USER MOD reduce.3.24.130724 H: found=0, std=0, add=951, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 954 hydrogens (31 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 115 MET CE :methyl 162:sc= -0.196 (180deg=-0.672) USER MOD Set 1.2: A 117 SER OG : rot -140:sc= 0 USER MOD Set 2.1: A 21 TYR OH : rot 30:sc= -0.265 USER MOD Set 2.2: A 23 SER OG : rot -72:sc= 0.814 USER MOD Set 2.3: A 85 HIS : no HD1:sc= -8.98! C(o=-8.4!,f=-6!) USER MOD Set 3.1: A 18 SER OG : rot 28:sc= 0.143 USER MOD Set 3.2: A 20 CYS SG : rot -67:sc= 0.33 USER MOD Single : A 10 THR OG1 : rot -15:sc= 1.08 USER MOD Single : A 11 MET CE :methyl 143:sc= -0.0912 (180deg=-0.456) USER MOD Single : A 12 THR OG1 : rot -1:sc= 1.25 USER MOD Single : A 14 SER OG : rot 180:sc= 0.0742 USER MOD Single : A 19 CYS SG : rot -115:sc= -0.905 USER MOD Single : A 30 THR OG1 : rot 140:sc= 1.5 USER MOD Single : A 40 THR OG1 : rot 76:sc= 1.22 USER MOD Single : A 41 SER OG : rot 150:sc= 0.965 USER MOD Single : A 42 GLN : amide:sc= -2.23! K(o=-2.2!,f=-0.23) USER MOD Single : A 44 HIS : no HD1:sc= -0.776 K(o=-0.78,f=-7.2!) USER MOD Single : A 45 ASN : amide:sc= 0.39 K(o=0.39,f=-7.7!) USER MOD Single : A 49 GLN : amide:sc= -0.127 X(o=-0.13,f=0) USER MOD Single : A 51 THR OG1 : rot 171:sc= -2.24! USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.35) USER MOD Single : A 63 GLN : amide:sc= -0.333 K(o=-0.33,f=-4.4!) USER MOD Single : A 68 HIS : no HD1:sc= -0.96 K(o=-0.96,f=-0.082) USER MOD Single : A 76 MET CE :methyl 148:sc= -2.37! (180deg=-5.06!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HE2:sc= 1.07 K(o=1.1,f=-4.4!) USER MOD Single : A 80 GLN : amide:sc= -5.87! C(o=-5.9!,f=-3.6!) USER MOD Single : A 86 SER OG : rot -160:sc= -0.223 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 22:sc= 0.497 USER MOD Single : A 98 LYS NZ :NH3+ 140:sc= 0.963 (180deg=0.137) USER MOD Single : A 105 HIS : no HE2:sc= -0.199 X(o=-0.2,f=-0.45) USER MOD Single : A 106 MET CE :methyl -120:sc= -0.0186 (180deg=-0.347) USER MOD Single : A 107 GLN : amide:sc= -2.06! C(o=-2.1!,f=-6.9!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 CYS SG : rot 63:sc= 0.193 USER MOD Single : A 111 SER OG : rot 7:sc= 1.07 USER MOD Single : A 123 SER OG : rot 180:sc= -0.0216 USER MOD Single : A 125 GLN : amide:sc= -0.541 K(o=-0.54,f=0) USER MOD Single : A1126 FAD O2' : rot 160:sc= -0.175 USER MOD Single : A1126 FAD O2B : rot -22:sc= 0.422 USER MOD Single : A1126 FAD O3' : rot -123:sc= 0.255 USER MOD Single : A1126 FAD O3B : rot -179:sc= 0.288 USER MOD Single : A1126 FAD O4' : rot 136:sc= 0.737 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 5 -6.836 32.399 -19.143 0.20 90.00 N ATOM 2 CA LEU A 5 -6.875 31.572 -17.959 0.20 90.00 C ATOM 3 C LEU A 5 -5.437 31.329 -17.554 0.20 90.00 C ATOM 4 O LEU A 5 -4.606 30.981 -18.399 0.20 90.00 O ATOM 5 CB LEU A 5 -7.546 30.226 -18.275 0.20 90.00 C ATOM 6 CG LEU A 5 -8.478 29.615 -17.203 0.20 90.00 C ATOM 7 CD1 LEU A 5 -7.810 29.495 -15.849 0.20 90.00 C ATOM 8 CD2 LEU A 5 -9.759 30.407 -17.104 0.20 90.00 C ATOM 0 HA LEU A 5 -7.442 32.058 -17.165 0.20 90.00 H new ATOM 0 HB2 LEU A 5 -8.124 30.347 -19.191 0.20 90.00 H new ATOM 0 HB3 LEU A 5 -6.760 29.502 -18.487 0.20 90.00 H new ATOM 0 HG LEU A 5 -8.713 28.600 -17.524 0.20 90.00 H new ATOM 0 HD11 LEU A 5 -8.510 29.060 -15.135 0.20 90.00 H new ATOM 0 HD12 LEU A 5 -6.932 28.855 -15.932 0.20 90.00 H new ATOM 0 HD13 LEU A 5 -7.507 30.484 -15.504 0.20 90.00 H new ATOM 0 HD21 LEU A 5 -10.403 29.963 -16.345 0.20 90.00 H new ATOM 0 HD22 LEU A 5 -9.530 31.437 -16.829 0.20 90.00 H new ATOM 0 HD23 LEU A 5 -10.270 30.394 -18.067 0.20 90.00 H new ATOM 22 N GLU A 6 -5.135 31.527 -16.306 0.20 90.00 N ATOM 23 CA GLU A 6 -3.815 31.330 -15.819 0.20 90.00 C ATOM 24 C GLU A 6 -3.682 29.940 -15.232 0.20 90.00 C ATOM 25 O GLU A 6 -4.682 29.318 -14.833 0.20 90.00 O ATOM 26 CB GLU A 6 -3.460 32.411 -14.809 0.20 90.00 C ATOM 27 CG GLU A 6 -2.019 32.427 -14.364 0.20 90.00 C ATOM 28 CD GLU A 6 -1.065 32.464 -15.532 0.20 90.00 C ATOM 29 OE1 GLU A 6 -0.882 33.548 -16.144 0.20 90.00 O ATOM 30 OE2 GLU A 6 -0.481 31.413 -15.872 0.20 90.00 O ATOM 0 H GLU A 6 -5.804 31.831 -15.599 0.20 90.00 H new ATOM 0 HA GLU A 6 -3.107 31.410 -16.644 0.20 90.00 H new ATOM 0 HB2 GLU A 6 -3.701 33.382 -15.241 0.20 90.00 H new ATOM 0 HB3 GLU A 6 -4.093 32.287 -13.931 0.20 90.00 H new ATOM 0 HG2 GLU A 6 -1.846 33.295 -13.728 0.20 90.00 H new ATOM 0 HG3 GLU A 6 -1.817 31.543 -13.759 0.20 90.00 H new ATOM 37 N ALA A 7 -2.481 29.442 -15.226 0.20 90.00 N ATOM 38 CA ALA A 7 -2.195 28.145 -14.681 0.20 90.00 C ATOM 39 C ALA A 7 -2.257 28.208 -13.167 0.20 90.00 C ATOM 40 O ALA A 7 -1.860 29.219 -12.567 0.20 90.00 O ATOM 41 CB ALA A 7 -0.834 27.661 -15.144 0.20 90.00 C ATOM 0 H ALA A 7 -1.666 29.926 -15.601 0.20 90.00 H new ATOM 0 HA ALA A 7 -2.941 27.434 -15.037 0.20 90.00 H new ATOM 0 HB1 ALA A 7 -0.635 26.676 -14.721 0.20 90.00 H new ATOM 0 HB2 ALA A 7 -0.821 27.598 -16.232 0.20 90.00 H new ATOM 0 HB3 ALA A 7 -0.067 28.361 -14.812 0.20 90.00 H new ATOM 47 N ASP A 8 -2.780 27.157 -12.564 0.20 90.00 N ATOM 48 CA ASP A 8 -2.925 27.070 -11.103 0.20 90.00 C ATOM 49 C ASP A 8 -1.573 27.146 -10.406 0.20 90.00 C ATOM 50 O ASP A 8 -1.274 28.127 -9.742 0.20 90.00 O ATOM 51 CB ASP A 8 -3.688 25.792 -10.729 0.20 90.00 C ATOM 52 CG ASP A 8 -3.713 25.490 -9.243 0.20 90.00 C ATOM 53 OD1 ASP A 8 -4.294 26.253 -8.468 0.20 90.00 O ATOM 54 OD2 ASP A 8 -3.201 24.426 -8.846 0.20 90.00 O ATOM 0 H ASP A 8 -3.119 26.335 -13.063 0.20 90.00 H new ATOM 0 HA ASP A 8 -3.504 27.926 -10.757 0.20 90.00 H new ATOM 0 HB2 ASP A 8 -4.714 25.878 -11.087 0.20 90.00 H new ATOM 0 HB3 ASP A 8 -3.237 24.948 -11.251 0.20 90.00 H new ATOM 59 N VAL A 9 -0.756 26.137 -10.589 0.20 90.00 N ATOM 60 CA VAL A 9 0.557 26.095 -10.044 0.20 90.00 C ATOM 61 C VAL A 9 1.536 25.600 -11.094 0.20 90.00 C ATOM 62 O VAL A 9 2.687 25.296 -10.797 0.20 90.00 O ATOM 63 CB VAL A 9 0.654 25.223 -8.781 0.20 90.00 C ATOM 64 CG1 VAL A 9 -0.167 25.814 -7.640 0.20 90.00 C ATOM 65 CG2 VAL A 9 0.193 23.829 -9.106 0.20 90.00 C ATOM 0 H VAL A 9 -1.001 25.311 -11.134 0.20 90.00 H new ATOM 0 HA VAL A 9 0.811 27.112 -9.746 0.20 90.00 H new ATOM 0 HB VAL A 9 1.692 25.191 -8.450 0.20 90.00 H new ATOM 0 HG11 VAL A 9 -0.079 25.176 -6.760 0.20 90.00 H new ATOM 0 HG12 VAL A 9 0.204 26.811 -7.404 0.20 90.00 H new ATOM 0 HG13 VAL A 9 -1.213 25.877 -7.939 0.20 90.00 H new ATOM 0 HG21 VAL A 9 0.260 23.206 -8.214 0.20 90.00 H new ATOM 0 HG22 VAL A 9 -0.840 23.859 -9.451 0.20 90.00 H new ATOM 0 HG23 VAL A 9 0.825 23.410 -9.889 0.20 90.00 H new ATOM 75 N THR A 10 1.034 25.559 -12.322 0.20 90.00 N ATOM 76 CA THR A 10 1.700 25.058 -13.524 0.20 90.00 C ATOM 77 C THR A 10 1.846 23.536 -13.495 0.20 90.00 C ATOM 78 O THR A 10 1.424 22.876 -12.519 0.20 90.00 O ATOM 79 CB THR A 10 3.030 25.782 -13.902 0.20 90.00 C ATOM 80 OG1 THR A 10 4.071 25.593 -12.934 0.20 90.00 O ATOM 81 CG2 THR A 10 2.793 27.269 -14.109 0.20 90.00 C ATOM 0 H THR A 10 0.092 25.895 -12.520 0.20 90.00 H new ATOM 0 HA THR A 10 1.027 25.316 -14.342 0.20 90.00 H new ATOM 0 HB THR A 10 3.366 25.326 -14.833 0.20 90.00 H new ATOM 0 HG1 THR A 10 3.685 25.247 -12.102 0.20 90.00 H new ATOM 0 HG21 THR A 10 3.733 27.754 -14.372 0.20 90.00 H new ATOM 0 HG22 THR A 10 2.073 27.414 -14.914 0.20 90.00 H new ATOM 0 HG23 THR A 10 2.403 27.707 -13.190 0.20 90.00 H new ATOM 89 N MET A 11 2.372 22.965 -14.558 0.20 90.00 N ATOM 90 CA MET A 11 2.523 21.540 -14.656 0.20 90.00 C ATOM 91 C MET A 11 3.575 21.025 -13.679 0.20 90.00 C ATOM 92 O MET A 11 4.307 21.805 -13.077 0.20 90.00 O ATOM 93 CB MET A 11 2.824 21.129 -16.096 0.20 90.00 C ATOM 94 CG MET A 11 1.666 21.397 -17.060 0.20 90.00 C ATOM 95 SD MET A 11 2.071 21.049 -18.789 0.20 90.00 S ATOM 96 CE MET A 11 2.507 19.312 -18.695 0.20 90.00 C ATOM 0 H MET A 11 2.704 23.480 -15.374 0.20 90.00 H new ATOM 0 HA MET A 11 1.579 21.074 -14.373 0.20 90.00 H new ATOM 0 HB2 MET A 11 3.707 21.666 -16.442 0.20 90.00 H new ATOM 0 HB3 MET A 11 3.068 20.067 -16.119 0.20 90.00 H new ATOM 0 HG2 MET A 11 0.811 20.789 -16.766 0.20 90.00 H new ATOM 0 HG3 MET A 11 1.362 22.440 -16.969 0.20 90.00 H new ATOM 0 HE1 MET A 11 2.155 18.799 -19.590 0.20 90.00 H new ATOM 0 HE2 MET A 11 3.590 19.212 -18.622 0.20 90.00 H new ATOM 0 HE3 MET A 11 2.042 18.867 -17.815 0.20 90.00 H new ATOM 106 N THR A 12 3.611 19.713 -13.513 0.20 90.00 N ATOM 107 CA THR A 12 4.463 18.989 -12.554 0.20 90.00 C ATOM 108 C THR A 12 4.011 19.112 -11.091 0.20 90.00 C ATOM 109 O THR A 12 4.537 18.439 -10.205 0.20 90.00 O ATOM 110 CB THR A 12 6.003 19.156 -12.733 0.20 90.00 C ATOM 111 OG1 THR A 12 6.475 20.510 -12.558 0.20 90.00 O ATOM 112 CG2 THR A 12 6.431 18.637 -14.093 0.20 90.00 C ATOM 0 H THR A 12 3.024 19.085 -14.063 0.20 90.00 H new ATOM 0 HA THR A 12 4.287 17.952 -12.839 0.20 90.00 H new ATOM 0 HB THR A 12 6.460 18.568 -11.937 0.20 90.00 H new ATOM 0 HG1 THR A 12 5.716 21.098 -12.362 0.20 90.00 H new ATOM 0 HG21 THR A 12 7.508 18.759 -14.206 0.20 90.00 H new ATOM 0 HG22 THR A 12 6.175 17.581 -14.177 0.20 90.00 H new ATOM 0 HG23 THR A 12 5.918 19.198 -14.874 0.20 90.00 H new ATOM 120 N GLY A 13 2.999 19.935 -10.853 0.20 90.00 N ATOM 121 CA GLY A 13 2.419 20.055 -9.533 0.20 90.00 C ATOM 122 C GLY A 13 3.251 20.898 -8.598 0.20 90.00 C ATOM 123 O GLY A 13 3.087 22.115 -8.535 0.20 90.00 O ATOM 0 H GLY A 13 2.566 20.528 -11.561 0.20 90.00 H new ATOM 0 HA2 GLY A 13 1.424 20.491 -9.618 0.20 90.00 H new ATOM 0 HA3 GLY A 13 2.296 19.060 -9.104 0.20 90.00 H new ATOM 127 N SER A 14 4.156 20.268 -7.901 0.20 90.00 N ATOM 128 CA SER A 14 4.986 20.941 -6.934 0.20 90.00 C ATOM 129 C SER A 14 6.292 20.178 -6.704 0.20 90.00 C ATOM 130 O SER A 14 7.372 20.640 -7.091 0.20 90.00 O ATOM 131 CB SER A 14 4.200 21.141 -5.616 0.20 90.00 C ATOM 132 OG SER A 14 3.595 19.919 -5.184 0.20 90.00 O ATOM 0 H SER A 14 4.341 19.269 -7.986 0.20 90.00 H new ATOM 0 HA SER A 14 5.256 21.923 -7.323 0.20 90.00 H new ATOM 0 HB2 SER A 14 4.872 21.511 -4.841 0.20 90.00 H new ATOM 0 HB3 SER A 14 3.431 21.900 -5.760 0.20 90.00 H new ATOM 0 HG SER A 14 3.106 20.073 -4.349 0.20 90.00 H new ATOM 138 N ASP A 15 6.180 19.010 -6.111 1.00 10.00 N ATOM 139 CA ASP A 15 7.283 18.146 -5.778 1.00 10.00 C ATOM 140 C ASP A 15 6.664 16.947 -5.234 1.00 10.00 C ATOM 141 O ASP A 15 6.322 16.901 -4.060 1.00 10.00 O ATOM 142 CB ASP A 15 8.147 18.723 -4.687 1.00 10.00 C ATOM 143 CG ASP A 15 9.493 18.062 -4.527 1.00 10.00 C ATOM 144 OD1 ASP A 15 9.992 17.455 -5.475 1.00 10.00 O ATOM 145 OD2 ASP A 15 10.107 18.213 -3.442 1.00 10.00 O ATOM 0 H ASP A 15 5.277 18.623 -5.837 1.00 10.00 H new ATOM 0 HA ASP A 15 7.909 17.985 -6.656 1.00 10.00 H new ATOM 0 HB2 ASP A 15 8.301 19.783 -4.888 1.00 10.00 H new ATOM 0 HB3 ASP A 15 7.609 18.652 -3.742 1.00 10.00 H new ATOM 150 N LEU A 16 6.345 16.077 -6.077 1.00 10.00 N ATOM 151 CA LEU A 16 5.781 14.873 -5.705 1.00 10.00 C ATOM 152 C LEU A 16 6.728 13.781 -6.007 1.00 10.00 C ATOM 153 O LEU A 16 7.666 13.926 -6.805 1.00 10.00 O ATOM 154 CB LEU A 16 4.396 14.635 -6.336 1.00 10.00 C ATOM 155 CG LEU A 16 3.315 15.725 -6.164 1.00 10.00 C ATOM 156 CD1 LEU A 16 3.184 16.246 -4.741 1.00 10.00 C ATOM 157 CD2 LEU A 16 3.461 16.832 -7.186 1.00 10.00 C ATOM 0 H LEU A 16 6.474 16.187 -7.083 1.00 10.00 H new ATOM 0 HA LEU A 16 5.598 14.900 -4.631 1.00 10.00 H new ATOM 0 HB2 LEU A 16 4.541 14.476 -7.405 1.00 10.00 H new ATOM 0 HB3 LEU A 16 3.999 13.706 -5.926 1.00 10.00 H new ATOM 0 HG LEU A 16 2.364 15.232 -6.364 1.00 10.00 H new ATOM 0 HD11 LEU A 16 2.405 17.008 -4.703 1.00 10.00 H new ATOM 0 HD12 LEU A 16 2.921 15.424 -4.075 1.00 10.00 H new ATOM 0 HD13 LEU A 16 4.132 16.680 -4.424 1.00 10.00 H new ATOM 0 HD21 LEU A 16 2.681 17.577 -7.029 1.00 10.00 H new ATOM 0 HD22 LEU A 16 4.439 17.301 -7.077 1.00 10.00 H new ATOM 0 HD23 LEU A 16 3.368 16.416 -8.189 1.00 10.00 H new ATOM 169 N VAL A 17 6.512 12.730 -5.354 1.00 10.00 N ATOM 170 CA VAL A 17 7.276 11.591 -5.397 1.00 10.00 C ATOM 171 C VAL A 17 6.328 10.404 -5.207 1.00 10.00 C ATOM 172 O VAL A 17 5.258 10.549 -4.608 1.00 10.00 O ATOM 173 CB VAL A 17 8.404 11.623 -4.314 1.00 10.00 C ATOM 174 CG1 VAL A 17 8.932 10.276 -4.077 1.00 10.00 C ATOM 175 CG2 VAL A 17 9.559 12.529 -4.713 1.00 10.00 C ATOM 0 H VAL A 17 5.719 12.644 -4.718 1.00 10.00 H new ATOM 0 HA VAL A 17 7.790 11.506 -6.355 1.00 10.00 H new ATOM 0 HB VAL A 17 7.948 12.017 -3.406 1.00 10.00 H new ATOM 0 HG11 VAL A 17 9.715 10.320 -3.320 1.00 10.00 H new ATOM 0 HG12 VAL A 17 8.129 9.626 -3.730 1.00 10.00 H new ATOM 0 HG13 VAL A 17 9.345 9.879 -5.004 1.00 10.00 H new ATOM 0 HG21 VAL A 17 10.317 12.518 -3.930 1.00 10.00 H new ATOM 0 HG22 VAL A 17 9.996 12.172 -5.646 1.00 10.00 H new ATOM 0 HG23 VAL A 17 9.193 13.546 -4.850 1.00 10.00 H new ATOM 185 N SER A 18 6.681 9.307 -5.762 1.00 10.00 N ATOM 186 CA SER A 18 5.901 8.134 -5.700 1.00 10.00 C ATOM 187 C SER A 18 6.805 6.965 -5.375 1.00 10.00 C ATOM 188 O SER A 18 7.726 6.633 -6.142 1.00 10.00 O ATOM 189 CB SER A 18 5.192 7.913 -7.035 1.00 10.00 C ATOM 190 OG SER A 18 4.156 6.962 -6.937 1.00 10.00 O ATOM 0 H SER A 18 7.548 9.198 -6.288 1.00 10.00 H new ATOM 0 HA SER A 18 5.142 8.228 -4.923 1.00 10.00 H new ATOM 0 HB2 SER A 18 4.782 8.859 -7.388 1.00 10.00 H new ATOM 0 HB3 SER A 18 5.917 7.583 -7.779 1.00 10.00 H new ATOM 0 HG SER A 18 3.800 6.959 -6.024 1.00 10.00 H new ATOM 196 N CYS A 19 6.592 6.401 -4.227 1.00 10.00 N ATOM 197 CA CYS A 19 7.305 5.236 -3.808 1.00 10.00 C ATOM 198 C CYS A 19 6.453 4.029 -4.142 1.00 10.00 C ATOM 199 O CYS A 19 5.322 3.913 -3.652 1.00 10.00 O ATOM 200 CB CYS A 19 7.599 5.317 -2.313 1.00 10.00 C ATOM 201 SG CYS A 19 8.582 6.761 -1.831 1.00 10.00 S ATOM 0 H CYS A 19 5.911 6.740 -3.548 1.00 10.00 H new ATOM 0 HA CYS A 19 8.263 5.157 -4.322 1.00 10.00 H new ATOM 0 HB2 CYS A 19 6.655 5.335 -1.768 1.00 10.00 H new ATOM 0 HB3 CYS A 19 8.126 4.413 -2.008 1.00 10.00 H new ATOM 0 HG CYS A 19 9.734 6.369 -1.373 1.00 10.00 H new ATOM 207 N CYS A 20 6.973 3.162 -4.972 1.00 10.00 N ATOM 208 CA CYS A 20 6.243 2.025 -5.477 1.00 10.00 C ATOM 209 C CYS A 20 6.852 0.813 -4.884 1.00 10.00 C ATOM 210 O CYS A 20 7.952 0.467 -5.253 1.00 10.00 O ATOM 211 CB CYS A 20 6.394 1.967 -6.992 1.00 10.00 C ATOM 212 SG CYS A 20 6.116 3.547 -7.803 1.00 10.00 S ATOM 0 H CYS A 20 7.929 3.226 -5.322 1.00 10.00 H new ATOM 0 HA CYS A 20 5.185 2.096 -5.223 1.00 10.00 H new ATOM 0 HB2 CYS A 20 7.396 1.614 -7.236 1.00 10.00 H new ATOM 0 HB3 CYS A 20 5.692 1.235 -7.391 1.00 10.00 H new ATOM 0 HG CYS A 20 4.868 3.887 -7.675 1.00 10.00 H new ATOM 218 N TYR A 21 6.186 0.170 -3.968 1.00 10.00 N ATOM 219 CA TYR A 21 6.837 -0.884 -3.284 1.00 10.00 C ATOM 220 C TYR A 21 6.296 -2.254 -3.586 1.00 10.00 C ATOM 221 O TYR A 21 5.079 -2.448 -3.763 1.00 10.00 O ATOM 222 CB TYR A 21 6.903 -0.630 -1.784 1.00 10.00 C ATOM 223 CG TYR A 21 5.698 -0.814 -0.871 1.00 10.00 C ATOM 224 CD1 TYR A 21 5.158 -2.068 -0.551 1.00 10.00 C ATOM 225 CD2 TYR A 21 5.187 0.281 -0.231 1.00 10.00 C ATOM 226 CE1 TYR A 21 4.137 -2.188 0.390 1.00 10.00 C ATOM 227 CE2 TYR A 21 4.184 0.174 0.671 1.00 10.00 C ATOM 228 CZ TYR A 21 3.662 -1.058 0.988 1.00 10.00 C ATOM 229 OH TYR A 21 2.693 -1.167 1.933 1.00 10.00 O ATOM 0 H TYR A 21 5.222 0.356 -3.691 1.00 10.00 H new ATOM 0 HA TYR A 21 7.853 -0.885 -3.678 1.00 10.00 H new ATOM 0 HB2 TYR A 21 7.692 -1.272 -1.393 1.00 10.00 H new ATOM 0 HB3 TYR A 21 7.237 0.400 -1.656 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.538 -2.953 -1.040 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.595 1.257 -0.451 1.00 10.00 H new ATOM 0 HE1 TYR A 21 3.730 -3.156 0.641 1.00 10.00 H new ATOM 0 HE2 TYR A 21 3.791 1.061 1.145 1.00 10.00 H new ATOM 0 HH TYR A 21 2.783 -2.026 2.396 1.00 10.00 H new ATOM 239 N ARG A 22 7.204 -3.189 -3.623 1.00 10.00 N ATOM 240 CA ARG A 22 6.915 -4.565 -3.816 1.00 10.00 C ATOM 241 C ARG A 22 7.114 -5.224 -2.463 1.00 10.00 C ATOM 242 O ARG A 22 8.228 -5.300 -1.944 1.00 10.00 O ATOM 243 CB ARG A 22 7.881 -5.162 -4.863 1.00 10.00 C ATOM 244 CG ARG A 22 7.522 -6.559 -5.407 1.00 10.00 C ATOM 245 CD ARG A 22 7.589 -7.681 -4.363 1.00 10.00 C ATOM 246 NE ARG A 22 8.928 -7.827 -3.765 1.00 10.00 N ATOM 247 CZ ARG A 22 9.828 -8.756 -4.146 1.00 10.00 C ATOM 248 NH1 ARG A 22 9.589 -9.533 -5.208 1.00 10.00 N ATOM 249 NH2 ARG A 22 10.965 -8.890 -3.483 1.00 10.00 N ATOM 0 H ARG A 22 8.200 -2.997 -3.515 1.00 10.00 H new ATOM 0 HA ARG A 22 5.901 -4.722 -4.185 1.00 10.00 H new ATOM 0 HB2 ARG A 22 7.941 -4.472 -5.705 1.00 10.00 H new ATOM 0 HB3 ARG A 22 8.876 -5.213 -4.421 1.00 10.00 H new ATOM 0 HG2 ARG A 22 6.515 -6.526 -5.823 1.00 10.00 H new ATOM 0 HG3 ARG A 22 8.198 -6.801 -6.227 1.00 10.00 H new ATOM 0 HD2 ARG A 22 6.864 -7.481 -3.574 1.00 10.00 H new ATOM 0 HD3 ARG A 22 7.300 -8.623 -4.830 1.00 10.00 H new ATOM 0 HE ARG A 22 9.190 -7.186 -3.017 1.00 10.00 H new ATOM 0 HH11 ARG A 22 8.722 -9.425 -5.735 1.00 10.00 H new ATOM 0 HH12 ARG A 22 10.274 -10.234 -5.491 1.00 10.00 H new ATOM 0 HH21 ARG A 22 11.162 -8.290 -2.682 1.00 10.00 H new ATOM 0 HH22 ARG A 22 11.644 -9.593 -3.773 1.00 10.00 H new ATOM 263 N SER A 23 6.076 -5.675 -1.903 1.00 10.00 N ATOM 264 CA SER A 23 6.123 -6.284 -0.642 1.00 10.00 C ATOM 265 C SER A 23 5.453 -7.615 -0.734 1.00 10.00 C ATOM 266 O SER A 23 4.822 -7.927 -1.721 1.00 10.00 O ATOM 267 CB SER A 23 5.412 -5.388 0.350 1.00 10.00 C ATOM 268 OG SER A 23 5.401 -5.885 1.685 1.00 10.00 O ATOM 0 H SER A 23 5.144 -5.632 -2.315 1.00 10.00 H new ATOM 0 HA SER A 23 7.151 -6.430 -0.311 1.00 10.00 H new ATOM 0 HB2 SER A 23 5.889 -4.408 0.343 1.00 10.00 H new ATOM 0 HB3 SER A 23 4.383 -5.244 0.020 1.00 10.00 H new ATOM 0 HG SER A 23 4.792 -6.651 1.744 1.00 10.00 H new ATOM 274 N LEU A 24 5.639 -8.403 0.239 1.00 10.00 N ATOM 275 CA LEU A 24 4.912 -9.607 0.366 1.00 10.00 C ATOM 276 C LEU A 24 3.977 -9.385 1.525 1.00 10.00 C ATOM 277 O LEU A 24 4.027 -8.304 2.146 1.00 10.00 O ATOM 278 CB LEU A 24 5.848 -10.822 0.598 1.00 10.00 C ATOM 279 CG LEU A 24 6.704 -11.318 -0.604 1.00 10.00 C ATOM 280 CD1 LEU A 24 5.823 -11.690 -1.786 1.00 10.00 C ATOM 281 CD2 LEU A 24 7.767 -10.306 -1.034 1.00 10.00 C ATOM 0 H LEU A 24 6.311 -8.235 0.988 1.00 10.00 H new ATOM 0 HA LEU A 24 4.365 -9.845 -0.546 1.00 10.00 H new ATOM 0 HB2 LEU A 24 6.528 -10.571 1.412 1.00 10.00 H new ATOM 0 HB3 LEU A 24 5.236 -11.656 0.940 1.00 10.00 H new ATOM 0 HG LEU A 24 7.229 -12.208 -0.257 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.447 -12.033 -2.611 1.00 10.00 H new ATOM 0 HD12 LEU A 24 5.139 -12.486 -1.493 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.251 -10.818 -2.102 1.00 10.00 H new ATOM 0 HD21 LEU A 24 8.332 -10.707 -1.875 1.00 10.00 H new ATOM 0 HD22 LEU A 24 7.284 -9.375 -1.332 1.00 10.00 H new ATOM 0 HD23 LEU A 24 8.444 -10.113 -0.202 1.00 10.00 H new ATOM 293 N ALA A 25 3.130 -10.301 1.787 1.00 10.00 N ATOM 294 CA ALA A 25 2.242 -10.217 2.903 1.00 10.00 C ATOM 295 C ALA A 25 2.455 -11.413 3.742 1.00 10.00 C ATOM 296 O ALA A 25 2.652 -12.508 3.203 1.00 10.00 O ATOM 297 CB ALA A 25 0.811 -10.171 2.442 1.00 10.00 C ATOM 0 H ALA A 25 3.023 -11.149 1.230 1.00 10.00 H new ATOM 0 HA ALA A 25 2.444 -9.306 3.467 1.00 10.00 H new ATOM 0 HB1 ALA A 25 0.152 -10.107 3.308 1.00 10.00 H new ATOM 0 HB2 ALA A 25 0.661 -9.298 1.807 1.00 10.00 H new ATOM 0 HB3 ALA A 25 0.582 -11.074 1.877 1.00 10.00 H new ATOM 303 N ALA A 26 2.446 -11.234 5.032 1.00 10.00 N ATOM 304 CA ALA A 26 2.659 -12.298 5.903 1.00 10.00 C ATOM 305 C ALA A 26 1.446 -13.206 5.870 1.00 10.00 C ATOM 306 O ALA A 26 0.305 -12.743 5.946 1.00 10.00 O ATOM 307 CB ALA A 26 2.942 -11.764 7.281 1.00 10.00 C ATOM 0 H ALA A 26 2.288 -10.335 5.487 1.00 10.00 H new ATOM 0 HA ALA A 26 3.525 -12.887 5.600 1.00 10.00 H new ATOM 0 HB1 ALA A 26 3.109 -12.595 7.966 1.00 10.00 H new ATOM 0 HB2 ALA A 26 3.831 -11.134 7.251 1.00 10.00 H new ATOM 0 HB3 ALA A 26 2.091 -11.176 7.625 1.00 10.00 H new ATOM 313 N PRO A 27 1.672 -14.497 5.724 1.00 10.00 N ATOM 314 CA PRO A 27 0.607 -15.538 5.621 1.00 10.00 C ATOM 315 C PRO A 27 -0.305 -15.634 6.845 1.00 10.00 C ATOM 316 O PRO A 27 -1.303 -16.358 6.848 1.00 10.00 O ATOM 317 CB PRO A 27 1.429 -16.814 5.494 1.00 10.00 C ATOM 318 CG PRO A 27 2.722 -16.440 6.120 1.00 10.00 C ATOM 319 CD PRO A 27 3.000 -15.110 5.600 1.00 10.00 C ATOM 0 HA PRO A 27 -0.079 -15.326 4.801 1.00 10.00 H new ATOM 0 HB2 PRO A 27 0.958 -17.651 6.009 1.00 10.00 H new ATOM 0 HB3 PRO A 27 1.555 -17.111 4.453 1.00 10.00 H new ATOM 0 HG2 PRO A 27 2.651 -16.435 7.208 1.00 10.00 H new ATOM 0 HG3 PRO A 27 3.511 -17.144 5.855 1.00 10.00 H new ATOM 0 HD2 PRO A 27 3.756 -14.585 6.184 1.00 10.00 H new ATOM 0 HD3 PRO A 27 3.353 -15.132 4.569 1.00 10.00 H new ATOM 327 N ASP A 28 0.035 -14.908 7.837 1.00 10.00 N ATOM 328 CA ASP A 28 -0.650 -14.933 9.103 1.00 10.00 C ATOM 329 C ASP A 28 -1.201 -13.562 9.440 1.00 10.00 C ATOM 330 O ASP A 28 -1.541 -13.286 10.591 1.00 10.00 O ATOM 331 CB ASP A 28 0.301 -15.414 10.209 1.00 10.00 C ATOM 332 CG ASP A 28 1.472 -14.477 10.465 1.00 10.00 C ATOM 333 OD1 ASP A 28 2.328 -14.305 9.566 1.00 10.00 O ATOM 334 OD2 ASP A 28 1.589 -13.951 11.601 1.00 10.00 O ATOM 0 H ASP A 28 0.818 -14.255 7.808 1.00 10.00 H new ATOM 0 HA ASP A 28 -1.486 -15.629 9.031 1.00 10.00 H new ATOM 0 HB2 ASP A 28 -0.264 -15.535 11.133 1.00 10.00 H new ATOM 0 HB3 ASP A 28 0.687 -16.397 9.941 1.00 10.00 H new ATOM 339 N LEU A 29 -1.303 -12.702 8.435 1.00 10.00 N ATOM 340 CA LEU A 29 -1.849 -11.379 8.644 1.00 10.00 C ATOM 341 C LEU A 29 -3.299 -11.418 9.003 1.00 10.00 C ATOM 342 O LEU A 29 -4.113 -12.107 8.365 1.00 10.00 O ATOM 343 CB LEU A 29 -1.685 -10.461 7.448 1.00 10.00 C ATOM 344 CG LEU A 29 -0.288 -10.007 7.108 1.00 10.00 C ATOM 345 CD1 LEU A 29 -0.356 -9.052 5.950 1.00 10.00 C ATOM 346 CD2 LEU A 29 0.377 -9.344 8.306 1.00 10.00 C ATOM 0 H LEU A 29 -1.016 -12.900 7.476 1.00 10.00 H new ATOM 0 HA LEU A 29 -1.268 -10.977 9.474 1.00 10.00 H new ATOM 0 HB2 LEU A 29 -2.096 -10.968 6.575 1.00 10.00 H new ATOM 0 HB3 LEU A 29 -2.295 -9.574 7.618 1.00 10.00 H new ATOM 0 HG LEU A 29 0.314 -10.874 6.836 1.00 10.00 H new ATOM 0 HD11 LEU A 29 0.649 -8.717 5.695 1.00 10.00 H new ATOM 0 HD12 LEU A 29 -0.800 -9.554 5.090 1.00 10.00 H new ATOM 0 HD13 LEU A 29 -0.967 -8.192 6.223 1.00 10.00 H new ATOM 0 HD21 LEU A 29 1.383 -9.026 8.034 1.00 10.00 H new ATOM 0 HD22 LEU A 29 -0.207 -8.476 8.612 1.00 10.00 H new ATOM 0 HD23 LEU A 29 0.432 -10.054 9.131 1.00 10.00 H new ATOM 358 N THR A 30 -3.608 -10.679 9.987 1.00 10.00 N ATOM 359 CA THR A 30 -4.903 -10.519 10.462 1.00 10.00 C ATOM 360 C THR A 30 -5.690 -9.595 9.597 1.00 10.00 C ATOM 361 O THR A 30 -5.172 -8.597 9.125 1.00 10.00 O ATOM 362 CB THR A 30 -4.797 -9.946 11.830 1.00 10.00 C ATOM 363 OG1 THR A 30 -3.528 -9.264 11.953 1.00 10.00 O ATOM 364 CG2 THR A 30 -4.893 -11.023 12.832 1.00 10.00 C ATOM 0 H THR A 30 -2.918 -10.140 10.510 1.00 10.00 H new ATOM 0 HA THR A 30 -5.417 -11.480 10.465 1.00 10.00 H new ATOM 0 HB THR A 30 -5.610 -9.240 12.000 1.00 10.00 H new ATOM 0 HG1 THR A 30 -3.652 -8.431 12.454 1.00 10.00 H new ATOM 0 HG21 THR A 30 -4.815 -10.597 13.832 1.00 10.00 H new ATOM 0 HG22 THR A 30 -5.851 -11.532 12.728 1.00 10.00 H new ATOM 0 HG23 THR A 30 -4.084 -11.737 12.677 1.00 10.00 H new ATOM 372 N LEU A 31 -6.939 -9.924 9.395 1.00 10.00 N ATOM 373 CA LEU A 31 -7.876 -9.092 8.664 1.00 10.00 C ATOM 374 C LEU A 31 -7.921 -7.747 9.304 1.00 10.00 C ATOM 375 O LEU A 31 -7.917 -6.743 8.622 1.00 10.00 O ATOM 376 CB LEU A 31 -9.243 -9.703 8.761 1.00 10.00 C ATOM 377 CG LEU A 31 -10.411 -8.972 8.090 1.00 10.00 C ATOM 378 CD1 LEU A 31 -10.250 -8.913 6.588 1.00 10.00 C ATOM 379 CD2 LEU A 31 -11.722 -9.627 8.465 1.00 10.00 C ATOM 0 H LEU A 31 -7.347 -10.793 9.738 1.00 10.00 H new ATOM 0 HA LEU A 31 -7.568 -9.010 7.622 1.00 10.00 H new ATOM 0 HB2 LEU A 31 -9.190 -10.706 8.338 1.00 10.00 H new ATOM 0 HB3 LEU A 31 -9.483 -9.815 9.818 1.00 10.00 H new ATOM 0 HG LEU A 31 -10.413 -7.944 8.453 1.00 10.00 H new ATOM 0 HD11 LEU A 31 -11.099 -8.387 6.151 1.00 10.00 H new ATOM 0 HD12 LEU A 31 -9.329 -8.384 6.341 1.00 10.00 H new ATOM 0 HD13 LEU A 31 -10.205 -9.925 6.187 1.00 10.00 H new ATOM 0 HD21 LEU A 31 -12.544 -9.099 7.982 1.00 10.00 H new ATOM 0 HD22 LEU A 31 -11.716 -10.666 8.137 1.00 10.00 H new ATOM 0 HD23 LEU A 31 -11.852 -9.589 9.547 1.00 10.00 H new ATOM 391 N ARG A 32 -7.871 -7.725 10.629 1.00 10.00 N ATOM 392 CA ARG A 32 -7.935 -6.474 11.340 1.00 10.00 C ATOM 393 C ARG A 32 -6.746 -5.601 10.969 1.00 10.00 C ATOM 394 O ARG A 32 -6.856 -4.405 10.936 1.00 10.00 O ATOM 395 CB ARG A 32 -8.007 -6.685 12.838 1.00 10.00 C ATOM 396 CG ARG A 32 -8.226 -5.405 13.621 1.00 10.00 C ATOM 397 CD ARG A 32 -9.532 -4.706 13.228 1.00 10.00 C ATOM 398 NE ARG A 32 -9.827 -3.595 14.136 1.00 10.00 N ATOM 399 CZ ARG A 32 -10.652 -2.570 13.895 1.00 10.00 C ATOM 400 NH1 ARG A 32 -11.221 -2.418 12.704 1.00 10.00 N ATOM 401 NH2 ARG A 32 -10.891 -1.693 14.851 1.00 10.00 N ATOM 0 H ARG A 32 -7.787 -8.553 11.219 1.00 10.00 H new ATOM 0 HA ARG A 32 -8.851 -5.963 11.044 1.00 10.00 H new ATOM 0 HB2 ARG A 32 -8.817 -7.380 13.060 1.00 10.00 H new ATOM 0 HB3 ARG A 32 -7.083 -7.154 13.175 1.00 10.00 H new ATOM 0 HG2 ARG A 32 -8.243 -5.631 14.687 1.00 10.00 H new ATOM 0 HG3 ARG A 32 -7.388 -4.729 13.452 1.00 10.00 H new ATOM 0 HD2 ARG A 32 -9.457 -4.335 12.206 1.00 10.00 H new ATOM 0 HD3 ARG A 32 -10.352 -5.423 13.247 1.00 10.00 H new ATOM 0 HE ARG A 32 -9.357 -3.604 15.041 1.00 10.00 H new ATOM 0 HH11 ARG A 32 -11.031 -3.088 11.959 1.00 10.00 H new ATOM 0 HH12 ARG A 32 -11.848 -1.631 12.535 1.00 10.00 H new ATOM 0 HH21 ARG A 32 -10.448 -1.800 15.764 1.00 10.00 H new ATOM 0 HH22 ARG A 32 -11.518 -0.908 14.678 1.00 10.00 H new ATOM 415 N ASP A 33 -5.652 -6.232 10.619 1.00 10.00 N ATOM 416 CA ASP A 33 -4.466 -5.542 10.165 1.00 10.00 C ATOM 417 C ASP A 33 -4.665 -4.968 8.781 1.00 10.00 C ATOM 418 O ASP A 33 -4.206 -3.878 8.517 1.00 10.00 O ATOM 419 CB ASP A 33 -3.220 -6.440 10.225 1.00 10.00 C ATOM 420 CG ASP A 33 -2.519 -6.401 11.566 1.00 10.00 C ATOM 421 OD1 ASP A 33 -3.149 -6.768 12.590 1.00 10.00 O ATOM 422 OD2 ASP A 33 -1.337 -5.997 11.629 1.00 10.00 O ATOM 0 H ASP A 33 -5.557 -7.247 10.641 1.00 10.00 H new ATOM 0 HA ASP A 33 -4.294 -4.712 10.850 1.00 10.00 H new ATOM 0 HB2 ASP A 33 -3.510 -7.467 10.004 1.00 10.00 H new ATOM 0 HB3 ASP A 33 -2.521 -6.132 9.448 1.00 10.00 H new ATOM 427 N LEU A 34 -5.423 -5.658 7.905 1.00 10.00 N ATOM 428 CA LEU A 34 -5.641 -5.102 6.535 1.00 10.00 C ATOM 429 C LEU A 34 -6.588 -3.952 6.626 1.00 10.00 C ATOM 430 O LEU A 34 -6.499 -2.962 5.896 1.00 10.00 O ATOM 431 CB LEU A 34 -6.210 -6.115 5.496 1.00 10.00 C ATOM 432 CG LEU A 34 -5.320 -7.271 5.013 1.00 10.00 C ATOM 433 CD1 LEU A 34 -4.065 -6.766 4.320 1.00 10.00 C ATOM 434 CD2 LEU A 34 -4.956 -8.125 6.154 1.00 10.00 C ATOM 0 H LEU A 34 -5.876 -6.552 8.095 1.00 10.00 H new ATOM 0 HA LEU A 34 -4.654 -4.811 6.175 1.00 10.00 H new ATOM 0 HB2 LEU A 34 -7.112 -6.552 5.924 1.00 10.00 H new ATOM 0 HB3 LEU A 34 -6.516 -5.547 4.617 1.00 10.00 H new ATOM 0 HG LEU A 34 -5.888 -7.850 4.284 1.00 10.00 H new ATOM 0 HD11 LEU A 34 -3.463 -7.614 3.994 1.00 10.00 H new ATOM 0 HD12 LEU A 34 -4.344 -6.165 3.455 1.00 10.00 H new ATOM 0 HD13 LEU A 34 -3.486 -6.156 5.014 1.00 10.00 H new ATOM 0 HD21 LEU A 34 -4.325 -8.944 5.809 1.00 10.00 H new ATOM 0 HD22 LEU A 34 -4.413 -7.534 6.892 1.00 10.00 H new ATOM 0 HD23 LEU A 34 -5.860 -8.530 6.608 1.00 10.00 H new ATOM 446 N LEU A 35 -7.500 -4.102 7.524 1.00 10.00 N ATOM 447 CA LEU A 35 -8.510 -3.104 7.772 1.00 10.00 C ATOM 448 C LEU A 35 -7.888 -1.915 8.458 1.00 10.00 C ATOM 449 O LEU A 35 -8.170 -0.780 8.124 1.00 10.00 O ATOM 450 CB LEU A 35 -9.673 -3.714 8.569 1.00 10.00 C ATOM 451 CG LEU A 35 -10.666 -4.611 7.773 1.00 10.00 C ATOM 452 CD1 LEU A 35 -11.577 -3.747 6.927 1.00 10.00 C ATOM 453 CD2 LEU A 35 -9.926 -5.557 6.841 1.00 10.00 C ATOM 0 H LEU A 35 -7.575 -4.927 8.119 1.00 10.00 H new ATOM 0 HA LEU A 35 -8.929 -2.751 6.830 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -9.255 -4.307 9.383 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -10.238 -2.901 9.025 1.00 10.00 H new ATOM 0 HG LEU A 35 -11.240 -5.187 8.499 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -12.269 -4.381 6.373 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -12.140 -3.072 7.572 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -10.979 -3.164 6.226 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -10.646 -6.170 6.299 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -9.334 -4.979 6.131 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -9.267 -6.201 7.424 1.00 10.00 H new ATOM 465 N ASP A 36 -6.989 -2.199 9.366 1.00 10.00 N ATOM 466 CA ASP A 36 -6.194 -1.160 10.051 1.00 10.00 C ATOM 467 C ASP A 36 -5.424 -0.353 9.021 1.00 10.00 C ATOM 468 O ASP A 36 -5.327 0.868 9.132 1.00 10.00 O ATOM 469 CB ASP A 36 -5.222 -1.799 11.035 1.00 10.00 C ATOM 470 CG ASP A 36 -4.415 -0.815 11.861 1.00 10.00 C ATOM 471 OD1 ASP A 36 -4.918 -0.361 12.915 1.00 10.00 O ATOM 472 OD2 ASP A 36 -3.253 -0.529 11.521 1.00 10.00 O ATOM 0 H ASP A 36 -6.773 -3.150 9.665 1.00 10.00 H new ATOM 0 HA ASP A 36 -6.867 -0.504 10.602 1.00 10.00 H new ATOM 0 HB2 ASP A 36 -5.783 -2.445 11.711 1.00 10.00 H new ATOM 0 HB3 ASP A 36 -4.534 -2.438 10.481 1.00 10.00 H new ATOM 477 N ILE A 37 -4.899 -1.047 8.003 1.00 10.00 N ATOM 478 CA ILE A 37 -4.219 -0.405 6.882 1.00 10.00 C ATOM 479 C ILE A 37 -5.159 0.604 6.221 1.00 10.00 C ATOM 480 O ILE A 37 -4.902 1.798 6.241 1.00 10.00 O ATOM 481 CB ILE A 37 -3.792 -1.434 5.775 1.00 10.00 C ATOM 482 CG1 ILE A 37 -2.769 -2.442 6.288 1.00 10.00 C ATOM 483 CG2 ILE A 37 -3.242 -0.713 4.545 1.00 10.00 C ATOM 484 CD1 ILE A 37 -2.594 -3.649 5.366 1.00 10.00 C ATOM 0 H ILE A 37 -4.936 -2.064 7.938 1.00 10.00 H new ATOM 0 HA ILE A 37 -3.328 0.074 7.289 1.00 10.00 H new ATOM 0 HB ILE A 37 -4.690 -1.985 5.495 1.00 10.00 H new ATOM 0 HG12 ILE A 37 -1.807 -1.944 6.409 1.00 10.00 H new ATOM 0 HG13 ILE A 37 -3.075 -2.789 7.275 1.00 10.00 H new ATOM 0 HG21 ILE A 37 -2.953 -1.446 3.792 1.00 10.00 H new ATOM 0 HG22 ILE A 37 -4.009 -0.056 4.135 1.00 10.00 H new ATOM 0 HG23 ILE A 37 -2.371 -0.122 4.829 1.00 10.00 H new ATOM 0 HD11 ILE A 37 -1.853 -4.326 5.790 1.00 10.00 H new ATOM 0 HD12 ILE A 37 -3.546 -4.170 5.265 1.00 10.00 H new ATOM 0 HD13 ILE A 37 -2.259 -3.312 4.385 1.00 10.00 H new ATOM 496 N VAL A 38 -6.271 0.110 5.690 1.00 10.00 N ATOM 497 CA VAL A 38 -7.210 0.929 4.917 1.00 10.00 C ATOM 498 C VAL A 38 -7.842 2.061 5.746 1.00 10.00 C ATOM 499 O VAL A 38 -7.854 3.221 5.321 1.00 10.00 O ATOM 500 CB VAL A 38 -8.305 0.054 4.184 1.00 10.00 C ATOM 501 CG1 VAL A 38 -9.120 -0.766 5.139 1.00 10.00 C ATOM 502 CG2 VAL A 38 -9.204 0.894 3.292 1.00 10.00 C ATOM 0 H VAL A 38 -6.551 -0.867 5.780 1.00 10.00 H new ATOM 0 HA VAL A 38 -6.615 1.413 4.142 1.00 10.00 H new ATOM 0 HB VAL A 38 -7.756 -0.640 3.547 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -9.856 -1.347 4.583 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -8.465 -1.441 5.689 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -9.632 -0.106 5.839 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -9.940 0.251 2.809 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -9.716 1.644 3.895 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -8.601 1.390 2.531 1.00 10.00 H new ATOM 512 N GLU A 39 -8.278 1.739 6.940 1.00 10.00 N ATOM 513 CA GLU A 39 -8.942 2.691 7.807 1.00 10.00 C ATOM 514 C GLU A 39 -7.992 3.798 8.279 1.00 10.00 C ATOM 515 O GLU A 39 -8.419 4.932 8.521 1.00 10.00 O ATOM 516 CB GLU A 39 -9.609 1.958 8.971 1.00 10.00 C ATOM 517 CG GLU A 39 -10.716 1.010 8.517 1.00 10.00 C ATOM 518 CD GLU A 39 -11.350 0.245 9.646 1.00 10.00 C ATOM 519 OE1 GLU A 39 -10.740 -0.708 10.157 1.00 10.00 O ATOM 520 OE2 GLU A 39 -12.477 0.569 10.043 1.00 10.00 O ATOM 0 H GLU A 39 -8.183 0.806 7.342 1.00 10.00 H new ATOM 0 HA GLU A 39 -9.721 3.195 7.235 1.00 10.00 H new ATOM 0 HB2 GLU A 39 -8.855 1.393 9.518 1.00 10.00 H new ATOM 0 HB3 GLU A 39 -10.025 2.689 9.664 1.00 10.00 H new ATOM 0 HG2 GLU A 39 -11.485 1.583 8.000 1.00 10.00 H new ATOM 0 HG3 GLU A 39 -10.306 0.304 7.795 1.00 10.00 H new ATOM 527 N THR A 40 -6.714 3.483 8.387 1.00 10.00 N ATOM 528 CA THR A 40 -5.735 4.480 8.758 1.00 10.00 C ATOM 529 C THR A 40 -5.219 5.278 7.532 1.00 10.00 C ATOM 530 O THR A 40 -5.256 6.521 7.525 1.00 10.00 O ATOM 531 CB THR A 40 -4.545 3.828 9.466 1.00 10.00 C ATOM 532 OG1 THR A 40 -5.011 3.065 10.600 1.00 10.00 O ATOM 533 CG2 THR A 40 -3.545 4.880 9.911 1.00 10.00 C ATOM 0 H THR A 40 -6.335 2.550 8.224 1.00 10.00 H new ATOM 0 HA THR A 40 -6.235 5.174 9.433 1.00 10.00 H new ATOM 0 HB THR A 40 -4.044 3.158 8.767 1.00 10.00 H new ATOM 0 HG1 THR A 40 -5.409 2.225 10.288 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.707 4.396 10.412 1.00 10.00 H new ATOM 0 HG22 THR A 40 -3.181 5.427 9.041 1.00 10.00 H new ATOM 0 HG23 THR A 40 -4.028 5.573 10.600 1.00 10.00 H new ATOM 541 N SER A 41 -4.789 4.550 6.496 1.00 10.00 N ATOM 542 CA SER A 41 -4.126 5.118 5.319 1.00 10.00 C ATOM 543 C SER A 41 -4.879 6.277 4.697 1.00 10.00 C ATOM 544 O SER A 41 -4.335 7.339 4.587 1.00 10.00 O ATOM 545 CB SER A 41 -3.874 4.030 4.299 1.00 10.00 C ATOM 546 OG SER A 41 -5.051 3.310 4.076 1.00 10.00 O ATOM 0 H SER A 41 -4.893 3.536 6.452 1.00 10.00 H new ATOM 0 HA SER A 41 -3.178 5.533 5.660 1.00 10.00 H new ATOM 0 HB2 SER A 41 -3.522 4.468 3.365 1.00 10.00 H new ATOM 0 HB3 SER A 41 -3.089 3.362 4.653 1.00 10.00 H new ATOM 0 HG SER A 41 -5.061 2.977 3.154 1.00 10.00 H new ATOM 552 N GLN A 42 -6.139 6.067 4.335 1.00 10.00 N ATOM 553 CA GLN A 42 -6.979 7.111 3.710 1.00 10.00 C ATOM 554 C GLN A 42 -6.978 8.390 4.510 1.00 10.00 C ATOM 555 O GLN A 42 -6.778 9.461 3.975 1.00 10.00 O ATOM 556 CB GLN A 42 -8.400 6.628 3.611 1.00 10.00 C ATOM 557 CG GLN A 42 -8.588 5.492 2.654 1.00 10.00 C ATOM 558 CD GLN A 42 -9.834 4.709 2.922 1.00 10.00 C ATOM 559 OE1 GLN A 42 -10.460 4.167 2.008 1.00 10.00 O ATOM 560 NE2 GLN A 42 -10.192 4.599 4.169 1.00 10.00 N ATOM 0 H GLN A 42 -6.617 5.175 4.461 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.561 7.311 2.723 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -8.738 6.317 4.600 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -9.035 7.459 3.303 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.621 5.882 1.637 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -7.727 4.827 2.713 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -9.649 5.062 4.898 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -11.015 4.050 4.417 1.00 10.00 H new ATOM 569 N ALA A 43 -7.146 8.251 5.793 1.00 10.00 N ATOM 570 CA ALA A 43 -7.275 9.375 6.684 1.00 10.00 C ATOM 571 C ALA A 43 -5.935 10.112 6.874 1.00 10.00 C ATOM 572 O ALA A 43 -5.894 11.343 7.024 1.00 10.00 O ATOM 573 CB ALA A 43 -7.874 8.885 7.982 1.00 10.00 C ATOM 0 H ALA A 43 -7.198 7.345 6.259 1.00 10.00 H new ATOM 0 HA ALA A 43 -7.944 10.120 6.252 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -7.981 9.722 8.672 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -8.853 8.447 7.788 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -7.221 8.132 8.423 1.00 10.00 H new ATOM 579 N HIS A 44 -4.853 9.369 6.822 1.00 10.00 N ATOM 580 CA HIS A 44 -3.511 9.940 6.914 1.00 10.00 C ATOM 581 C HIS A 44 -3.122 10.506 5.546 1.00 10.00 C ATOM 582 O HIS A 44 -2.537 11.560 5.465 1.00 10.00 O ATOM 583 CB HIS A 44 -2.511 8.847 7.335 1.00 10.00 C ATOM 584 CG HIS A 44 -1.100 9.307 7.646 1.00 10.00 C ATOM 585 ND1 HIS A 44 -0.166 8.494 8.220 1.00 10.00 N ATOM 586 CD2 HIS A 44 -0.456 10.470 7.398 1.00 10.00 C ATOM 587 CE1 HIS A 44 0.966 9.131 8.299 1.00 10.00 C ATOM 588 NE2 HIS A 44 0.817 10.318 7.818 1.00 10.00 N ATOM 0 H HIS A 44 -4.868 8.355 6.715 1.00 10.00 H new ATOM 0 HA HIS A 44 -3.495 10.736 7.658 1.00 10.00 H new ATOM 0 HB2 HIS A 44 -2.908 8.342 8.216 1.00 10.00 H new ATOM 0 HB3 HIS A 44 -2.461 8.105 6.538 1.00 10.00 H new ATOM 0 HD2 HIS A 44 -0.881 11.355 6.948 1.00 10.00 H new ATOM 0 HE1 HIS A 44 1.884 8.730 8.703 1.00 10.00 H new ATOM 0 HE2 HIS A 44 1.546 11.029 7.764 1.00 10.00 H new ATOM 597 N ASN A 45 -3.465 9.806 4.497 1.00 10.00 N ATOM 598 CA ASN A 45 -3.140 10.218 3.131 1.00 10.00 C ATOM 599 C ASN A 45 -3.904 11.436 2.737 1.00 10.00 C ATOM 600 O ASN A 45 -3.388 12.275 2.033 1.00 10.00 O ATOM 601 CB ASN A 45 -3.347 9.091 2.109 1.00 10.00 C ATOM 602 CG ASN A 45 -2.277 8.021 2.182 1.00 10.00 C ATOM 603 OD1 ASN A 45 -1.679 7.793 3.224 1.00 10.00 O ATOM 604 ND2 ASN A 45 -2.027 7.362 1.080 1.00 10.00 N ATOM 0 H ASN A 45 -3.981 8.928 4.552 1.00 10.00 H new ATOM 0 HA ASN A 45 -2.077 10.461 3.127 1.00 10.00 H new ATOM 0 HB2 ASN A 45 -4.322 8.633 2.274 1.00 10.00 H new ATOM 0 HB3 ASN A 45 -3.360 9.516 1.105 1.00 10.00 H new ATOM 0 HD21 ASN A 45 -1.314 6.632 1.073 1.00 10.00 H new ATOM 0 HD22 ASN A 45 -2.545 7.578 0.228 1.00 10.00 H new ATOM 611 N ALA A 46 -5.136 11.543 3.204 1.00 10.00 N ATOM 612 CA ALA A 46 -5.928 12.745 2.998 1.00 10.00 C ATOM 613 C ALA A 46 -5.181 13.917 3.598 1.00 10.00 C ATOM 614 O ALA A 46 -5.027 14.971 2.963 1.00 10.00 O ATOM 615 CB ALA A 46 -7.288 12.607 3.663 1.00 10.00 C ATOM 0 H ALA A 46 -5.611 10.810 3.730 1.00 10.00 H new ATOM 0 HA ALA A 46 -6.085 12.902 1.931 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -7.867 13.516 3.499 1.00 10.00 H new ATOM 0 HB2 ALA A 46 -7.818 11.756 3.234 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -7.155 12.450 4.733 1.00 10.00 H new ATOM 621 N ARG A 47 -4.670 13.689 4.807 1.00 10.00 N ATOM 622 CA ARG A 47 -3.901 14.679 5.545 1.00 10.00 C ATOM 623 C ARG A 47 -2.612 15.005 4.829 1.00 10.00 C ATOM 624 O ARG A 47 -2.318 16.164 4.549 1.00 10.00 O ATOM 625 CB ARG A 47 -3.544 14.168 6.933 1.00 10.00 C ATOM 626 CG ARG A 47 -2.976 15.246 7.833 1.00 10.00 C ATOM 627 CD ARG A 47 -2.519 14.735 9.185 1.00 10.00 C ATOM 628 NE ARG A 47 -1.220 14.033 9.147 1.00 10.00 N ATOM 629 CZ ARG A 47 -0.430 13.860 10.229 1.00 10.00 C ATOM 630 NH1 ARG A 47 -0.768 14.395 11.396 1.00 10.00 N ATOM 631 NH2 ARG A 47 0.715 13.199 10.123 1.00 10.00 N ATOM 0 H ARG A 47 -4.781 12.804 5.302 1.00 10.00 H new ATOM 0 HA ARG A 47 -4.524 15.570 5.622 1.00 10.00 H new ATOM 0 HB2 ARG A 47 -4.434 13.746 7.399 1.00 10.00 H new ATOM 0 HB3 ARG A 47 -2.818 13.360 6.841 1.00 10.00 H new ATOM 0 HG2 ARG A 47 -2.133 15.720 7.330 1.00 10.00 H new ATOM 0 HG3 ARG A 47 -3.732 16.017 7.983 1.00 10.00 H new ATOM 0 HD2 ARG A 47 -2.448 15.575 9.876 1.00 10.00 H new ATOM 0 HD3 ARG A 47 -3.276 14.059 9.583 1.00 10.00 H new ATOM 0 HE ARG A 47 -0.902 13.658 8.254 1.00 10.00 H new ATOM 0 HH11 ARG A 47 -1.627 14.939 11.478 1.00 10.00 H new ATOM 0 HH12 ARG A 47 -0.169 14.262 12.211 1.00 10.00 H new ATOM 0 HH21 ARG A 47 1.003 12.819 9.221 1.00 10.00 H new ATOM 0 HH22 ARG A 47 1.308 13.071 10.943 1.00 10.00 H new ATOM 645 N ALA A 48 -1.850 13.977 4.532 1.00 10.00 N ATOM 646 CA ALA A 48 -0.560 14.142 3.926 1.00 10.00 C ATOM 647 C ALA A 48 -0.651 14.591 2.455 1.00 10.00 C ATOM 648 O ALA A 48 0.355 14.944 1.862 1.00 10.00 O ATOM 649 CB ALA A 48 0.291 12.887 4.091 1.00 10.00 C ATOM 0 H ALA A 48 -2.112 13.007 4.706 1.00 10.00 H new ATOM 0 HA ALA A 48 -0.059 14.951 4.457 1.00 10.00 H new ATOM 0 HB1 ALA A 48 1.263 13.042 3.622 1.00 10.00 H new ATOM 0 HB2 ALA A 48 0.429 12.678 5.152 1.00 10.00 H new ATOM 0 HB3 ALA A 48 -0.210 12.043 3.617 1.00 10.00 H new ATOM 655 N GLN A 49 -1.884 14.602 1.889 1.00 10.00 N ATOM 656 CA GLN A 49 -2.178 15.048 0.489 1.00 10.00 C ATOM 657 C GLN A 49 -1.653 14.016 -0.500 1.00 10.00 C ATOM 658 O GLN A 49 -1.376 14.296 -1.678 1.00 10.00 O ATOM 659 CB GLN A 49 -1.600 16.445 0.239 1.00 10.00 C ATOM 660 CG GLN A 49 -2.095 17.442 1.222 1.00 10.00 C ATOM 661 CD GLN A 49 -0.966 18.230 1.859 1.00 10.00 C ATOM 662 OE1 GLN A 49 -0.558 19.286 1.369 1.00 10.00 O ATOM 663 NE2 GLN A 49 -0.477 17.738 2.975 1.00 10.00 N ATOM 0 H GLN A 49 -2.718 14.299 2.392 1.00 10.00 H new ATOM 0 HA GLN A 49 -3.256 15.123 0.346 1.00 10.00 H new ATOM 0 HB2 GLN A 49 -0.512 16.400 0.287 1.00 10.00 H new ATOM 0 HB3 GLN A 49 -1.862 16.770 -0.768 1.00 10.00 H new ATOM 0 HG2 GLN A 49 -2.780 18.129 0.726 1.00 10.00 H new ATOM 0 HG3 GLN A 49 -2.663 16.931 2.000 1.00 10.00 H new ATOM 0 HE21 GLN A 49 -0.841 16.861 3.349 1.00 10.00 H new ATOM 0 HE22 GLN A 49 0.267 18.233 3.468 1.00 10.00 H new ATOM 672 N LEU A 50 -1.564 12.827 0.015 1.00 10.00 N ATOM 673 CA LEU A 50 -1.116 11.648 -0.670 1.00 10.00 C ATOM 674 C LEU A 50 -2.243 10.901 -1.341 1.00 10.00 C ATOM 675 O LEU A 50 -3.327 10.724 -0.774 1.00 10.00 O ATOM 676 CB LEU A 50 -0.433 10.728 0.321 1.00 10.00 C ATOM 677 CG LEU A 50 1.063 10.887 0.466 1.00 10.00 C ATOM 678 CD1 LEU A 50 1.468 12.297 0.777 1.00 10.00 C ATOM 679 CD2 LEU A 50 1.598 9.947 1.496 1.00 10.00 C ATOM 0 H LEU A 50 -1.818 12.641 0.985 1.00 10.00 H new ATOM 0 HA LEU A 50 -0.425 11.967 -1.450 1.00 10.00 H new ATOM 0 HB2 LEU A 50 -0.889 10.881 1.299 1.00 10.00 H new ATOM 0 HB3 LEU A 50 -0.640 9.698 0.030 1.00 10.00 H new ATOM 0 HG LEU A 50 1.500 10.639 -0.501 1.00 10.00 H new ATOM 0 HD11 LEU A 50 2.553 12.352 0.870 1.00 10.00 H new ATOM 0 HD12 LEU A 50 1.139 12.956 -0.027 1.00 10.00 H new ATOM 0 HD13 LEU A 50 1.007 12.610 1.714 1.00 10.00 H new ATOM 0 HD21 LEU A 50 2.676 10.079 1.584 1.00 10.00 H new ATOM 0 HD22 LEU A 50 1.128 10.154 2.457 1.00 10.00 H new ATOM 0 HD23 LEU A 50 1.381 8.921 1.200 1.00 10.00 H new ATOM 691 N THR A 51 -1.986 10.474 -2.538 1.00 10.00 N ATOM 692 CA THR A 51 -2.900 9.709 -3.319 1.00 10.00 C ATOM 693 C THR A 51 -2.266 8.337 -3.590 1.00 10.00 C ATOM 694 O THR A 51 -1.071 8.198 -3.458 1.00 10.00 O ATOM 695 CB THR A 51 -3.270 10.521 -4.560 1.00 10.00 C ATOM 696 OG1 THR A 51 -2.103 10.881 -5.266 1.00 10.00 O ATOM 697 CG2 THR A 51 -3.910 11.796 -4.081 1.00 10.00 C ATOM 0 H THR A 51 -1.102 10.656 -3.013 1.00 10.00 H new ATOM 0 HA THR A 51 -3.842 9.507 -2.809 1.00 10.00 H new ATOM 0 HB THR A 51 -3.928 9.937 -5.204 1.00 10.00 H new ATOM 0 HG1 THR A 51 -2.351 11.272 -6.130 1.00 10.00 H new ATOM 0 HG21 THR A 51 -4.190 12.407 -4.939 1.00 10.00 H new ATOM 0 HG22 THR A 51 -4.800 11.560 -3.498 1.00 10.00 H new ATOM 0 HG23 THR A 51 -3.204 12.346 -3.459 1.00 10.00 H new ATOM 705 N GLY A 52 -3.049 7.322 -3.859 1.00 10.00 N ATOM 706 CA GLY A 52 -2.494 5.982 -3.829 1.00 10.00 C ATOM 707 C GLY A 52 -3.378 4.926 -4.412 1.00 10.00 C ATOM 708 O GLY A 52 -4.487 5.200 -4.873 1.00 10.00 O ATOM 0 H GLY A 52 -4.039 7.386 -4.094 1.00 