USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 850 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 ASN : amide:sc= 1.49 K(o=0.88,f=-7.3!) USER MOD Set 1.2: A 25 THR OG1 : rot -67:sc= -0.602 USER MOD Set 2.1: A 5 SER OG : rot 180:sc= 0.315 USER MOD Set 2.2: A 6 THR OG1 : rot 180:sc= 0.0682 USER MOD Single : A 1 MET CE :methyl 158:sc= -0.172 (180deg=-0.768) USER MOD Single : A 1 MET N :NH3+ 174:sc= -0.119 (180deg=-0.351) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 160:sc= -1.37 USER MOD Single : A 9 CYS SG : rot -33:sc= 1.2 USER MOD Single : A 10 GLN : amide:sc= -0.521 X(o=-0.52,f=-0.63) USER MOD Single : A 16 LYS NZ :NH3+ -149:sc= -1.88! (180deg=-3.45!) USER MOD Single : A 24 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0119) USER MOD Single : A 28 TYR OH : rot -119:sc= 0.72 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -96:sc= 1.26 USER MOD Single : A 39 MET CE :methyl 163:sc= -0.0909 (180deg=-0.524) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -21:sc= 0.165 USER MOD Single : A 50 SER OG : rot -96:sc= 1.3 USER MOD Single : A 55 SER OG : rot 160:sc= 0.0364 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -1.87 K(o=-1.9,f=-6.2!) USER MOD Single : A 70 GLN :FLIP amide:sc=-0.000687 F(o=-0.92,f=-0.00069) USER MOD Single : A 75 GLN : amide:sc= -1.37 X(o=-1.4,f=-1.6) USER MOD Single : A 76 ASN : amide:sc= -0.0139 K(o=-0.014,f=-1.3) USER MOD Single : A 78 ASN : amide:sc= -0.201 K(o=-0.2,f=-3.1!) USER MOD Single : A 82 ASN :FLIP amide:sc= -1.03 F(o=-2!,f=-1) USER MOD Single : A 90 TYR OH : rot 151:sc= 0.0146 USER MOD Single : A 94 GLN : amide:sc= 0.0488 K(o=0.049,f=-3.3!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : A 102 GLN : amide:sc= -0.0868 K(o=-0.087,f=-1.4) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.889 2.930 0.303 1.00 0.00 N ATOM 2 CA MET A 1 1.545 2.550 -1.086 1.00 0.00 C ATOM 3 C MET A 1 0.718 3.647 -1.753 1.00 0.00 C ATOM 4 O MET A 1 0.107 3.430 -2.800 1.00 0.00 O ATOM 5 CB MET A 1 0.774 1.225 -1.102 1.00 0.00 C ATOM 6 CG MET A 1 -0.598 1.299 -0.451 1.00 0.00 C ATOM 7 SD MET A 1 -1.441 -0.293 -0.425 1.00 0.00 S ATOM 8 CE MET A 1 -0.336 -1.244 0.617 1.00 0.00 C ATOM 0 H1 MET A 1 2.363 2.133 0.774 1.00 0.00 H new ATOM 0 H2 MET A 1 2.526 3.752 0.290 1.00 0.00 H new ATOM 0 H3 MET A 1 1.021 3.172 0.822 1.00 0.00 H new ATOM 0 HA MET A 1 2.471 2.424 -1.646 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.657 0.897 -2.135 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.366 0.466 -0.591 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.492 1.666 0.570 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.212 2.022 -0.988 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.877 -2.087 1.047 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.498 -1.614 0.021 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.044 -0.610 1.418 1.00 0.00 H new ATOM 18 N SER A 2 0.712 4.828 -1.147 1.00 0.00 N ATOM 19 CA SER A 2 -0.039 5.952 -1.680 1.00 0.00 C ATOM 20 C SER A 2 0.882 6.865 -2.485 1.00 0.00 C ATOM 21 O SER A 2 2.096 6.873 -2.274 1.00 0.00 O ATOM 22 CB SER A 2 -0.689 6.733 -0.534 1.00 0.00 C ATOM 23 OG SER A 2 -1.418 5.865 0.322 1.00 0.00 O ATOM 0 H SER A 2 1.220 5.030 -0.286 1.00 0.00 H new ATOM 0 HA SER A 2 -0.821 5.576 -2.340 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.079 7.254 0.038 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.355 7.494 -0.940 1.00 0.00 H new ATOM 0 HG SER A 2 -1.823 6.385 1.047 1.00 0.00 H new ATOM 29 N ILE A 3 0.305 7.618 -3.412 1.00 0.00 N ATOM 