00 C ATOM 250 CD ARG A 15 35.008 -15.307 -20.592 1.00 0.00 C ATOM 251 NE ARG A 15 35.374 -14.076 -21.287 1.00 0.00 N ATOM 252 CZ ARG A 15 34.862 -13.713 -22.458 1.00 0.00 C ATOM 253 NH1 ARG A 15 33.967 -14.483 -23.061 1.00 0.00 N ATOM 254 NH2 ARG A 15 35.246 -12.578 -23.027 1.00 0.00 N ATOM 0 H ARG A 15 33.821 -18.674 -17.805 1.00 0.00 H new ATOM 0 HA ARG A 15 35.233 -18.005 -20.320 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.581 -16.377 -18.166 1.00 0.00 H new ATOM 0 HB3 ARG A 15 36.216 -16.873 -17.776 1.00 0.00 H new ATOM 0 HG2 ARG A 15 36.393 -14.840 -19.019 1.00 0.00 H new ATOM 0 HG3 ARG A 15 36.927 -16.125 -20.084 1.00 0.00 H new ATOM 0 HD2 ARG A 15 34.877 -16.108 -21.319 1.00 0.00 H new ATOM 0 HD3 ARG A 15 34.049 -15.170 -20.093 1.00 0.00 H new ATOM 0 HE ARG A 15 36.060 -13.461 -20.850 1.00 0.00 H new ATOM 0 HH11 ARG A 15 33.670 -15.356 -22.626 1.00 0.00 H new ATOM 0 HH12 ARG A 15 33.575 -14.202 -23.960 1.00 0.00 H new ATOM 0 HH21 ARG A 15 35.935 -11.984 -22.566 1.00 0.00 H new ATOM 0 HH22 ARG A 15 34.853 -12.300 -23.926 1.00 0.00 H new ATOM 268 N GLU A 16 37.071 -19.584 -19.874 1.00 0.00 N ATOM 269 CA GLU A 16 38.164 -20.523 -19.652 1.00 0.00 C ATOM 270 C GLU A 16 39.363 -19.823 -19.020 1.00 0.00 C ATOM 271 O GLU A 16 40.060 -20.396 -18.182 1.00 0.00 O ATOM 272 CB GLU A 16 38.580 -21.178 -20.971 1.00 0.00 C ATOM 273 CG GLU A 16 39.907 -21.914 -20.894 1.00 0.00 C ATOM 274 CD GLU A 16 40.136 -22.830 -22.080 1.00 0.00 C ATOM 275 OE1 GLU A 16 39.350 -22.754 -23.048 1.00 0.00 O ATOM 276 OE2 GLU A 16 41.100 -23.622 -22.042 1.00 0.00 O ATOM 0 H GLU A 16 36.906 -19.352 -20.854 1.00 0.00 H new ATOM 0 HA GLU A 16 37.812 -21.294 -18.967 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.804 -21.878 -21.280 1.00 0.00 H new ATOM 0 HB3 GLU A 16 38.644 -20.411 -21.743 1.00 0.00 H new ATOM 0 HG2 GLU A 16 40.718 -21.188 -20.839 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.940 -22.500 -19.975 1.00 0.00 H new ATOM 283 N ASP A 17 39.597 -18.580 -19.427 1.00 0.00 N ATOM 284 CA ASP A 17 40.711 -17.800 -18.900 1.00 0.00 C ATOM 285 C ASP A 17 40.559 -17.580 -17.398 1.00 0.00 C ATOM 286 O ASP A 17 41.543 -17.380 -16.687 1.00 0.00 O ATOM 287 CB ASP A 17 40.804 -16.453 -19.619 1.00 0.00 C ATOM 288 CG ASP A 17 41.589 -15.427 -18.827 1.00 0.00 C ATOM 289 OD1 ASP A 17 42.817 -15.603 -18.682 1.00 0.00 O ATOM 290 OD2 ASP A 17 40.977 -14.448 -18.352 1.00 0.00 O ATOM 0 H ASP A 17 39.030 -18.091 -20.120 1.00 0.00 H new ATOM 0 HA ASP A 17 41.629 -18.361 -19.075 1.00 0.00 H new ATOM 0 HB2 ASP A 17 41.275 -16.595 -20.591 1.00 0.00 H new ATOM 0 HB3 ASP A 17 39.799 -16.073 -19.804 1.00 0.00 H new ATOM 295 N MET A 18 39.318 -17.616 -16.923 1.00 0.00 N ATOM 296 CA MET A 18 39.037 -17.420 -15.506 1.00 0.00 C ATOM 297 C MET A 18 38.749 -18.752 -14.820 1.00 0.00 C ATOM 298 O MET A 18 38.839 -18.864 -13.598 1.00 0.00 O ATOM 299 CB MET A 18 37.849 -16.473 -15.326 1.00 0.00 C ATOM 300 CG MET A 18 38.168 -15.027 -15.669 1.00 0.00 C ATOM 301 SD MET A 18 37.042 -13.861 -14.878 1.00 0.00 S ATOM 302 CE MET A 18 35.509 -14.245 -15.721 1.00 0.00 C ATOM 0 H MET A 18 38.492 -17.779 -17.498 1.00 0.00 H new ATOM 0 HA MET A 18 39.919 -16.976 -15.044 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.025 -16.813 -15.953 1.00 0.00 H new ATOM 0 HB3 MET A 18 37.506 -16.526 -14.293 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.190 -14.802 -15.365 1.00 0.00 H new ATOM 0 HG3 MET A 18 38.121 -14.895 -16.750 1.00 0.00 H new ATOM 0 HE1 MET A 18 34.681 -14.188 -15.014 1.00 0.00 H new ATOM 0 HE2 MET A 18 35.348 -13.530 -16.527 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.564 -15.252 -16.135 1.00 0.00 H new ATOM 312 N GLY A 19 38.401 -19.760 -15.615 1.00 0.00 N ATOM 313 CA GLY A 19 38.105 -21.070 -15.065 1.00 0.00 C ATOM 314 C GLY A 19 36.802 -21.093 -14.292 1.00 0.00 C ATOM 315 O GLY A 19 36.530 -22.035 -13.546 1.00 0.00 O ATOM 0 H GLY A 19 38.319 -19.692 -16.629 1.00 0.00 H new ATOM 0 HA2 GLY A 19 38.056 -21.798 -15.875 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.919 -21.377 -14.408 1.00 0.00 H new ATOM 319 N LEU A 20 35.993 -20.054 -14.467 1.00 0.00 N ATOM 320 CA LEU A 20 34.711 -19.957 -13.778 1.00 0.00 C ATOM 321 C LEU A 20 33.605 -19.537 -14.742 1.00 0.00 C ATOM 322 O LEU A 20 33.873 -19.152 -15.879 1.00 0.00 O ATOM 323 CB LEU A 20 34.804 -18.958 -12.624 1.00 0.00 C ATOM 324 CG LEU A 20 35.613 -17.690 -12.897 1.00 0.00 C ATOM 325 CD1 LEU A 20 34.891 -16.801 -13.898 1.00 0.00 C ATOM 326 CD2 LEU A 20 35.874 -16.934 -11.602 1.00 0.00 C ATOM 0 H LEU A 20 36.202 -19.266 -15.080 1.00 0.00 H new ATOM 0 HA LEU A 20 34.466 -20.941 -13.379 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.793 -18.666 -12.341 1.00 0.00 H new ATOM 0 HB3 LEU A 20 35.242 -19.466 -11.765 1.00 0.00 H new ATOM 0 HG LEU A 20 36.573 -17.980 -13.325 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.482 -15.903 -14.080 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.756 -17.342 -14.834 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.917 -16.519 -13.498 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.451 -16.034 -11.816 1.00 0.00 H new ATOM 0 HD22 LEU A 20 34.924 -16.656 -11.145 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.434 -17.570 -10.916 1.00 0.00 H new ATOM 338 N ASN A 21 32.363 -19.611 -14.277 1.00 0.00 N ATOM 339 CA ASN A 21 31.216 -19.236 -15.097 1.00 0.00 C ATOM 340 C ASN A 21 30.593 -17.936 -14.599 1.00 0.00 C ATOM 341 O ASN A 21 30.594 -17.654 -13.400 1.00 0.00 O ATOM 342 CB ASN A 21 30.170 -20.353 -15.088 1.00 0.00 C ATOM 343 CG ASN A 21 29.097 -20.131 -14.040 1.00 0.00 C ATOM 344 OD1 ASN A 21 29.324 -20.340 -12.848 1.00 0.00 O ATOM 345 ND2 ASN A 21 27.919 -19.705 -14.481 1.00 0.00 N ATOM 0 H ASN A 21 32.124 -19.927 -13.337 1.00 0.00 H new ATOM 0 HA ASN A 21 31.565 -19.082 -16.118 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.705 -20.420 -16.072 1.00 0.00 H new ATOM 0 HB3 ASN A 21 30.663 -21.307 -14.903 1.00 0.00 H new ATOM 0 HD21 ASN A 21 27.158 -19.538 -13.823 1.00 0.00 H new ATOM 0 HD22 ASN A 21 27.775 -19.545 -15.478 1.00 0.00 H new ATOM 352 N TYR A 22 30.060 -17.148 -15.526 1.00 0.00 N ATOM 353 CA TYR A 22 29.435 -15.877 -15.183 1.00 0.00 C ATOM 354 C TYR A 22 28.024 -15.791 -15.757 1.00 0.00 C ATOM 355 O TYR A 22 27.692 -16.477 -16.724 1.00 0.00 O ATOM 356 CB TYR A 22 30.281 -14.712 -15.700 1.00 0.00 C ATOM 357 CG TYR A 22 30.158 -14.490 -17.191 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.163 -13.670 -17.711 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.035 -15.100 -18.079 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.047 -13.465 -19.072 1.00 0.00 C ATOM 361 CE2 TYR A 22 30.926 -14.899 -19.441 1.00 0.00 C ATOM 362 CZ TYR A 22 29.931 -14.081 -19.933 1.00 0.00 C ATOM 363 OH TYR A 22 29.819 -13.880 -21.290 1.00 0.00 O ATOM 0 H TYR A 22 30.049 -17.368 -16.522 1.00 0.00 H new ATOM 0 HA TYR A 22 29.370 -15.815 -14.097 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.986 -13.801 -15.180 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.327 -14.896 -15.453 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.469 -13.185 -17.040 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.815 -15.742 -17.698 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.268 -12.826 -19.460 1.00 0.00 H new ATOM 0 HE2 TYR A 22 31.617 -15.380 -20.117 1.00 0.00 H new ATOM 0 HH TYR A 22 30.519 -14.385 -21.754 1.00 0.00 H new ATOM 373 N VAL A 23 27.198 -14.941 -15.155 1.00 0.00 N ATOM 374 CA VAL A 23 25.823 -14.762 -15.606 1.00 0.00 C ATOM 375 C VAL A 23 25.317 -13.361 -15.284 1.00 0.00 C ATOM 376 O VAL A 23 25.489 -12.869 -14.169 1.00 0.00 O ATOM 377 CB VAL A 23 24.882 -15.797 -14.962 1.00 0.00 C ATOM 378 CG1 VAL A 23 25.086 -15.840 -13.455 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.433 -15.483 -15.303 1.00 0.00 C ATOM 0 H VAL A 23 27.457 -14.366 -14.354 1.00 0.00 H new ATOM 0 HA VAL A 23 25.823 -14.905 -16.687 1.00 0.00 H new ATOM 0 HB VAL A 23 25.122 -16.781 -15.365 1.00 0.00 H new ATOM 0 HG11 VAL A 23 24.412 -16.577 -13.018 1.00 0.00 H new ATOM 0 HG12 VAL A 23 26.117 -16.115 -13.235 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.874 -14.858 -13.031 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.781 -16.224 -14.840 1.00 0.00 H new ATOM 0 HG22 VAL A 23 23.178 -14.491 -14.929 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.300 -15.508 -16.385 1.00 0.00 H new ATOM 389 N ARG A 24 24.692 -12.723 -16.268 1.00 0.00 N ATOM 390 CA ARG A 24 24.161 -11.377 -16.090 1.00 0.00 C ATOM 391 C ARG A 24 22.663 -11.417 -15.803 1.00 0.00 C ATOM 392 O ARG A 24 21.897 -12.045 -16.534 1.00 0.00 O ATOM 393 CB ARG A 24 24.430 -10.530 -17.336 1.00 0.00 C ATOM 394 CG ARG A 24 25.807 -9.888 -17.350 1.00 0.00 C ATOM 395 CD ARG A 24 26.910 -10.934 -17.314 1.00 0.00 C ATOM 396 NE ARG A 24 28.158 -10.433 -17.883 1.00 0.00 N ATOM 397 CZ ARG A 24 28.334 -10.199 -19.179 1.00 0.00 C ATOM 398 NH1 ARG A 24 27.346 -10.420 -20.035 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.499 -9.743 -19.620 1.00 0.00 N ATOM 0 H ARG A 24 24.541 -13.117 -17.197 1.00 0.00 H new ATOM 0 HA ARG A 24 24.665 -10.925 -15.236 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.322 -11.157 -18.221 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.673 -9.748 -17.404 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.915 -9.275 -18.245 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.908 -9.222 -16.493 1.00 0.00 H new ATOM 0 HD2 ARG A 24 27.081 -11.245 -16.283 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.589 -11.818 -17.865 1.00 0.00 H new ATOM 0 HE ARG A 24 28.938 -10.253 -17.251 1.00 0.00 H new ATOM 0 HH11 ARG A 24 26.449 -10.770 -19.699 1.00 0.00 H new ATOM 0 HH12 ARG A 24 27.483 -10.240 -21.030 1.00 0.00 H new ATOM 0 HH21 ARG A 24 30.261 -9.572 -18.964 