10.00 H new ATOM 0 HA2 GLY A 52 -1.547 5.983 -4.370 1.00 10.00 H new ATOM 0 HA3 GLY A 52 -2.270 5.719 -2.795 1.00 10.00 H new ATOM 712 N ALA A 53 -2.873 3.737 -4.418 1.00 10.00 N ATOM 713 CA ALA A 53 -3.607 2.539 -4.797 1.00 10.00 C ATOM 714 C ALA A 53 -2.742 1.345 -4.491 1.00 10.00 C ATOM 715 O ALA A 53 -1.538 1.510 -4.245 1.00 10.00 O ATOM 716 CB ALA A 53 -4.030 2.550 -6.270 1.00 10.00 C ATOM 0 H ALA A 53 -1.906 3.549 -4.153 1.00 10.00 H new ATOM 0 HA ALA A 53 -4.533 2.496 -4.223 1.00 10.00 H new ATOM 0 HB1 ALA A 53 -4.574 1.634 -6.499 1.00 10.00 H new ATOM 0 HB2 ALA A 53 -4.673 3.410 -6.458 1.00 10.00 H new ATOM 0 HB3 ALA A 53 -3.145 2.614 -6.902 1.00 10.00 H new ATOM 722 N LEU A 54 -3.312 0.170 -4.468 1.00 10.00 N ATOM 723 CA LEU A 54 -2.522 -1.004 -4.243 1.00 10.00 C ATOM 724 C LEU A 54 -3.146 -2.198 -4.891 1.00 10.00 C ATOM 725 O LEU A 54 -4.341 -2.197 -5.197 1.00 10.00 O ATOM 726 CB LEU A 54 -2.231 -1.226 -2.731 1.00 10.00 C ATOM 727 CG LEU A 54 -3.353 -1.694 -1.765 1.00 10.00 C ATOM 728 CD1 LEU A 54 -3.596 -3.202 -1.853 1.00 10.00 C ATOM 729 CD2 LEU A 54 -2.981 -1.305 -0.346 1.00 10.00 C ATOM 0 H LEU A 54 -4.310 0.004 -4.601 1.00 10.00 H new ATOM 0 HA LEU A 54 -1.552 -0.853 -4.716 1.00 10.00 H new ATOM 0 HB2 LEU A 54 -1.425 -1.957 -2.664 1.00 10.00 H new ATOM 0 HB3 LEU A 54 -1.842 -0.286 -2.339 1.00 10.00 H new ATOM 0 HG LEU A 54 -4.281 -1.203 -2.058 1.00 10.00 H new ATOM 0 HD11 LEU A 54 -4.389 -3.484 -1.160 1.00 10.00 H new ATOM 0 HD12 LEU A 54 -3.892 -3.464 -2.869 1.00 10.00 H new ATOM 0 HD13 LEU A 54 -2.681 -3.734 -1.593 1.00 10.00 H new ATOM 0 HD21 LEU A 54 -3.765 -1.631 0.338 1.00 10.00 H new ATOM 0 HD22 LEU A 54 -2.040 -1.782 -0.073 1.00 10.00 H new ATOM 0 HD23 LEU A 54 -2.871 -0.222 -0.282 1.00 10.00 H new ATOM 741 N PHE A 55 -2.343 -3.183 -5.123 1.00 10.00 N ATOM 742 CA PHE A 55 -2.754 -4.422 -5.692 1.00 10.00 C ATOM 743 C PHE A 55 -2.177 -5.537 -4.843 1.00 10.00 C ATOM 744 O PHE A 55 -0.962 -5.753 -4.806 1.00 10.00 O ATOM 745 CB PHE A 55 -2.285 -4.536 -7.153 1.00 10.00 C ATOM 746 CG PHE A 55 -2.824 -3.447 -8.048 1.00 10.00 C ATOM 747 CD1 PHE A 55 -4.084 -3.558 -8.604 1.00 10.00 C ATOM 748 CD2 PHE A 55 -2.079 -2.309 -8.315 1.00 10.00 C ATOM 749 CE1 PHE A 55 -4.592 -2.564 -9.407 1.00 10.00 C ATOM 750 CE2 PHE A 55 -2.582 -1.308 -9.117 1.00 10.00 C ATOM 751 CZ PHE A 55 -3.841 -1.435 -9.665 1.00 10.00 C ATOM 0 H PHE A 55 -1.346 -3.145 -4.913 1.00 10.00 H new ATOM 0 HA PHE A 55 -3.842 -4.489 -5.703 1.00 10.00 H new ATOM 0 HB2 PHE A 55 -1.196 -4.510 -7.179 1.00 10.00 H new ATOM 0 HB3 PHE A 55 -2.590 -5.504 -7.549 1.00 10.00 H new ATOM 0 HD1 PHE A 55 -4.678 -4.438 -8.405 1.00 10.00 H new ATOM 0 HD2 PHE A 55 -1.092 -2.206 -7.889 1.00 10.00 H new ATOM 0 HE1 PHE A 55 -5.578 -2.667 -9.836 1.00 10.00 H new ATOM 0 HE2 PHE A 55 -1.992 -0.426 -9.316 1.00 10.00 H new ATOM 0 HZ PHE A 55 -4.239 -0.653 -10.295 1.00 10.00 H new ATOM 761 N TYR A 56 -3.028 -6.184 -4.115 1.00 10.00 N ATOM 762 CA TYR A 56 -2.645 -7.256 -3.236 1.00 10.00 C ATOM 763 C TYR A 56 -3.426 -8.492 -3.639 1.00 10.00 C ATOM 764 O TYR A 56 -4.659 -8.448 -3.677 1.00 10.00 O ATOM 765 CB TYR A 56 -2.965 -6.866 -1.764 1.00 10.00 C ATOM 766 CG TYR A 56 -2.796 -7.983 -0.745 1.00 10.00 C ATOM 767 CD1 TYR A 56 -1.761 -8.901 -0.831 1.00 10.00 C ATOM 768 CD2 TYR A 56 -3.699 -8.118 0.297 1.00 10.00 C ATOM 769 CE1 TYR A 56 -1.640 -9.919 0.081 1.00 10.00 C ATOM 770 CE2 TYR A 56 -3.581 -9.131 1.221 1.00 10.00 C ATOM 771 CZ TYR A 56 -2.551 -10.031 1.107 1.00 10.00 C ATOM 772 OH TYR A 56 -2.438 -11.054 2.015 1.00 10.00 O ATOM 0 H TYR A 56 -4.028 -5.984 -4.110 1.00 10.00 H new ATOM 0 HA TYR A 56 -1.575 -7.452 -3.311 1.00 10.00 H new ATOM 0 HB2 TYR A 56 -2.321 -6.034 -1.477 1.00 10.00 H new ATOM 0 HB3 TYR A 56 -3.992 -6.505 -1.716 1.00 10.00 H new ATOM 0 HD1 TYR A 56 -1.038 -8.814 -1.629 1.00 10.00 H new ATOM 0 HD2 TYR A 56 -4.513 -7.413 0.386 1.00 10.00 H new ATOM 0 HE1 TYR A 56 -0.832 -10.631 -0.006 1.00 10.00 H new ATOM 0 HE2 TYR A 56 -4.293 -9.217 2.029 1.00 10.00 H new ATOM 0 HH TYR A 56 -3.160 -10.987 2.675 1.00 10.00 H new ATOM 782 N SER A 57 -2.736 -9.565 -3.967 1.00 10.00 N ATOM 783 CA SER A 57 -3.372 -10.764 -4.340 1.00 10.00 C ATOM 784 C SER A 57 -2.359 -11.861 -4.136 1.00 10.00 C ATOM 785 O SER A 57 -1.165 -11.630 -4.339 1.00 10.00 O ATOM 786 CB SER A 57 -3.821 -10.684 -5.827 1.00 10.00 C ATOM 787 OG SER A 57 -4.606 -11.812 -6.215 1.00 10.00 O ATOM 0 H SER A 57 -1.717 -9.607 -3.975 1.00 10.00 H new ATOM 0 HA SER A 57 -4.266 -10.952 -3.745 1.00 10.00 H new ATOM 0 HB2 SER A 57 -4.397 -9.772 -5.982 1.00 10.00 H new ATOM 0 HB3 SER A 57 -2.941 -10.618 -6.467 1.00 10.00 H new ATOM 0 HG SER A 57 -4.868 -11.720 -7.155 1.00 10.00 H new ATOM 793 N GLN A 58 -2.807 -12.989 -3.607 1.00 10.00 N ATOM 794 CA GLN A 58 -1.993 -14.207 -3.478 1.00 10.00 C ATOM 795 C GLN A 58 -0.787 -14.099 -2.523 1.00 10.00 C ATOM 796 O GLN A 58 0.024 -15.031 -2.416 1.00 10.00 O ATOM 797 CB GLN A 58 -1.560 -14.681 -4.857 1.00 10.00 C ATOM 798 CG GLN A 58 -2.723 -15.104 -5.748 1.00 10.00 C ATOM 799 CD GLN A 58 -3.606 -16.165 -5.113 1.00 10.00 C ATOM 800 OE1 GLN A 58 -4.561 -15.849 -4.400 1.00 10.00 O ATOM 801 NE2 GLN A 58 -3.320 -17.412 -5.374 1.00 10.00 N ATOM 0 H GLN A 58 -3.756 -13.095 -3.248 1.00 10.00 H new ATOM 0 HA GLN A 58 -2.640 -14.946 -3.005 1.00 10.00 H new ATOM 0 HB2 GLN A 58 -1.007 -13.882 -5.350 1.00 10.00 H new ATOM 0 HB3 GLN A 58 -0.874 -15.521 -4.745 1.00 10.00 H new ATOM 0 HG2 GLN A 58 -3.329 -14.229 -5.984 1.00 10.00 H new ATOM 0 HG3 GLN A 58 -2.331 -15.484 -6.691 1.00 10.00 H new ATOM 0 HE21 GLN A 58 -2.522 -17.639 -5.968 1.00 10.00 H new ATOM 0 HE22 GLN A 58 -3.894 -18.159 -4.984 1.00 10.00 H new ATOM 810 N GLY A 59 -0.664 -12.998 -1.833 1.00 10.00 N ATOM 811 CA GLY A 59 0.415 -12.871 -0.888 1.00 10.00 C ATOM 812 C GLY A 59 1.421 -11.828 -1.289 1.00 10.00 C ATOM 813 O GLY A 59 2.275 -11.464 -0.500 1.00 10.00 O ATOM 0 H GLY A 59 -1.283 -12.190 -1.903 1.00 10.00 H new ATOM 0 HA2 GLY A 59 0.007 -12.618 0.091 1.00 10.00 H new ATOM 0 HA3 GLY A 59 0.917 -13.833 -0.785 1.00 10.00 H new ATOM 817 N VAL A 60 1.337 -11.348 -2.500 1.00 10.00 N ATOM 818 CA VAL A 60 2.241 -10.311 -2.928 1.00 10.00 C ATOM 819 C VAL A 60 1.547 -8.953 -2.909 1.00 10.00 C ATOM 820 O VAL A 60 0.407 -8.799 -3.376 1.00 10.00 O ATOM 821 CB VAL A 60 2.927 -10.610 -4.305 1.00 10.00 C ATOM 822 CG1 VAL A 60 1.911 -10.864 -5.402 1.00 10.00 C ATOM 823 CG2 VAL A 60 3.883 -9.484 -4.717 1.00 10.00 C ATOM 0 H VAL A 60 0.662 -11.652 -3.201 1.00 10.00 H new ATOM 0 HA VAL A 60 3.058 -10.285 -2.207 1.00 10.00 H new ATOM 0 HB VAL A 60 3.509 -11.521 -4.169 1.00 10.00 H new ATOM 0 HG11 VAL A 60 2.430 -11.067 -6.339 1.00 10.00 H new ATOM 0 HG12 VAL A 60 1.295 -11.723 -5.135 1.00 10.00 H new ATOM 0 HG13 VAL A 60 1.277 -9.985 -5.521 1.00 10.00 H new ATOM 0 HG21 VAL A 60 4.340 -9.727 -5.676 1.00 10.00 H new ATOM 0 HG22 VAL A 60 3.328 -8.550 -4.805 1.00 10.00 H new ATOM 0 HG23 VAL A 60 4.662 -9.373 -3.962 1.00 10.00 H new ATOM 833 N PHE A 61 2.202 -8.019 -2.288 1.00 10.00 N ATOM 834 CA PHE A 61 1.738 -6.665 -2.173 1.00 10.00 C ATOM 835 C PHE A 61 2.424 -5.753 -3.162 1.00 10.00 C ATOM 836 O PHE A 61 3.650 -5.632 -3.151 1.00 10.00 O ATOM 837 CB PHE A 61 2.102 -6.111 -0.815 1.00 10.00 C ATOM 838 CG PHE A 61 1.066 -6.117 0.228 1.00 10.00 C ATOM 839 CD1 PHE A 61 -0.099 -5.401 0.055 1.00 10.00 C ATOM 840 CD2 PHE A 61 1.283 -6.773 1.415 1.00 10.00 C ATOM 841 CE1 PHE A 61 -1.032 -5.351 1.050 1.00 10.00 C ATOM 842 CE2 PHE A 61 0.364 -6.712 2.422 1.00 10.00 C ATOM 843 CZ PHE A 61 -0.791 -6.001 2.234 1.00 10.00 C ATOM 0 H PHE A 61 3.101 -8.180 -1.833 1.00 10.00 H new ATOM 0 HA PHE A 61 0.662 -6.694 -2.346 1.00 10.00 H new ATOM 0 HB2 PHE A 61 2.957 -6.675 -0.441 1.00 10.00 H new ATOM 0 HB3 PHE A 61 2.434 -5.082 -0.951 1.00 10.00 H new ATOM 0 HD1 PHE A 61 -0.275 -4.877 -0.873 1.00 10.00 H new ATOM 0 HD2 PHE A 61 2.190 -7.343 1.553 1.00 10.00 H new ATOM 0 HE1 PHE A 61 -1.952 -4.804 0.906 1.00 10.00 H new ATOM 0 HE2 PHE A 61 0.546 -7.219 3.358 1.00 10.00 H new ATOM 0 HZ PHE A 61 -1.522 -5.951 3.028 1.00 10.00 H new ATOM 853 N PHE A 62 1.676 -5.115 -3.991 1.00 10.00 N ATOM 854 CA PHE A 62 2.213 -4.018 -4.726 1.00 10.00 C ATOM 855 C PHE A 62 1.439 -2.806 -4.282 1.00 10.00 C ATOM 856 O PHE A 62 0.236 -2.739 -4.474 1.00 10.00 O ATOM 857 CB PHE A 62 2.135 -4.213 -6.245 1.00 10.00 C ATOM 858 CG PHE A 62 2.751 -3.064 -7.010 1.00 10.00 C ATOM 859 CD1 PHE A 62 4.125 -2.915 -7.066 1.00 10.00 C ATOM 860 CD2 PHE A 62 1.955 -2.132 -7.652 1.00 10.00 C ATOM 861 CE1 PHE A 62 4.693 -1.858 -7.748 1.00 10.00 C ATOM 862 CE2 PHE A 62 2.514 -1.073 -8.337 1.00 10.00 C ATOM 863 CZ PHE A 62 3.886 -0.935 -8.385 1.00 10.00 C ATOM 0 H PHE A 62 0.697 -5.329 -4.179 1.00 10.00 H new ATOM 0 HA PHE A 62 3.279 -3.915 -4.522 1.00 10.00 H new ATOM 0 HB2 PHE A 62 2.643 -5.139 -6.515 1.00 10.00 H new ATOM 0 HB3 PHE A 62 1.092 -4.324 -6.540 1.00 10.00 H new ATOM 0 HD1 PHE A 62 4.761 -3.634 -6.570 1.00 10.00 H new ATOM 0 HD2 PHE A 62 0.881 -2.235 -7.616 1.00 10.00 H new ATOM 0 HE1 PHE A 62 5.767 -1.752 -7.784 1.00 10.00 H new ATOM 0 HE2 PHE A 62 1.880 -0.354 -8.834 1.00 10.00 H new ATOM 0 HZ PHE A 62 4.328 -0.107 -8.919 1.00 10.00 H new ATOM 873 N GLN A 63 2.101 -1.885 -3.665 1.00 10.00 N ATOM 874 CA GLN A 63 1.439 -0.738 -3.081 1.00 10.00 C ATOM 875 C GLN A 63 2.281 0.451 -3.380 1.00 10.00 C ATOM 876 O GLN A 63 3.501 0.403 -3.164 1.00 10.00 O ATOM 877 CB GLN A 63 1.373 -0.959 -1.550 1.00 10.00 C ATOM 878 CG GLN A 63 0.402 -0.091 -0.710 1.00 10.00 C ATOM 879 CD GLN A 63 0.652 1.419 -0.651 1.00 10.00 C ATOM 880 OE1 GLN A 63 -0.275 2.194 -0.517 1.00 10.00 O ATOM 881 NE2 GLN A 63 1.888 1.842 -0.702 1.00 10.00 N ATOM 0 H GLN A 63 3.114 -1.894 -3.545 1.00 10.00 H new ATOM 0 HA GLN A 63 0.432 -0.599 -3.475 1.00 10.00 H new ATOM 0 HB2 GLN A 63 1.114 -2.004 -1.379 1.00 10.00 H new ATOM 0 HB3 GLN A 63 2.377 -0.810 -1.152 1.00 10.00 H new ATOM 0 HG2 GLN A 63 -0.605 -0.247 -1.097 1.00 10.00 H new ATOM 0 HG3 GLN A 63 0.414 -0.471 0.312 1.00 10.00 H new ATOM 0 HE21 GLN A 63 2.651 1.175 -0.815 1.00 10.00 H new ATOM 0 HE22 GLN A 63 2.089 2.839 -0.629 1.00 10.00 H new ATOM 890 N TRP A 64 1.697 1.501 -3.858 1.00 10.00 N ATOM 891 CA TRP A 64 2.469 2.667 -4.072 1.00 10.00 C ATOM 892 C TRP A 64 1.654 3.894 -3.722 1.00 10.00 C ATOM 893 O TRP A 64 0.424 3.828 -3.621 1.00 10.00 O ATOM 894 CB TRP A 64 3.035 2.734 -5.502 1.00 10.00 C ATOM 895 CG TRP A 64 2.192 3.317 -6.580 1.00 10.00 C ATOM 896 CD1 TRP A 64 2.506 4.422 -7.294 1.00 10.00 C ATOM 897 CD2 TRP A 64 0.942 2.860 -7.087 1.00 10.00 C ATOM 898 NE1 TRP A 64 1.557 4.681 -8.214 1.00 10.00 N ATOM 899 CE2 TRP A 64 0.574 3.746 -8.115 1.00 10.00 C ATOM 900 CE3 TRP A 64 0.099 1.799 -6.785 1.00 10.00 C ATOM 901 CZ2 TRP A 64 -0.594 3.602 -8.834 1.00 10.00 C ATOM 902 CZ3 TRP A 64 -1.065 1.664 -7.498 1.00 10.00 C ATOM 903 CH2 TRP A 64 -1.404 2.557 -8.512 1.00 10.00 C ATOM 0 H TRP A 64 0.709 1.571 -4.101 1.00 10.00 H new ATOM 0 HA TRP A 64 3.335 2.631 -3.411 1.00 10.00 H new ATOM 0 HB2 TRP A 64 3.963 3.305 -5.463 1.00 10.00 H new ATOM 0 HB3 TRP A 64 3.298 1.719 -5.801 1.00 10.00 H new ATOM 0 HD1 TRP A 64 3.396 5.016 -7.147 1.00 10.00 H new ATOM 0 HE1 TRP A 64 1.573 5.455 -8.879 1.00 10.00 H new ATOM 0 HE3 TRP A 64 0.354 1.096 -6.006 1.00 10.00 H new ATOM 0 HZ2 TRP A 64 -0.856 4.292 -9.622 1.00 10.00 H new ATOM 0 HZ3 TRP A 64 -1.733 0.847 -7.268 1.00 10.00 H new ATOM 0 HH2 TRP A 64 -2.328 2.417 -9.053 1.00 10.00 H new ATOM 914 N LEU A 65 2.321 4.991 -3.542 1.00 10.00 N ATOM 915 CA LEU A 65 1.682 6.208 -3.138 1.00 10.00 C ATOM 916 C LEU A 65 2.283 7.398 -3.852 1.00 10.00 C ATOM 917 O LEU A 65 3.463 7.378 -4.216 1.00 10.00 O ATOM 918 CB LEU A 65 1.763 6.404 -1.610 1.00 10.00 C ATOM 919 CG LEU A 65 3.159 6.386 -0.982 1.00 10.00 C ATOM 920 CD1 LEU A 65 3.106 7.020 0.372 1.00 10.00 C ATOM 921 CD2 LEU A 65 3.715 4.972 -0.831 1.00 10.00 C ATOM 0 H LEU A 65 3.330 5.070 -3.671 1.00 10.00 H new ATOM 0 HA LEU A 65 0.631 6.132 -3.415 1.00 10.00 H new ATOM 0 HB2 LEU A 65 1.293 7.356 -1.365 1.00 10.00 H new ATOM 0 HB3 LEU A 65 1.168 5.624 -1.136 1.00 10.00 H new ATOM 0 HG LEU A 65 3.817 6.939 -1.652 1.00 10.00 H new ATOM 0 HD11 LEU A 65 4.100 7.007 0.819 1.00 10.00 H new ATOM 0 HD12 LEU A 65 2.764 8.051 0.278 1.00 10.00 H new ATOM 0 HD13 LEU A 65 2.415 6.465 1.007 1.00 10.00 H new ATOM 0 HD21 LEU A 65 4.707 5.017 -0.381 1.00 10.00 H new ATOM 0 HD22 LEU A 65 3.053 4.387 -0.193 1.00 10.00 H new ATOM 0 HD23 LEU A 65 3.783 4.501 -1.812 1.00 10.00 H new ATOM 933 N GLU A 66 1.466 8.393 -4.077 1.00 10.00 N ATOM 934 CA GLU A 66 1.846 9.635 -4.696 1.00 10.00 C ATOM 935 C GLU A 66 1.771 10.715 -3.614 1.00 10.00 C ATOM 936 O GLU A 66 0.732 10.866 -2.987 1.00 10.00 O ATOM 937 CB GLU A 66 0.802 10.036 -5.741 1.00 10.00 C ATOM 938 CG GLU A 66 0.376 9.023 -6.793 1.00 10.00 C ATOM 939 CD GLU A 66 -0.737 9.618 -7.661 1.00 10.00 C ATOM 940 OE1 GLU A 66 -0.445 10.453 -8.531 1.00 10.00 O ATOM 941 OE2 GLU A 66 -1.939 9.318 -7.426 1.00 10.00 O ATOM 0 H GLU A 66 0.478 8.359 -3.824 1.00 10.00 H new ATOM 0 HA GLU A 66 2.833 9.531 -5.147 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -0.094 10.349 -5.206 1.00 10.00 H new ATOM 0 HB3 GLU A 66 1.183 10.913 -6.265 1.00 10.00 H new ATOM 0 HG2 GLU A 66 1.228 8.749 -7.415 1.00 10.00 H new ATOM 0 HG3 GLU A 66 0.026 8.110 -6.312 1.00 10.00 H new ATOM 948 N GLY A 67 2.822 11.435 -3.380 1.00 10.00 N ATOM 949 CA GLY A 67 2.765 12.485 -2.390 1.00 10.00 C ATOM 950 C GLY A 67 3.979 13.380 -2.476 1.00 10.00 C ATOM 951 O GLY A 67 4.849 13.118 -3.286 1.00 10.00 O ATOM 0 H GLY A 67 3.721 11.325 -3.848 1.00 10.00 H new ATOM 0 HA2 GLY A 67 1.862 13.077 -2.535 1.00 10.00 H new ATOM 0 HA3 GLY A 67 2.702 12.047 -1.394 1.00 10.00 H new ATOM 955 N HIS A 68 4.035 14.446 -1.687 1.00 10.00 N ATOM 956 CA HIS A 68 5.265 15.252 -1.606 1.00 10.00 C ATOM 957 C HIS A 68 6.329 14.414 -0.881 1.00 10.00 C ATOM 958 O HIS A 68 6.054 13.937 0.189 1.00 10.00 O ATOM 959 CB HIS A 68 5.018 16.582 -0.848 1.00 10.00 C ATOM 960 CG HIS A 68 6.244 17.327 -0.469 1.00 10.00 C ATOM 961 ND1 HIS A 68 6.872 17.200 0.755 1.00 10.00 N ATOM 962 