30 CA ILE A 3 1.075 8.542 -4.233 1.00 0.00 C ATOM 31 C ILE A 3 1.581 9.710 -3.392 1.00 0.00 C ATOM 32 O ILE A 3 0.838 10.286 -2.597 1.00 0.00 O ATOM 33 CB ILE A 3 0.239 9.073 -5.420 1.00 0.00 C ATOM 34 CG1 ILE A 3 -0.206 7.912 -6.314 1.00 0.00 C ATOM 35 CG2 ILE A 3 1.029 10.095 -6.230 1.00 0.00 C ATOM 36 CD1 ILE A 3 0.945 7.131 -6.911 1.00 0.00 C ATOM 0 H ILE A 3 -0.695 7.607 -3.614 1.00 0.00 H new ATOM 0 HA ILE A 3 1.927 7.994 -4.634 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.645 9.569 -5.020 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.830 7.235 -5.731 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.826 8.303 -7.121 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.418 10.453 -7.059 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.301 10.935 -5.590 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.934 9.629 -6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.554 6.325 -7.532 1.00 0.00 H new ATOM 0 HD12 ILE A 3 1.557 7.795 -7.521 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.553 6.710 -6.110 1.00 0.00 H new ATOM 48 N THR A 4 2.848 10.043 -3.568 1.00 0.00 N ATOM 49 CA THR A 4 3.484 11.086 -2.786 1.00 0.00 C ATOM 50 C THR A 4 3.403 12.439 -3.491 1.00 0.00 C ATOM 51 O THR A 4 2.770 12.571 -4.542 1.00 0.00 O ATOM 52 CB THR A 4 4.959 10.727 -2.535 1.00 0.00 C ATOM 53 OG1 THR A 4 5.615 10.493 -3.787 1.00 0.00 O ATOM 54 CG2 THR A 4 5.070 9.485 -1.662 1.00 0.00 C ATOM 0 H THR A 4 3.461 9.600 -4.253 1.00 0.00 H new ATOM 0 HA THR A 4 2.954 11.162 -1.836 1.00 0.00 H new ATOM 0 HB THR A 4 5.436 11.559 -2.018 1.00 0.00 H new ATOM 0 HG1 THR A 4 6.584 10.583 -3.670 1.00 0.00 H new ATOM 0 HG21 THR A 4 6.121 9.249 -1.497 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.585 9.669 -0.704 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.583 8.646 -2.159 1.00 0.00 H new ATOM 62 N SER A 5 4.044 13.434 -2.898 1.00 0.00 N ATOM 63 CA SER A 5 4.127 14.764 -3.474 1.00 0.00 C ATOM 64 C SER A 5 5.199 14.781 -4.567 1.00 0.00 C ATOM 65 O SER A 5 5.678 13.723 -4.987 1.00 0.00 O ATOM 66 CB SER A 5 4.439 15.796 -2.381 1.00 0.00 C ATOM 67 OG SER A 5 4.236 17.121 -2.849 1.00 0.00 O ATOM 0 H SER A 5 4.522 13.340 -2.002 1.00 0.00 H new ATOM 0 HA SER A 5 3.169 15.028 -3.921 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.805 15.613 -1.514 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.471 15.679 -2.051 1.00 0.00 H new ATOM 0 HG SER A 5 4.441 17.756 -2.131 1.00 0.00 H new ATOM 73 N THR A 6 5.561 15.979 -5.023 1.00 0.00 N ATOM 74 CA THR A 6 6.513 16.174 -6.119 1.00 0.00 C ATOM 75 C THR A 6 7.805 15.367 -5.923 1.00 0.00 C ATOM 76 O THR A 6 8.519 15.081 -6.885 1.00 0.00 O ATOM 77 CB THR A 6 6.869 17.666 -6.254 1.00 0.00 C ATOM 78 OG1 THR A 6 5.700 18.465 -6.032 1.00 0.00 O ATOM 79 CG2 THR A 6 7.433 17.975 -7.634 1.00 0.00 C ATOM 0 H THR A 6 5.199 16.852 -4.639 1.00 0.00 H new ATOM 0 HA THR A 6 6.027 15.817 -7.027 1.00 0.00 H new ATOM 0 HB THR A 6 7.629 17.900 -5.508 1.00 0.00 H new ATOM 0 HG1 THR A 6 5.931 19.414 -6.117 1.00 0.00 H new ATOM 0 HG21 THR A 6 7.675 19.036 -7.699 1.00 0.00 H new ATOM 0 HG22 THR A 6 8.336 17.386 -7.798 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.693 17.724 -8.394 1.00 0.00 H new ATOM 87 N ASP A 7 8.100 15.005 -4.676 1.00 0.00 N ATOM 88 CA ASP A 7 9.272 14.192 -4.343 1.00 0.00 C ATOM 89 C ASP A 7 9.323 12.916 -5.185 1.00 0.00 C ATOM 90 O ASP A 7 10.391 12.342 -5.385 1.00 0.00 O ATOM 91 CB ASP A 7 9.243 13.799 -2.864 1.00 0.00 C ATOM 92 CG ASP A 7 9.048 14.981 -1.943 1.00 0.00 C ATOM 93 OD1 ASP