1.00 0.00 H new ATOM 0 HH22 ARG A 24 29.633 -9.564 -20.615 1.00 0.00 H new ATOM 413 N TYR A 25 22.252 -10.744 -14.734 1.00 0.00 N ATOM 414 CA TYR A 25 20.847 -10.705 -14.348 1.00 0.00 C ATOM 415 C TYR A 25 20.222 -9.358 -14.702 1.00 0.00 C ATOM 416 O TYR A 25 20.894 -8.327 -14.692 1.00 0.00 O ATOM 417 CB TYR A 25 20.700 -10.969 -12.849 1.00 0.00 C ATOM 418 CG TYR A 25 21.206 -12.328 -12.422 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.671 -13.492 -12.959 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.222 -12.449 -11.480 1.00 0.00 C ATOM 421 CE1 TYR A 25 21.130 -14.736 -12.571 1.00 0.00 C ATOM 422 CE2 TYR A 25 22.688 -13.688 -11.087 1.00 0.00 C ATOM 423 CZ TYR A 25 22.139 -14.828 -11.635 1.00 0.00 C ATOM 424 OH TYR A 25 22.600 -16.065 -11.247 1.00 0.00 O ATOM 0 H TYR A 25 22.873 -10.218 -14.119 1.00 0.00 H new ATOM 0 HA TYR A 25 20.323 -11.485 -14.900 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.241 -10.200 -12.298 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.649 -10.879 -12.574 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.882 -13.423 -13.693 1.00 0.00 H new ATOM 0 HD2 TYR A 25 22.654 -11.558 -11.048 1.00 0.00 H new ATOM 0 HE1 TYR A 25 20.702 -15.631 -12.998 1.00 0.00 H new ATOM 0 HE2 TYR A 25 23.478 -13.764 -10.355 1.00 0.00 H new ATOM 0 HH TYR A 25 22.606 -16.669 -12.019 1.00 0.00 H new ATOM 434 N ARG A 26 18.930 -9.377 -15.014 1.00 0.00 N ATOM 435 CA ARG A 26 18.213 -8.159 -15.372 1.00 0.00 C ATOM 436 C ARG A 26 17.248 -7.751 -14.263 1.00 0.00 C ATOM 437 O ARG A 26 16.269 -8.446 -13.990 1.00 0.00 O ATOM 438 CB ARG A 26 17.447 -8.358 -16.681 1.00 0.00 C ATOM 439 CG ARG A 26 17.081 -7.058 -17.376 1.00 0.00 C ATOM 440 CD ARG A 26 15.693 -7.128 -17.995 1.00 0.00 C ATOM 441 NE ARG A 26 15.573 -6.269 -19.169 1.00 0.00 N ATOM 442 CZ ARG A 26 14.618 -6.402 -20.083 1.00 0.00 C ATOM 443 NH1 ARG A 26 13.705 -7.356 -19.958 1.00 0.00 N ATOM 444 NH2 ARG A 26 14.575 -5.581 -21.124 1.00 0.00 N ATOM 0 H ARG A 26 18.359 -10.222 -15.026 1.00 0.00 H new ATOM 0 HA ARG A 26 18.945 -7.362 -15.505 1.00 0.00 H new ATOM 0 HB2 ARG A 26 18.051 -8.964 -17.357 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.536 -8.920 -16.477 1.00 0.00 H new ATOM 0 HG2 ARG A 26 17.120 -6.238 -16.659 1.00 0.00 H new ATOM 0 HG3 ARG A 26 17.816 -6.839 -18.151 1.00 0.00 H new ATOM 0 HD2 ARG A 26 15.473 -8.158 -18.276 1.00 0.00 H new ATOM 0 HD3 ARG A 26 14.950 -6.834 -17.253 1.00 0.00 H new ATOM 0 HE ARG A 26 16.260 -5.526 -19.295 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.735 -7.989 -19.159 1.00 0.00 H new ATOM 0 HH12 ARG A 26 12.973 -7.456 -20.661 1.00 0.00 H new ATOM 0 HH21 ARG A 26 15.276 -4.846 -21.224 1.00 0.00 H new ATOM 0 HH22 ARG A 26 13.841 -5.684 -21.825 1.00 0.00 H new ATOM 458 N VAL A 27 17.530 -6.619 -13.626 1.00 0.00 N ATOM 459 CA VAL A 27 16.688 -6.118 -12.547 1.00 0.00 C ATOM 460 C VAL A 27 16.175 -4.716 -12.856 1.00 0.00 C ATOM 461 O VAL A 27 16.952 -3.765 -12.943 1.00 0.00 O ATOM 462 CB VAL A 27 17.447 -6.091 -11.207 1.00 0.00 C ATOM 463 CG1 VAL A 27 16.571 -5.511 -10.108 1.00 0.00 C ATOM 464 CG2 VAL A 27 17.926 -7.487 -10.839 1.00 0.00 C ATOM 0 H VAL A 27 18.336 -6.031 -13.839 1.00 0.00 H new ATOM 0 HA VAL A 27 15.843 -6.801 -12.463 1.00 0.00 H new ATOM 0 HB VAL A 27 18.321 -5.449 -11.317 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.125 -5.500 -9.169 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.283 -4.493 -10.371 1.00 0.00 H new ATOM 0 HG13 VAL A 27 15.676 -6.123 -9.995 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.460 -7.450 -9.890 1.00 0.00 H new ATOM 0 HG22 VAL A 27 17.068 -8.153 -10.747 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.593 -7.859 -11.616 1.00 0.00 H new ATOM 474 N SER A 28 14.862 -4.595 -13.021 1.00 0.00 N ATOM 475 CA SER A 28 14.244 -3.309 -13.324 1.00 0.00 C ATOM 476 C SER A 28 13.298 -2.883 -12.206 1.00 0.00 C ATOM 477 O SER A 28 12.510 -3.684 -11.706 1.00 0.00 O ATOM 478 CB SER A 28 13.484 -3.384 -14.650 1.00 0.00 C ATOM 479 OG SER A 28 13.118 -4.719 -14.953 1.00 0.00 O ATOM 0 H SER A 28 14.205 -5.372 -12.950 1.00 0.00 H new ATOM 0 HA SER A 28 15.036 -2.565 -13.409 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.591 -2.762 -14.596 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.104 -2.983 -15.452 1.00 0.00 H new ATOM 0 HG SER A 28 12.632 -4.740 -15.804 1.00 0.00 H new ATOM 485 N GLY A 29 13.383 -1.614 -11.817 1.00 0.00 N ATOM 486 CA GLY A 29 12.530 -1.103 -10.761 1.00 0.00 C ATOM 487 C GLY A 29 13.322 -0.530 -9.602 1.00 0.00 C ATOM 488 O GLY A 29 12.837 -0.486 -8.471 1.00 0.00 O ATOM 0 H GLY A 29 14.028 -0.931 -12.215 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.877 -0.331 -11.168 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.888 -1.905 -10.397 1.00 0.00 H new ATOM 492 N LEU A 30 14.545 -0.093 -9.882 1.00 0.00 N ATOM 493 CA LEU A 30 15.407 0.479 -8.854 1.00 0.00 C ATOM 494 C LEU A 30 15.765 1.924 -9.184 1.00 0.00 C ATOM 495 O LEU A 30 15.430 2.427 -10.257 1.00 0.00 O ATOM 496 CB LEU A 30 16.682 -0.354 -8.709 1.00 0.00 C ATOM 497 CG LEU A 30 17.430 -0.667 -10.005 1.00 0.00 C ATOM 498 CD1 LEU A 30 18.399 0.454 -10.347 1.00 0.00 C ATOM 499 CD2 LEU A 30 18.166 -1.994 -9.890 1.00 0.00 C ATOM 0 H LEU A 30 14.962 -0.124 -10.812 1.00 0.00 H new ATOM 0 HA LEU A 30 14.862 0.466 -7.910 1.00 0.00 H new ATOM 0 HB2 LEU A 30 17.362 0.172 -8.039 1.00 0.00 H new ATOM 0 HB3 LEU A 30 16.424 -1.296 -8.226 1.00 0.00 H new ATOM 0 HG LEU A 30 16.701 -0.748 -10.811 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.922 0.213 -11.272 1.00 0.00 H new ATOM 0 HD12 LEU A 30 17.848 1.386 -10.474 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.123 0.568 -9.540 1.00 0.00 H new ATOM 0 HD21 LEU A 30 18.693 -2.200 -10.822 1.00 0.00 H new ATOM 0 HD22 LEU A 30 18.884 -1.942 -9.071 1.00 0.00 H new ATOM 0 HD23 LEU A 30 17.449 -2.792 -9.694 1.00 0.00 H new ATOM 511 N ASP A 31 16.449 2.585 -8.257 1.00 0.00 N ATOM 512 CA ASP A 31 16.855 3.972 -8.451 1.00 0.00 C ATOM 513 C ASP A 31 18.360 4.130 -8.254 1.00 0.00 C ATOM 514 O ASP A 31 19.038 3.203 -7.811 1.00 0.00 O ATOM 515 CB ASP A 31 16.103 4.887 -7.483 1.00 0.00 C ATOM 516 CG ASP A 31 14.682 5.163 -7.933 1.00 0.00 C ATOM 517 OD1 ASP A 31 14.455 5.262 -9.157 1.00 0.00 O ATOM 518 OD2 ASP A 31 13.796 5.278 -7.060 1.00 0.00 O ATOM 0 H ASP A 31 16.734 2.183 -7.364 1.00 0.00 H new ATOM 0 HA ASP A 31 16.608 4.257 -9.474 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.085 4.429 -6.494 1.00 0.00 H new ATOM 0 HB3 ASP A 31 16.641 5.830 -7.388 1.00 0.00 H new ATOM 523 N GLU A 32 18.875 5.310 -8.588 1.00 0.00 N ATOM 524 CA GLU A 32 20.300 5.587 -8.449 1.00 0.00 C ATOM 525 C GLU A 32 20.736 5.478 -6.991 1.00 0.00 C ATOM 526 O GLU A 32 21.799 4.936 -6.689 1.00 0.00 O ATOM 527 CB GLU A 32 20.625 6.981 -8.988 1.00 0.00 C ATOM 528 CG GLU A 32 20.269 7.166 -10.453 1.00 0.00 C ATOM 529 CD GLU A 32 21.135 8.206 -11.137 1.00 0.00 C ATOM 530 OE1 GLU A 32 22.330 8.307 -10.789 1.00 0.00 O ATOM 531 OE2 GLU A 32 20.617 8.919 -12.022 1.00 0.00 O ATOM 0 H GLU A 32 18.327 6.088 -8.956 1.00 0.00 H new ATOM 0 HA GLU A 32 20.847 4.844 -9.029 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.090 7.724 -8.396 1.00 0.00 H new ATOM 0 HB3 GLU A 32 21.689 7.174 -8.854 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.374 6.213 -10.972 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.222 7.460 -10.534 1.00 0.00 H new ATOM 538 N GLU A 33 19.907 5.999 -6.091 1.00 0.00 N ATOM 539 CA GLU A 33 20.208 5.962 -4.665 1.00 0.00 C ATOM 540 C GLU A 33 20.115 4.537 -4.126 1.00 0.00 C ATOM 541 O GLU A 33 20.939 4.113 -3.314 1.00 0.00 O ATOM 542 CB GLU A 33 19.250 6.873 -3.895 1.00 0.00 C ATOM 543 CG GLU A 33 19.421 6.801 -2.387 1.00 0.00 C ATOM 544 CD GLU A 33 18.351 7.574 -1.641 1.00 0.00 C ATOM 545 OE1 GLU A 33 17.283 6.989 -1.362 1.00 0.00 O ATOM 546 OE2 GLU A 33 18.580 8.762 -1.335 1.00 0.00 O ATOM 0 H GLU A 33 19.023 6.451 -6.324 1.00 0.00 H new ATOM 0 HA GLU A 33 21.228 6.319 -4.526 1.00 0.00 H new ATOM 0 HB2 GLU A 33 19.401 7.902 -4.220 1.00 0.00 H new ATOM 0 HB3 GLU A 33 18.224 6.605 -4.149 1.00 0.00 H new ATOM 0 HG2 GLU A 33 19.397 5.758 -2.072 1.00 0.00 H new ATOM 0 HG3 GLU A 33 20.402 7.193 -2.117 1.00 0.00 H new ATOM 553 N LEU A 34 19.106 3.803 -4.582 1.00 0.00 N ATOM 554 CA LEU A 34 18.904 2.425 -4.147 1.00 0.00 C ATOM 555 C LEU A 34 20.002 1.516 -4.689 1.00 0.00 C ATOM 556 O LEU A 34 20.457 0.598 -4.007 1.00 0.00 O ATOM 557 CB LEU A 34 17.534 1.921 -4.605 1.00 0.00 C ATOM 558 CG LEU A 34 16.417 1.971 -3.563 1.00 0.00 C ATOM 559 CD1 LEU A 34 16.774 1.119 -2.355 1.00 0.00 C ATOM 560 CD2 LEU A 34 16.146 3.408 -3.141 1.00 0.00 C ATOM 0 H LEU A 34 18.415 4.139 -5.253 1.00 0.00 H new ATOM 0 HA LEU A 34 18.946 2.403 -3.058 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.224 2.508 -5.469 1.00 0.00 H new ATOM 0 HB3 LEU A 34 17.643 0.890 -4.942 1.00 0.00 H new ATOM 0 HG LEU A 34 15.510 1.567 -4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.967 1.167 -1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.918 0.085 -2.669 1.00 0.00 H new ATOM 0 HD13 LEU A 34 17.694 1.493 -1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 34 15.348 3.425 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.051 3.838 -2.711 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.845 3.992 -4.011 1.00 0.00 H new ATOM 572 N THR A 35 20.425 1.778 -5.922 1.00 0.00 N ATOM 573 CA THR A 35 21.470 0.985 -6.557 1.00 0.00 C ATOM 574 C THR A 35 22.708 0.897 -5.671 1.00 0.00 C ATOM 575 O THR A 35 23.336 -0.156 -5.571 1.00 0.00 O ATOM 576 CB THR A 35 21.870 1.573 -7.923 1.00 0.00 C ATOM 577 OG1 THR A 35 20.752 1.539 -8.817 1.00 0.00 O ATOM 578 CG2 THR A 35 23.032 0.798 -8.526 1.00 0.00 C ATOM 0 H THR A 35 20.059 2.534 -6.501 1.00 0.00 H new ATOM 0 HA THR A 35 21.062 -0.015 -6.706 1.00 0.00 