CD2 HIS A 68 6.950 18.161 -1.158 1.00 10.00 C ATOM 963 CE1 HIS A 68 7.945 17.940 0.774 1.00 10.00 C ATOM 964 NE2 HIS A 68 8.024 18.552 -0.389 1.00 10.00 N ATOM 0 H HIS A 68 3.266 14.774 -1.103 1.00 10.00 H new ATOM 0 HA HIS A 68 5.600 15.513 -2.610 1.00 10.00 H new ATOM 0 HB2 HIS A 68 4.397 17.227 -1.470 1.00 10.00 H new ATOM 0 HB3 HIS A 68 4.448 16.367 0.056 1.00 10.00 H new ATOM 0 HD2 HIS A 68 6.735 18.494 -2.163 1.00 10.00 H new ATOM 0 HE1 HIS A 68 8.642 18.034 1.594 1.00 10.00 H new ATOM 0 HE2 HIS A 68 8.755 19.204 -0.672 1.00 10.00 H new ATOM 973 N PRO A 69 7.556 14.275 -1.466 1.00 10.00 N ATOM 974 CA PRO A 69 8.678 13.413 -1.000 1.00 10.00 C ATOM 975 C PRO A 69 8.719 13.087 0.492 1.00 10.00 C ATOM 976 O PRO A 69 8.715 11.921 0.885 1.00 10.00 O ATOM 977 CB PRO A 69 9.917 14.229 -1.426 1.00 10.00 C ATOM 978 CG PRO A 69 9.386 15.339 -2.312 1.00 10.00 C ATOM 979 CD PRO A 69 7.991 14.964 -2.656 1.00 10.00 C ATOM 0 HA PRO A 69 8.593 12.416 -1.432 1.00 10.00 H new ATOM 0 HB2 PRO A 69 10.437 14.634 -0.558 1.00 10.00 H new ATOM 0 HB3 PRO A 69 10.632 13.606 -1.964 1.00 10.00 H new ATOM 0 HG2 PRO A 69 9.415 16.298 -1.794 1.00 10.00 H new ATOM 0 HG3 PRO A 69 9.994 15.444 -3.211 1.00 10.00 H new ATOM 0 HD2 PRO A 69 7.375 15.838 -2.868 1.00 10.00 H new ATOM 0 HD3 PRO A 69 7.948 14.323 -3.536 1.00 10.00 H new ATOM 987 N ALA A 70 8.704 14.094 1.311 1.00 10.00 N ATOM 988 CA ALA A 70 8.845 13.879 2.736 1.00 10.00 C ATOM 989 C ALA A 70 7.619 13.320 3.387 1.00 10.00 C ATOM 990 O ALA A 70 7.722 12.654 4.404 1.00 10.00 O ATOM 991 CB ALA A 70 9.316 15.095 3.426 1.00 10.00 C ATOM 0 H ALA A 70 8.597 15.069 1.030 1.00 10.00 H new ATOM 0 HA ALA A 70 9.611 13.111 2.840 1.00 10.00 H new ATOM 0 HB1 ALA A 70 9.410 14.895 4.493 1.00 10.00 H new ATOM 0 HB2 ALA A 70 10.286 15.388 3.025 1.00 10.00 H new ATOM 0 HB3 ALA A 70 8.600 15.902 3.270 1.00 10.00 H new ATOM 997 N ALA A 71 6.498 13.566 2.819 1.00 10.00 N ATOM 998 CA ALA A 71 5.269 13.022 3.317 1.00 10.00 C ATOM 999 C ALA A 71 5.275 11.554 3.044 1.00 10.00 C ATOM 1000 O ALA A 71 4.927 10.744 3.887 1.00 10.00 O ATOM 1001 CB ALA A 71 4.140 13.611 2.573 1.00 10.00 C ATOM 0 H ALA A 71 6.395 14.152 1.991 1.00 10.00 H new ATOM 0 HA ALA A 71 5.170 13.232 4.382 1.00 10.00 H new ATOM 0 HB1 ALA A 71 3.203 13.200 2.948 1.00 10.00 H new ATOM 0 HB2 ALA A 71 4.141 14.693 2.706 1.00 10.00 H new ATOM 0 HB3 ALA A 71 4.240 13.376 1.513 1.00 10.00 H new ATOM 1007 N VAL A 72 5.722 11.242 1.843 1.00 10.00 N ATOM 1008 CA VAL A 72 5.823 9.893 1.359 1.00 10.00 C ATOM 1009 C VAL A 72 6.759 9.157 2.266 1.00 10.00 C ATOM 1010 O VAL A 72 6.480 8.068 2.673 1.00 10.00 O ATOM 1011 CB VAL A 72 6.420 9.843 -0.069 1.00 10.00 C ATOM 1012 CG1 VAL A 72 6.020 8.613 -0.764 1.00 10.00 C ATOM 1013 CG2 VAL A 72 6.047 11.020 -0.888 1.00 10.00 C ATOM 0 H VAL A 72 6.030 11.941 1.167 1.00 10.00 H new ATOM 0 HA VAL A 72 4.826 9.453 1.337 1.00 10.00 H new ATOM 0 HB VAL A 72 7.503 9.856 0.055 1.00 10.00 H new ATOM 0 HG11 VAL A 72 6.453 8.603 -1.764 1.00 10.00 H new ATOM 0 HG12 VAL A 72 6.377 7.747 -0.206 1.00 10.00 H new ATOM 0 HG13 VAL A 72 4.933 8.574 -0.838 1.00 10.00 H new ATOM 0 HG21 VAL A 72 6.494 10.930 -1.878 1.00 10.00 H new ATOM 0 HG22 VAL A 72 4.962 11.069 -0.982 1.00 10.00 H new ATOM 0 HG23 VAL A 72 6.410 11.928 -0.407 1.00 10.00 H new ATOM 1023 N ALA A 73 7.867 9.800 2.592 1.00 10.00 N ATOM 1024 CA ALA A 73 8.858 9.226 3.475 1.00 10.00 C ATOM 1025 C ALA A 73 8.401 9.127 4.917 1.00 10.00 C ATOM 1026 O ALA A 73 8.778 8.196 5.605 1.00 10.00 O ATOM 1027 CB ALA A 73 10.120 9.969 3.416 1.00 10.00 C ATOM 0 H ALA A 73 8.101 10.732 2.251 1.00 10.00 H new ATOM 0 HA ALA A 73 9.010 8.210 3.111 1.00 10.00 H new ATOM 0 HB1 ALA A 73 10.843 9.512 4.091 1.00 10.00 H new ATOM 0 HB2 ALA A 73 10.509 9.946 2.398 1.00 10.00 H new ATOM 0 HB3 ALA A 73 9.948 11.003 3.715 1.00 10.00 H new ATOM 1033 N GLU A 74 7.650 10.110 5.382 1.00 10.00 N ATOM 1034 CA GLU A 74 7.030 10.071 6.713 1.00 10.00 C ATOM 1035 C GLU A 74 6.176 8.821 6.774 1.00 10.00 C ATOM 1036 O GLU A 74 6.282 7.998 7.707 1.00 10.00 O ATOM 1037 CB GLU A 74 6.230 11.400 6.925 1.00 10.00 C ATOM 1038 CG GLU A 74 5.397 11.542 8.204 1.00 10.00 C ATOM 1039 CD GLU A 74 4.000 10.966 8.078 1.00 10.00 C ATOM 1040 OE1 GLU A 74 3.814 9.782 8.368 1.00 10.00 O ATOM 1041 OE2 GLU A 74 3.056 11.710 7.697 1.00 10.00 O ATOM 0 H GLU A 74 7.448 10.960 4.856 1.00 10.00 H new ATOM 0 HA GLU A 74 7.755 10.015 7.525 1.00 10.00 H new ATOM 0 HB2 GLU A 74 6.941 12.226 6.896 1.00 10.00 H new ATOM 0 HB3 GLU A 74 5.560 11.526 6.074 1.00 10.00 H new ATOM 0 HG2 GLU A 74 5.915 11.044 9.024 1.00 10.00 H new ATOM 0 HG3 GLU A 74 5.325 12.597 8.467 1.00 10.00 H new ATOM 1048 N VAL A 75 5.412 8.650 5.736 1.00 10.00 N ATOM 1049 CA VAL A 75 4.625 7.487 5.535 1.00 10.00 C ATOM 1050 C VAL A 75 5.522 6.240 5.434 1.00 10.00 C ATOM 1051 O VAL A 75 5.283 5.275 6.143 1.00 10.00 O ATOM 1052 CB VAL A 75 3.714 7.668 4.301 1.00 10.00 C ATOM 1053 CG1 VAL A 75 3.139 6.366 3.827 1.00 10.00 C ATOM 1054 CG2 VAL A 75 2.590 8.633 4.643 1.00 10.00 C ATOM 0 H VAL A 75 5.322 9.339 4.990 1.00 10.00 H new ATOM 0 HA VAL A 75 3.973 7.336 6.395 1.00 10.00 H new ATOM 0 HB VAL A 75 4.323 8.069 3.491 1.00 10.00 H new ATOM 0 HG11 VAL A 75 2.505 6.543 2.958 1.00 10.00 H new ATOM 0 HG12 VAL A 75 3.948 5.689 3.554 1.00 10.00 H new ATOM 0 HG13 VAL A 75 2.545 5.919 4.624 1.00 10.00 H new ATOM 0 HG21 VAL A 75 1.945 8.763 3.774 1.00 10.00 H new ATOM 0 HG22 VAL A 75 2.006 8.232 5.472 1.00 10.00 H new ATOM 0 HG23 VAL A 75 3.012 9.596 4.929 1.00 10.00 H new ATOM 1064 N MET A 76 6.574 6.277 4.580 1.00 10.00 N ATOM 1065 CA MET A 76 7.523 5.184 4.456 1.00 10.00 C ATOM 1066 C MET A 76 8.040 4.776 5.790 1.00 10.00 C ATOM 1067 O MET A 76 7.935 3.637 6.133 1.00 10.00 O ATOM 1068 CB MET A 76 8.696 5.554 3.559 1.00 10.00 C ATOM 1069 CG MET A 76 8.368 5.817 2.097 1.00 10.00 C ATOM 1070 SD MET A 76 8.114 4.354 1.064 1.00 10.00 S ATOM 1071 CE MET A 76 6.635 3.653 1.741 1.00 10.00 C ATOM 0 H MET A 76 6.773 7.069 3.968 1.00 10.00 H new ATOM 0 HA MET A 76 6.986 4.351 4.002 1.00 10.00 H new ATOM 0 HB2 MET A 76 9.173 6.445 3.969 1.00 10.00 H new ATOM 0 HB3 MET A 76 9.430 4.750 3.606 1.00 10.00 H new ATOM 0 HG2 MET A 76 7.467 6.430 2.052 1.00 10.00 H new ATOM 0 HG3 MET A 76 9.176 6.406 1.664 1.00 10.00 H new ATOM 0 HE1 MET A 76 6.071 3.160 0.949 1.00 10.00 H new ATOM 0 HE2 MET A 76 6.896 2.924 2.508 1.00 10.00 H new ATOM 0 HE3 MET A 76 6.027 4.443 2.182 1.00 10.00 H new ATOM 1081 N SER A 77 8.521 5.721 6.552 1.00 10.00 N ATOM 1082 CA SER A 77 9.059 5.465 7.869 1.00 10.00 C ATOM 1083 C SER A 77 8.020 4.754 8.756 1.00 10.00 C ATOM 1084 O SER A 77 8.330 3.755 9.414 1.00 10.00 O ATOM 1085 CB SER A 77 9.510 6.776 8.501 1.00 10.00 C ATOM 1086 OG SER A 77 10.229 6.553 9.688 1.00 10.00 O ATOM 0 H SER A 77 8.553 6.703 6.277 1.00 10.00 H new ATOM 0 HA SER A 77 9.921 4.804 7.778 1.00 10.00 H new ATOM 0 HB2 SER A 77 10.132 7.327 7.795 1.00 10.00 H new ATOM 0 HB3 SER A 77 8.640 7.398 8.712 1.00 10.00 H new ATOM 0 HG SER A 77 10.506 7.412 10.069 1.00 10.00 H new ATOM 1092 N HIS A 78 6.787 5.226 8.716 1.00 10.00 N ATOM 1093 CA HIS A 78 5.718 4.606 9.492 1.00 10.00 C ATOM 1094 C HIS A 78 5.355 3.190 9.010 1.00 10.00 C ATOM 1095 O HIS A 78 4.912 2.347 9.812 1.00 10.00 O ATOM 1096 CB HIS A 78 4.480 5.509 9.598 1.00 10.00 C ATOM 1097 CG HIS A 78 4.700 6.685 10.500 1.00 10.00 C ATOM 1098 ND1 HIS A 78 4.507 7.995 10.131 1.00 10.00 N ATOM 1099 CD2 HIS A 78 5.096 6.729 11.791 1.00 10.00 C ATOM 1100 CE1 HIS A 78 4.771 8.774 11.144 1.00 10.00 C ATOM 1101 NE2 HIS A 78 5.129 8.036 12.160 1.00 10.00 N ATOM 0 H HIS A 78 6.498 6.031 8.160 1.00 10.00 H new ATOM 0 HA HIS A 78 6.119 4.486 10.498 1.00 10.00 H new ATOM 0 HB2 HIS A 78 4.208 5.864 8.604 1.00 10.00 H new ATOM 0 HB3 HIS A 78 3.639 4.924 9.969 1.00 10.00 H new ATOM 0 HD1 HIS A 78 4.205 8.309 9.209 1.00 10.00 H new ATOM 0 HD2 HIS A 78 5.341 5.882 12.414 1.00 10.00 H new ATOM 0 HE1 HIS A 78 4.704 9.852 11.142 1.00 10.00 H new ATOM 1110 N ILE A 79 5.552 2.913 7.726 1.00 10.00 N ATOM 1111 CA ILE A 79 5.234 1.592 7.187 1.00 10.00 C ATOM 1112 C ILE A 79 6.453 0.655 7.245 1.00 10.00 C ATOM 1113 O ILE A 79 6.300 -0.559 7.460 1.00 10.00 O ATOM 1114 CB ILE A 79 4.775 1.616 5.701 1.00 10.00 C ATOM 1115 CG1 ILE A 79 3.865 2.780 5.401 1.00 10.00 C ATOM 1116 CG2 ILE A 79 4.031 0.344 5.406 1.00 10.00 C ATOM 1117 CD1 ILE A 79 3.386 2.828 3.957 1.00 10.00 C ATOM 0 H ILE A 79 5.925 3.574 7.045 1.00 10.00 H new ATOM 0 HA ILE A 79 4.417 1.237 7.815 1.00 10.00 H new ATOM 0 HB ILE A 79 5.665 1.715 5.080 1.00 10.00 H new ATOM 0 HG12 ILE A 79 2.998 2.731 6.060 1.00 10.00 H new ATOM 0 HG13 ILE A 79 4.389 3.708 5.631 1.00 10.00 H new ATOM 0 HG21 ILE A 79 3.703 0.347 4.367 1.00 10.00 H new ATOM 0 HG22 ILE A 79 4.687 -0.509 5.577 1.00 10.00 H new ATOM 0 HG23 ILE A 79 3.162 0.270 6.060 1.00 10.00 H new ATOM 0 HD11 ILE A 79 2.736 3.692 3.818 1.00 10.00 H new ATOM 0 HD12 ILE A 79 4.245 2.909 3.291 1.00 10.00 H new ATOM 0 HD13 ILE A 79 2.833 1.917 3.727 1.00 10.00 H new ATOM 1129 N GLN A 80 7.652 1.215 7.032 1.00 10.00 N ATOM 1130 CA GLN A 80 8.896 0.430 6.896 1.00 10.00 C ATOM 1131 C GLN A 80 9.325 -0.296 8.143 1.00 10.00 C ATOM 1132 O GLN A 80 10.162 -1.183 8.081 1.00 10.00 O ATOM 1133 CB GLN A 80 10.061 1.227 6.270 1.00 10.00 C ATOM 1134 CG GLN A 80 9.805 1.677 4.829 1.00 10.00 C ATOM 1135 CD GLN A 80 9.222 0.593 4.002 1.00 10.00 C ATOM 1136 OE1 GLN A 80 9.925 -0.210 3.412 1.00 10.00 O ATOM 1137 NE2 GLN A 80 7.922 0.587 3.917 1.00 10.00 N ATOM 0 H GLN A 80 7.791 2.222 6.949 1.00 10.00 H new ATOM 0 HA GLN A 80 8.624 -0.350 6.185 1.00 10.00 H new ATOM 0 HB2 GLN A 80 10.258 2.106 6.884 1.00 10.00 H new ATOM 0 HB3 GLN A 80 10.961 0.613 6.293 1.00 10.00 H new ATOM 0 HG2 GLN A 80 9.131 2.533 4.831 1.00 10.00 H new ATOM 0 HG3 GLN A 80 10.742 2.010 4.382 1.00 10.00 H new ATOM 0 HE21 GLN A 80 7.374 1.279 4.429 1.00 10.00 H new ATOM 0 HE22 GLN A 80 7.452 -0.109 3.339 1.00 10.00 H new ATOM 1146 N ARG A 81 8.759 0.071 9.276 1.00 10.00 N ATOM 1147 CA ARG A 81 8.973 -0.705 10.495 1.00 10.00 C ATOM 1148 C ARG A 81 8.402 -2.121 10.317 1.00 10.00 C ATOM 1149 O ARG A 81 8.916 -3.082 10.877 1.00 10.00 O ATOM 1150 CB ARG A 81 8.369 0.000 11.723 1.00 10.00 C ATOM 1151 CG ARG A 81 9.304 0.957 12.493 1.00 10.00 C ATOM 1152 CD ARG A 81 9.916 2.048 11.630 1.00 10.00 C ATOM 1153 NE ARG A 81 11.009 1.547 10.772 1.00 10.00 N ATOM 1154 CZ ARG A 81 11.600 2.220 9.775 1.00 10.00 C ATOM 1155 NH1 ARG A 81 11.285 3.486 9.533 1.00 10.00 N ATOM 1156 NH2 ARG A 81 12.522 1.618 9.032 1.00 10.00 N ATOM 0 H ARG A 81 8.156 0.887 9.385 1.00 10.00 H new ATOM 0 HA ARG A 81 10.045 -0.785 10.675 1.00 10.00 H new ATOM 0 HB2 ARG A 81 7.495 0.564 11.398 1.00 10.00 H new ATOM 0 HB3 ARG A 81 8.016 -0.764 12.416 1.00 10.00 H new ATOM 0 HG2 ARG A 81 8.744 1.421 13.305 1.00 10.00 H new ATOM 0 HG3 ARG A 81 10.105 0.376 12.950 1.00 10.00 H new ATOM 0 HD2 ARG A 81 9.140 2.489 11.004 1.00 10.00 H new ATOM 0 HD3 ARG A 81 10.298 2.842 12.271 1.00 10.00 H new ATOM 0 HE ARG A 81 11.345 0.602 10.955 1.00 10.00 H new ATOM 0 HH11 ARG A 81 10.587 3.957 10.108 1.00 10.00 H new ATOM 0 HH12 ARG A 81 11.741 3.988 8.772 1.00 10.00 H new ATOM 0 HH21 ARG A 81 12.777 0.649 9.222 1.00 10.00 H new ATOM 0 HH22 ARG A 81 12.975 2.125 8.272 1.00 10.00 H new ATOM 1170 N ASP A 82 7.379 -2.211 9.457 1.00 10.00 N ATOM 1171 CA ASP A 82 6.692 -3.452 9.077 1.00 10.00 C ATOM 1172 C ASP A 82 6.046 -4.268 10.173 1.00 10.00 C ATOM 1173 O ASP A 82 6.571 -4.445 11.267 1.00 10.00 O ATOM 1174 CB ASP A 82 7.382 -4.264 7.970 1.00 10.00 C ATOM 1175 CG ASP A 82 6.981 -5.715 7.923 1.00 10.00 C ATOM 1176 OD1 ASP A 82 5.819 -5.991 7.623 1.00 10.00 O ATOM 1177 OD2 ASP A 82 7.821 -6.586 8.180 1.00 10.00 O ATOM 0 H ASP A 82 6.993 -1.391 8.989 1.00 10.00 H new ATOM 0 HA ASP A 82 5.801 -3.046 8.598 1.00 10.00 H new ATOM 0 HB2 ASP A 82 7.158 -3.806 7.007 1.00 10.00 H new ATOM 0 HB3 ASP A 82 8.461 -4.202 8.109 1.00 10.00 H new ATOM 1182 N ARG A 83 4.880 -4.773 9.823 1.00 10.00 N ATOM 1183 CA ARG A 83 3.947 -5.386 10.745 1.00 10.00 C ATOM 1184 C ARG A 83 2.737 -5.931 9.982 1.00 10.00 C ATOM 1185 O ARG A 83 2.343 -7.076 10.161 1.00 10.00 O ATOM 1186 CB ARG A 83 3.532 -4.348 11.809 1.00 10.00 C ATOM 1187 CG ARG A 83 3.349 -2.952 11.229 1.00 10.00 C ATOM 1188 CD ARG A 83 3.166 -1.914 12.302 1.00 10.00 C ATOM 1189 NE ARG A 83 3.194 -0.573 11.731 1.00 10.00 N ATOM 1190 CZ ARG A 83 2.756 0.523 12.337 1.00 10.00 C ATOM 1191 NH1 ARG A 83 2.246 0.461 13.565 1.00 10.00 N ATOM 1192 NH2 ARG A 83 2.850 1.675 11.712 1.00 10.00 N ATOM 0 H ARG A 83 4.546 -4.768 8.859 1.00 10.00 H new ATOM 0 HA ARG A 83 4.419 -6.228 11.252 1.00 10.00 H new ATOM 0 HB2 ARG A 83 2.601 -4.667 12.278 1.00 10.00 H new ATOM 0 HB3 ARG A 83 4.289 -4.315 12.593 1.00 10.00 H new ATOM 0 HG2 ARG A 83 4.217 -2.696 10.621 1.00 10.00 H new ATOM 0 HG3 ARG A 83 2.483 -2.945 10.567 1.00 10.00 H new ATOM 0 HD2 ARG A 83 2.218 -2.077 12.815 1.00 10.00 H new ATOM 0 HD3 ARG A 83 3.953 -2.013 13.049 1.00 10.00 H new ATOM 0 HE ARG A 83 3.580 -0.469 10.793 1.00 10.00 H new ATOM 0 HH11 ARG A 83 2.189 -0.435 14.049 1.00 10.00 H new ATOM 0 HH12 ARG A 83 1.912 1.310 14.022 1.00 10.00 H new ATOM 0 HH21 ARG A 83 3.254 1.716 10.777 1.00 10.00 H new ATOM 0 HH22 ARG A 83 2.518 2.528 12.162 1.00 10.00 H new ATOM 1206 N ARG A 84 2.178 -5.115 9.095 1.00 10.00 N ATOM 1207 CA ARG A 84 0.999 -5.513 8.313 1.00 10.00 C ATOM 1208 C ARG A 84 1.391 -6.067 6.925 1.00 10.00 C ATOM 1209 O ARG A 84 0.581 -6.059 6.021 1.00 10.00 O ATOM 1210 CB ARG A 84 0.015 -4.337 8.079 1.00 10.00 C ATOM 1211 CG ARG A 84 -0.867 -3.832 9.243 1.00 10.00 C ATOM 1212 CD ARG A 84 -0.110 -3.178 10.367 1.00 10.00 C ATOM 1213 NE ARG A 84 -1.016 -2.502 11.314 1.00 10.00 N ATOM 1214 CZ ARG A 84 -0.974 -2.607 12.643 1.00 10.00 C ATOM 1215 NH1 ARG A 84 -0.282 -3.584 13.220 1.00 10.00 N ATOM 1216 NH2 ARG A 84 -1.724 -1.804 13.376 1.00 10.00 N ATOM 0 H ARG A 84 2.517 -4.174 8.895 1.00 10.00 H new ATOM 0 HA ARG A 84 0.513 -6.286 8.909 1.00 10.00 H new ATOM 0 HB2 ARG A 84 0.600 -3.489 7.723 1.00 10.00 H new ATOM 0 HB3 ARG A 84 -0.652 -4.628 7.268 