A 7 7.910 15.489 -1.865 1.00 0.00 O ATOM 94 OD2 ASP A 7 10.022 15.399 -1.283 1.00 0.00 O ATOM 0 H ASP A 7 7.535 15.266 -3.868 1.00 0.00 H new ATOM 0 HA ASP A 7 10.155 14.794 -4.555 1.00 0.00 H new ATOM 0 HB2 ASP A 7 8.439 13.081 -2.700 1.00 0.00 H new ATOM 0 HB3 ASP A 7 10.176 13.297 -2.609 1.00 0.00 H new ATOM 99 N ILE A 8 8.163 12.478 -5.670 1.00 0.00 N ATOM 100 CA ILE A 8 8.072 11.270 -6.482 1.00 0.00 C ATOM 101 C ILE A 8 8.921 11.382 -7.756 1.00 0.00 C ATOM 102 O ILE A 8 9.733 10.502 -8.045 1.00 0.00 O ATOM 103 CB ILE A 8 6.598 10.934 -6.834 1.00 0.00 C ATOM 104 CG1 ILE A 8 6.515 9.650 -7.663 1.00 0.00 C ATOM 105 CG2 ILE A 8 5.921 12.087 -7.567 1.00 0.00 C ATOM 106 CD1 ILE A 8 5.094 9.193 -7.919 1.00 0.00 C ATOM 0 H ILE A 8 7.270 12.945 -5.513 1.00 0.00 H new ATOM 0 HA ILE A 8 8.472 10.451 -5.884 1.00 0.00 H new ATOM 0 HB ILE A 8 6.066 10.776 -5.896 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.016 9.809 -8.618 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.057 8.857 -7.147 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.891 11.817 -7.798 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.930 12.975 -6.935 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.457 12.295 -8.493 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.107 8.278 -8.512 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.596 9.002 -6.968 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.554 9.969 -8.462 1.00 0.00 H new ATOM 118 N CYS A 9 8.752 12.467 -8.506 1.00 0.00 N ATOM 119 CA CYS A 9 9.530 12.672 -9.720 1.00 0.00 C ATOM 120 C CYS A 9 10.951 13.091 -9.364 1.00 0.00 C ATOM 121 O CYS A 9 11.902 12.790 -10.086 1.00 0.00 O ATOM 122 CB CYS A 9 8.867 13.715 -10.627 1.00 0.00 C ATOM 123 SG CYS A 9 8.653 15.343 -9.872 1.00 0.00 S ATOM 0 H CYS A 9 8.088 13.212 -8.295 1.00 0.00 H new ATOM 0 HA CYS A 9 9.569 11.731 -10.269 1.00 0.00 H new ATOM 0 HB2 CYS A 9 9.466 13.824 -11.531 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.891 13.341 -10.935 1.00 0.00 H new ATOM 0 HG CYS A 9 8.425 15.205 -8.600 1.00 0.00 H new ATOM 129 N GLN A 10 11.084 13.769 -8.228 1.00 0.00 N ATOM 130 CA GLN A 10 12.383 14.208 -7.739 1.00 0.00 C ATOM 131 C GLN A 10 13.281 13.014 -7.446 1.00 0.00 C ATOM 132 O GLN A 10 14.478 13.048 -7.721 1.00 0.00 O ATOM 133 CB GLN A 10 12.221 15.060 -6.480 1.00 0.00 C ATOM 134 CG GLN A 10 11.505 16.378 -6.722 1.00 0.00 C ATOM 135 CD GLN A 10 11.259 17.149 -5.441 1.00 0.00 C ATOM 136 OE1 GLN A 10 12.018 17.038 -4.479 1.00 0.00 O ATOM 137 NE2 GLN A 10 10.202 17.943 -5.421 1.00 0.00 N ATOM 0 H GLN A 10 10.301 14.027 -7.627 1.00 0.00 H new ATOM 0 HA GLN A 10 12.850 14.812 -8.517 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.669 14.488 -5.734 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.206 15.264 -6.061 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.097 16.990 -7.402 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.552 16.185 -7.215 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.597 18.007 -6.240 1.00 0.00 H new ATOM 0 HE22 GLN A 10 9.992 18.491 -4.587 1.00 0.00 H new ATOM 146 N ALA A 11 12.694 11.957 -6.893 1.00 0.00 N ATOM 147 CA ALA A 11 13.434 10.741 -6.587 1.00 0.00 C ATOM 148 C ALA A 11 13.902 10.045 -7.861 1.00 0.00 C ATOM 149 O ALA A 11 14.944 9.395 -7.874 1.00 0.00 O ATOM 150 CB ALA A 11 12.584 9.800 -5.746 1.00 0.00 C ATOM 0 H ALA A 11 11.705 11.920 -6.648 1.00 0.00 H new ATOM 0 HA ALA A 11 14.318 11.020 -6.014 1.00 0.00 H new ATOM 0 HB1 ALA A 11 13.152 8.896 -5.526 1.00 0.00 H new ATOM 0 HB2 ALA A 11 