H new ATOM 0 HB THR A 35 22.182 2.606 -7.772 1.00 0.00 H new ATOM 0 HG1 THR A 35 19.993 2.007 -8.410 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.297 1.231 -9.490 1.00 0.00 H new ATOM 0 HG22 THR A 35 23.891 0.850 -7.857 1.00 0.00 H new ATOM 0 HG23 THR A 35 22.742 -0.244 -8.664 1.00 0.00 H new ATOM 586 N GLU A 36 23.051 2.010 -5.031 1.00 0.00 N ATOM 587 CA GLU A 36 24.215 2.058 -4.154 1.00 0.00 C ATOM 588 C GLU A 36 24.076 1.056 -3.011 1.00 0.00 C ATOM 589 O GLU A 36 25.070 0.583 -2.460 1.00 0.00 O ATOM 590 CB GLU A 36 24.401 3.468 -3.591 1.00 0.00 C ATOM 591 CG GLU A 36 24.763 4.501 -4.644 1.00 0.00 C ATOM 592 CD GLU A 36 25.718 5.557 -4.122 1.00 0.00 C ATOM 593 OE1 GLU A 36 26.930 5.268 -4.033 1.00 0.00 O ATOM 594 OE2 GLU A 36 25.255 6.671 -3.802 1.00 0.00 O ATOM 0 H GLU A 36 22.540 2.890 -5.103 1.00 0.00 H new ATOM 0 HA GLU A 36 25.093 1.792 -4.743 1.00 0.00 H new ATOM 0 HB2 GLU A 36 23.481 3.776 -3.094 1.00 0.00 H new ATOM 0 HB3 GLU A 36 25.182 3.447 -2.831 1.00 0.00 H new ATOM 0 HG2 GLU A 36 25.215 3.999 -5.500 1.00 0.00 H new ATOM 0 HG3 GLU A 36 23.854 4.984 -5.001 1.00 0.00 H new ATOM 601 N LYS A 37 22.835 0.738 -2.659 1.00 0.00 N ATOM 602 CA LYS A 37 22.563 -0.208 -1.582 1.00 0.00 C ATOM 603 C LYS A 37 22.893 -1.633 -2.014 1.00 0.00 C ATOM 604 O LYS A 37 23.658 -2.332 -1.349 1.00 0.00 O ATOM 605 CB LYS A 37 21.096 -0.118 -1.156 1.00 0.00 C ATOM 606 CG LYS A 37 20.593 1.306 -1.001 1.00 0.00 C ATOM 607 CD LYS A 37 21.372 2.060 0.064 1.00 0.00 C ATOM 608 CE LYS A 37 22.452 2.937 -0.550 1.00 0.00 C ATOM 609 NZ LYS A 37 22.772 4.108 0.312 1.00 0.00 N ATOM 0 H LYS A 37 22.001 1.121 -3.104 1.00 0.00 H new ATOM 0 HA LYS A 37 23.197 0.051 -0.734 1.00 0.00 H new ATOM 0 HB2 LYS A 37 20.480 -0.633 -1.893 1.00 0.00 H new ATOM 0 HB3 LYS A 37 20.968 -0.644 -0.210 1.00 0.00 H new ATOM 0 HG2 LYS A 37 20.678 1.829 -1.954 1.00 0.00 H new ATOM 0 HG3 LYS A 37 19.535 1.293 -0.738 1.00 0.00 H new ATOM 0 HD2 LYS A 37 20.689 2.677 0.647 1.00 0.00 H new ATOM 0 HD3 LYS A 37 21.828 1.350 0.754 1.00 0.00 H new ATOM 0 HE2 LYS A 37 23.354 2.345 -0.708 1.00 0.00 H new ATOM 0 HE3 LYS A 37 22.124 3.286 -1.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 23.512 4.681 -0.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 21.918 4.687 0.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 23.110 3.776 1.238 1.00 0.00 H new ATOM 623 N LEU A 38 22.311 -2.057 -3.130 1.00 0.00 N ATOM 624 CA LEU A 38 22.544 -3.400 -3.652 1.00 0.00 C ATOM 625 C LEU A 38 24.000 -3.575 -4.073 1.00 0.00 C ATOM 626 O LEU A 38 24.651 -4.551 -3.698 1.00 0.00 O ATOM 627 CB LEU A 38 21.621 -3.674 -4.840 1.00 0.00 C ATOM 628 CG LEU A 38 20.145 -3.330 -4.637 1.00 0.00 C ATOM 629 CD1 LEU A 38 19.757 -3.485 -3.175 1.00 0.00 C ATOM 630 CD2 LEU A 38 19.856 -1.916 -5.120 1.00 0.00 C ATOM 0 H LEU A 38 21.674 -1.491 -3.691 1.00 0.00 H new ATOM 0 HA LEU A 38 22.326 -4.115 -2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 38 21.990 -3.112 -5.698 1.00 0.00 H new ATOM 0 HB3 LEU A 38 21.695 -4.731 -5.096 1.00 0.00 H new ATOM 0 HG LEU A 38 19.546 -4.024 -5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 38 18.703 -3.236 -3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 38 19.926 -4.515 -2.861 1.00 0.00 H new ATOM 0 HD13 LEU A 38 20.363 -2.815 -2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 38 18.801 -1.688 -4.968 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.465 -1.208 -4.558 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.095 -1.838 -6.181 1.00 0.00 H new ATOM 642 N ILE A 39 24.504 -2.624 -4.852 1.00 0.00 N ATOM 643 CA ILE A 39 25.883 -2.673 -5.321 1.00 0.00 C ATOM 644 C ILE A 39 26.854 -2.827 -4.155 1.00 0.00 C ATOM 645 O ILE A 39 27.939 -3.387 -4.309 1.00 0.00 O ATOM 646 CB ILE A 39 26.251 -1.407 -6.118 1.00 0.00 C ATOM 647 CG1 ILE A 39 27.468 -1.674 -7.006 1.00 0.00 C ATOM 648 CG2 ILE A 39 26.523 -0.246 -5.172 1.00 0.00 C ATOM 649 CD1 ILE A 39 27.966 -0.445 -7.734 1.00 0.00 C ATOM 0 H ILE A 39 23.978 -1.811 -5.172 1.00 0.00 H new ATOM 0 HA ILE A 39 25.964 -3.541 -5.976 1.00 0.00 H new ATOM 0 HB ILE A 39 25.409 -1.140 -6.757 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.275 -2.075 -6.392 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.213 -2.441 -7.737 1.00 0.00 H new ATOM 0 HG21 ILE A 39 26.782 0.641 -5.750 1.00 0.00 H new ATOM 0 HG22 ILE A 39 25.632 -0.045 -4.577 1.00 0.00 H new ATOM 0 HG23 ILE A 39 27.350 -0.502 -4.510 1.00 0.00 H new ATOM 0 HD11 ILE A 39 28.830 -0.709 -8.344 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.175 -0.056 -8.375 1.00 0.00 H new ATOM 0 HD13 ILE A 39 28.253 0.316 -7.009 1.00 0.00 H new ATOM 661 N GLU A 40 26.456 -2.327 -2.990 1.00 0.00 N ATOM 662 CA GLU A 40 27.292 -2.410 -1.798 1.00 0.00 C ATOM 663 C GLU A 40 27.235 -3.809 -1.191 1.00 0.00 C ATOM 664 O GLU A 40 28.267 -4.400 -0.869 1.00 0.00 O ATOM 665 CB GLU A 40 26.848 -1.375 -0.763 1.00 0.00 C ATOM 666 CG GLU A 40 27.664 -0.094 -0.794 1.00 0.00 C ATOM 667 CD GLU A 40 29.022 -0.251 -0.137 1.00 0.00 C ATOM 668 OE1 GLU A 40 29.105 -0.094 1.099 1.00 0.00 O ATOM 669 OE2 GLU A 40 30.001 -0.532 -0.860 1.00 0.00 O ATOM 0 H GLU A 40 25.561 -1.860 -2.846 1.00 0.00 H new ATOM 0 HA GLU A 40 28.321 -2.201 -2.091 1.00 0.00 H new ATOM 0 HB2 GLU A 40 25.799 -1.132 -0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 40 26.917 -1.816 0.232 1.00 0.00 H new ATOM 0 HG2 GLU A 40 27.799 0.221 -1.829 1.00 0.00 H new ATOM 0 HG3 GLU A 40 27.110 0.698 -0.290 1.00 0.00 H new ATOM 676 N ARG A 41 26.023 -4.332 -1.036 1.00 0.00 N ATOM 677 CA ARG A 41 25.831 -5.660 -0.466 1.00 0.00 C ATOM 678 C ARG A 41 26.402 -6.735 -1.387 1.00 0.00 C ATOM 679 O ARG A 41 27.092 -7.651 -0.937 1.00 0.00 O ATOM 680 CB ARG A 41 24.345 -5.922 -0.218 1.00 0.00 C ATOM 681 CG ARG A 41 23.720 -4.977 0.796 1.00 0.00 C ATOM 682 CD ARG A 41 23.896 -5.490 2.217 1.00 0.00 C ATOM 683 NE ARG A 41 23.007 -4.813 3.156 1.00 0.00 N ATOM 684 CZ ARG A 41 23.214 -4.776 4.468 1.00 0.00 C ATOM 685 NH1 ARG A 41 24.274 -5.375 4.992 1.00 0.00 N ATOM 686 NH2 ARG A 41 22.359 -4.140 5.258 1.00 0.00 N ATOM 0 H ARG A 41 25.159 -3.856 -1.297 1.00 0.00 H new ATOM 0 HA ARG A 41 26.363 -5.700 0.484 1.00 0.00 H new ATOM 0 HB2 ARG A 41 23.807 -5.836 -1.162 1.00 0.00 H new ATOM 0 HB3 ARG A 41 24.219 -6.948 0.128 1.00 0.00 H new ATOM 0 HG2 ARG A 41 24.175 -3.991 0.705 1.00 0.00 H new ATOM 0 HG3 ARG A 41 22.658 -4.859 0.579 1.00 0.00 H new ATOM 0 HD2 ARG A 41 23.702 -6.562 2.242 1.00 0.00 H new ATOM 0 HD3 ARG A 41 24.930 -5.346 2.529 1.00 0.00 H new ATOM 0 HE ARG A 41 22.182 -4.343 2.785 1.00 0.00 H new ATOM 0 HH11 ARG A 41 24.933 -5.866 4.388 1.00 0.00 H new ATOM 0 HH12 ARG A 41 24.431 -5.345 5.999 1.00 0.00 H new ATOM 0 HH21 ARG A 41 21.542 -3.679 4.858 1.00 0.00 H new ATOM 0 HH22 ARG A 41 22.519 -4.112 6.265 1.00 0.00 H new ATOM 700 N LEU A 42 26.109 -6.617 -2.677 1.00 0.00 N ATOM 701 CA LEU A 42 26.592 -7.578 -3.662 1.00 0.00 C ATOM 702 C LEU A 42 28.060 -7.329 -3.992 1.00 0.00 C ATOM 703 O LEU A 42 28.836 -8.270 -4.165 1.00 0.00 O ATOM 704 CB LEU A 42 25.751 -7.498 -4.937 1.00 0.00 C ATOM 705 CG LEU A 42 24.276 -7.876 -4.793 1.00 0.00 C ATOM 706 CD1 LEU A 42 23.554 -7.724 -6.123 1.00 0.00 C ATOM 707 CD2 LEU A 42 24.139 -9.298 -4.269 1.00 0.00 C ATOM 0 H LEU A 42 25.539 -5.865 -3.065 1.00 0.00 H new ATOM 0 HA LEU A 42 26.499 -8.576 -3.234 1.00 0.00 H new ATOM 0 HB2 LEU A 42 25.809 -6.480 -5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.201 -8.149 -5.687 1.00 0.00 H new ATOM 0 HG LEU A 42 23.815 -7.199 -4.074 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.506 -7.997 -6.001 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.623 -6.689 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.015 -8.377 -6.864 1.00 0.00 H new ATOM 0 HD21 LEU A 42 23.083 -9.550 -4.173 1.00 0.00 H new ATOM 0 HD22 LEU A 42 24.615 -9.989 -4.964 1.00 0.00 H new ATOM 0 HD23 LEU A 42 24.621 -9.375 -3.294 1.00 0.00 H new ATOM 719 N ASP A 43 28.435 -6.058 -4.075 1.00 0.00 N ATOM 720 CA ASP A 43 29.811 -5.684 -4.380 1.00 0.00 C ATOM 721 C ASP A 43 30.208 -6.164 -5.773 1.00 0.00 C ATOM 722 O ASP A 43 31.388 -6.370 -6.055 1.00 0.00 O ATOM 723 CB ASP A 43 30.764 -6.267 -3.335 1.00 0.00 C ATOM 724 CG ASP A 43 32.046 -5.467 -3.210 1.00 0.00 C ATOM 725 OD1 ASP A 43 32.272 -4.573 -4.052 1.00 0.00 O ATOM 726 OD2 ASP A 43 32.822 -5.735 -2.270 1.00 0.00 O ATOM 0 H ASP A 43 27.805 -5.268 -3.935 1.00 0.00 H new ATOM 0 HA ASP A 43 29.880 -4.596 -4.356 1.00 0.00 H new ATOM 0 HB2 ASP A 43 30.263 -6.298 -2.368 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.006 -7.296 -3.602 1.00 0.00 H new ATOM 731 N GLU A 44 29.215 -6.341 -6.638 1.00 0.00 N ATOM 732 CA GLU A 44 29.461 -6.799 -8.000 1.00 0.00 C ATOM 733 C GLU A 44 29.428 -5.631 -8.981 1.00 0.00 C ATOM 734 O GLU A 44 29.310 -4.473 -8.580 1.00 0.00 O ATOM 735 CB GLU A 44 28.424 -7.849 -8.405 1.00 0.00 C ATOM 736 CG GLU A 44 28.202 -8.923 -7.352 1.00 0.00 C ATOM 737 CD GLU A 44 29.389 -9.856 -7.212 1.00 0.00 C ATOM 738 OE1 GLU A 44 30.364 -9.694 -7.976 1.00 0.00 O ATOM 739 OE2 GLU A 44 29.343 -10.748 -6.339 1.00 0.00 O ATOM 0 H GLU A 44 28.233 -6.174 -6.420 1.00 0.00 H new ATOM 0 HA GLU A 44 30.453 -7.249 -8.030 1.00 0.00 H new ATOM 0 HB2 GLU A 44 27.476 -7.351 -8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 44 28.742 -8.323 -9.334 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.002 -8.449 -6.391 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.317 -9.504 -7.611 1.00 0.00 H new ATOM 746 N ASP A 45 29.534 -5.944 -10.268 1.00 0.00 N ATOM 747 CA ASP A 45 29.516 -4.921 -11.307 1.00 0.00 C ATOM 748 C ASP A 45 28.084 -4.573 -11.701 1.00 0.00 C ATOM 749 O ASP A 45 27.423 -5.327 -12.417 1.00 0.00 O ATOM 750 CB ASP A 45 30.294 -5.397 -12.535 1.00 0.00 C ATOM 751 CG ASP A 45 31.358 -4.407 -12.966 1.00 0.00 C ATOM 752 OD1 ASP A 45 30.992 -3.320 -13.457 1.00 0.00 O ATOM 753 OD2 ASP A 45 32.557 -4.721 -12.812 1.00 0.00 O ATOM 0 H ASP A 45 29.633 -6.898 -10.616 1.00 0.00 H new ATOM 0 HA ASP A 45 29.993 -4.025 -10.909 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.762 -6.356 -12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.600 -5.562 -13.359 1.00 0.00 H new ATOM 758 N THR A 46 27.608 -3.425 -11.229 1.00 0.00 N ATOM 759 CA THR A 46 26.254 -2.977 -11.529 1.00 0.00 C ATOM 760 C THR A 46 26.267 -1.783 -12.476 1.00 0.00 C ATOM 761 O THR A 46 27.136 -0.916 -12.384 1.00 0.00 O ATOM 762 CB THR A 46 25.492 -2.592 -10.247 1.00 0.00 C ATOM 763 OG1 THR A 46 26.063 -1.410 -9.674 1.00 0.00 O ATOM 764 CG2 THR A 46 25.534 -3.724 -9.232 1.00 0.00 C ATOM 0 H THR A 46 28.141 -2.788 -10.637 1.00 0.00 H new ATOM 0 HA THR A 46 25.744 -3.813 -12.009 1.00 0.00 H new ATOM 0 HB THR A 46 24.452 -2.401 -10.512 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.367 -0.906 -9.202 1.00 0.00 H new ATOM 0 HG21 THR A 46 24.989 -3.429 -8.335 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.073 -4.614 -9.660 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.570 -3.942 -8.972 1.00 0.00 H new ATOM 772 N GLU A 47 25.299 -1.744 -13.386 1.00 0.00 N ATOM 773 CA GLU A 47 25.201 -0.655 -14.351 1.00 0.00 C ATOM 774 C GLU A 47 23.770 -0.506 -14.860 1.00 0.00 C ATOM 775 O GLU A 47 23.069 -1.495 -15.071 1.00 0.00 O ATOM 776 CB GLU A 47 26.149 -0.898 -15.527 1.00 0.00 C ATOM 777 CG GLU A 47 27.496 -0.211 -15.375 1.00 0.00 C ATOM 778 CD GLU A 47 28.069 0.249 -16.701 1.00 0.00 C ATOM 779 OE1 GLU A 47 27.333 0.906 -17.468 1.00 0.00 O ATOM 780 OE2 GLU A 47 29.251 -0.047 -16.973 1.00 0.00 O ATOM 0 H GLU A 47 24.572 -2.454 -13.475 1.00 0.00 H new ATOM 0 HA GLU A 47 25.488 0.268 -13.848 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.308 -1.971 -15.639 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.674 -0.549 -16.444 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.389 0.648 -14.712 1.00 0.00 H new ATOM 0 HG3 GLU A 47 28.197 -0.896 -14.898 1.00 0.00 H new ATOM 787 N ARG A 48 23.344 0.738 -15.054 1.00 0.00 N ATOM 788 CA ARG A 48 21.997 1.018 -15.536 1.00 0.00 C ATOM 789 C ARG A 48 21.945 0.976 -17.061 1.00 0.00 C ATOM 790 O ARG A 48 22.705 1.669 -17.737 1.00 0.00 O ATOM 791 CB ARG A 48 21.527 2.385 -15.037 1.00 0.00 C ATOM 792 CG ARG A 48 21.558 2.525 -13.524 1.00 0.00 C ATOM 793 CD ARG A 48 22.226 3.823 -13.097 1.00 0.00 C ATOM 794 NE ARG A 48 23.646 3.845 -13.438 1.00 0.00 N ATOM 795 CZ ARG A 48 24.387 4.948 -13.426 1.00 0.00 C ATOM 796 NH1 ARG A 48 23.846 6.110 -13.090 1.00 0.00 N ATOM 797 NH2 ARG A 48 25.673 4.888 -13.749 1.00 0.00 N ATOM 0 H ARG A 48 23.912 1.568 -14.885 1.00 0.00 H new ATOM 0 HA ARG A 48 21.332 0.248 -15.145 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.155 3.159 -15.478 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.510 2.561 -15.389 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.541 2.493 -13.134 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.093 1.680 -13.090 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.725 4.664 -13.577 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.109 3.954 -12.021 1.00 0.00 H new ATOM 0 HE ARG A 48 24.093 2.966 -13.699 1.00 0.00 H new ATOM 0 HH11 ARG A 48 22.858 6.159 -12.840 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.417 6.955 -13.082 1.00 0.00 H new ATOM 0 HH21 ARG A 48 26.093 3.995 -14.007 1.00 0.00 H new ATOM 0 HH22 ARG A 48 26.241 5.735 -13.740 1.00 0.00 H new ATOM 811 N ASP A 49 21.045 0.157 -17.594 1.00 0.00 N ATOM 812 CA ASP A 49 20.894 0.025 -19.039 1.00 0.00 C ATOM 813 C ASP A 49 19.421 -0.069 -19.424 1.00 0.00 C ATOM 814 O ASP A 49 18.773 -1.091 -19.198 1.00 0.00 O ATOM 815 CB ASP A 49 21.644 -1.210 -19.541 1.00 0.00 C ATOM 816 CG ASP A 49 22.138 -1.048 -20.965 1.00 0.00 C ATOM 817 OD1 ASP A 49 22.867 -0.070 -21.232 1.00 0.00 O ATOM 818 OD2 ASP A 49 21.794 -1.898 -21.813 1.00 0.00 O ATOM 0 H ASP A 49 20.410 -0.425 -17.048 1.00 0.00 H new ATOM 0 HA ASP A 49 21.318 0.913 -19.507 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.492 -1.408 -18.886 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.988 -2.078 -19.484 1.00 0.00 H new ATOM 823 N ASP A 50 18.898 1.005 -20.007 1.00 0.00 N ATOM 824 CA ASP A 50 17.501 1.045 -20.424 1.00 0.00 C ATOM 825 C ASP A 50 16.571 0.927 -19.220 1.00 0.00 C ATOM 826 O ASP A 50 15.423 0.504 -19.350 1.00 0.00 O ATOM 827 CB ASP A 50 17.212 -0.080 -21.420 1.00 0.00 C ATOM 828 CG ASP A 50 18.319 -0.246 -22.442 1.00 0.00 C ATOM 829 OD1 ASP A 50 18.873 0.780 -22.889 1.00 0.00 O ATOM 830 OD2 ASP A 50 18.631 -1.403 -22.796 1.00 0.00 O ATOM 0 H ASP A 50 19.421 1.859 -20.201 1.00 0.00 H new ATOM 0 HA ASP A 50 17.319 2.004 -20.908 1.00 0.00 H new ATOM 0 HB2 ASP A 50 17.079 -1.016 -20.878 1.00 0.00 H new ATOM 0 HB3 ASP A 50 16.274 0.127 -21.935 1.00 0.00 H new ATOM 835 N GLY A 51 17.076 1.303 -18.049 1.00 0.00 N ATOM 836 CA GLY A 51 16.277 1.230 -16.840 1.00 0.00 C ATOM 837 C GLY A 51 16.427 -0.098 -16.125 1.00 0.00 C ATOM 838 O GLY A 51 15.714 -0.375 -15.160 1.00 0.00 O ATOM 0 H GLY A 51 18.023 1.657 -17.916 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.568 2.036 -16.167 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.228 1.387 -17.091 1.00 0.00 H new ATOM 842 N ASP A 52 17.353 -0.923 -16.601 1.00 0.00 N ATOM 843 CA ASP A 52 17.593 -2.231 -16.001 1.00 0.00 C ATOM 844 C ASP A 52 18.928 -2.253 -15.263 1.00 0.00 C ATOM 845 O ASP A 52 19.724 -1.318 -15.368 1.00 0.00 O ATOM 846 CB ASP A 52 17.571 -3.319 -17.075 1.00 0.00 C ATOM 847 CG ASP A 52 18.957 -3.845 -17.395 1.00 0.00 C ATOM 848 OD1 ASP A 52 19.822 -3.035 -17.790 1.00 0.00 O ATOM 849 OD2 ASP A 52 19.176 -5.065 -17.251 1.00 0.00 O ATOM 0 H ASP A 52 17.950 -0.710 -17.400 1.00 0.00 H new ATOM 0 HA ASP A 52 16.798 -2.426 -15.281 1.00 0.00 H new ATOM 0 HB2 ASP A 52 16.941 -4.143 -16.740 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.118 -2.920 -17.983 1.00 0.00 H new ATOM 854 N LEU A 53 19.168 -3.326 -14.517 1.00 0.00 N ATOM 855 CA LEU A 53 20.407 -3.470 -13.760 1.00 0.00 C ATOM 856 C LEU A 53 21.113 -4.775 -14.115 1.00 0.00 C ATOM 857 O LEU A 53 20.527 -5.854 -14.022 1.00 0.00 O ATOM 858 CB LEU A 53 20.118 -3.425 -12.259 1.00 0.00 C ATOM 859 CG LEU A 53 21.239 -2.874 -11.376 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.471 -3.762 -11.461 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.580 -1.446 -11.777 1.00 0.00 C ATOM 0 H LEU A 53 18.521 -4.109 -14.420 1.00 0.00 H new ATOM 0 HA LEU A 53 21.063 -2.640 -14.022 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.226 -2.820 -12.099 1.00 0.00 H new ATOM 0 HB3 LEU A 53 19.882 -4.435 -11.924 1.00 0.00 H new ATOM 0 HG LEU A 53 20.892 -2.867 -10.343 1.00 0.00 H new ATOM 0 HD11 LEU A 53 23.258 -3.354 -10.826 1.00 0.00 H new ATOM 0 HD12 LEU A 53 22.218 -4.768 -11.125 1.00 0.00 H new ATOM 0 HD13 LEU A 53 22.821 -3.801 -12.493 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.379 -1.070 -11.138 1.00 0.00 H new ATOM 0 HD22 LEU A 53 21.907 -1.428 -12.817 1.00 0.00 H new ATOM 0 HD23 LEU A 53 20.698 -0.816 -11.664 1.00 0.00 H new ATOM 873 N ILE A 54 22.374 -4.668 -14.520 1.00 0.00 N ATOM 874 CA ILE A 54 23.160 -5.840 -14.885 1.00 0.00 C ATOM 875 C ILE A 54 24.053 -6.284 -13.732 1.00 0.00 C ATOM 876 O ILE A 54 24.850 -5.501 -13.213 1.00 0.00 O ATOM 877 CB ILE A 54 24.036 -5.567 -16.122 1.00 0.00 C ATOM 878 CG1 ILE A 54 23.240 -4.798 -17.178 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.564 -6.873 -16.696 1.00 0.00 C ATOM 880 CD1 ILE A 54 22.006 -5.531 -17.657 1.00 0.00 C ATOM 0 H ILE A 54 22.873 -3.782 -14.604 1.00 0.00 H new ATOM 0 HA ILE A 54 22.452 -6.635 -15.119 1.00 0.00 H new ATOM 0 HB ILE A 54 24.886 -4.956 -15.819 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.943 -3.833 -16.766 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.886 -4.595 -18.032 1.00 0.00 H new ATOM 0 HG21 ILE A 54 25.181 -6.663 -17.570 1.00 0.00 H new ATOM 0 HG22 ILE A 54 25.163 -7.386 -15.943 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.727 -7.507 -16.987 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.491 -4.927 -18.404 1.00 0.00 H new ATOM 0 HD12 ILE A 54 22.297 -6.484 -18.099 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.339 -5.711 -16.814 1.00 0.00 H new ATOM 892 N ILE A 55 23.915 -7.545 -13.336 1.00 0.00 N ATOM 893 CA ILE A 55 24.712 -8.094 -12.246 1.00 0.00 C ATOM 894 C ILE A 55 25.432 -9.367 -12.678 1.00 0.00 C ATOM 895 O ILE A 55 24.799 -10.361 -13.036 1.00 0.00 O ATOM 896 CB ILE A 55 23.842 -8.403 -11.013 1.00 0.00 C ATOM 897 CG1 ILE A 55 22.949 -7.207 -10.679 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.718 -8.766 -9.823 1.00 0.00 C ATOM 899 CD1 ILE A 55 22.073 -7.426 -9.465 1.00 0.00 C ATOM 0 H ILE A 55 23.259 -8.205 -13.753 1.00 0.00 H new ATOM 0 HA ILE A 55 25.448 -7.335 -11.980 1.00 0.00 H new ATOM 0 HB ILE A 55 23.204 -9.256 -11.242 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.576 -6.332 -10.511 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.316 -6.986 -11.538 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.088 -8.981 -8.960 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.315 -9.645 -10.065 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.379 -7.932 -9.590 1.00 0.00 H new ATOM 0 HD11 ILE A 55 21.467 -6.537 -9.288 1.00 0.00 H new ATOM 0 HD12 ILE A 55 21.420 -8.282 -9.637 1.00 0.00 H new ATOM 0 HD13 ILE A 55 22.700 -7.617 -8.594 1.00 0.00 H new ATOM 911 N THR A 56 26.760 -9.331 -12.640 1.00 0.00 N ATOM 912 CA THR A 56 27.567 -10.481 -13.027 1.00 0.00 C ATOM 913 C THR A 56 28.296 -11.071 -11.825 1.00 0.00 C ATOM 914 O THR A 56 29.103 -10.398 -11.183 1.00 0.00 O ATOM 915 CB THR A 56 28.601 -10.105 -14.106 1.00 0.00 C ATOM 916 OG1 THR A 56 27.990 -9.277 -15.101 1.00 0.00 O ATOM 917 CG2 THR A 56 