1.00 10.00 H new ATOM 0 HG2 ARG A 84 -1.592 -3.120 8.849 1.00 10.00 H new ATOM 0 HG3 ARG A 84 -1.432 -4.673 9.645 1.00 10.00 H new ATOM 0 HD2 ARG A 84 0.476 -3.929 10.897 1.00 10.00 H new ATOM 0 HD3 ARG A 84 0.595 -2.454 9.958 1.00 10.00 H new ATOM 0 HE ARG A 84 -1.739 -1.901 10.918 1.00 10.00 H new ATOM 0 HH11 ARG A 84 0.222 -4.260 12.646 1.00 10.00 H new ATOM 0 HH12 ARG A 84 -0.255 -3.658 14.237 1.00 10.00 H new ATOM 0 HH21 ARG A 84 -2.325 -1.115 12.925 1.00 10.00 H new ATOM 0 HH22 ARG A 84 -1.702 -1.873 14.393 1.00 10.00 H new ATOM 1230 N HIS A 85 2.617 -6.557 6.757 1.00 10.00 N ATOM 1231 CA HIS A 85 3.067 -7.090 5.481 1.00 10.00 C ATOM 1232 C HIS A 85 4.344 -7.858 5.663 1.00 10.00 C ATOM 1233 O HIS A 85 4.625 -8.315 6.759 1.00 10.00 O ATOM 1234 CB HIS A 85 3.158 -6.015 4.339 1.00 10.00 C ATOM 1235 CG HIS A 85 3.922 -4.745 4.605 1.00 10.00 C ATOM 1236 ND1 HIS A 85 3.689 -3.596 3.898 1.00 10.00 N ATOM 1237 CD2 HIS A 85 4.881 -4.419 5.500 1.00 10.00 C ATOM 1238 CE1 HIS A 85 4.455 -2.657 4.351 1.00 10.00 C ATOM 1239 NE2 HIS A 85 5.174 -3.127 5.327 1.00 10.00 N ATOM 0 H HIS A 85 3.318 -6.594 7.497 1.00 10.00 H new ATOM 0 HA HIS A 85 2.299 -7.781 5.133 1.00 10.00 H new ATOM 0 HB2 HIS A 85 3.605 -6.494 3.468 1.00 10.00 H new ATOM 0 HB3 HIS A 85 2.141 -5.738 4.063 1.00 10.00 H new ATOM 0 HD2 HIS A 85 5.329 -5.083 6.224 1.00 10.00 H new ATOM 0 HE1 HIS A 85 4.491 -1.644 3.978 1.00 10.00 H new ATOM 0 HE2 HIS A 85 5.852 -2.595 5.873 1.00 10.00 H new ATOM 1248 N SER A 86 5.054 -8.072 4.606 1.00 10.00 N ATOM 1249 CA SER A 86 6.271 -8.779 4.652 1.00 10.00 C ATOM 1250 C SER A 86 7.345 -8.183 3.737 1.00 10.00 C ATOM 1251 O SER A 86 7.132 -7.992 2.539 1.00 10.00 O ATOM 1252 CB SER A 86 5.979 -10.173 4.308 1.00 10.00 C ATOM 1253 OG SER A 86 5.290 -10.822 5.338 1.00 10.00 O ATOM 0 H SER A 86 4.792 -7.751 3.674 1.00 10.00 H new ATOM 0 HA SER A 86 6.691 -8.709 5.655 1.00 10.00 H new ATOM 0 HB2 SER A 86 5.386 -10.207 3.394 1.00 10.00 H new ATOM 0 HB3 SER A 86 6.910 -10.701 4.103 1.00 10.00 H new ATOM 0 HG SER A 86 5.385 -11.792 5.235 1.00 10.00 H new ATOM 1259 N ASN A 87 8.462 -7.832 4.342 1.00 10.00 N ATOM 1260 CA ASN A 87 9.706 -7.317 3.676 1.00 10.00 C ATOM 1261 C ASN A 87 9.682 -5.896 3.214 1.00 10.00 C ATOM 1262 O ASN A 87 10.650 -5.171 3.397 1.00 10.00 O ATOM 1263 CB ASN A 87 10.311 -8.255 2.604 1.00 10.00 C ATOM 1264 CG ASN A 87 11.017 -9.473 3.170 1.00 10.00 C ATOM 1265 OD1 ASN A 87 12.219 -9.432 3.445 1.00 10.00 O ATOM 1266 ND2 ASN A 87 10.310 -10.574 3.304 1.00 10.00 N ATOM 0 H ASN A 87 8.562 -7.889 5.355 1.00 10.00 H new ATOM 0 HA ASN A 87 10.393 -7.320 4.522 1.00 10.00 H new ATOM 0 HB2 ASN A 87 9.515 -8.587 1.937 1.00 10.00 H new ATOM 0 HB3 ASN A 87 11.018 -7.688 1.998 1.00 10.00 H new ATOM 0 HD21 ASN A 87 10.754 -11.427 3.644 1.00 10.00 H new ATOM 0 HD22 ASN A 87 9.318 -10.575 3.068 1.00 10.00 H new ATOM 1273 N VAL A 88 8.585 -5.524 2.690 1.00 10.00 N ATOM 1274 CA VAL A 88 8.323 -4.259 2.053 1.00 10.00 C ATOM 1275 C VAL A 88 9.499 -3.581 1.351 1.00 10.00 C ATOM 1276 O VAL A 88 10.203 -2.744 1.908 1.00 10.00 O ATOM 1277 CB VAL A 88 7.454 -3.318 2.892 1.00 10.00 C ATOM 1278 CG1 VAL A 88 8.061 -2.932 4.192 1.00 10.00 C ATOM 1279 CG2 VAL A 88 7.029 -2.115 2.136 1.00 10.00 C ATOM 0 H VAL A 88 7.766 -6.132 2.684 1.00 10.00 H new ATOM 0 HA VAL A 88 7.707 -4.548 1.201 1.00 10.00 H new ATOM 0 HB VAL A 88 6.567 -3.905 3.127 1.00 10.00 H new ATOM 0 HG11 VAL A 88 7.384 -2.265 4.726 1.00 10.00 H new ATOM 0 HG12 VAL A 88 8.237 -3.826 4.791 1.00 10.00 H new ATOM 0 HG13 VAL A 88 9.008 -2.422 4.014 1.00 10.00 H new ATOM 0 HG21 VAL A 88 6.415 -1.481 2.776 1.00 10.00 H new ATOM 0 HG22 VAL A 88 7.909 -1.560 1.811 1.00 10.00 H new ATOM 0 HG23 VAL A 88 6.450 -2.419 1.264 1.00 10.00 H new ATOM 1289 N GLU A 89 9.690 -3.954 0.138 1.00 10.00 N ATOM 1290 CA GLU A 89 10.741 -3.431 -0.656 1.00 10.00 C ATOM 1291 C GLU A 89 10.227 -2.382 -1.574 1.00 10.00 C ATOM 1292 O GLU A 89 9.703 -2.692 -2.644 1.00 10.00 O ATOM 1293 CB GLU A 89 11.373 -4.541 -1.437 1.00 10.00 C ATOM 1294 CG GLU A 89 12.162 -5.468 -0.585 1.00 10.00 C ATOM 1295 CD GLU A 89 12.482 -6.747 -1.273 1.00 10.00 C ATOM 1296 OE1 GLU A 89 11.632 -7.647 -1.277 1.00 10.00 O ATOM 1297 OE2 GLU A 89 13.587 -6.891 -1.832 1.00 10.00 O ATOM 0 H GLU A 89 9.110 -4.644 -0.339 1.00 10.00 H new ATOM 0 HA GLU A 89 11.488 -2.977 -0.005 1.00 10.00 H new ATOM 0 HB2 GLU A 89 10.596 -5.103 -1.955 1.00 10.00 H new ATOM 0 HB3 GLU A 89 12.023 -4.116 -2.202 1.00 10.00 H new ATOM 0 HG2 GLU A 89 13.089 -4.979 -0.285 1.00 10.00 H new ATOM 0 HG3 GLU A 89 11.604 -5.680 0.327 1.00 10.00 H new ATOM 1304 N ILE A 90 10.231 -1.162 -1.073 1.00 10.00 N ATOM 1305 CA ILE A 90 9.951 0.038 -1.859 1.00 10.00 C ATOM 1306 C ILE A 90 10.734 -0.069 -3.125 1.00 10.00 C ATOM 1307 O ILE A 90 10.206 -0.397 -4.160 1.00 10.00 O ATOM 1308 CB ILE A 90 10.356 1.343 -1.086 1.00 10.00 C ATOM 1309 CG1 ILE A 90 10.035 1.236 0.395 1.00 10.00 C ATOM 1310 CG2 ILE A 90 9.664 2.583 -1.650 1.00 10.00 C ATOM 1311 CD1 ILE A 90 8.597 0.979 0.683 1.00 10.00 C ATOM 0 H ILE A 90 10.432 -0.967 -0.092 1.00 10.00 H new ATOM 0 HA ILE A 90 8.882 0.105 -2.059 1.00 10.00 H new ATOM 0 HB ILE A 90 11.433 1.448 -1.218 1.00 10.00 H new ATOM 0 HG12 ILE A 90 10.632 0.434 0.829 1.00 10.00 H new ATOM 0 HG13 ILE A 90 10.335 2.160 0.890 1.00 10.00 H new ATOM 0 HG21 ILE A 90 9.974 3.462 -1.084 1.00 10.00 H new ATOM 0 HG22 ILE A 90 9.940 2.709 -2.697 1.00 10.00 H new ATOM 0 HG23 ILE A 90 8.583 2.464 -1.572 1.00 10.00 H new ATOM 0 HD11 ILE A 90 8.447 0.916 1.761 1.00 10.00 H new ATOM 0 HD12 ILE A 90 7.994 1.793 0.280 1.00 10.00 H new ATOM 0 HD13 ILE A 90 8.295 0.040 0.219 1.00 10.00 H new ATOM 1323 N LEU A 91 11.996 0.129 -2.999 1.00 10.00 N ATOM 1324 CA LEU A 91 13.004 0.017 -4.058 1.00 10.00 C ATOM 1325 C LEU A 91 12.815 1.019 -5.194 1.00 10.00 C ATOM 1326 O LEU A 91 13.770 1.352 -5.901 1.00 10.00 O ATOM 1327 CB LEU A 91 13.108 -1.419 -4.595 1.00 10.00 C ATOM 1328 CG LEU A 91 13.550 -2.491 -3.588 1.00 10.00 C ATOM 1329 CD1 LEU A 91 13.585 -3.840 -4.259 1.00 10.00 C ATOM 1330 CD2 LEU A 91 14.922 -2.163 -3.028 1.00 10.00 C ATOM 0 H LEU A 91 12.407 0.393 -2.103 1.00 10.00 H new ATOM 0 HA LEU A 91 13.952 0.274 -3.585 1.00 10.00 H new ATOM 0 HB2 LEU A 91 12.136 -1.706 -4.996 1.00 10.00 H new ATOM 0 HB3 LEU A 91 13.810 -1.423 -5.429 1.00 10.00 H new ATOM 0 HG LEU A 91 12.833 -2.512 -2.767 1.00 10.00 H new ATOM 0 HD11 LEU A 91 13.899 -4.596 -3.540 1.00 10.00 H new ATOM 0 HD12 LEU A 91 12.591 -4.086 -4.633 1.00 10.00 H new ATOM 0 HD13 LEU A 91 14.290 -3.815 -5.090 1.00 10.00 H new ATOM 0 HD21 LEU A 91 15.218 -2.934 -2.316 1.00 10.00 H new ATOM 0 HD22 LEU A 91 15.647 -2.122 -3.841 1.00 10.00 H new ATOM 0 HD23 LEU A 91 14.888 -1.197 -2.524 1.00 10.00 H new ATOM 1342 N ALA A 92 11.617 1.491 -5.371 1.00 10.00 N ATOM 1343 CA ALA A 92 11.341 2.426 -6.407 1.00 10.00 C ATOM 1344 C ALA A 92 10.744 3.656 -5.824 1.00 10.00 C ATOM 1345 O ALA A 92 9.645 3.615 -5.281 1.00 10.00 O ATOM 1346 CB ALA A 92 10.387 1.825 -7.417 1.00 10.00 C ATOM 0 H ALA A 92 10.810 1.237 -4.801 1.00 10.00 H new ATOM 0 HA ALA A 92 12.274 2.678 -6.912 1.00 10.00 H new ATOM 0 HB1 ALA A 92 10.185 2.552 -8.204 1.00 10.00 H new ATOM 0 HB2 ALA A 92 10.835 0.932 -7.854 1.00 10.00 H new ATOM 0 HB3 ALA A 92 9.454 1.558 -6.922 1.00 10.00 H new ATOM 1352 N GLU A 93 11.461 4.726 -5.898 1.00 10.00 N ATOM 1353 CA GLU A 93 10.967 5.991 -5.466 1.00 10.00 C ATOM 1354 C GLU A 93 11.276 6.965 -6.570 1.00 10.00 C ATOM 1355 O GLU A 93 12.439 7.271 -6.842 1.00 10.00 O ATOM 1356 CB GLU A 93 11.628 6.416 -4.151 1.00 10.00 C ATOM 1357 CG GLU A 93 11.514 5.397 -3.055 1.00 10.00 C ATOM 1358 CD GLU A 93 12.218 5.806 -1.801 1.00 10.00 C ATOM 1359 OE1 GLU A 93 13.450 5.574 -1.693 1.00 10.00 O ATOM 1360 OE2 GLU A 93 11.564 6.336 -0.881 1.00 10.00 O ATOM 0 H GLU A 93 12.413 4.748 -6.262 1.00 10.00 H new ATOM 0 HA GLU A 93 9.895 5.950 -5.271 1.00 10.00 H new ATOM 0 HB2 GLU A 93 12.683 6.620 -4.335 1.00 10.00 H new ATOM 0 HB3 GLU A 93 11.177 7.349 -3.814 1.00 10.00 H new ATOM 0 HG2 GLU A 93 10.460 5.225 -2.834 1.00 10.00 H new ATOM 0 HG3 GLU A 93 11.925 4.449 -3.403 1.00 10.00 H new ATOM 1367 N GLU A 94 10.262 7.411 -7.227 1.00 10.00 N ATOM 1368 CA GLU A 94 10.424 8.275 -8.359 1.00 10.00 C ATOM 1369 C GLU A 94 9.745 9.586 -8.107 1.00 10.00 C ATOM 1370 O GLU A 94 8.737 9.639 -7.415 1.00 10.00 O ATOM 1371 CB GLU A 94 9.881 7.604 -9.629 1.00 10.00 C ATOM 1372 CG GLU A 94 8.447 7.096 -9.515 1.00 10.00 C ATOM 1373 CD GLU A 94 7.923 6.534 -10.810 1.00 10.00 C ATOM 1374 OE1 GLU A 94 7.739 7.306 -11.782 1.00 10.00 O ATOM 1375 OE2 GLU A 94 7.661 5.311 -10.883 1.00 10.00 O ATOM 0 H GLU A 94 9.293 7.190 -6.999 1.00 10.00 H new ATOM 0 HA GLU A 94 11.487 8.465 -8.510 1.00 10.00 H new ATOM 0 HB2 GLU A 94 9.936 8.316 -10.452 1.00 10.00 H new ATOM 0 HB3 GLU A 94 10.530 6.767 -9.888 1.00 10.00 H new ATOM 0 HG2 GLU A 94 8.399 6.327 -8.744 1.00 10.00 H new ATOM 0 HG3 GLU A 94 7.802 7.912 -9.191 1.00 10.00 H new ATOM 1382 N SER A 95 10.300 10.640 -8.622 1.00 10.00 N ATOM 1383 CA SER A 95 9.707 11.919 -8.473 1.00 10.00 C ATOM 1384 C SER A 95 8.590 12.057 -9.487 1.00 10.00 C ATOM 1385 O SER A 95 8.802 11.919 -10.690 1.00 10.00 O ATOM 1386 CB SER A 95 10.745 13.025 -8.618 1.00 10.00 C ATOM 1387 OG SER A 95 10.169 14.318 -8.398 1.00 10.00 O ATOM 0 H SER A 95 11.171 10.631 -9.153 1.00 10.00 H new ATOM 0 HA SER A 95 9.290 12.017 -7.471 1.00 10.00 H new ATOM 0 HB2 SER A 95 11.555 12.861 -7.907 1.00 10.00 H new ATOM 0 HB3 SER A 95 11.183 12.986 -9.615 1.00 10.00 H new ATOM 0 HG SER A 95 9.343 14.224 -7.878 1.00 10.00 H new ATOM 1393 N ILE A 96 7.412 12.289 -9.003 1.00 10.00 N ATOM 1394 CA ILE A 96 6.259 12.387 -9.858 1.00 10.00 C ATOM 1395 C ILE A 96 5.624 13.750 -9.857 1.00 10.00 C ATOM 1396 O ILE A 96 6.006 14.630 -9.097 1.00 10.00 O ATOM 1397 CB ILE A 96 5.184 11.388 -9.506 1.00 10.00 C ATOM 1398 CG1 ILE A 96 4.816 11.499 -8.046 1.00 10.00 C ATOM 1399 CG2 ILE A 96 5.620 9.976 -9.897 1.00 10.00 C ATOM 1400 CD1 ILE A 96 3.478 10.962 -7.700 1.00 10.00 C ATOM 0 H ILE A 96 7.216 12.416 -8.010 1.00 10.00 H new ATOM 0 HA ILE A 96 6.658 12.176 -10.850 1.00 10.00 H new ATOM 0 HB ILE A 96 4.283 11.613 -10.077 1.00 10.00 H new ATOM 0 HG12 ILE A 96 5.567 10.974 -7.456 1.00 10.00 H new ATOM 0 HG13 ILE A 96 4.858 12.548 -7.754 1.00 10.00 H new ATOM 0 HG21 ILE A 96 4.834 9.267 -9.637 1.00 10.00 H new ATOM 0 HG22 ILE A 96 5.803 9.936 -10.971 1.00 10.00 H new ATOM 0 HG23 ILE A 96 6.534 9.716 -9.363 1.00 10.00 H new ATOM 0 HD11 ILE A 96 3.302 11.085 -6.631 1.00 10.00 H new ATOM 0 HD12 ILE A 96 2.714 11.502 -8.258 1.00 10.00 H new ATOM 0 HD13 ILE A 96 3.434 9.903 -7.955 1.00 10.00 H new ATOM 1412 N ALA A 97 4.639 13.904 -10.712 1.00 10.00 N ATOM 1413 CA ALA A 97 3.851 15.117 -10.774 1.00 10.00 C ATOM 1414 C ALA A 97 2.515 14.861 -10.204 1.00 10.00 C ATOM 1415 O ALA A 97 1.652 15.753 -10.126 1.00 10.00 O ATOM 1416 CB ALA A 97 3.703 15.588 -12.155 1.00 10.00 C ATOM 0 H ALA A 97 4.360 13.191 -11.386 1.00 10.00 H new ATOM 0 HA ALA A 97 4.367 15.888 -10.202 1.00 10.00 H new ATOM 0 HB1 ALA A 97 3.106 16.500 -12.166 1.00 10.00 H new ATOM 0 HB2 ALA A 97 4.687 15.793 -12.577 1.00 10.00 H new ATOM 0 HB3 ALA A 97 3.206 14.822 -12.749 1.00 10.00 H new ATOM 1422 N LYS A 98 2.384 13.646 -9.787 1.00 10.00 N ATOM 1423 CA LYS A 98 1.244 13.101 -9.207 1.00 10.00 C ATOM 1424 C LYS A 98 0.050 13.233 -10.145 1.00 10.00 C ATOM 1425 O LYS A 98 0.239 13.288 -11.375 1.00 10.00 O ATOM 1426 CB LYS A 98 1.117 13.805 -7.910 1.00 10.00 C ATOM 1427 CG LYS A 98 0.282 13.174 -6.931 1.00 10.00 C ATOM 1428 CD LYS A 98 -0.775 14.065 -6.410 1.00 10.00 C ATOM 1429 CE LYS A 98 -0.394 14.485 -5.066 1.00 10.00 C ATOM 1430 NZ LYS A 98 -1.453 15.276 -4.392 1.00 10.00 N ATOM 0 H LYS A 98 3.144 12.970 -9.858 1.00 10.00 H new ATOM 0 HA LYS A 98 1.299 12.027 -9.030 1.00 10.00 H new ATOM 0 HB2 LYS A 98 2.114 13.925 -7.485 1.00 10.00 H new ATOM 0 HB3 LYS A 98 0.729 14.806 -8.099 1.00 10.00 H new ATOM 0 HG2 LYS A 98 -0.180 12.291 -7.371 1.00 10.00 H new ATOM 0 HG3 LYS A 98 0.900 12.830 -6.102 1.00 10.00 H new ATOM 0 HD2 LYS A 98 -0.896 14.932 -7.059 1.00 10.00 H new ATOM 0 HD3 LYS A 98 -1.733 13.546 -6.389 1.00 10.00 H new ATOM 0 HE2 LYS A 98 -0.166 13.604 -4.465 1.00 10.00 H new ATOM 0 HE3 LYS A 98 0.518 15.079 -5.120 1.00 10.00 H new ATOM 0 HZ1 LYS A 98 -1.510 14.998 -3.391 1.00 10.00 H new ATOM 0 HZ2 LYS A 98 -1.225 16.289 -4.457 1.00 10.00 H new ATOM 0 HZ3 LYS A 98 -2.367 15.097 -4.854 1.00 10.00 H new ATOM 1444 N ARG A 99 -1.149 13.169 -9.578 1.00 10.00 N ATOM 1445 CA ARG A 99 -2.416 13.397 -10.288 1.00 10.00 C ATOM 1446 C ARG A 99 -2.791 12.155 -11.065 1.00 10.00 C ATOM 1447 O ARG A 99 -3.496 12.216 -12.057 1.00 10.00 O ATOM 1448 CB ARG A 99 -2.296 14.635 -11.212 1.00 10.00 C ATOM 1449 CG ARG A 99 -1.907 15.917 -10.487 1.00 10.00 C ATOM 1450 CD ARG A 99 -1.147 16.849 -11.418 1.00 10.00 C ATOM 1451 NE ARG A 99 -1.959 17.343 -12.531 1.00 10.00 N ATOM 1452 CZ ARG A 99 -1.552 17.425 -13.803 1.00 10.00 C ATOM 1453 NH1 ARG A 99 -0.425 16.819 -14.205 1.00 10.00 N ATOM 1454 NH2 ARG A 99 -2.287 18.081 -14.674 1.00 10.00 N ATOM 0 H ARG A 99 -1.277 12.953 -8.590 1.00 10.00 H new ATOM 0 HA ARG A 99 -3.209 13.601 -9.568 1.00 10.00 H new ATOM 0 HB2 ARG A 99 -1.555 14.428 -11.984 1.00 10.00 H new ATOM 0 HB3 ARG A 99 -3.249 14.791 -11.718 1.00 10.00 H new ATOM 0 HG2 ARG A 99 -2.801 16.416 -10.115 1.00 10.00 H new ATOM 0 HG3 ARG A 99 -1.291 15.678 -9.620 1.00 10.00 H new ATOM 0 HD2 ARG A 99 -0.773 17.698 -10.845 1.00 10.00 H new ATOM 0 HD3 ARG A 99 -0.278 16.325 -11.816 1.00 10.00 H new ATOM 0 HE ARG A 99 -2.909 17.649 -12.321 1.00 10.00 H new ATOM 0 HH11 ARG A 99 0.134 16.287 -13.538 1.00 10.00 H new ATOM 0 HH12 ARG A 99 -0.127 16.890 -15.178 1.00 10.00 H new ATOM 0 HH21 ARG A 99 -3.158 18.521 -14.377 1.00 10.00 H new ATOM 0 HH22 ARG A 99 -1.986 18.150 -15.646 1.00 10.00 H new ATOM 1468 N ARG A 100 -2.350 11.027 -10.571 1.00 10.00 N ATOM 1469 CA ARG A 100 -2.600 9.775 -11.223 1.00 10.00 C ATOM 1470 C ARG A 100 -3.855 9.104 -10.655 1.00 10.00 C ATOM 1471 O ARG A 100 -4.763 8.753 -11.411 1.00 10.00 