12.310 10.293 -4.813 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.681 9.536 -6.296 1.00 0.00 H new ATOM 156 N ALA A 12 13.133 10.197 -8.934 1.00 0.00 N ATOM 157 CA ALA A 12 13.498 9.625 -10.224 1.00 0.00 C ATOM 158 C ALA A 12 14.673 10.387 -10.826 1.00 0.00 C ATOM 159 O ALA A 12 15.540 9.813 -11.481 1.00 0.00 O ATOM 160 CB ALA A 12 12.309 9.650 -11.170 1.00 0.00 C ATOM 0 H ALA A 12 12.253 10.712 -8.935 1.00 0.00 H new ATOM 0 HA ALA A 12 13.797 8.588 -10.073 1.00 0.00 H new ATOM 0 HB1 ALA A 12 12.598 9.220 -12.129 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.492 9.069 -10.743 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.983 10.680 -11.318 1.00 0.00 H new ATOM 166 N ASP A 13 14.694 11.689 -10.581 1.00 0.00 N ATOM 167 CA ASP A 13 15.784 12.545 -11.033 1.00 0.00 C ATOM 168 C ASP A 13 17.007 12.359 -10.139 1.00 0.00 C ATOM 169 O ASP A 13 18.128 12.694 -10.515 1.00 0.00 O ATOM 170 CB ASP A 13 15.322 14.008 -11.028 1.00 0.00 C ATOM 171 CG ASP A 13 16.419 14.996 -11.385 1.00 0.00 C ATOM 172 OD1 ASP A 13 16.933 14.943 -12.523 1.00 0.00 O ATOM 173 OD2 ASP A 13 16.740 15.859 -10.539 1.00 0.00 O ATOM 0 H ASP A 13 13.962 12.180 -10.067 1.00 0.00 H new ATOM 0 HA ASP A 13 16.064 12.269 -12.050 1.00 0.00 H new ATOM 0 HB2 ASP A 13 14.499 14.122 -11.733 1.00 0.00 H new ATOM 0 HB3 ASP A 13 14.932 14.253 -10.040 1.00 0.00 H new ATOM 178 N ALA A 14 16.783 11.791 -8.960 1.00 0.00 N ATOM 179 CA ALA A 14 17.851 11.577 -7.995 1.00 0.00 C ATOM 180 C ALA A 14 18.416 10.162 -8.088 1.00 0.00 C ATOM 181 O ALA A 14 19.243 9.762 -7.263 1.00 0.00 O ATOM 182 CB ALA A 14 17.351 11.854 -6.585 1.00 0.00 C ATOM 0 H ALA A 14 15.866 11.469 -8.650 1.00 0.00 H new ATOM 0 HA ALA A 14 18.656 12.272 -8.231 1.00 0.00 H new ATOM 0 HB1 ALA A 14 18.160 11.690 -5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 14 17.011 12.887 -6.516 1.00 0.00 H new ATOM 0 HB3 ALA A 14 16.523 11.183 -6.354 1.00 0.00 H new ATOM 188 N LEU A 15 17.965 9.405 -9.087 1.00 0.00 N ATOM 189 CA LEU A 15 18.475 8.054 -9.315 1.00 0.00 C ATOM 190 C LEU A 15 19.936 8.113 -9.749 1.00 0.00 C ATOM 191 O LEU A 15 20.409 9.150 -10.214 1.00 0.00 O ATOM 192 CB LEU A 15 17.647 7.332 -10.386 1.00 0.00 C ATOM 193 CG LEU A 15 16.168 7.120 -10.051 1.00 0.00 C ATOM 194 CD1 LEU A 15 15.456 6.413 -11.195 1.00 0.00 C ATOM 195 CD2 LEU A 15 16.014 6.327 -8.765 1.00 0.00 C ATOM 0 H LEU A 15 17.249 9.703 -9.750 1.00 0.00 H new ATOM 0 HA LEU A 15 18.397 7.498 -8.381 1.00 0.00 H new ATOM 0 HB2 LEU A 15 17.713 7.900 -11.314 1.00 0.00 H new ATOM 0 HB3 LEU A 15 18.101 6.359 -10.575 1.00 0.00 H new ATOM 0 HG LEU A 15 15.710 8.099 -9.908 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.406 6.271 -10.938 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.530 7.018 -12.099 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.921 5.443 -11.369 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.955 6.189 -8.547 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.491 5.354 -8.878 1.00 0.00 H new ATOM 0 HD23 LEU A 15 16.485 6.869 -7.945 1.00 0.00 H new ATOM 207 N LYS A 16 20.651 7.008 -9.606 1.00 0.00 N ATOM 208 CA LYS A 16 22.063 6.978 -9.954 1.00 0.00 C ATOM 209 C LYS A 16 22.376 5.794 -10.857 1.00 0.00 C ATOM 210 O LYS A 16 21.803 4.719 -10.705 1.00 0.00 O ATOM 211 CB LYS A 16 22.926 6.930 -8.689 1.00 0.00 C ATOM 212 CG LYS A 16 22.654 5.732 -7.793 1.00 0.00 C ATOM 213 CD LYS A 16 23.406 5.832 -6.473 1.00 0.00 C ATOM 214 CE LYS A 16 22.710 6.759 -5.480 1.00 0.00 C ATOM 215 NZ LYS A 16 22.758 8.192 -5.880 1.00 0.00 N ATOM 0 H