29.178 -11.352 -14.760 1.00 0.00 C ATOM 0 H THR A 56 27.300 -8.517 -12.345 1.00 0.00 H new ATOM 0 HA THR A 56 26.882 -11.225 -13.434 1.00 0.00 H new ATOM 0 HB THR A 56 29.412 -9.557 -13.626 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.681 -8.911 -15.691 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.905 -11.062 -15.518 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.667 -11.966 -14.004 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.375 -11.923 -15.227 1.00 0.00 H new ATOM 925 N VAL A 57 28.007 -12.333 -11.524 1.00 0.00 N ATOM 926 CA VAL A 57 28.637 -13.015 -10.400 1.00 0.00 C ATOM 927 C VAL A 57 29.212 -14.361 -10.825 1.00 0.00 C ATOM 928 O VAL A 57 28.476 -15.266 -11.219 1.00 0.00 O ATOM 929 CB VAL A 57 27.639 -13.236 -9.247 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.306 -11.916 -8.569 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.377 -13.915 -9.759 1.00 0.00 C ATOM 0 H VAL A 57 27.340 -12.904 -12.043 1.00 0.00 H new ATOM 0 HA VAL A 57 29.446 -12.372 -10.053 1.00 0.00 H new ATOM 0 HB VAL A 57 28.102 -13.890 -8.508 1.00 0.00 H new ATOM 0 HG11 VAL A 57 26.600 -12.092 -7.757 1.00 0.00 H new ATOM 0 HG12 VAL A 57 28.217 -11.473 -8.168 1.00 0.00 H new ATOM 0 HG13 VAL A 57 26.862 -11.236 -9.296 1.00 0.00 H new ATOM 0 HG21 VAL A 57 25.683 -14.064 -8.932 1.00 0.00 H new ATOM 0 HG22 VAL A 57 25.909 -13.288 -10.518 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.634 -14.880 -10.195 1.00 0.00 H new ATOM 941 N PHE A 58 30.532 -14.487 -10.741 1.00 0.00 N ATOM 942 CA PHE A 58 31.207 -15.724 -11.118 1.00 0.00 C ATOM 943 C PHE A 58 31.988 -16.298 -9.939 1.00 0.00 C ATOM 944 O PHE A 58 32.526 -15.556 -9.116 1.00 0.00 O ATOM 945 CB PHE A 58 32.150 -15.476 -12.297 1.00 0.00 C ATOM 946 CG PHE A 58 32.985 -14.237 -12.147 1.00 0.00 C ATOM 947 CD1 PHE A 58 34.011 -14.185 -11.218 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.743 -13.123 -12.936 1.00 0.00 C ATOM 949 CE1 PHE A 58 34.781 -13.046 -11.077 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.510 -11.982 -12.800 1.00 0.00 C ATOM 951 CZ PHE A 58 34.530 -11.942 -11.869 1.00 0.00 C ATOM 0 H PHE A 58 31.156 -13.748 -10.415 1.00 0.00 H new ATOM 0 HA PHE A 58 30.448 -16.447 -11.415 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.809 -16.337 -12.412 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.562 -15.400 -13.212 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.212 -15.045 -10.596 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.946 -13.147 -13.665 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.578 -13.019 -10.349 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.312 -11.121 -13.422 1.00 0.00 H new ATOM 0 HZ PHE A 58 35.130 -11.050 -11.761 1.00 0.00 H new ATOM 961 N TYR A 59 32.046 -17.623 -9.865 1.00 0.00 N ATOM 962 CA TYR A 59 32.759 -18.297 -8.786 1.00 0.00 C ATOM 963 C TYR A 59 33.489 -19.532 -9.304 1.00 0.00 C ATOM 964 O TYR A 59 32.950 -20.294 -10.106 1.00 0.00 O ATOM 965 CB TYR A 59 31.786 -18.696 -7.675 1.00 0.00 C ATOM 966 CG TYR A 59 30.814 -17.600 -7.300 1.00 0.00 C ATOM 967 CD1 TYR A 59 29.645 -17.403 -8.024 1.00 0.00 C ATOM 968 CD2 TYR A 59 31.065 -16.760 -6.221 1.00 0.00 C ATOM 969 CE1 TYR A 59 28.754 -16.403 -7.685 1.00 0.00 C ATOM 970 CE2 TYR A 59 30.180 -15.759 -5.874 1.00 0.00 C ATOM 971 CZ TYR A 59 29.026 -15.583 -6.609 1.00 0.00 C ATOM 972 OH TYR A 59 28.142 -14.586 -6.268 1.00 0.00 O ATOM 0 H TYR A 59 31.608 -18.251 -10.539 1.00 0.00 H new ATOM 0 HA TYR A 59 33.496 -17.603 -8.383 1.00 0.00 H new ATOM 0 HB2 TYR A 59 31.225 -19.575 -7.993 1.00 0.00 H new ATOM 0 HB3 TYR A 59 32.355 -18.984 -6.791 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.429 -18.043 -8.867 1.00 0.00 H new ATOM 0 HD2 TYR A 59 31.968 -16.893 -5.644 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.850 -16.264 -8.259 1.00 0.00 H new ATOM 0 HE2 TYR A 59 30.390 -15.117 -5.031 1.00 0.00 H new ATOM 0 HH TYR A 59 28.539 -13.713 -6.472 1.00 0.00 H new ATOM 982 N GLU A 60 34.720 -19.722 -8.839 1.00 0.00 N ATOM 983 CA GLU A 60 35.526 -20.864 -9.256 1.00 0.00 C ATOM 984 C GLU A 60 35.365 -22.027 -8.281 1.00 0.00 C ATOM 985 O GLU A 60 34.592 -21.949 -7.327 1.00 0.00 O ATOM 986 CB GLU A 60 37.000 -20.467 -9.355 1.00 0.00 C ATOM 987 CG GLU A 60 37.672 -20.278 -8.005 1.00 0.00 C ATOM 988 CD GLU A 60 38.550 -19.043 -7.958 1.00 0.00 C ATOM 989 OE1 GLU A 60 39.363 -18.858 -8.888 1.00 0.00 O ATOM 990 OE2 GLU A 60 38.425 -18.262 -6.992 1.00 0.00 O ATOM 0 H GLU A 60 35.181 -19.101 -8.174 1.00 0.00 H new ATOM 0 HA GLU A 60 35.177 -21.184 -10.238 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.537 -21.233 -9.915 1.00 0.00 H new ATOM 0 HB3 GLU A 60 37.081 -19.541 -9.924 1.00 0.00 H new ATOM 0 HG2 GLU A 60 36.909 -20.206 -7.230 1.00 0.00 H new ATOM 0 HG3 GLU A 60 38.275 -21.157 -7.777 1.00 0.00 H new ATOM 997 N ARG A 61 36.100 -23.106 -8.531 1.00 0.00 N ATOM 998 CA ARG A 61 36.039 -24.286 -7.677 1.00 0.00 C ATOM 999 C ARG A 61 36.099 -23.895 -6.203 1.00 0.00 C ATOM 1000 O ARG A 61 35.483 -24.540 -5.355 1.00 0.00 O ATOM 1001 CB ARG A 61 37.186 -25.243 -8.010 1.00 0.00 C ATOM 1002 CG ARG A 61 36.727 -26.551 -8.633 1.00 0.00 C ATOM 1003 CD ARG A 61 35.977 -27.413 -7.629 1.00 0.00 C ATOM 1004 NE ARG A 61 35.626 -28.718 -8.183 1.00 0.00 N ATOM 1005 CZ ARG A 61 36.486 -29.724 -8.297 1.00 0.00 C ATOM 1006 NH1 ARG A 61 37.741 -29.576 -7.896 1.00 0.00 N ATOM 1007 NH2 ARG A 61 36.091 -30.881 -8.811 1.00 0.00 N ATOM 0 H ARG A 61 36.744 -23.187 -9.318 1.00 0.00 H new ATOM 0 HA ARG A 61 35.090 -24.789 -7.863 1.00 0.00 H new ATOM 0 HB2 ARG A 61 37.875 -24.747 -8.694 1.00 0.00 H new ATOM 0 HB3 ARG A 61 37.743 -25.460 -7.098 1.00 0.00 H new ATOM 0 HG2 ARG A 61 36.083 -26.342 -9.488 1.00 0.00 H new ATOM 0 HG3 ARG A 61 37.591 -27.098 -9.011 1.00 0.00 H new ATOM 0 HD2 ARG A 61 36.591 -27.550 -6.739 1.00 0.00 H new ATOM 0 HD3 ARG A 61 35.070 -26.897 -7.314 1.00 0.00 H new ATOM 0 HE ARG A 61 34.668 -28.865 -8.500 1.00 0.00 H new ATOM 0 HH11 ARG A 61 38.048 -28.688 -7.499 1.00 0.00 H new ATOM 0 HH12 ARG A 61 38.399 -30.350 -7.985 1.00 0.00 H new ATOM 0 HH21 ARG A 61 35.126 -30.999 -9.119 1.00 0.00 H new ATOM 0 HH22 ARG A 61 36.752 -31.653 -8.898 1.00 0.00 H new ATOM 1021 N GLU A 62 36.846 -22.836 -5.907 1.00 0.00 N ATOM 1022 CA GLU A 62 36.987 -22.361 -4.536 1.00 0.00 C ATOM 1023 C GLU A 62 35.621 -22.144 -3.892 1.00 0.00 C ATOM 1024 O GLU A 62 35.435 -22.402 -2.703 1.00 0.00 O ATOM 1025 CB GLU A 62 37.792 -21.060 -4.504 1.00 0.00 C ATOM 1026 CG GLU A 62 39.271 -21.252 -4.795 1.00 0.00 C ATOM 1027 CD GLU A 62 39.912 -22.293 -3.899 1.00 0.00 C ATOM 1028 OE1 GLU A 62 40.401 -21.919 -2.812 1.00 0.00 O ATOM 1029 OE2 GLU A 62 39.925 -23.481 -4.283 1.00 0.00 O ATOM 0 H GLU A 62 37.362 -22.291 -6.598 1.00 0.00 H new ATOM 0 HA GLU A 62 37.520 -23.123 -3.967 1.00 0.00 H new ATOM 0 HB2 GLU A 62 37.374 -20.366 -5.233 1.00 0.00 H new ATOM 0 HB3 GLU A 62 37.680 -20.598 -3.523 1.00 0.00 H new ATOM 0 HG2 GLU A 62 39.397 -21.548 -5.837 1.00 0.00 H new ATOM 0 HG3 GLU A 62 39.789 -20.301 -4.669 1.00 0.00 H new ATOM 1036 N TYR A 63 34.669 -21.666 -4.686 1.00 0.00 N ATOM 1037 CA TYR A 63 33.321 -21.410 -4.194 1.00 0.00 C ATOM 1038 C TYR A 63 32.294 -22.235 -4.963 1.00 0.00 C ATOM 1039 O TYR A 63 31.090 -21.996 -4.868 1.00 0.00 O ATOM 1040 CB TYR A 63 32.987 -19.922 -4.311 1.00 0.00 C ATOM 1041 CG TYR A 63 33.138 -19.162 -3.012 1.00 0.00 C ATOM 1042 CD1 TYR A 63 34.353 -18.589 -2.658 1.00 0.00 C ATOM 1043 CD2 TYR A 63 32.067 -19.020 -2.139 1.00 0.00 C ATOM 1044 CE1 TYR A 63 34.497 -17.895 -1.472 1.00 0.00 C ATOM 1045 CE2 TYR A 63 32.201 -18.326 -0.952 1.00 0.00 C ATOM 1046 CZ TYR A 63 33.418 -17.766 -0.623 1.00 0.00 C ATOM 1047 OH TYR A 63 33.555 -17.076 0.560 1.00 0.00 O ATOM 0 H TYR A 63 34.806 -21.448 -5.673 1.00 0.00 H new ATOM 0 HA TYR A 63 33.283 -21.703 -3.145 1.00 0.00 H new ATOM 0 HB2 TYR A 63 33.635 -19.471 -5.063 1.00 0.00 H new ATOM 0 HB3 TYR A 63 31.962 -19.815 -4.667 1.00 0.00 H new ATOM 0 HD1 TYR A 63 35.200 -18.688 -3.321 1.00 0.00 H new ATOM 0 HD2 TYR A 63 31.114 -19.459 -2.392 1.00 0.00 H new ATOM 0 HE1 TYR A 63 35.449 -17.456 -1.211 1.00 0.00 H new ATOM 0 HE2 TYR A 63 31.358 -18.222 -0.285 1.00 0.00 H new ATOM 0 HH TYR A 63 32.701 -17.077 1.040 1.00 0.00 H new ATOM 1057 N PHE A 64 32.780 -23.210 -5.725 1.00 0.00 N ATOM 1058 CA PHE A 64 31.906 -24.072 -6.512 1.00 0.00 C ATOM 1059 C PHE A 64 31.224 -23.284 -7.627 1.00 0.00 C ATOM 1060 O PHE A 64 30.260 -22.551 -7.403 1.00 0.00 O ATOM 1061 CB PHE A 64 30.852 -24.722 -5.614 1.00 0.00 C ATOM 1062 CG PHE A 64 30.941 -26.221 -5.573 1.00 0.00 C ATOM 1063 CD1 PHE A 64 31.938 -26.850 -4.846 1.00 0.00 C ATOM 1064 CD2 PHE A 64 30.027 -27.001 -6.264 1.00 0.00 C ATOM 1065 CE1 PHE A 64 32.022 -28.229 -4.807 1.00 0.00 C ATOM 1066 CE2 PHE A 64 30.105 -28.380 -6.228 1.00 0.00 C ATOM 1067 CZ PHE A 64 31.105 -28.995 -5.499 1.00 0.00 C ATOM 0 H PHE A 64 33.774 -23.422 -5.814 1.00 0.00 H new ATOM 0 HA PHE A 64 32.519 -24.852 -6.965 1.00 0.00 H new ATOM 0 HB2 PHE A 64 30.958 -24.332 -4.602 1.00 0.00 H new ATOM 0 HB3 PHE A 64 29.861 -24.434 -5.964 1.00 0.00 H new ATOM 0 HD1 PHE A 64 32.658 -26.256 -4.303 1.00 0.00 H new ATOM 0 HD2 PHE A 64 29.245 -26.525 -6.837 1.00 0.00 H new ATOM 0 HE1 PHE A 64 32.804 -28.707 -4.236 1.00 0.00 H new ATOM 0 HE2 PHE A 64 29.385 -28.977 -6.769 1.00 0.00 H new ATOM 0 HZ PHE A 64 31.169 -30.073 -5.471 1.00 0.00 H new ATOM 1077 N PRO A 65 31.736 -23.437 -8.857 1.00 0.00 N ATOM 1078 CA PRO A 65 31.192 -22.748 -10.031 1.00 0.00 C ATOM 1079 C PRO A 65 29.819 -23.277 -10.430 1.00 0.00 C ATOM 1080 O PRO A 65 29.476 -24.424 -10.140 1.00 0.00 O ATOM 1081 CB PRO A 65 32.219 -23.048 -11.126 1.00 0.00 C ATOM 1082 CG PRO A 65 32.865 -24.321 -10.700 1.00 0.00 C ATOM 1083 CD PRO A 65 32.883 -24.294 -9.197 1.00 0.00 C ATOM 0 HA PRO A 65 31.044 -21.684 -9.846 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.740 -23.153 -12.100 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.949 -22.244 -11.215 1.00 0.00 H new ATOM 0 HG2 PRO A 65 32.309 -25.183 -11.068 1.00 0.00 H new ATOM 0 HG3 PRO A 65 33.876 -24.399 -11.101 1.00 0.00 H new ATOM 0 HD2 PRO A 65 32.776 -25.294 -8.776 1.00 0.00 H new ATOM 0 HD3 PRO A 65 33.818 -23.885 -8.814 1.00 0.00 H new ATOM 1091 N PHE A 66 29.036 -22.436 -11.097 1.00 0.00 N ATOM 1092 CA PHE A 66 27.699 -22.819 -11.536 1.00 0.00 C ATOM 1093 C PHE A 66 27.758 -23.583 -12.856 1.00 0.00 C ATOM 1094 O PHE A 66 27.923 -22.991 -13.921 1.00 0.00 O ATOM 1095 CB PHE A 66 26.815 -21.580 -11.690 1.00 0.00 C ATOM 1096 CG PHE A 66 26.838 -20.675 -10.491 1.00 0.00 C ATOM 1097 CD1 PHE A 66 26.768 -21.197 -9.210 1.00 0.00 C ATOM 1098 CD2 PHE A 66 26.930 -19.301 -10.647 1.00 0.00 C ATOM 1099 CE1 PHE A 66 26.790 -20.367 -8.105 1.00 0.00 C ATOM 1100 CE2 PHE A 66 26.952 -18.466 -9.546 1.00 0.00 C ATOM 1101 CZ PHE A 66 26.881 -18.999 -8.274 1.00 0.00 C ATOM 0 H PHE A 66 29.304 -21.484 -11.346 1.00 0.00 H new ATOM 0 HA PHE A 66 27.268 -23.472 -10.777 1.00 0.00 H new ATOM 0 HB2 PHE A 66 27.140 -21.018 -12.566 1.00 0.00 H new ATOM 0 HB3 PHE A 66 25.789 -21.896 -11.877 1.00 0.00 H new ATOM 0 HD1 PHE A 66 26.695 -22.266 -9.073 1.00 0.00 H new ATOM 0 HD2 PHE A 66 26.985 -18.878 -11.639 1.00 0.00 H new ATOM 0 HE1 PHE A 66 26.736 -20.787 -7.112 1.00 0.00 H new ATOM 0 HE2 PHE A 66 27.025 -17.397 -9.680 1.00 0.00 H new ATOM 0 HZ PHE A 66 26.897 -18.347 -7.413 1.00 0.00 H new ATOM 1111 N GLY A 67 27.622 -24.903 -12.775 1.00 0.00 N ATOM 1112 CA GLY A 67 27.663 -25.727 -13.969 1.00 0.00 C ATOM 1113 C GLY A 67 27.278 -27.167 -13.693 1.00 0.00 C ATOM 1114 O GLY A 67 28.116 -27.974 -13.291 1.00 0.00 O ATOM 0 H GLY A 67 27.484 -25.416 -11.904 1.00 0.00 H new ATOM 0 HA2 GLY A 67 26.988 -25.311 -14.717 1.00 0.00 H new ATOM 0 HA3 GLY A 67 28.667 -25.697 -14.393 1.00 0.00 H new ATOM 1118 N SER A 68 26.007 -27.490 -13.908 1.00 0.00 N ATOM 1119 CA SER A 68 25.512 -28.842 -13.675 1.00 0.00 C ATOM 1120 C SER A 68 24.269 -29.118 -14.516 1.00 0.00 C ATOM 1121 O SER A 68 23.327 -29.762 -14.057 1.00 0.00 O ATOM 1122 CB SER A 68 25.192 -29.041 -12.192 1.00 0.00 C ATOM 1123 OG SER A 68 24.775 -30.371 -11.935 1.00 0.00 O ATOM 0 H SER A 68 25.301 -26.834 -14.243 1.00 0.00 H new ATOM 0 HA SER A 68 26.292 -29.544 -13.969 1.00 0.00 H new ATOM 0 HB2 SER A 68 26.073 -28.810 -11.592 1.00 0.00 H new ATOM 0 HB3 SER A 68 24.409 -28.346 -11.889 1.00 0.00 H new ATOM 0 HG SER A 68 24.027 -30.599 -12.526 1.00 0.00 H new ATOM 1129 N GLU A 69 24.277 -28.625 -15.751 1.00 0.00 N ATOM 1130 CA GLU A 69 23.151 -28.818 -16.657 1.00 0.00 C ATOM 1131 C GLU A 69 22.994 -30.291 -17.024 1.00 0.00 C ATOM 1132 O GLU A 69 21.910 -30.735 -17.401 1.00 0.00 O ATOM 1133 CB GLU A 69 23.338 -27.982 -17.925 1.00 0.00 C ATOM 1134 CG GLU A 69 24.649 -28.253 -18.644 1.00 0.00 C ATOM 1135 CD GLU A 69 24.468 -29.109 -19.883 1.00 0.00 C ATOM 1136 OE1 GLU A 69 23.741 -28.678 -20.802 1.00 0.00 O ATOM 1137 OE2 GLU A 69 25.055 -30.210 -19.933 1.00 0.00 O ATOM 0 H GLU A 69 25.050 -28.090 -16.146 1.00 0.00 H new ATOM 0 HA GLU A 69 22.246 -28.490 -16.145 1.00 0.00 H new ATOM 0 HB2 GLU A 69 22.511 -28.181 -18.607 1.00 0.00 H new ATOM 0 HB3 GLU A 69 23.288 -26.925 -17.664 1.00 0.00 H new ATOM 0 HG2 GLU A 69 25.108 -27.305 -18.926 1.00 0.00 H new ATOM 0 HG3 GLU A 69 25.338 -28.750 -17.961 1.00 0.00 H new ATOM 1144 N GLU A 70 24.085 -31.042 -16.912 1.00 0.00 N ATOM 1145 CA GLU A 70 24.069 -32.464 -17.234 1.00 0.00 C ATOM 1146 C GLU A 70 22.996 -33.192 -16.430 1.00 0.00 C ATOM 1147 O GLU A 70 22.507 -34.245 -16.838 1.00 0.00 O ATOM 1148 CB GLU A 70 25.439 -33.088 -16.957 1.00 0.00 C ATOM 1149 CG GLU A 70 26.462 -32.819 -18.049 1.00 0.00 C ATOM 1150 CD GLU A 70 27.639 -33.773 -17.993 1.00 0.00 C ATOM 1151 OE1 GLU A 70 27.924 -34.302 -16.898 1.00 0.00 O ATOM 1152 OE2 GLU A 70 28.275 -33.992 -19.046 1.00 0.00 O ATOM 0 H GLU A 70 24.990 -30.690 -16.601 1.00 0.00 H new ATOM 0 HA GLU A 70 23.838 -32.567 -18.294 1.00 0.00 H new ATOM 0 HB2 GLU A 70 25.820 -32.703 -16.011 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.321 -34.165 -16.838 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.979 -32.901 -19.023 1.00 0.00 H new ATOM 0 HG3 GLU A 70 26.824 -31.795 -17.958 1.00 0.00 H new ATOM 1159 N SER A 71 22.634 -32.622 -15.285 1.00 0.00 N ATOM 1160 CA SER A 71 21.622 -33.218 -14.421 1.00 0.00 C ATOM 1161 C SER A 71 20.242 -33.140 -15.067 1.00 0.00 C ATOM 1162 O SER A 71 19.581 -34.159 -15.273 1.00 0.00 O ATOM 1163 CB SER A 71 21.602 -32.515 -13.063 1.00 0.00 C ATOM 1164 OG SER A 71 20.807 -33.227 -12.130 1.00 0.00 O ATOM 0 H SER A 71 23.027 -31.748 -14.934 1.00 0.00 H new ATOM 0 HA SER A 71 21.877 -34.268 -14.275 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.619 -32.423 -12.683 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.213 -31.504 -13.180 1.00 0.00 H new ATOM 0 HG SER A 71 20.812 -32.757 -11.270 1.00 0.00 H new ATOM 1170 N LYS A 72 19.812 -31.924 -15.385 1.00 0.00 N ATOM 1171 CA LYS A 72 18.512 -31.710 -16.009 1.00 0.00 C ATOM 1172 C LYS A 72 18.524 -32.170 -17.463 1.00 0.00 C ATOM 1173 O LYS A 72 17.481 -32.495 -18.031 1.00 0.00 O ATOM 1174 CB LYS A 72 18.125 -30.231 -15.934 1.00 0.00 C ATOM 1175 CG LYS A 72 16.642 -30.002 -15.694 1.00 0.00 C ATOM 1176 CD LYS A 72 16.352 -28.554 -15.339 1.00 0.00 C ATOM 1177 CE LYS A 72 16.011 -28.398 -13.865 1.00 0.00 C ATOM 1178 NZ LYS A 72 14.555 -28.170 -13.653 1.00 0.00 N ATOM 0 H LYS A 72 20.346 -31.070 -15.221 1.00 0.00 H new ATOM 0 HA LYS A 72 17.774 -32.301 -15.466 1.00 0.00 H new ATOM 0 HB2 LYS A 72 18.692 -29.756 -15.133 1.00 0.00 H new ATOM 0 HB3 LYS A 72 18.414 -29.741 -16.864 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.081 -30.278 -16.587 1.00 0.00 H new ATOM 0 HG3 LYS A 72 16.298 -30.651 -14.888 1.00 0.00 H new ATOM 0 HD2 LYS A 72 17.219 -27.939 -15.580 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.523 -28.189 -15.946 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.321 -29.292 -13.324 1.00 0.00 H new ATOM 0 HE3 LYS A 72 16.574 -27.562 -13.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.364 -28.069 -12.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.264 -27.303 -14.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 14.019 -28.979 -14.027 1.00 0.00 H new ATOM 1192 N VAL A 73 19.711 -32.195 -18.061 1.00 0.00 N ATOM 1193 CA VAL A 73 19.859 -32.618 -19.449 1.00 0.00 C ATOM 1194 C VAL A 73 19.183 -31.635 -20.398 1.00 0.00 C ATOM 1195 O VAL A 73 18.700 -32.017 -21.464 1.00 0.00 O ATOM 1196 CB VAL A 73 19.268 -34.022 -19.674 1.00 0.00 C ATOM 1197 CG1 VAL A 73 19.788 -34.619 -20.972 1.00 0.00 C ATOM 1198 CG2 VAL A 73 19.586 -34.929 -18.495 1.00 0.00 C ATOM 0 H VAL A 73 20.584 -31.927 -17.606 1.00 0.00 H new ATOM 0 HA VAL A 73 20.928 -32.645 -19.660 1.00 0.00 H new ATOM 0 HB VAL A 73 18.184 -33.933 -19.752 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.359 -35.611 -21.114 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.504 -33.978 -21.807 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.874 -34.696 -20.927 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.161 -35.917 -18.671 1.00 0.00 H new ATOM 0 HG22 VAL A 73 20.667 -35.014 -18.382 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.159 -34.507 -17.586 1.00 0.00 H new ATOM 1208 N LYS A 74 19.152 -30.367 -20.004 1.00 0.00 N ATOM 1209 CA LYS A 74 18.537 -29.326 -20.819 1.00 0.00 C ATOM 1210 C LYS A 74 19.009 -27.943 -20.383 1.00 0.00 C ATOM 1211 O LYS A 74 19.369 -27.737 -19.224 1.00 0.00 O ATOM 1212 CB LYS A 74 17.012 -29.410 -20.724 1.00 0.00 C ATOM 1213 CG LYS A 74 16.502 -29.632 -19.310 1.00 0.00 C ATOM 1214 CD LYS A 74 15.073 -29.143 -19.150 1.00 0.00 C ATOM 1215 CE LYS A 74 14.072 -30.169 -19.657 1.00 0.00 C ATOM 1216 NZ LYS A 74 13.932 -30.123 -21.139 1.00 0.00 N ATOM 0 H LYS A 74 19.546 -30.035 -19.124 1.00 0.00 H new ATOM 0 HA LYS A 74 18.840 -29.484 -21.854 1.00 0.00 H new ATOM 0 HB2 LYS A 74 16.581 -28.489 -21.117 1.00 0.00 H new ATOM 0 HB3 LYS A 74 16.661 -30.223 -21.360 1.00 0.00 H new ATOM 0 HG2 LYS A 74 16.554 -30.693 -19.066 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.147 -29.110 -18.603 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.876 -28.930 -18.099 1.00 0.00 H new ATOM 0 HD3 LYS A 74 14.944 -28.208 -19.695 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.389 -31.167 -19.353 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.101 -29.988 -19.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 12.955 -30.361 -21.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.159 -29.167 -21.