O ATOM 1472 CB ARG A 100 -1.362 8.896 -11.086 1.00 10.00 C ATOM 1473 CG ARG A 100 -0.123 9.580 -11.655 1.00 10.00 C ATOM 1474 CD ARG A 100 1.163 9.000 -11.114 1.00 10.00 C ATOM 1475 NE ARG A 100 1.400 7.615 -11.508 1.00 10.00 N ATOM 1476 CZ ARG A 100 2.306 6.829 -10.925 1.00 10.00 C ATOM 1477 NH1 ARG A 100 2.905 7.216 -9.793 1.00 10.00 N ATOM 1478 NH2 ARG A 100 2.569 5.642 -11.421 1.00 10.00 N ATOM 0 H ARG A 100 -1.810 10.954 -9.709 1.00 10.00 H new ATOM 0 HA ARG A 100 -2.794 9.938 -12.283 1.00 10.00 H new ATOM 0 HB2 ARG A 100 -1.197 8.659 -10.035 1.00 10.00 H new ATOM 0 HB3 ARG A 100 -1.527 7.951 -11.603 1.00 10.00 H new ATOM 0 HG2 ARG A 100 -0.129 9.489 -12.741 1.00 10.00 H new ATOM 0 HG3 ARG A 100 -0.162 10.645 -11.424 1.00 10.00 H new ATOM 0 HD2 ARG A 100 1.998 9.612 -11.455 1.00 10.00 H new ATOM 0 HD3 ARG A 100 1.147 9.060 -10.026 1.00 10.00 H new ATOM 0 HE ARG A 100 0.843 7.228 -12.270 1.00 10.00 H new ATOM 0 HH11 ARG A 100 2.669 8.115 -9.373 1.00 10.00 H new ATOM 0 HH12 ARG A 100 3.597 6.612 -9.350 1.00 10.00 H new ATOM 0 HH21 ARG A 100 2.080 5.318 -12.255 1.00 10.00 H new ATOM 0 HH22 ARG A 100 3.263 5.044 -10.972 1.00 10.00 H new ATOM 1492 N PHE A 101 -3.946 8.956 -9.332 1.00 10.00 N ATOM 1493 CA PHE A 101 -5.123 8.277 -8.762 1.00 10.00 C ATOM 1494 C PHE A 101 -6.039 9.163 -7.970 1.00 10.00 C ATOM 1495 O PHE A 101 -7.160 8.770 -7.639 1.00 10.00 O ATOM 1496 CB PHE A 101 -4.774 6.982 -8.020 1.00 10.00 C ATOM 1497 CG PHE A 101 -4.534 5.823 -8.942 1.00 10.00 C ATOM 1498 CD1 PHE A 101 -3.411 5.773 -9.740 1.00 10.00 C ATOM 1499 CD2 PHE A 101 -5.456 4.794 -9.026 1.00 10.00 C ATOM 1500 CE1 PHE A 101 -3.207 4.720 -10.599 1.00 10.00 C ATOM 1501 CE2 PHE A 101 -5.257 3.735 -9.887 1.00 10.00 C ATOM 1502 CZ PHE A 101 -4.129 3.699 -10.676 1.00 10.00 C ATOM 0 H PHE A 101 -3.254 9.279 -8.656 1.00 10.00 H new ATOM 0 HA PHE A 101 -5.705 7.988 -9.637 1.00 10.00 H new ATOM 0 HB2 PHE A 101 -3.884 7.146 -7.413 1.00 10.00 H new ATOM 0 HB3 PHE A 101 -5.585 6.732 -7.335 1.00 10.00 H new ATOM 0 HD1 PHE A 101 -2.684 6.570 -9.690 1.00 10.00 H new ATOM 0 HD2 PHE A 101 -6.342 4.821 -8.410 1.00 10.00 H new ATOM 0 HE1 PHE A 101 -2.321 4.693 -11.216 1.00 10.00 H new ATOM 0 HE2 PHE A 101 -5.983 2.937 -9.942 1.00 10.00 H new ATOM 0 HZ PHE A 101 -3.968 2.873 -11.353 1.00 10.00 H new ATOM 1512 N ALA A 102 -5.550 10.329 -7.653 1.00 10.00 N ATOM 1513 CA ALA A 102 -6.292 11.409 -6.916 1.00 10.00 C ATOM 1514 C ALA A 102 -6.730 11.049 -5.467 1.00 10.00 C ATOM 1515 O ALA A 102 -7.089 11.928 -4.680 1.00 10.00 O ATOM 1516 CB ALA A 102 -7.450 11.969 -7.734 1.00 10.00 C ATOM 0 H ALA A 102 -4.596 10.599 -7.891 1.00 10.00 H new ATOM 0 HA ALA A 102 -5.551 12.197 -6.787 1.00 10.00 H new ATOM 0 HB1 ALA A 102 -7.957 12.746 -7.162 1.00 10.00 H new ATOM 0 HB2 ALA A 102 -7.068 12.393 -8.663 1.00 10.00 H new ATOM 0 HB3 ALA A 102 -8.154 11.169 -7.963 1.00 10.00 H new ATOM 1522 N GLY A 103 -6.734 9.805 -5.149 1.00 10.00 N ATOM 1523 CA GLY A 103 -6.965 9.347 -3.805 1.00 10.00 C ATOM 1524 C GLY A 103 -6.271 8.041 -3.644 1.00 10.00 C ATOM 1525 O GLY A 103 -5.886 7.464 -4.648 1.00 10.00 O ATOM 0 H GLY A 103 -6.575 9.053 -5.820 1.00 10.00 H new ATOM 0 HA2 GLY A 103 -6.587 10.072 -3.084 1.00 10.00 H new ATOM 0 HA3 GLY A 103 -8.033 9.238 -3.617 1.00 10.00 H new ATOM 1529 N TRP A 104 -6.052 7.586 -2.433 1.00 10.00 N ATOM 1530 CA TRP A 104 -5.456 6.280 -2.225 1.00 10.00 C ATOM 1531 C TRP A 104 -6.544 5.230 -2.298 1.00 10.00 C ATOM 1532 O TRP A 104 -7.642 5.441 -1.781 1.00 10.00 O ATOM 1533 CB TRP A 104 -4.624 6.232 -0.910 1.00 10.00 C ATOM 1534 CG TRP A 104 -4.169 4.866 -0.478 1.00 10.00 C ATOM 1535 CD1 TRP A 104 -2.952 4.272 -0.661 1.00 10.00 C ATOM 1536 CD2 TRP A 104 -4.957 3.937 0.236 1.00 10.00 C ATOM 1537 NE1 TRP A 104 -2.966 3.015 -0.114 1.00 10.00 N ATOM 1538 CE2 TRP A 104 -4.202 2.794 0.443 1.00 10.00 C ATOM 1539 CE3 TRP A 104 -6.250 3.979 0.707 1.00 10.00 C ATOM 1540 CZ2 TRP A 104 -4.727 1.703 1.112 1.00 10.00 C ATOM 1541 CZ3 TRP A 104 -6.761 2.962 1.339 1.00 10.00 C ATOM 1542 CH2 TRP A 104 -6.028 1.828 1.551 1.00 10.00 C ATOM 0 H TRP A 104 -6.275 8.095 -1.578 1.00 10.00 H new ATOM 0 HA TRP A 104 -4.736 6.067 -3.015 1.00 10.00 H new ATOM 0 HB2 TRP A 104 -3.746 6.865 -1.034 1.00 10.00 H new ATOM 0 HB3 TRP A 104 -5.220 6.667 -0.108 1.00 10.00 H new ATOM 0 HD1 TRP A 104 -2.108 4.724 -1.160 1.00 10.00 H new ATOM 0 HE1 TRP A 104 -2.189 2.354 -0.120 1.00 10.00 H new ATOM 0 HE3 TRP A 104 -6.847 4.865 0.550 1.00 10.00 H new ATOM 0 HZ2 TRP A 104 -4.151 0.805 1.281 1.00 10.00 H new ATOM 0 HZ3 TRP A 104 -7.777 3.015 1.700 1.00 10.00 H new ATOM 0 HH2 TRP A 104 -6.483 1.003 2.080 1.00 10.00 H new ATOM 1553 N HIS A 105 -6.265 4.132 -2.967 1.00 10.00 N ATOM 1554 CA HIS A 105 -7.254 3.109 -3.182 1.00 10.00 C ATOM 1555 C HIS A 105 -6.815 1.809 -2.580 1.00 10.00 C ATOM 1556 O HIS A 105 -5.634 1.482 -2.603 1.00 10.00 O ATOM 1557 CB HIS A 105 -7.465 2.920 -4.673 1.00 10.00 C ATOM 1558 CG HIS A 105 -8.136 4.061 -5.354 1.00 10.00 C ATOM 1559 ND1 HIS A 105 -7.446 5.119 -5.912 1.00 10.00 N ATOM 1560 CD2 HIS A 105 -9.440 4.305 -5.583 1.00 10.00 C ATOM 1561 CE1 HIS A 105 -8.306 5.956 -6.457 1.00 10.00 C ATOM 1562 NE2 HIS A 105 -9.518 5.484 -6.270 1.00 10.00 N ATOM 0 H HIS A 105 -5.352 3.928 -3.373 1.00 10.00 H new ATOM 0 HA HIS A 105 -8.184 3.420 -2.705 1.00 10.00 H new ATOM 0 HB2 HIS A 105 -6.497 2.751 -5.145 1.00 10.00 H new ATOM 0 HB3 HIS A 105 -8.059 2.020 -4.831 1.00 10.00 H new ATOM 0 HD1 HIS A 105 -6.433 5.234 -5.904 1.00 10.00 H new ATOM 0 HD2 HIS A 105 -10.270 3.684 -5.280 1.00 10.00 H new ATOM 0 HE1 HIS A 105 -8.057 6.873 -6.970 1.00 10.00 H new ATOM 1571 N MET A 106 -7.751 1.076 -2.053 1.00 10.00 N ATOM 1572 CA MET A 106 -7.469 -0.220 -1.515 1.00 10.00 C ATOM 1573 C MET A 106 -7.932 -1.237 -2.520 1.00 10.00 C ATOM 1574 O MET A 106 -8.931 -1.022 -3.196 1.00 10.00 O ATOM 1575 CB MET A 106 -8.166 -0.434 -0.152 1.00 10.00 C ATOM 1576 CG MET A 106 -7.875 -1.794 0.487 1.00 10.00 C ATOM 1577 SD MET A 106 -6.108 -2.153 0.500 1.00 10.00 S ATOM 1578 CE MET A 106 -6.012 -3.758 1.280 1.00 10.00 C ATOM 0 H MET A 106 -8.728 1.359 -1.984 1.00 10.00 H new ATOM 0 HA MET A 106 -6.399 -0.321 -1.333 1.00 10.00 H new ATOM 0 HB2 MET A 106 -7.851 0.353 0.533 1.00 10.00 H new ATOM 0 HB3 MET A 106 -9.243 -0.329 -0.285 1.00 10.00 H new ATOM 0 HG2 MET A 106 -8.258 -1.807 1.508 1.00 10.00 H new ATOM 0 HG3 MET A 106 -8.402 -2.575 -0.061 1.00 10.00 H new ATOM 0 HE1 MET A 106 -5.408 -3.687 2.184 1.00 10.00 H new ATOM 0 HE2 MET A 106 -7.015 -4.097 1.539 1.00 10.00 H new ATOM 0 HE3 MET A 106 -5.555 -4.470 0.593 1.00 10.00 H new ATOM 1588 N GLN A 107 -7.198 -2.305 -2.678 1.00 10.00 N ATOM 1589 CA GLN A 107 -7.612 -3.315 -3.617 1.00 10.00 C ATOM 1590 C GLN A 107 -8.706 -4.157 -3.000 1.00 10.00 C ATOM 1591 O GLN A 107 -9.722 -4.464 -3.631 1.00 10.00 O ATOM 1592 CB GLN A 107 -6.440 -4.193 -4.067 1.00 10.00 C ATOM 1593 CG GLN A 107 -6.784 -5.138 -5.212 1.00 10.00 C ATOM 1594 CD GLN A 107 -7.113 -4.396 -6.510 1.00 10.00 C ATOM 1595 OE1 GLN A 107 -7.584 -3.265 -6.503 1.00 10.00 O ATOM 1596 NE2 GLN A 107 -6.887 -5.031 -7.618 1.00 10.00 N ATOM 0 H GLN A 107 -6.328 -2.498 -2.181 1.00 10.00 H new ATOM 0 HA GLN A 107 -7.994 -2.817 -4.508 1.00 10.00 H new ATOM 0 HB2 GLN A 107 -5.614 -3.551 -4.374 1.00 10.00 H new ATOM 0 HB3 GLN A 107 -6.090 -4.779 -3.217 1.00 10.00 H new ATOM 0 HG2 GLN A 107 -5.945 -5.812 -5.386 1.00 10.00 H new ATOM 0 HG3 GLN A 107 -7.635 -5.755 -4.925 1.00 10.00 H new ATOM 0 HE21 GLN A 107 -6.494 -5.972 -7.595 1.00 10.00 H new ATOM 0 HE22 GLN A 107 -7.102 -4.589 -8.512 1.00 10.00 H new ATOM 1605 N LEU A 108 -8.519 -4.497 -1.754 1.00 10.00 N ATOM 1606 CA LEU A 108 -9.486 -5.280 -1.044 1.00 10.00 C ATOM 1607 C LEU A 108 -10.374 -4.362 -0.244 1.00 10.00 C ATOM 1608 O LEU A 108 -10.215 -4.226 0.952 1.00 10.00 O ATOM 1609 CB LEU A 108 -8.845 -6.352 -0.117 1.00 10.00 C ATOM 1610 CG LEU A 108 -7.968 -7.448 -0.766 1.00 10.00 C ATOM 1611 CD1 LEU A 108 -8.701 -8.158 -1.877 1.00 10.00 C ATOM 1612 CD2 LEU A 108 -6.642 -6.903 -1.255 1.00 10.00 C ATOM 0 H LEU A 108 -7.697 -4.240 -1.208 1.00 10.00 H new ATOM 0 HA LEU A 108 -10.070 -5.827 -1.784 1.00 10.00 H new ATOM 0 HB2 LEU A 108 -8.235 -5.832 0.622 1.00 10.00 H new ATOM 0 HB3 LEU A 108 -9.650 -6.847 0.426 1.00 10.00 H new ATOM 0 HG LEU A 108 -7.751 -8.177 0.014 1.00 10.00 H new ATOM 0 HD11 LEU A 108 -8.054 -8.921 -2.310 1.00 10.00 H new ATOM 0 HD12 LEU A 108 -9.600 -8.628 -1.478 1.00 10.00 H new ATOM 0 HD13 LEU A 108 -8.979 -7.439 -2.647 1.00 10.00 H new ATOM 0 HD21 LEU A 108 -6.060 -7.709 -1.703 1.00 10.00 H new ATOM 0 HD22 LEU A 108 -6.820 -6.127 -1.999 1.00 10.00 H new ATOM 0 HD23 LEU A 108 -6.090 -6.481 -0.415 1.00 10.00 H new ATOM 1624 N SER A 109 -11.213 -3.636 -0.935 0.20 90.00 N ATOM 1625 CA SER A 109 -12.161 -2.767 -0.282 0.20 90.00 C ATOM 1626 C SER A 109 -13.297 -3.614 0.287 0.20 90.00 C ATOM 1627 O SER A 109 -13.706 -3.465 1.439 0.20 90.00 O ATOM 1628 CB SER A 109 -12.691 -1.782 -1.305 0.20 90.00 C ATOM 1629 OG SER A 109 -11.617 -1.195 -2.011 0.20 90.00 O ATOM 0 H SER A 109 -11.260 -3.628 -1.954 0.20 90.00 H new ATOM 0 HA SER A 109 -11.690 -2.219 0.534 0.20 90.00 H new ATOM 0 HB2 SER A 109 -13.359 -2.291 -2.000 0.20 90.00 H new ATOM 0 HB3 SER A 109 -13.277 -1.009 -0.808 0.20 90.00 H new ATOM 0 HG SER A 109 -11.967 -0.561 -2.671 0.20 90.00 H new ATOM 1635 N CYS A 110 -13.777 -4.505 -0.543 0.20 90.00 N ATOM 1636 CA CYS A 110 -14.818 -5.431 -0.177 0.20 90.00 C ATOM 1637 C CYS A 110 -14.290 -6.855 -0.297 0.20 90.00 C ATOM 1638 O CYS A 110 -14.927 -7.803 0.135 0.20 90.00 O ATOM 1639 CB CYS A 110 -15.974 -5.240 -1.147 0.20 90.00 C ATOM 1640 SG CYS A 110 -15.469 -5.410 -2.881 0.20 90.00 S ATOM 0 H CYS A 110 -13.452 -4.609 -1.504 0.20 90.00 H new ATOM 0 HA CYS A 110 -15.145 -5.255 0.848 0.20 90.00 H new ATOM 0 HB2 CYS A 110 -16.752 -5.970 -0.926 0.20 90.00 H new ATOM 0 HB3 CYS A 110 -16.411 -4.253 -0.995 0.20 90.00 H new ATOM 0 HG CYS A 110 -15.031 -6.616 -3.089 0.20 90.00 H new ATOM 1646 N SER A 111 -13.085 -6.966 -0.869 0.20 90.00 N ATOM 1647 CA SER A 111 -12.424 -8.234 -1.243 0.20 90.00 C ATOM 1648 C SER A 111 -13.281 -9.091 -2.204 0.20 90.00 C ATOM 1649 O SER A 111 -14.371 -8.676 -2.631 0.20 90.00 O ATOM 1650 CB SER A 111 -11.886 -9.038 -0.021 0.20 90.00 C ATOM 1651 OG SER A 111 -12.884 -9.363 0.926 0.20 90.00 O ATOM 0 H SER A 111 -12.518 -6.149 -1.095 0.20 90.00 H new ATOM 0 HA SER A 111 -11.536 -7.947 -1.806 0.20 90.00 H new ATOM 0 HB2 SER A 111 -11.422 -9.958 -0.378 0.20 90.00 H new ATOM 0 HB3 SER A 111 -11.106 -8.457 0.471 0.20 90.00 H new ATOM 0 HG SER A 111 -13.763 -9.112 0.574 0.20 90.00 H new ATOM 1657 N GLU A 112 -12.770 -10.242 -2.592 0.20 90.00 N ATOM 1658 CA GLU A 112 -13.487 -11.118 -3.503 0.20 90.00 C ATOM 1659 C GLU A 112 -13.759 -12.450 -2.828 0.20 90.00 C ATOM 1660 O GLU A 112 -14.013 -13.469 -3.494 0.20 90.00 O ATOM 1661 CB GLU A 112 -12.659 -11.324 -4.760 0.20 90.00 C ATOM 1662 CG GLU A 112 -12.266 -10.017 -5.424 0.20 90.00 C ATOM 1663 CD GLU A 112 -11.288 -10.189 -6.547 0.20 90.00 C ATOM 1664 OE1 GLU A 112 -10.081 -10.348 -6.270 0.20 90.00 O ATOM 1665 OE2 GLU A 112 -11.696 -10.136 -7.733 0.20 90.00 O ATOM 0 H GLU A 112 -11.861 -10.595 -2.292 0.20 90.00 H new ATOM 0 HA GLU A 112 -14.440 -10.663 -3.774 0.20 90.00 H new ATOM 0 HB2 GLU A 112 -11.758 -11.884 -4.509 0.20 90.00 H new ATOM 0 HB3 GLU A 112 -13.225 -11.930 -5.467 0.20 90.00 H new ATOM 0 HG2 GLU A 112 -13.163 -9.528 -5.805 0.20 90.00 H new ATOM 0 HG3 GLU A 112 -11.834 -9.353 -4.675 0.20 90.00 H new ATOM 1672 N ALA A 113 -13.772 -12.428 -1.509 0.20 90.00 N ATOM 1673 CA ALA A 113 -13.989 -13.629 -0.723 0.20 90.00 C ATOM 1674 C ALA A 113 -15.435 -14.048 -0.814 0.20 90.00 C ATOM 1675 O ALA A 113 -15.748 -15.217 -0.968 0.20 90.00 O ATOM 1676 CB ALA A 113 -13.569 -13.414 0.722 0.20 90.00 C ATOM 0 H ALA A 113 -13.633 -11.583 -0.954 0.20 90.00 H new ATOM 0 HA ALA A 113 -13.371 -14.430 -1.128 0.20 90.00 H new ATOM 0 HB1 ALA A 113 -13.741 -14.328 1.291 0.20 90.00 H new ATOM 0 HB2 ALA A 113 -12.510 -13.158 0.759 0.20 90.00 H new ATOM 0 HB3 ALA A 113 -14.154 -12.602 1.154 0.20 90.00 H new ATOM 1682 N ASP A 114 -16.288 -13.070 -0.821 0.20 90.00 N ATOM 1683 CA ASP A 114 -17.732 -13.269 -0.920 0.20 90.00 C ATOM 1684 C ASP A 114 -18.120 -13.668 -2.334 0.20 90.00 C ATOM 1685 O ASP A 114 -19.150 -14.288 -2.565 0.20 90.00 O ATOM 1686 CB ASP A 114 -18.496 -12.023 -0.472 0.20 90.00 C ATOM 1687 CG ASP A 114 -19.997 -12.153 -0.649 0.20 90.00 C ATOM 1688 OD1 ASP A 114 -20.633 -12.961 0.057 0.20 90.00 O ATOM 1689 OD2 ASP A 114 -20.564 -11.453 -1.513 0.20 90.00 O ATOM 0 H ASP A 114 -16.013 -12.090 -0.758 0.20 90.00 H new ATOM 0 HA ASP A 114 -18.007 -14.082 -0.248 0.20 90.00 H new ATOM 0 HB2 ASP A 114 -18.275 -11.826 0.577 0.20 90.00 H new ATOM 0 HB3 ASP A 114 -18.142 -11.163 -1.040 0.20 90.00 H new ATOM 1694 N MET A 115 -17.266 -13.333 -3.283 0.20 90.00 N ATOM 1695 CA MET A 115 -17.465 -13.750 -4.667 0.20 90.00 C ATOM 1696 C MET A 115 -17.033 -15.188 -4.794 0.20 90.00 C ATOM 1697 O MET A 115 -17.402 -15.892 -5.728 0.20 90.00 O ATOM 1698 CB MET A 115 -16.610 -12.914 -5.615 0.20 90.00 C ATOM 1699 CG MET A 115 -16.972 -11.447 -5.675 0.20 90.00 C ATOM 1700 SD MET A 115 -15.877 -10.499 -6.765 0.20 90.00 S ATOM 1701 CE MET A 115 -16.122 -11.351 -8.336 0.20 90.00 C ATOM 0 H MET A 115 -16.427 -12.774 -3.126 0.20 90.00 H new ATOM 0 HA MET A 115 -18.516 -13.621 -4.927 0.20 90.00 H new ATOM 0 HB2 MET A 115 -15.566 -13.003 -5.314 0.20 90.00 H new ATOM 0 HB3 MET A 115 -16.689 -13.334 -6.618 0.20 90.00 H new ATOM 0 HG2 MET A 115 -18.000 -11.345 -6.022 0.20 90.00 H new ATOM 0 HG3 MET A 115 -16.931 -11.026 -4.671 0.20 90.00 H new ATOM 0 HE1 MET A 115 -15.783 -10.714 -9.152 0.20 90.00 H new ATOM 0 HE2 MET A 115 -15.551 -12.280 -8.339 0.20 90.00 H new ATOM 0 HE3 MET A 115 -17.181 -11.575 -8.467 0.20 90.00 H new ATOM 1711 N ARG A 116 -16.231 -15.607 -3.808 0.20 90.00 N ATOM 1712 CA ARG A 116 -15.593 -16.908 -3.717 0.20 90.00 C ATOM 1713 C ARG A 116 -14.843 -17.327 -4.966 0.20 90.00 C ATOM 1714 O ARG A 116 -14.531 -18.501 -5.155 0.20 90.00 O ATOM 1715 CB ARG A 116 -16.432 -18.059 -3.061 0.20 90.00 C ATOM 1716 CG ARG A 116 -17.864 -18.312 -3.527 0.20 90.00 C ATOM 1717 CD ARG A 116 -18.850 -17.403 -2.806 0.20 90.00 C ATOM 1718 NE ARG A 116 -20.240 -17.777 -3.078 0.20 90.00 N ATOM 1719 CZ ARG A 116 -21.326 -17.193 -2.547 0.20 90.00 C ATOM 1720 NH1 ARG A 116 -21.218 -16.066 -1.850 0.20 90.00 N ATOM 1721 NH2 ARG A 116 -22.522 -17.724 -2.752 0.20 90.00 N ATOM 0 H ARG A 116 -16.003 -15.009 -3.014 0.20 90.00 H new ATOM 0 HA ARG A 116 -14.824 -16.725 -2.966 0.20 90.00 H new ATOM 0 HB2 ARG A 116 -15.876 -18.986 -3.199 0.20 90.00 H new ATOM 0 HB3 ARG A 116 -16.468 -17.865 -1.989 0.20 90.00 H new ATOM 0 HG2 ARG A 116 -17.933 -18.147 -4.602 0.20 90.00 H new ATOM 0 HG3 ARG A 116 -18.128 -19.354 -3.347 0.20 90.00 H new ATOM 0 HD2 ARG A 116 -18.666 -17.447 -1.733 0.20 90.00 H new ATOM 0 HD3 ARG A 116 -18.685 -16.371 -3.115 0.20 90.00 H new ATOM 0 HE ARG A 116 -20.396 -18.548 -3.727 0.20 90.00 H new ATOM 0 HH11 ARG A 116 -20.303 -15.636 -1.714 0.20 90.00 H new ATOM 0 HH12 ARG A 116 -22.050 -15.631 -1.451 0.20 90.00 H new ATOM 0 HH21 ARG A 116 -22.614 -18.572 -3.311 0.20 90.00 H new ATOM 0 HH22 ARG A 116 -23.351 -17.285 -2.351 0.20 90.00 H new ATOM 1735 N SER A 117 -14.424 -16.330 -5.735 0.20 90.00 N ATOM 1736 CA SER A 117 -13.659 -16.536 -6.950 0.20 90.00 C ATOM 1737 C SER A 117 -12.223 -16.910 -6.594 0.20 90.00 C ATOM 1738 O SER A 117 -11.440 -17.329 -7.436 0.20 90.00 O ATOM 1739 CB SER A 117 -13.704 -15.261 -7.768 0.20 90.00 C ATOM 1740 OG SER A 117 -15.052 -14.841 -7.920 0.20 90.00 O ATOM 0 H SER A 117 -14.609 -15.349 -5.528 0.20 90.00 H new ATOM 0 HA SER A 117 -14.083 -17.351 -7.537 0.20 90.00 H new ATOM 0 HB2 SER A 117 -13.122 -14.481 -7.277 0.20 90.00 H new ATOM 0 HB3 SER A 117 -13.252 -15.428 -8.746 0.20 90.00 H new ATOM 0 HG SER A 117 -15.190 -14.506 -8.831 0.20 90.00 H new ATOM 1746 N LEU A 118 -11.913 -16.773 -5.321 0.20 90.00 N ATOM 1747 CA LEU A 118 -10.615 -17.124 -4.782 0.20 90.00 C ATOM 1748 C LEU A 118 -10.574 -18.607 -4.410 0.20 90.00 C ATOM 1749 O LEU A 118 -9.528 -19.129 -4.048 0.20 90.00 O ATOM 1750 CB LEU A 118 -10.337 -16.293 -3.526 0.20 90.00 C ATOM 1751 CG LEU A 118 -10.375 -14.768 -3.688 0.20 90.00 C ATOM 1752 CD1 LEU A 118 -10.121 -14.093 -2.349 0.20 90.00 C ATOM 1753 CD2 LEU A 118 -9.353 -14.304 -4.720 0.20 90.00 C ATOM 0 H LEU A 118 -12.563 -16.411 -4.623 0.20 90.00 H new ATOM 0 HA LEU A 118 -9.860 -16.921 -5.541 0.20 90.00 H new ATOM 0 HB2 LEU A 118 -11.065 -16.573 -2.765 0.20 90.00 H new ATOM 0 HB3 LEU A 118 -9.354 -16.571 -3.145 0.20 90.00 H new ATOM 0 HG LEU A 118 -11.366 -14.485 -4.043 0.20 90.00 H new ATOM 0 HD11 LEU A 118 -10.150 -13.011 -2.476 0.20 90.00 H new ATOM 0 HD12 LEU A 118 -10.889 -14.396 -1.637 0.20 90.00 H new ATOM 0 HD13 LEU A 118 -9.141 -14.388 -1.973 0.20 90.00 H new ATOM 0 HD21 LEU A 118 -9.400 -13.219 -4.816 0.20 90.00 H new ATOM 0 HD22 LEU A 118 -8.353 -14.597 -4.399 0.20 90.00 H new ATOM 0 HD23 LEU A 118 -9.574 -14.764 -5.683 0.20 90.00 H new ATOM 1765 N GLY A 119 -11.714 -19.280 -4.504 0.20 90.00 N ATOM 1766 CA GLY A 119 -11.784 -20.669 -4.107 0.20 90.00 C ATOM 1767 C GLY A 119 -12.044 -20.781 -2.620 0.20 90.00 C ATOM 1768 O GLY A 119 -11.266 -21.381 -1.877 0.20 90.00 O ATOM 0 H GLY A 119 -12.590 -18.887 -4.848 0.20 90.00 H new ATOM 0 HA2 GLY A 119 -12.577 -21.172 -4.660 0.20 90.00 H new ATOM 0 HA3 GLY A 119 -10.851 -21.173 -4.358 0.20 90.00 H new ATOM 1772 N LEU A 120 -13.139 -20.192 -2.187 0.20 90.00 N ATOM 1773 CA LEU A 120 -13.492 -20.165 -0.770 0.20 90.00 C ATOM 1774 C LEU A 120 -14.262 -21.418 -0.409 0.20 90.00 C ATOM 1775 O LEU A 120 -14.204 -21.904 0.726 0.20 90.00 O ATOM 1776 CB LEU A 120 -14.375 -18.959 -0.476 0.20 90.00 C ATOM 1777 CG LEU A 120 -14.763 -18.725 0.990 0.20 90.00 C ATOM 1778 CD1 LEU A 120 -13.549 -18.346 1.828 0.20 90.00 C ATOM 1779 CD2 LEU A 120 -15.858 -17.672 1.094 0.20 90.00 C ATOM 0 H LEU A 120 -13.808 -19.721 -2.795 0.20 90.00 H new ATOM 0 HA LEU A 120 -12.574 -20.106 -0.186 0.20 90.00 H new ATOM 0 HB2 LEU A 120 -13.863 -18.067 -0.838 0.20 90.00 H new ATOM 0 HB3 LEU A 120 -15.291 -19.059 -1.058 0.20 90.00 H new ATOM 0 HG LEU A 120 -15.156 -19.660 1.390 0.20 90.00 H new ATOM 0 HD11 LEU A 120 -13.856 -18.187 2.862 0.20 90.00 H new ATOM 0 HD12 LEU A 120 -12.814 -19.150 1.787 0.20 90.00 H new ATOM 0 HD13 LEU A 120 -13.107 -17.430 1.435 0.20 90.00 H new ATOM 0 HD21 LEU A 120 -16.119 -17.521 2.141 0.20 90.00 H new ATOM 0 HD22 LEU A 120 -15.502 -16.733 0.670 0.20 90.00 H new ATOM 0 HD23 LEU A 120 -16.738 -18.007 0.546 0.20 90.00 H new ATOM 1791 N ALA A 121 -14.963 -21.956 -1.384 0.20 90.00 N ATOM 1792 CA ALA A 121 -15.808 -23.115 -1.175 0.20 90.00 C ATOM 1793 C ALA A 121 -15.015 -24.414 -1.325 0.20 90.00 C ATOM 1794 O ALA A 121 -15.494 -25.411 -1.890 0.20 90.00 O ATOM 1795 CB ALA A 121 -17.000 -23.079 -2.114 0.20 90.00 C ATOM 0 H ALA A 121 -14.964 -21.605 -2.342 0.20 90.00 H new ATOM 0 HA ALA A 121 -16.184 -23.084 -0.152 0.20 90.00 H new ATOM 0 HB1 ALA A 121 -17.624 -23.956 -1.944 0.20 90.00 H new ATOM 0 HB2 ALA A 121 -17.583 -22.177 -1.927 0.20 90.00 H new ATOM 0 HB3 ALA A 121 -16.650 -23.077 -3.146 0.20 90.00 H new ATOM 1801 N GLU A 122 -13.831 -24.395 -0.790 0.20 90.00 N ATOM 1802 CA GLU A 122 -12.949 -25.526 -0.800 0.20 90.00 C ATOM 1803 C GLU A 122 -13.399 -26.450 0.319 0.20 90.00 C ATOM 1804 O GLU A 122 -13.726 -25.985 1.416 0.20 90.00 O ATOM 1805 CB GLU A 122 -11.504 -25.064 -0.584 0.20 90.00 C ATOM 1806 CG GLU A 122 -10.465 -26.155 -0.772 0.20 90.00 C ATOM 1807 CD GLU A 122 -10.497 -26.737 -2.167 0.20 90.00 C ATOM 1808 OE1 GLU A 122 -9.838 -26.173 -3.082 0.20 90.00 O ATOM 1809 OE2 GLU A 122 -11.175 -27.757 -2.380 0.20 90.00 O ATOM 0 H GLU A 122 -13.442 -23.575 -0.324 0.20 90.00 H new ATOM 0 HA GLU A 122 -12.983 -26.047 -1.757 0.20 90.00 H new ATOM 0 HB2 GLU A 122 -11.288 -24.250 -1.276 0.20 90.00 H new ATOM 0 HB3 GLU A 122 -11.411 -24.660 0.424 0.20 90.00 H new ATOM 0 HG2 GLU A 122 -9.473 -25.749 -0.572 0.20 90.00 H new ATOM 0 HG3 GLU A 122 -10.637 -26.948 -0.045 0.20 90.00 H new ATOM 1816 N SER A 123 -13.433 -27.712 0.065 0.20 90.00 N ATOM 1817 CA SER A 123 -13.967 -28.627 1.017 0.20 90.00 C ATOM 1818 C SER A 123 -12.958 -29.692 1.374 0.20 90.00 C ATOM 1819 O SER A 123 -11.915 -29.826 0.730 0.20 90.00 O ATOM 1820 CB SER A 123 -15.260 -29.237 0.462 0.20 90.00 C ATOM 1821 OG SER A 123 -15.959 -29.999 1.443 0.20 90.00 O ATOM 0 H SER A 123 -13.096 -28.137 -0.799 0.20 90.00 H new ATOM 0 HA SER A 123 -14.199 -28.092 1.938 0.20 90.00 H new ATOM 0 HB2 SER A 123 -15.907 -28.441 0.094 0.20 90.00 H new ATOM 0 HB3 SER A 123 -15.023 -29.874 -0.390 0.20 90.00 H new ATOM 0 HG SER A 123 -16.777 -30.368 1.049 0.20 90.00 H new ATOM 1827 N ARG A 124 -13.261 -30.428 2.426 0.20 90.00 N ATOM 1828 CA ARG A 124 -12.400 -31.485 2.925 0.20 90.00 C ATOM 1829 C ARG A 124 -13.123 -32.811 2.713 0.20 90.00 C ATOM 1830 O ARG A 124 -12.785 -33.841 3.308 0.20 90.00 O ATOM 1831 CB ARG A 124 -12.143 -31.274 4.428 0.20 90.00 C ATOM 1832 CG ARG A 124 -11.846 -29.824 4.830 0.20 90.00 C ATOM 1833 CD ARG A 124 -10.702 -29.196 4.037 0.20 90.00 C ATOM 1834 NE ARG A 124 -9.451 -29.957 4.143 0.20 90.00 N ATOM 1835 CZ ARG A 124 -8.221 -29.474 3.920 0.20 90.00 C ATOM 1836 NH1 ARG A 124 -8.047 -28.183 3.610 0.20 90.00 N ATOM 1837 NH2 ARG A 124 -7.171 -30.293 3.999 0.20 90.00 N ATOM 0 H ARG A 124 -14.119 -30.309 2.964 0.20 90.00 H new ATOM 0 HA ARG A 124 -11.444 -31.480 2.401 0.20 90.00 H new ATOM 0 HB2 ARG A 124 -13.015 -31.620 4.984 0.20 90.00 H new ATOM 0 HB3 ARG A 124 -11.303 -31.900 4.731 0.20 90.00 H new ATOM 0 HG2 ARG A 124 -12.746 -29.225 4.691 0.20 90.00 H new ATOM 0 HG3 ARG A 124 -11.602 -29.792 5.892 0.20 90.00 H new ATOM 0 HD2 ARG A 124 -10.990 -29.123 2.988 0.20 90.00 H new ATOM 0 HD3 ARG A 124 -10.535 -28.179 4.393 0.20 90.00 H new ATOM 0 HE ARG A 124 -9.524 -30.939 4.410 0.20 90.00 H new ATOM 0 HH11 ARG A 124 -8.853 -27.562 3.543 0.20 90.00 H new ATOM 0 HH12 ARG A 124 -7.108 -27.821 3.441 0.20 90.00 H new ATOM 0 HH21 ARG A 124 -7.308 -31.278 4.227 0.20 90.00 H new ATOM 0 HH22 ARG A 124 -6.231 -29.935 3.831 0.20 90.00 H new ATOM 1851 N GLN A 125 -14.139 -32.746 1.861 0.20 90.00 N ATOM 1852 CA GLN A 125 -15.016 -33.885 1.519 0.20 90.00 C ATOM 1853 C GLN A 125 -14.235 -35.115 1.034 0.20 90.00 C ATOM 1854 O GLN A 125 -13.237 -34.990 0.317 0.20 90.00 O ATOM 1855 CB GLN A 125 -16.049 -33.461 0.460 0.20 90.00 C ATOM 1856 CG GLN A 125 -15.438 -32.941 -0.838 0.20 90.00 C ATOM 1857 CD GLN A 125 -16.465 -32.478 -1.860 0.20 90.00 C ATOM 1858 OE1 GLN A 125 -16.198 -31.573 -2.640 0.20 90.00 O ATOM 1859 NE2 GLN A 125 -17.615 -33.098 -1.894 0.20 90.00 N ATOM 0 H GLN A 125 -14.391 -31.887 1.372 0.20 90.00 H new ATOM 0 HA GLN A 125 -15.528 -34.176 2.436 0.20 90.00 H new ATOM 0 HB2 GLN A 125 -16.689 -34.313 0.231 0.20 90.00 H new ATOM 0 HB3 GLN A 125 -16.689 -32.687 0.883 0.20 90.00 H new ATOM 0 HG2 GLN A 125 -14.770 -32.111 -0.607 0.20 90.00 H new ATOM 0 HG3 GLN A 125 -14.827 -33.728 -1.281 0.20 90.00 H new ATOM 0 HE21 GLN A 125 -17.810 -33.849 -1.231 0.20 90.00 H new ATOM 0 HE22 GLN A 125 -18.318 -32.831 -2.583 0.20 90.00 H new TER 1868 GLN A 125 HETATM 1869 PA FAD A1126 -1.621 5.797 12.961 1.00 10.00 P HETATM 1870 O1A FAD A1126 -1.139 6.252 11.603 1.00 10.00 O HETATM 1871 O2A FAD A1126 -3.036 5.339 13.144 1.00 10.00 O HETATM 1872 O5B FAD A1126 -1.494 7.065 13.881 1.00 10.00 O HETATM 1873 C5B FAD A1126 -0.224 7.611 14.221 1.00 10.00 C HETATM 1874 C4B FAD A1126 -0.408 8.785 15.149 1.00 10.00 C HETATM 1875 O4B FAD A1126 -1.237 9.778 14.490 1.00 10.00 O HETATM 1876 C3B FAD A1126 -1.099 8.458 16.481 1.00 10.00 C HETATM 1877 O3B FAD A1126 -0.254 8.769 17.590 1.00 10.00 O HETATM 1878 C2B FAD A1126 -2.366 9.325 16.519 1.00 10.00 C HETATM 1879 O2B FAD A1126 -2.182 10.452 17.360 1.00 10.00 O HETATM 1880 C1B FAD A1126 -2.517 9.803 15.072 1.00 10.00 C HETATM 1881 N9A FAD A1126 -3.441 9.015 14.222 1.00 10.00 N HETATM 1882 C8A FAD A1126 -4.289 7.990 14.587 1.00 10.00 C HETATM 1883 N7A FAD A1126 -5.013 7.528 13.599 1.00 10.00 N HETATM 1884 C5A FAD A1126 -4.620 8.286 12.510 1.00 10.00 C HETATM 1885 C6A FAD A1126 -5.019 8.275 11.163 1.00 10.00 C HETATM 1886 N6A FAD A1126 -5.932 7.439 10.672 1.00 10.00 N HETATM 1887 N1A FAD A1126 -4.438 9.161 10.327 1.00 10.00 N HETATM 1888 C2A FAD A1126 -3.515 9.994 10.825 1.00 10.00 C HETATM 1889 N3A FAD A1126 -3.056 10.097 12.069 1.00 10.00 N HETATM 1890 C4A FAD A1126 -3.655 9.202 12.874 1.00 10.00 C HETATM 1891 N1 FAD A1126 0.343 4.388 6.183 1.00 10.00 N HETATM 1892 C2 FAD A1126 0.063 5.616 5.687 1.00 10.00 C HETATM 1893 O2 FAD A1126 0.166 6.608 6.382 1.00 10.00 O HETATM 1894 N3 FAD A1126 -0.352 5.758 4.364 1.00 10.00 N HETATM 1895 C4 FAD A1126 -0.479 4.701 3.560 1.00 10.00 C HETATM 1896 O4 FAD A1126 -0.843 4.820 2.380 1.00 10.00 O HETATM 1897 C4X FAD A1126 -0.196 3.432 4.058 1.00 10.00 C HETATM 1898 N5 FAD A1126 -0.324 2.355 3.258 1.00 10.00 N HETATM 1899 C5X FAD A1126 -0.056 1.109 3.705 1.00 10.00 C HETATM 1900 C6 FAD A1126 -0.202 0.037 2.839 1.00 10.00 C HETATM 1901 C7 FAD A1126 0.067 -1.262 3.269 1.00 10.00 C HETATM 1902 C7M FAD A1126 -0.105 -2.413 2.294 1.00 10.00 C HETATM 1903 C8 FAD A1126 0.494 -1.496 4.599 1.00 10.00 C HETATM 1904 C8M FAD A1126 0.792 -2.902 5.081 1.00 10.00 C HETATM 1905 C9 FAD A1126 0.644 -0.428 5.481 1.00 10.00 C HETATM 1906 C9A FAD A1126 0.372 0.894 5.043 1.00 10.00 C HETATM 1907 N10 FAD A1126 0.512 2.009 5.904 1.00 10.00 N HETATM 1908 C10 FAD A1126 0.223 3.291 5.397 1.00 10.00 C HETATM 1909 C1' FAD A1126 0.944 1.852 7.274 1.00 10.00 C HETATM 1910 C2' FAD A1126 -0.245 1.507 8.165 1.00 10.00 C HETATM 1911 O2' FAD A1126 -1.211 2.552 8.096 1.00 10.00 O HETATM 1912 C3' FAD A1126 0.434 1.392 9.551 1.00 10.00 C HETATM 1913 O3' FAD A1126 1.344 0.291 9.610 1.00 10.00 O HETATM 1914 C4' FAD A1126 -0.725 1.160 10.534 1.00 10.00 C HETATM 1915 O4' FAD A1126 -0.241 0.397 11.639 1.00 10.00 O HETATM 1916 C5' FAD A1126 -1.410 2.411 11.044 1.00 10.00 C HETATM 1917 O5' FAD A1126 -1.238 2.541 12.461 1.00 10.00 O HETATM 1918 P FAD A1126 -0.019 3.331 13.082 1.00 10.00 P HETATM 1919 O1P FAD A1126 0.475 2.492 14.265 1.00 10.00 O HETATM 1920 O2P FAD A1126 1.032 3.600 12.044 1.00 10.00 O HETATM 1921 O3P FAD A1126 -0.582 4.748 13.696 1.00 10.00 O HETATM 0 HO4' FAD A1126 -0.586 0.776 12.474 1.00 10.00 H new HETATM 0 HO3A FAD A1126 -0.712 8.538 18.425 1.00 10.00 H new HETATM 0 HO3' FAD A1126 1.085 -0.309 10.340 1.00 10.00 H new HETATM 0 HO2A FAD A1126 -1.459 10.271 17.996 1.00 10.00 H new HETATM 0 HO2' FAD A1126 -2.082 2.212 8.389 1.00 10.00 H new HETATM 0 HM83 FAD A1126 -0.104 -3.516 4.988 1.00 10.00 H new HETATM 0 HM82 FAD A1126 1.591 -3.332 4.477 1.00 10.00 H new HETATM 0 HM81 FAD A1126 1.104 -2.870 6.125 1.00 10.00 H new HETATM 0 HM73 FAD A1126 -1.139 -2.448 1.952 1.00 10.00 H new HETATM 0 HM72 FAD A1126 0.555 -2.267 1.439 1.00 10.00 H new HETATM 0 HM71 FAD A1126 0.145 -3.351 2.790 1.00 10.00 H new HETATM 0 H62A FAD A1126 -6.181 7.479 9.684 1.00 10.00 H new HETATM 0 H61A FAD A1126 -6.383 6.759 11.284 1.00 10.00 H new HETATM 0 H52A FAD A1126 0.393 6.850 14.699 1.00 10.00 H new HETATM 0 H51A FAD A1126 0.300 7.927 13.319 1.00 10.00 H new HETATM 0 H5'2 FAD A1126 -1.000 3.287 10.541 1.00 10.00 H new HETATM 0 H5'1 FAD A1126 -2.472 2.374 10.804 1.00 10.00 H new HETATM 0 H1'2 FAD A1126 1.696 1.066 7.338 1.00 10.00 H new HETATM 0 H1'1 FAD A1126 1.414 2.772 7.622 1.00 10.00 H new HETATM 0 HN3 FAD A1126 -0.563 6.689 4.003 1.00 10.00 H new HETATM 0 H9 FAD A1126 0.970 -0.608 6.506 1.00 10.00 H new HETATM 0 H8A FAD A1126 -4.350 7.601 15.603 1.00 10.00 H new HETATM 0 H6 FAD A1126 -0.530 0.210 1.814 1.00 10.00 H new HETATM 0 H4B FAD A1126 0.601 9.130 15.376 1.00 10.00 H new HETATM 0 H4' FAD A1126 -1.492 0.630 9.969 1.00 10.00 H new HETATM 0 H3B FAD A1126 -1.330 7.395 16.552 1.00 10.00 H new HETATM 0 H3' FAD A1126 1.019 2.283 9.777 1.00 10.00 H new HETATM 0 H2B FAD A1126 -3.229 8.778 16.899 1.00 10.00 H new HETATM 0 H2A FAD A1126 -3.077 10.688 10.107 1.00 10.00 H new HETATM 0 H2' FAD A1126 -0.795 0.605 7.897 1.00 10.00 H new HETATM 0 H1B FAD A1126 -2.962 10.797 15.121 1.00 10.00 H new