LYS A 16 20.280 6.126 -9.254 1.00 0.00 H new ATOM 0 HA LYS A 16 22.297 7.892 -10.500 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.976 6.921 -8.980 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.762 7.843 -8.116 1.00 0.00 H new ATOM 0 HG2 LYS A 16 21.584 5.660 -7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 16 22.946 4.818 -8.310 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.500 4.838 -6.035 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.417 6.195 -6.659 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.669 6.453 -5.376 1.00 0.00 H new ATOM 0 HE3 LYS A 16 23.175 6.646 -4.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 22.774 8.790 -5.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 23.615 8.367 -6.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 21.918 8.422 -6.448 1.00 0.00 H new ATOM 229 N GLY A 17 23.279 6.005 -11.802 1.00 0.00 N ATOM 230 CA GLY A 17 23.645 4.954 -12.726 1.00 0.00 C ATOM 231 C GLY A 17 23.507 5.395 -14.168 1.00 0.00 C ATOM 232 O GLY A 17 22.687 6.261 -14.485 1.00 0.00 O ATOM 0 H GLY A 17 23.766 6.889 -11.945 1.00 0.00 H new ATOM 0 HA2 GLY A 17 24.674 4.647 -12.537 1.00 0.00 H new ATOM 0 HA3 GLY A 17 23.015 4.082 -12.551 1.00 0.00 H new ATOM 236 N PHE A 18 24.309 4.808 -15.041 1.00 0.00 N ATOM 237 CA PHE A 18 24.281 5.140 -16.455 1.00 0.00 C ATOM 238 C PHE A 18 23.797 3.938 -17.246 1.00 0.00 C ATOM 239 O PHE A 18 24.448 2.898 -17.267 1.00 0.00 O ATOM 240 CB PHE A 18 25.676 5.551 -16.934 1.00 0.00 C ATOM 241 CG PHE A 18 26.263 6.705 -16.172 1.00 0.00 C ATOM 242 CD1 PHE A 18 27.010 6.487 -15.024 1.00 0.00 C ATOM 243 CD2 PHE A 18 26.069 8.006 -16.602 1.00 0.00 C ATOM 244 CE1 PHE A 18 27.551 7.546 -14.321 1.00 0.00 C ATOM 245 CE2 PHE A 18 26.609 9.069 -15.904 1.00 0.00 C ATOM 246 CZ PHE A 18 27.350 8.839 -14.762 1.00 0.00 C ATOM 0 H PHE A 18 24.993 4.093 -14.792 1.00 0.00 H new ATOM 0 HA PHE A 18 23.600 5.977 -16.610 1.00 0.00 H new ATOM 0 HB2 PHE A 18 26.345 4.695 -16.851 1.00 0.00 H new ATOM 0 HB3 PHE A 18 25.624 5.814 -17.991 1.00 0.00 H new ATOM 0 HD1 PHE A 18 27.171 5.477 -14.676 1.00 0.00 H new ATOM 0 HD2 PHE A 18 25.489 8.193 -17.494 1.00 0.00 H new ATOM 0 HE1 PHE A 18 28.130 7.363 -13.428 1.00 0.00 H new ATOM 0 HE2 PHE A 18 26.452 10.079 -16.252 1.00 0.00 H new ATOM 0 HZ PHE A 18 27.772 9.669 -14.215 1.00 0.00 H new ATOM 256 N VAL A 19 22.663 4.080 -17.900 1.00 0.00 N ATOM 257 CA VAL A 19 22.075 2.974 -18.631 1.00 0.00 C ATOM 258 C VAL A 19 22.476 3.061 -20.096 1.00 0.00 C ATOM 259 O VAL A 19 22.238 4.076 -20.756 1.00 0.00 O ATOM 260 CB VAL A 19 20.535 2.974 -18.507 1.00 0.00 C ATOM 261 CG1 VAL A 19 19.967 1.600 -18.821 1.00 0.00 C ATOM 262 CG2 VAL A 19 20.104 3.426 -17.120 1.00 0.00 C ATOM 0 H VAL A 19 22.130 4.949 -17.941 1.00 0.00 H new ATOM 0 HA VAL A 19 22.447 2.044 -18.201 1.00 0.00 H new ATOM 0 HB VAL A 19 20.139 3.682 -19.235 1.00 0.00 H new ATOM 0 HG11 VAL A 19 18.881 1.625 -18.727 1.00 0.00 H new ATOM 0 HG12 VAL A 19 20.237 1.319 -19.839 1.00 0.00 H new ATOM 0 HG13 VAL A 19 20.375 0.869 -18.123 1.00 0.00 H new ATOM 0 HG21 VAL A 19 19.016 3.418 -17.056 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.516 2.749 -16.372 1.00 0.00 H new ATOM 0 HG23 VAL A 19 20.471 4.436 -16.936 1.00 0.00 H new ATOM 272 N GLY A 20 23.079 1.999 -20.602 1.00 0.00 N ATOM 273 CA GLY A 20 23.597 2.015 -21.950 1.00 0.00 C ATOM 274 C GLY A 20 23.381 0.698 -22.662 1.00 0.00 C ATOM 275 O GLY A 20 22.813 -0.233 -22.097 1.00 0.00 O ATOM 0 H GLY A 20 23.219 1.122 -20.100 1.00 0.00 H new ATOM 0 HA2 GLY