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.584 -30.808 -21.571 1.00 0.00 H new ATOM 1230 N MET A 75 19.002 -26.998 -21.318 1.00 0.00 N ATOM 1231 CA MET A 75 19.427 -25.634 -21.028 1.00 0.00 C ATOM 1232 C MET A 75 18.634 -25.053 -19.862 1.00 0.00 C ATOM 1233 O MET A 75 19.109 -24.163 -19.157 1.00 0.00 O ATOM 1234 CB MET A 75 19.258 -24.750 -22.266 1.00 0.00 C ATOM 1235 CG MET A 75 17.846 -24.216 -22.442 1.00 0.00 C ATOM 1236 SD MET A 75 16.661 -25.510 -22.859 1.00 0.00 S ATOM 1237 CE MET A 75 15.225 -24.528 -23.288 1.00 0.00 C ATOM 0 H MET A 75 18.707 -27.152 -22.282 1.00 0.00 H new ATOM 0 HA MET A 75 20.481 -25.660 -20.750 1.00 0.00 H new ATOM 0 HB2 MET A 75 19.950 -23.910 -22.200 1.00 0.00 H new ATOM 0 HB3 MET A 75 19.535 -25.322 -23.152 1.00 0.00 H new ATOM 0 HG2 MET A 75 17.531 -23.723 -21.522 1.00 0.00 H new ATOM 0 HG3 MET A 75 17.843 -23.459 -23.227 1.00 0.00 H new ATOM 0 HE1 MET A 75 14.404 -25.188 -23.570 1.00 0.00 H new ATOM 0 HE2 MET A 75 14.928 -23.924 -22.430 1.00 0.00 H new ATOM 0 HE3 MET A 75 15.468 -23.874 -24.125 1.00 0.00 H new ATOM 1247 N ALA A 76 17.422 -25.563 -19.665 1.00 0.00 N ATOM 1248 CA ALA A 76 16.564 -25.096 -18.583 1.00 0.00 C ATOM 1249 C ALA A 76 17.306 -25.104 -17.251 1.00 0.00 C ATOM 1250 O ALA A 76 17.020 -24.298 -16.365 1.00 0.00 O ATOM 1251 CB ALA A 76 15.310 -25.953 -18.496 1.00 0.00 C ATOM 0 H ALA A 76 17.013 -26.299 -20.240 1.00 0.00 H new ATOM 0 HA ALA A 76 16.274 -24.068 -18.801 1.00 0.00 H new ATOM 0 HB1 ALA A 76 14.679 -25.593 -17.684 1.00 0.00 H new ATOM 0 HB2 ALA A 76 14.762 -25.892 -19.436 1.00 0.00 H new ATOM 0 HB3 ALA A 76 15.590 -26.989 -18.306 1.00 0.00 H new ATOM 1257 N ASP A 77 18.259 -26.020 -17.116 1.00 0.00 N ATOM 1258 CA ASP A 77 19.043 -26.132 -15.891 1.00 0.00 C ATOM 1259 C ASP A 77 19.880 -24.878 -15.664 1.00 0.00 C ATOM 1260 O ASP A 77 20.051 -24.429 -14.531 1.00 0.00 O ATOM 1261 CB ASP A 77 19.950 -27.362 -15.952 1.00 0.00 C ATOM 1262 CG ASP A 77 20.251 -27.929 -14.579 1.00 0.00 C ATOM 1263 OD1 ASP A 77 19.970 -27.237 -13.578 1.00 0.00 O ATOM 1264 OD2 ASP A 77 20.767 -29.064 -14.504 1.00 0.00 O ATOM 0 H ASP A 77 18.507 -26.695 -17.839 1.00 0.00 H new ATOM 0 HA ASP A 77 18.352 -26.241 -15.055 1.00 0.00 H new ATOM 0 HB2 ASP A 77 19.475 -28.130 -16.563 1.00 0.00 H new ATOM 0 HB3 ASP A 77 20.885 -27.096 -16.445 1.00 0.00 H new ATOM 1269 N PHE A 78 20.402 -24.316 -16.750 1.00 0.00 N ATOM 1270 CA PHE A 78 21.224 -23.114 -16.670 1.00 0.00 C ATOM 1271 C PHE A 78 20.394 -21.918 -16.213 1.00 0.00 C ATOM 1272 O PHE A 78 20.767 -21.213 -15.275 1.00 0.00 O ATOM 1273 CB PHE A 78 21.864 -22.817 -18.027 1.00 0.00 C ATOM 1274 CG PHE A 78 23.280 -23.302 -18.141 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.237 -22.913 -17.217 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.656 -24.148 -19.172 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.541 -23.357 -17.321 1.00 0.00 C ATOM 1278 CE2 PHE A 78 24.959 -24.597 -19.280 1.00 0.00 C ATOM 1279 CZ PHE A 78 25.903 -24.201 -18.352 1.00 0.00 C ATOM 0 H PHE A 78 20.270 -24.674 -17.696 1.00 0.00 H new ATOM 0 HA PHE A 78 22.011 -23.290 -15.936 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.265 -23.281 -18.811 1.00 0.00 H new ATOM 0 HB3 PHE A 78 21.842 -21.741 -18.203 1.00 0.00 H new ATOM 0 HD1 PHE A 78 23.960 -22.255 -16.406 1.00 0.00 H new ATOM 0 HD2 PHE A 78 22.922 -24.460 -19.900 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.277 -23.044 -16.596 1.00 0.00 H new ATOM 0 HE2 PHE A 78 25.239 -25.256 -20.088 1.00 0.00 H new ATOM 0 HZ PHE A 78 26.922 -24.551 -18.433 1.00 0.00 H new ATOM 1289 N ILE A 79 19.268 -21.696 -16.882 1.00 0.00 N ATOM 1290 CA ILE A 79 18.386 -20.585 -16.545 1.00 0.00 C ATOM 1291 C ILE A 79 17.726 -20.801 -15.188 1.00 0.00 C ATOM 1292 O ILE A 79 17.502 -19.852 -14.437 1.00 0.00 O ATOM 1293 CB ILE A 79 17.291 -20.393 -17.611 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.247 -19.386 -17.124 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.636 -21.725 -17.944 1.00 0.00 C ATOM 1296 CD1 ILE A 79 15.022 -20.033 -16.516 1.00 0.00 C ATOM 0 H ILE A 79 18.945 -22.270 -17.660 1.00 0.00 H new ATOM 0 HA ILE A 79 19.006 -19.689 -16.507 1.00 0.00 H new ATOM 0 HB ILE A 79 17.752 -20.001 -18.518 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.705 -18.728 -16.385 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.940 -18.760 -17.961 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.864 -21.572 -18.699 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.388 -22.414 -18.328 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.186 -22.144 -17.044 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.325 -19.260 -16.193 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.540 -20.669 -17.259 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.317 -20.637 -15.658 1.00 0.00 H new ATOM 1308 N ALA A 80 17.418 -22.056 -14.878 1.00 0.00 N ATOM 1309 CA ALA A 80 16.787 -22.397 -13.609 1.00 0.00 C ATOM 1310 C ALA A 80 17.769 -22.255 -12.452 1.00 0.00 C ATOM 1311 O ALA A 80 17.459 -21.636 -11.434 1.00 0.00 O ATOM 1312 CB ALA A 80 16.229 -23.812 -13.660 1.00 0.00 C ATOM 0 H ALA A 80 17.595 -22.854 -15.489 1.00 0.00 H new ATOM 0 HA ALA A 80 15.966 -21.700 -13.441 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.761 -24.053 -12.706 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.488 -23.882 -14.456 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.038 -24.516 -13.855 1.00 0.00 H new ATOM 1318 N ARG A 81 18.955 -22.833 -12.614 1.00 0.00 N ATOM 1319 CA ARG A 81 19.983 -22.772 -11.582 1.00 0.00 C ATOM 1320 C ARG A 81 20.411 -21.330 -11.326 1.00 0.00 C ATOM 1321 O ARG A 81 20.693 -20.949 -10.190 1.00 0.00 O ATOM 1322 CB ARG A 81 21.195 -23.611 -11.989 1.00 0.00 C ATOM 1323 CG ARG A 81 22.347 -23.536 -11.000 1.00 0.00 C ATOM 1324 CD ARG A 81 22.637 -24.893 -10.378 1.00 0.00 C ATOM 1325 NE ARG A 81 23.482 -24.783 -9.192 1.00 0.00 N ATOM 1326 CZ ARG A 81 23.625 -25.754 -8.298 1.00 0.00 C ATOM 1327 NH1 ARG A 81 22.982 -26.903 -8.454 1.00 0.00 N ATOM 1328 NH2 ARG A 81 24.413 -25.578 -7.245 1.00 0.00 N ATOM 0 H ARG A 81 19.228 -23.349 -13.451 1.00 0.00 H new ATOM 0 HA ARG A 81 19.563 -23.177 -10.661 1.00 0.00 H new ATOM 0 HB2 ARG A 81 20.887 -24.651 -12.097 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.544 -23.279 -12.967 1.00 0.00 H new ATOM 0 HG2 ARG A 81 23.239 -23.169 -11.507 1.00 0.00 H new ATOM 0 HG3 ARG A 81 22.108 -22.818 -10.215 1.00 0.00 H new ATOM 0 HD2 ARG A 81 21.698 -25.377 -10.110 1.00 0.00 H new ATOM 0 HD3 ARG A 81 23.126 -25.532 -11.113 1.00 0.00 H new ATOM 0 HE ARG A 81 23.991 -23.912 -9.042 1.00 0.00 H new ATOM 0 HH11 ARG A 81 22.376 -27.042 -9.262 1.00 0.00 H new ATOM 0 HH12 ARG A 81 23.094 -27.647 -7.766 1.00 0.00 H new ATOM 0 HH21 ARG A 81 24.910 -24.696 -7.122 1.00 0.00 H new ATOM 0 HH22 ARG A 81 24.522 -26.325 -6.559 1.00 0.00 H new ATOM 1342 N GLU A 82 20.458 -20.534 -12.389 1.00 0.00 N ATOM 1343 CA GLU A 82 20.854 -19.135 -12.279 1.00 0.00 C ATOM 1344 C GLU A 82 19.733 -18.299 -11.667 1.00 0.00 C ATOM 1345 O GLU A 82 19.956 -17.542 -10.723 1.00 0.00 O ATOM 1346 CB GLU A 82 21.228 -18.577 -13.654 1.00 0.00 C ATOM 1347 CG GLU A 82 22.503 -19.173 -14.226 1.00 0.00 C ATOM 1348 CD GLU A 82 23.751 -18.631 -13.556 1.00 0.00 C ATOM 1349 OE1 GLU A 82 23.644 -18.131 -12.417 1.00 0.00 O ATOM 1350 OE2 GLU A 82 24.835 -18.709 -14.171 1.00 0.00 O ATOM 0 H GLU A 82 20.227 -20.834 -13.336 1.00 0.00 H new ATOM 0 HA GLU A 82 21.724 -19.081 -11.624 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.408 -18.762 -14.347 1.00 0.00 H new ATOM 0 HB3 GLU A 82 21.344 -17.496 -13.579 1.00 0.00 H new ATOM 0 HG2 GLU A 82 22.476 -20.257 -14.113 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.549 -18.965 -15.295 1.00 0.00 H new ATOM 1357 N GLU A 83 18.530 -18.443 -12.212 1.00 0.00 N ATOM 1358 CA GLU A 83 17.375 -17.700 -11.721 1.00 0.00 C ATOM 1359 C GLU A 83 17.166 -17.945 -10.229 1.00 0.00 C ATOM 1360 O GLU A 83 17.077 -17.003 -9.441 1.00 0.00 O ATOM 1361 CB GLU A 83 16.117 -18.098 -12.495 1.00 0.00 C ATOM 1362 CG GLU A 83 15.940 -17.339 -13.799 1.00 0.00 C ATOM 1363 CD GLU A 83 14.529 -17.438 -14.345 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.737 -18.236 -13.800 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.215 -16.719 -15.317 1.00 0.00 O ATOM 0 H GLU A 83 18.329 -19.067 -12.993 1.00 0.00 H new ATOM 0 HA GLU A 83 17.566 -16.638 -11.875 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.154 -19.166 -12.708 1.00 0.00 H new ATOM 0 HB3 GLU A 83 15.244 -17.929 -11.865 1.00 0.00 H new ATOM 0 HG2 GLU A 83 16.192 -16.290 -13.642 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.640 -17.727 -14.539 1.00 0.00 H new ATOM 1372 N ILE A 84 17.088 -19.216 -9.850 1.00 0.00 N ATOM 1373 CA ILE A 84 16.889 -19.585 -8.453 1.00 0.00 C ATOM 1374 C ILE A 84 18.066 -19.136 -7.594 1.00 0.00 C ATOM 1375 O ILE A 84 17.901 -18.822 -6.415 1.00 0.00 O ATOM 1376 CB ILE A 84 16.703 -21.106 -8.294 1.00 0.00 C ATOM 1377 CG1 ILE A 84 18.010 -21.838 -8.607 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.583 -21.600 -9.198 1.00 0.00 C ATOM 1379 CD1 ILE A 84 18.816 -22.187 -7.376 1.00 0.00 C ATOM 0 H ILE A 84 17.159 -20.007 -10.490 1.00 0.00 H new ATOM 0 HA ILE A 84 15.983 -19.079 -8.118 1.00 0.00 H new ATOM 0 HB ILE A 84 16.429 -21.317 -7.260 1.00 0.00 H new ATOM 0 HG12 ILE A 84 17.783 -22.753 -9.154 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.617 -21.216 -9.265 1.00 0.00 H new ATOM 0 HG21 ILE A 84 15.464 -22.676 -9.074 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.652 -21.099 -8.932 1.00 0.00 H new ATOM 0 HG23 ILE A 84 15.830 -21.379 -10.237 1.00 0.00 H new ATOM 0 HD11 ILE A 84 19.729 -22.704 -7.673 1.00 0.00 H new ATOM 0 HD12 ILE A 84 19.074 -21.274 -6.839 1.00 0.00 H new ATOM 0 HD13 ILE A 84 18.227 -22.835 -6.727 1.00 0.00 H new ATOM 1391 N GLU A 85 19.252 -19.107 -8.192 1.00 0.00 N ATOM 1392 CA GLU A 85 20.456 -18.694 -7.481 1.00 0.00 C ATOM 1393 C GLU A 85 20.316 -17.269 -6.955 1.00 0.00 C ATOM 1394 O GLU A 85 20.604 -16.994 -5.790 1.00 0.00 O ATOM 1395 CB GLU A 85 21.677 -18.793 -8.398 1.00 0.00 C ATOM 1396 CG GLU A 85 22.541 -20.014 -8.131 1.00 0.00 C ATOM 1397 CD GLU A 85 23.522 -20.291 -9.254 1.00 0.00 C ATOM 1398 OE1 GLU A 85 23.922 -19.329 -9.943 1.00 0.00 O ATOM 1399 OE2 GLU A 85 23.889 -21.469 -9.445 1.00 0.00 O ATOM 0 H GLU A 85 19.405 -19.365 -9.167 1.00 0.00 H new ATOM 0 HA GLU A 85 20.593 -19.364 -6.632 1.00 0.00 H new ATOM 0 HB2 GLU A 85 21.341 -18.815 -9.435 1.00 0.00 H new ATOM 0 HB3 GLU A 85 22.284 -17.896 -8.279 1.00 0.00 H new ATOM 0 HG2 GLU A 85 23.091 -19.869 -7.201 1.00 0.00 H new ATOM 0 HG3 GLU A 85 21.900 -20.884 -7.990 1.00 0.00 H new ATOM 1406 N MET A 86 19.873 -16.365 -7.823 1.00 0.00 N ATOM 1407 CA MET A 86 19.694 -14.968 -7.446 1.00 0.00 C ATOM 1408 C MET A 86 18.418 -14.784 -6.630 1.00 0.00 C ATOM 1409 O MET A 86 18.423 -14.118 -5.595 1.00 0.00 O ATOM 1410 CB MET A 86 19.648 -14.083 -8.693 1.00 0.00 C ATOM 1411 CG MET A 86 20.450 -12.799 -8.557 1.00 0.00 C ATOM 1412 SD MET A 86 19.790 -11.698 -7.292 1.00 0.00 S ATOM 1413 CE MET A 86 21.119 -11.727 -6.091 1.00 0.00 C ATOM 0 H MET A 86 19.632 -16.575 -8.792 1.00 0.00 H new ATOM 0 HA MET A 86 20.543 -14.672 -6.830 1.00 0.00 H new ATOM 0 HB2 MET A 86 20.026 -14.649 -9.544 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.610 -13.832 -8.912 1.00 0.00 H new ATOM 0 HG2 MET A 86 21.484 -13.045 -8.315 1.00 0.00 H new ATOM 0 HG3 MET A 86 20.462 -12.279 -9.515 1.00 0.00 H new ATOM 0 HE1 MET A 86 20.803 -11.208 -5.186 1.00 0.00 H new ATOM 0 HE2 MET A 86 21.368 -12.760 -5.849 1.00 0.00 H new ATOM 0 HE3 MET A 86 21.996 -11.230 -6.506 1.00 0.00 H new ATOM 1423 N MET A 87 17.327 -15.377 -7.104 1.00 0.00 N ATOM 1424 CA MET A 87 16.045 -15.279 -6.417 1.00 0.00 C ATOM 1425 C MET A 87 16.160 -15.767 -4.976 1.00 0.00 C ATOM 1426 O MET A 87 15.649 -15.134 -4.053 1.00 0.00 O ATOM 1427 CB MET A 87 14.981 -16.090 -7.159 1.00 0.00 C ATOM 1428 CG MET A 87 14.708 -15.590 -8.568 1.00 0.00 C ATOM 1429 SD MET A 87 13.303 -14.462 -8.645 1.00 0.00 S ATOM 1430 CE MET A 87 12.207 -15.362 -9.739 1.00 0.00 C ATOM 0 H MET A 87 17.305 -15.930 -7.961 1.00 0.00 H new ATOM 0 HA MET A 87 15.748 -14.230 -6.403 1.00 0.00 H new ATOM 0 HB2 MET A 87 15.298 -17.132 -7.207 1.00 0.00 H new ATOM 0 HB3 MET A 87 14.053 -16.065 -6.588 1.00 0.00 H new ATOM 0 HG2 MET A 87 15.596 -15.085 -8.948 1.00 0.00 H new ATOM 0 HG3 MET A 87 14.521 -16.442 -9.222 1.00 0.00 H new ATOM 0 HE1 MET A 87 11.290 -14.791 -9.885 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.697 -15.514 -10.701 1.00 0.00 H new ATOM 0 HE3 MET A 87 11.966 -16.329 -9.298 1.00 0.00 H new ATOM 1440 N VAL A 88 16.836 -16.897 -4.792 1.00 0.00 N ATOM 1441 CA VAL A 88 17.019 -17.470 -3.464 1.00 0.00 C ATOM 1442 C VAL A 88 18.046 -16.679 -2.661 1.00 0.00 C ATOM 1443 O VAL A 88 17.894 -16.489 -1.454 1.00 0.00 O ATOM 1444 CB VAL A 88 17.469 -18.941 -3.544 1.00 0.00 C ATOM 1445 CG1 VAL A 88 17.839 -19.463 -2.164 1.00 0.00 C ATOM 1446 CG2 VAL A 88 16.380 -19.797 -4.172 1.00 0.00 C ATOM 0 H VAL A 88 17.266 -17.433 -5.546 1.00 0.00 H new ATOM 0 HA VAL A 88 16.053 -17.420 -2.962 1.00 0.00 H new ATOM 0 HB VAL A 88 18.355 -18.998 -4.177 1.00 0.00 H new ATOM 0 HG11 VAL A 88 18.154 -20.504 -2.241 1.00 0.00 H new ATOM 0 HG12 VAL A 88 18.655 -18.866 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.974 -19.394 -1.505 1.00 0.00 H new ATOM 0 HG21 VAL A 88 16.715 -20.833 -4.221 1.00 0.00 H new ATOM 0 HG22 VAL A 88 15.475 -19.736 -3.567 1.00 0.00 H new ATOM 0 HG23 VAL A 88 16.169 -19.436 -5.179 1.00 0.00 H new ATOM 1456 N PHE A 89 19.092 -16.219 -3.339 1.00 0.00 N ATOM 1457 CA PHE A 89 20.146 -15.448 -2.690 1.00 0.00 C ATOM 1458 C PHE A 89 19.583 -14.173 -2.070 1.00 0.00 C ATOM 1459 O PHE A 89 19.758 -13.918 -0.878 1.00 0.00 O ATOM 1460 CB PHE A 89 21.245 -15.099 -3.695 1.00 0.00 C ATOM 1461 CG PHE A 89 22.321 -14.219 -3.125 1.00 0.00 C ATOM 1462 CD1 PHE A 89 22.175 -12.841 -3.116 1.00 0.00 C ATOM 1463 CD2 PHE A 89 23.478 -14.771 -2.598 1.00 0.00 C ATOM 1464 CE1 PHE A 89 23.165 -12.030 -2.592 1.00 0.00 C ATOM 1465 CE2 PHE A 89 24.470 -13.964 -2.073 1.00 0.00 C ATOM 1466 CZ PHE A 89 24.313 -12.592 -2.069 1.00 0.00 C ATOM 0 H PHE A 89 19.233 -16.367 -4.338 1.00 0.00 H new ATOM 0 HA PHE A 89 20.573 -16.060 -1.895 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.697 -16.021 -4.062 1.00 0.00 H new ATOM 0 HB3 PHE A 89 20.796 -14.600 -4.554 1.00 0.00 H new ATOM 0 HD1 PHE A 89 21.279 -12.396 -3.522 1.00 0.00 H new ATOM 0 HD2 PHE A 89 23.606 -15.843 -2.598 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.040 -10.957 -2.592 1.00 0.00 H new ATOM 0 HE2 PHE A 89 25.367 -14.406 -1.666 1.00 0.00 H new ATOM 0 HZ PHE A 89 25.086 -11.960 -1.658 1.00 0.00 H new ATOM 1476 N LEU A 90 18.907 -13.373 -2.888 1.00 0.00 N ATOM 1477 CA LEU A 90 18.318 -12.123 -2.422 1.00 0.00 C ATOM 1478 C LEU A 90 17.263 -12.383 -1.351 1.00 0.00 C ATOM 1479 O LEU A 90 17.107 -11.599 -0.416 1.00 0.00 O ATOM 1480 CB LEU A 90 17.695 -11.361 -3.593 1.00 0.00 C ATOM 1481 CG LEU A 90 16.584 -12.089 -4.352 1.00 0.00 C ATOM 1482 CD1 LEU A 90 15.236 -11.835 -3.696 1.00 0.00 C ATOM 1483 CD2 LEU A 90 16.561 -11.653 -5.810 1.00 0.00 C ATOM 0 H LEU A 90 18.753 -13.568 -3.877 1.00 0.00 H new ATOM 0 HA LEU A 90 19.112 -11.518 -1.984 1.00 0.00 H new ATOM 0 HB2 LEU A 90 17.294 -10.420 -3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 90 18.486 -11.110 -4.299 1.00 0.00 H new ATOM 0 HG LEU A 90 16.786 -13.160 -4.317 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.457 -12.360 -4.249 1.00 0.00 H new ATOM 0 HD12 LEU A 90 15.258 -12.197 -2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 90 15.025 -10.766 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.765 -12.181 -6.335 1.00 0.00 H new ATOM 0 HD22 LEU A 90 16.383 -10.579 -5.866 1.00 0.00 H new ATOM 0 HD23 LEU A 90 17.519 -11.887 -6.275 1.00 0.00 H new ATOM 1495 N SER A 91 16.543 -13.491 -1.495 1.00 0.00 N ATOM 1496 CA SER A 91 15.501 -13.855 -0.542 1.00 0.00 C ATOM 1497 C SER A 91 16.082 -14.020 0.860 1.00 0.00 C ATOM 1498 O SER A 91 15.408 -13.759 1.857 1.00 0.00 O ATOM 1499 CB SER A 91 14.812 -15.150 -0.976 1.00 0.00 C ATOM 1500 OG SER A 91 13.964 -15.644 0.046 1.00 0.00 O ATOM 0 H SER A 91 16.662 -14.152 -2.262 1.00 0.00 H new ATOM 0 HA SER A 91 14.766 -13.051 -0.521 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.230 -14.971 -1.880 1.00 0.00 H new ATOM 0 HB3 SER A 91 15.563 -15.900 -1.224 1.00 0.00 H new ATOM 0 HG SER A 91 13.534 -16.471 -0.257 1.00 0.00 H new ATOM 1506 N SER A 92 17.336 -14.455 0.927 1.00 0.00 N ATOM 1507 CA SER A 92 18.007 -14.659 2.206 1.00 0.00 C ATOM 1508 C SER A 92 18.268 -13.326 2.901 1.00 0.00 C ATOM 1509 O SER A 92 18.268 -13.242 4.129 1.00 0.00 O ATOM 1510 CB SER A 92 19.325 -15.407 2.000 1.00 0.00 C ATOM 1511 OG SER A 92 20.085 -15.438 3.195 1.00 0.00 O ATOM 0 H SER A 92 17.908 -14.673 0.111 1.00 0.00 H new ATOM 0 HA SER A 92 17.353 -15.257 2.841 1.00 0.00 H new ATOM 0 HB2 SER A 92 19.121 -16.425 1.668 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.901 -14.924 1.211 1.00 0.00 H new ATOM 0 HG SER A 92 20.922 -15.923 3.038 1.00 0.00 H new ATOM 1517 N VAL A 93 18.491 -12.284 2.105 1.00 0.00 N ATOM 1518 CA VAL A 93 18.753 -10.954 2.642 1.00 0.00 C ATOM 1519 C VAL A 93 17.455 -10.250 3.023 1.00 0.00 C ATOM 1520 O VAL A 93 17.401 -9.515 4.010 1.00 0.00 O ATOM 1521 CB VAL A 93 19.520 -10.082 1.631 1.00 0.00 C ATOM 1522 CG1 VAL A 93 19.950 -8.772 2.273 1.00 0.00 C ATOM 1523 CG2 VAL A 93 20.722 -10.836 1.081 1.00 0.00 C ATOM 0 H VAL A 93 18.495 -12.336 1.086 1.00 0.00 H new ATOM 0 HA VAL A 93 19.366 -11.087 3.534 1.00 0.00 H new ATOM 0 HB VAL A 93 18.854 -9.850 0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 93 20.491 -8.169 1.543 1.00 0.00 H new ATOM 0 HG12 VAL A 93 19.069 -8.227 2.613 1.00 0.00 H new ATOM 0 HG13 VAL A 93 20.599 -8.980 3.124 1.00 0.00 H new ATOM 0 HG21 VAL A 93 21.252 -10.205 0.368 1.00 0.00 H new ATOM 0 HG22 VAL A 93 21.391 -11.100 1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 93 20.384 -11.744 0.581 1.00 0.00 H new ATOM 1533 N LEU A 94 16.411 -10.480 2.235 1.00 0.00 N ATOM 1534 CA LEU A 94 15.111 -9.868 2.489 1.00 0.00 C ATOM 1535 C LEU A 94 14.384 -10.585 3.622 1.00 0.00 C ATOM 1536 O LEU A 94 13.700 -9.957 4.429 1.00 0.00 O ATOM 1537 CB LEU A 94 14.256 -9.895 1.221 1.00 0.00 C ATOM 1538 CG LEU A 94 14.856 -9.210 -0.008 1.00 0.00 C ATOM 1539 CD1 LEU A 94 13.857 -9.201 -1.154 1.00 0.00 C ATOM 1540 CD2 LEU A 94 15.294 -7.793 0.332 1.00 0.00 C ATOM 0 H LEU A 94 16.439 -11.086 1.415 1.00 0.00 H new ATOM 0 HA LEU A 94 15.276 -8.832 2.786 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.050 -10.935 0.968 1.00 0.00 H new ATOM 0 HB3 LEU A 94 13.298 -9.425 1.443 1.00 0.00 H new ATOM 0 HG LEU A 94 15.734 -9.774 -0.323 1.00 0.00 H new ATOM 0 HD11 LEU A 94 14.301 -8.710 -2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 94 13.593 -10.226 -1.414 1.00 0.00 H new ATOM 0 HD13 LEU A 94 12.960 -8.661 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 94 15.718 -7.321 -0.554 1.00 0.00 H new ATOM 0 HD22 LEU A 94 14.433 -7.218 0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 94 16.045 -7.824 1.122 1.00 0.00 H new ATOM 1552 N GLU A 95 14.539 -11.904 3.677 1.00 0.00 N ATOM 1553 CA GLU A 95 13.898 -12.706 4.712 1.00 0.00 C ATOM 1554 C GLU A 95 14.451 -12.358 6.091 1.00 0.00 C ATOM 1555 O GLU A 95 13.739 -12.424 7.092 1.00 0.00 O ATOM 1556 CB GLU A 95 14.099 -14.197 4.432 1.00 0.00 C ATOM 1557 CG GLU A 95 15.522 -14.674 4.669 1.00 0.00 C ATOM 1558 CD GLU A 95 15.680 -16.167 4.452 1.00 0.00 C ATOM 1559 OE1 GLU A 95 14.696 -16.815 4.040 1.00 0.00 O ATOM 1560 OE2 GLU A 95 16.790 -16.686 4.693 1.00 0.00 O ATOM 0 H GLU A 95 15.103 -12.440 3.017 1.00 0.00 H new ATOM 0 HA GLU A 95 12.831 -12.482 4.700 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.422 -14.771 5.064 1.00 0.00 H new ATOM 0 HB3 GLU A 95 13.823 -14.405 3.398 1.00 0.00 H new ATOM 0 HG2 GLU A 95 16.197 -14.140 4.000 1.00 0.00 H new ATOM 0 HG3 GLU A 95 15.820 -14.425 5.687 1.00 0.00 H new ATOM 1567 N ASP A 96 15.726 -11.987 6.133 1.00 0.00 N ATOM 1568 CA ASP A 96 16.376 -11.627 7.388 1.00 0.00 C ATOM 1569 C ASP A 96 17.422 -10.539 7.166 1.00 0.00 C ATOM 1570 O ASP A 96 18.383 -10.731 6.420 1.00 0.00 O ATOM 1571 CB ASP A 96 17.029 -12.858 8.020 1.00 0.00 C ATOM 1572 CG ASP A 96 17.198 -12.717 9.520 1.00 0.00 C ATOM 1573 OD1 ASP A 96 16.183 -12.806 10.242 1.00 0.00 O ATOM 1574 OD2 ASP A 96 18.345 -12.518 9.972 1.00 0.00 O ATOM 0 H ASP A 96 16.330 -11.928 5.313 1.00 0.00 H new ATOM 0 HA ASP A 96 15.614 -11.241 8.065 1.00 0.00 H new ATOM 0 HB2 ASP A 96 16.422 -13.738 7.807 1.00 0.00 H new ATOM 0 HB3 ASP A 96 18.004 -13.025 7.561 1.00 0.00 H new TER 1579 ASP A 96