A 20 23.114 2.814 -22.513 1.00 0.00 H new ATOM 0 HA3 GLY A 20 24.663 2.242 -21.925 1.00 0.00 H new ATOM 279 N PHE A 21 23.833 0.617 -23.899 1.00 0.00 N ATOM 280 CA PHE A 21 23.642 -0.580 -24.702 1.00 0.00 C ATOM 281 C PHE A 21 24.871 -1.480 -24.630 1.00 0.00 C ATOM 282 O PHE A 21 26.001 -1.007 -24.707 1.00 0.00 O ATOM 283 CB PHE A 21 23.352 -0.191 -26.155 1.00 0.00 C ATOM 284 CG PHE A 21 23.064 -1.362 -27.052 1.00 0.00 C ATOM 285 CD1 PHE A 21 21.825 -1.982 -27.025 1.00 0.00 C ATOM 286 CD2 PHE A 21 24.031 -1.845 -27.921 1.00 0.00 C ATOM 287 CE1 PHE A 21 21.557 -3.059 -27.845 1.00 0.00 C ATOM 288 CE2 PHE A 21 23.767 -2.923 -28.744 1.00 0.00 C ATOM 289 CZ PHE A 21 22.528 -3.531 -28.705 1.00 0.00 C ATOM 0 H PHE A 21 24.337 1.367 -24.372 1.00 0.00 H new ATOM 0 HA PHE A 21 22.791 -1.134 -24.305 1.00 0.00 H new ATOM 0 HB2 PHE A 21 22.500 0.489 -26.176 1.00 0.00 H new ATOM 0 HB3 PHE A 21 24.207 0.357 -26.552 1.00 0.00 H new ATOM 0 HD1 PHE A 21 21.060 -1.618 -26.355 1.00 0.00 H new ATOM 0 HD2 PHE A 21 25.002 -1.373 -27.955 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.587 -3.533 -27.814 1.00 0.00 H new ATOM 0 HE2 PHE A 21 24.528 -3.289 -29.417 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.319 -4.374 -29.346 1.00 0.00 H new ATOM 299 N ASN A 22 24.642 -2.773 -24.464 1.00 0.00 N ATOM 300 CA ASN A 22 25.722 -3.751 -24.482 1.00 0.00 C ATOM 301 C ASN A 22 25.635 -4.576 -25.759 1.00 0.00 C ATOM 302 O ASN A 22 24.653 -5.282 -25.980 1.00 0.00 O ATOM 303 CB ASN A 22 25.646 -4.664 -23.256 1.00 0.00 C ATOM 304 CG ASN A 22 26.786 -5.665 -23.202 1.00 0.00 C ATOM 305 OD1 ASN A 22 26.702 -6.754 -23.774 1.00 0.00 O ATOM 306 ND2 ASN A 22 27.853 -5.312 -22.504 1.00 0.00 N ATOM 0 H ASN A 22 23.715 -3.172 -24.315 1.00 0.00 H new ATOM 0 HA ASN A 22 26.676 -3.225 -24.454 1.00 0.00 H new ATOM 0 HB2 ASN A 22 25.659 -4.055 -22.352 1.00 0.00 H new ATOM 0 HB3 ASN A 22 24.697 -5.200 -23.265 1.00 0.00 H new ATOM 0 HD21 ASN A 22 28.645 -5.950 -22.425 1.00 0.00 H new ATOM 0 HD22 ASN A 22 27.884 -4.402 -22.045 1.00 0.00 H new ATOM 313 N ARG A 23 26.662 -4.485 -26.597 1.00 0.00 N ATOM 314 CA ARG A 23 26.628 -5.111 -27.917 1.00 0.00 C ATOM 315 C ARG A 23 26.674 -6.638 -27.842 1.00 0.00 C ATOM 316 O ARG A 23 26.133 -7.315 -28.713 1.00 0.00 O ATOM 317 CB ARG A 23 27.774 -4.600 -28.796 1.00 0.00 C ATOM 318 CG ARG A 23 29.158 -4.847 -28.217 1.00 0.00 C ATOM 319 CD ARG A 23 30.230 -4.778 -29.294 1.00 0.00 C ATOM 320 NE ARG A 23 30.260 -3.487 -29.981 1.00 0.00 N ATOM 321 CZ ARG A 23 30.636 -3.332 -31.250 1.00 0.00 C ATOM 322 NH1 ARG A 23 30.966 -4.388 -31.982 1.00 0.00 N ATOM 323 NH2 ARG A 23 30.672 -2.120 -31.789 1.00 0.00 N ATOM 0 H ARG A 23 27.527 -3.986 -26.388 1.00 0.00 H new ATOM 0 HA ARG A 23 25.676 -4.830 -28.367 1.00 0.00 H new ATOM 0 HB2 ARG A 23 27.710 -5.079 -29.773 1.00 0.00 H new ATOM 0 HB3 ARG A 23 27.645 -3.530 -28.957 1.00 0.00 H new ATOM 0 HG2 ARG A 23 29.368 -4.108 -27.444 1.00 0.00 H new ATOM 0 HG3 ARG A 23 29.184 -5.825 -27.737 1.00 0.00 H new ATOM 0 HD2 ARG A 23 31.204 -4.967 -28.843 1.00 0.00 H new ATOM 0 HD3 ARG A 23 30.057 -5.569 -30.024 1.00 0.00 H new ATOM 0 HE ARG A 23 29.977 -2.658 -29.459 1.00 0.00 H new ATOM 0 HH11 ARG A 23 30.932 -5.322 -31.574 1.00 0.00 H new ATOM 0 HH12 ARG A 23 31.253 -4.266 -32.953 1.00 0.00 H new ATOM 0 HH21 ARG A 23 30.412 -1.306 -31.232 1.00 0.00 H new ATOM 0 HH22 ARG A 23 30.960 -2.002 -32.760 1.00 0.00 H new ATOM 337 N LYS A 24 27.309 -7.179 -26.808 1.00 0.00 N ATOM 338 CA LYS A 24 27.442 -8.628 -26.677 1.00 0.00 C ATOM 339 C LYS A 24 26.106 -9.280 -26.351 1.00 0.00 C ATOM 340 O LYS A 24 25.703 -10.244 -27.003 1.00 0.00 O ATOM 341 CB LYS A 24 28.479 -8.991 -25.613 1.00 0.00 C ATOM 342 CG LYS A 24 29.898 -9.086 -26.155 1.00 0.00 C ATOM 343 CD LYS A 24 30.902 -9.436 -25.065 1.00 0.00 C ATOM 344 CE LYS A 24 30.519 -10.707 -24.315 1.00 0.00 C ATOM 345 NZ LYS A 24 30.441 -11.897 -25.205 1.00 0.00 N ATOM 0 H LYS A 24 27.737 -6.643 -26.053 1.00 0.00 H new ATOM 0 HA LYS A 24 27.783 -9.010 -27.639 1.00 0.00 H new ATOM 0 HB2 LYS A 24 28.451 -8.244 -24.820 1.00 0.00 H new ATOM 0 HB3 LYS A 24 28.206 -9.945 -25.162 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.937 -9.841 -26.940 1.00 0.00 H new ATOM 0 HG3 LYS A 24 30.176 -8.137 -26.613 1.00 0.00 H new ATOM 0 HD2 LYS A 24 31.889 -9.562 -25.510 1.00 0.00 H new ATOM 0 HD3 LYS A 24 30.974 -8.608 -24.360 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.250 -10.894 -23.528 1.00 0.00 H new ATOM 0 HE3 LYS A 24 29.556 -10.560 -23.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 30.227 -12.742 -24.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 29.690 -11.755 -25.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 31.351 -12.028 -25.691 1.00 0.00 H new ATOM 359 N THR A 25 25.420 -8.752 -25.351 1.00 0.00 N ATOM 360 CA THR A 25 24.129 -9.291 -24.954 1.00 0.00 C ATOM 361 C THR A 25 23.020 -8.780 -25.871 1.00 0.00 C ATOM 362 O THR A 25 21.951 -9.385 -25.970 1.00 0.00 O ATOM 363 CB THR A 25 23.805 -8.933 -23.493 1.00 0.00 C ATOM 364 OG1 THR A 25 24.068 -7.543 -23.262 1.00 0.00 O ATOM 365 CG2 THR A 25 24.628 -9.775 -22.529 1.00 0.00 C ATOM 0 H THR A 25 25.734 -7.953 -24.800 1.00 0.00 H new ATOM 0 HA THR A 25 24.186 -10.376 -25.042 1.00 0.00 H new ATOM 0 HB THR A 25 22.749 -9.140 -23.318 1.00 0.00 H new ATOM 0 HG1 THR A 25 25.032 -7.378 -23.322 1.00 0.00 H new ATOM 0 HG21 THR A 25 24.379 -9.502 -21.504 1.00 0.00 H new ATOM 0 HG22 THR A 25 24.406 -10.830 -22.687 1.00 0.00 H new ATOM 0 HG23 THR A 25 25.689 -9.597 -22.705 1.00 0.00 H new ATOM 373 N GLY A 26 23.287 -7.663 -26.540 1.00 0.00 N ATOM 374 CA GLY A 26 22.326 -7.096 -27.467 1.00 0.00 C ATOM 375 C GLY A 26 21.162 -6.444 -26.754 1.00 0.00 C ATOM 376 O GLY A 26 20.061 -6.352 -27.298 1.00 0.00 O ATOM 0 H GLY A 26 24.157 -7.138 -26.455 1.00 0.00 H new ATOM 0 HA2 GLY A 26 22.823 -6.359 -28.097 1.00 0.00 H new ATOM 0 HA3 GLY A 26 21.953 -7.880 -28.126 1.00 0.00 H new ATOM 380 N ARG A 27 21.408 -5.977 -25.538 1.00 0.00 N ATOM 381 CA ARG A 27 20.351 -5.404 -24.720 1.00 0.00 C ATOM 382 C ARG A 27 20.818 -4.122 -24.040 1.00 0.00 C ATOM 383 O ARG A 27 22.015 -3.823 -24.001 1.00 0.00 O ATOM 384 CB ARG A 27 19.884 -6.421 -23.676 1.00 0.00 C ATOM 385 CG ARG A 27 20.981 -6.872 -22.726 1.00 0.00 C ATOM 386 CD ARG A 27 20.492 -7.956 -21.781 1.00 0.00 C ATOM 387 NE ARG A 27 19.384 -7.498 -20.945 1.00 0.00 N ATOM 388 CZ ARG A 27 18.595 -8.306 -20.242 1.00 0.00 C ATOM 389 NH1 ARG A 27 18.786 -9.619 -20.273 1.00 0.00 N ATOM 390 NH2 ARG A 27 17.618 -7.796 -19.507 1.00 0.00 N ATOM 0 H ARG A 27 22.328 -5.984 -25.098 1.00 0.00 H new ATOM 0 HA ARG A 27 19.513 -5.154 -25.371 1.00 0.00 H new ATOM 0 HB2 ARG A 27 19.071 -5.985 -23.096 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.478 -7.293 -24.188 1.00 0.00 H new ATOM 0 HG2 ARG A 27 21.830 -7.245 -23.300 1.00 0.00 H new ATOM 0 HG3 ARG A 27 21.337 -6.019 -22.149 1.00 0.00 H new ATOM 0 HD2 ARG A 27 20.175 -8.824 -22.359 1.00 0.00 H new ATOM 0 HD3 ARG A 27 21.316 -8.280 -21.145 1.00 0.00 H new ATOM 0 HE ARG A 27 19.204 -6.495 -20.898 1.00 0.00 H new ATOM 0 HH11 ARG A 27 19.540 -10.012 -20.837 1.00 0.00 H new ATOM 0 HH12 ARG A 27 18.179 -10.236 -19.733 1.00 0.00 H new ATOM 0 HH21 ARG A 27 17.473 -6.787 -19.481 1.00 0.00 H new ATOM 0 HH22 ARG A 27 17.011 -8.413 -18.967 1.00 0.00 H new ATOM 404 N TYR A 28 19.863 -3.378 -23.506 1.00 0.00 N ATOM 405 CA TYR A 28 20.135 -2.115 -22.841 1.00 0.00 C ATOM 406 C TYR A 28 20.230 -2.348 -21.331 1.00 0.00 C ATOM 407 O TYR A 28 19.250 -2.730 -20.691 1.00 0.00 O ATOM 408 CB TYR A 28 19.014 -1.126 -23.176 1.00 0.00 C ATOM 409 CG TYR A 28 19.429 0.326 -23.146 1.00 0.00 C ATOM 410 CD1 TYR A 28 20.112 0.893 -24.214 1.00 0.00 C ATOM 411 CD2 TYR A 28 19.132 1.128 -22.057 1.00 0.00 C ATOM 412 CE1 TYR A 28 20.490 2.222 -24.194 1.00 0.00 C ATOM 413 CE2 TYR A 28 19.507 2.457 -22.030 1.00 0.00 C ATOM 414 CZ TYR A 28 20.185 2.999 -23.098 1.00 0.00 C ATOM 415 OH TYR A 28 20.561 4.322 -23.067 1.00 0.00 O ATOM 0 H TYR A 28 18.876 -3.634 -23.522 1.00 0.00 H new ATOM 0 HA TYR A 28 21.083 -1.699 -23.184 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.625 -1.359 -24.167 1.00 0.00 H new ATOM 0 HB3 TYR A 28 18.196 -1.271 -22.471 1.00 0.00 H new ATOM 0 HD1 TYR A 28 20.352 0.285 -25.074 1.00 0.00 H new ATOM 0 HD2 TYR A 28 18.599 0.708 -21.216 1.00 0.00 H new ATOM 0 HE1 TYR A 28 21.021 2.649 -25.032 1.00 0.00 H new ATOM 0 HE2 TYR A 28 19.269 3.069 -21.173 1.00 0.00 H new ATOM 0 HH TYR A 28 21.169 4.472 -22.313 1.00 0.00 H new ATOM 425 N ILE A 29 21.410 -2.125 -20.768 1.00 0.00 N ATOM 426 CA ILE A 29 21.677 -2.483 -19.377 1.00 0.00 C ATOM 427 C ILE A 29 22.243 -1.309 -18.582 1.00 0.00 C ATOM 428 O ILE A 29 22.605 -0.279 -19.146 1.00 0.00 O ATOM 429 CB ILE A 29 22.636 -3.696 -19.277 1.00 0.00 C ATOM 430 CG1 ILE A 29 23.838 -3.542 -20.221 1.00 0.00 C ATOM 431 CG2 ILE A 29 21.892 -4.988 -19.577 1.00 0.00 C ATOM 432 CD1 ILE A 29 24.935 -2.642 -19.691 1.00 0.00 C ATOM 0 H ILE A 29 22.200 -1.698 -21.252 1.00 0.00 H new ATOM 0 HA ILE A 29 20.717 -2.758 -18.940 1.00 0.00 H new ATOM 0 HB ILE A 29 23.015 -3.735 -18.256 1.00 0.00 H new ATOM 0 HG12 ILE A 29 24.258 -4.528 -20.420 1.00 0.00 H new ATOM 0 HG13 ILE A 29 23.488 -3.146 -21.174 1.00 0.00 H new ATOM 0 HG21 ILE A 29 22.580 -5.830 -19.502 1.00 0.00 H new ATOM 0 HG22 ILE A 29 21.082 -5.117 -18.859 1.00 0.00 H new ATOM 0 HG23 ILE A 29 21.480 -4.945 -20.585 1.00 0.00 H new ATOM 0 HD11 ILE A 29 25.745 -2.588 -20.419 1.00 0.00 H new ATOM 0 HD12 ILE A 29 24.535 -1.643 -19.519 1.00 0.00 H new ATOM 0 HD13 ILE A 29 25.316 -3.046 -18.753 1.00 0.00 H new ATOM 444 N VAL A 30 22.330 -1.477 -17.269 1.00 0.00 N ATOM 445 CA VAL A 30 22.798 -0.412 -16.393 1.00 0.00 C ATOM 446 C VAL A 30 24.275 -0.583 -16.047 1.00 0.00 C ATOM 447 O VAL A 30 24.726 -1.676 -15.701 1.00 0.00 O ATOM 448 CB VAL A 30 21.985 -0.350 -15.083 1.00 0.00 C ATOM 449 CG1 VAL A 30 22.477 0.792 -14.208 1.00 0.00 C ATOM 450 CG2 VAL A 30 20.498 -0.202 -15.377 1.00 0.00 C ATOM 0 H VAL A 30 22.082 -2.341 -16.787 1.00 0.00 H new ATOM 0 HA VAL A 30 22.660 0.519 -16.943 1.00 0.00 H new ATOM 0 HB VAL A 30 22.131 -1.285 -14.543 1.00 0.00 H new ATOM 0 HG11 VAL A 30 21.894 0.823 -13.288 1.00 0.00 H new ATOM 0 HG12 VAL A 30 23.529 0.638 -13.966 1.00 0.00 H new ATOM 0 HG13 VAL A 30 22.362 1.735 -14.742 1.00 0.00 H new ATOM 0 HG21 VAL A 30 19.944 -0.160 -14.439 1.00 0.00 H new ATOM 0 HG22 VAL A 30 20.328 0.716 -15.940 1.00 0.00 H new ATOM 0 HG23 VAL A 30 20.156 -1.055 -15.963 1.00 0.00 H new ATOM 460 N ARG A 31 25.015 0.506 -16.162 1.00 0.00 N ATOM 461 CA ARG A 31 26.409 0.563 -15.753 1.00 0.00 C ATOM 462 C ARG A 31 26.582 1.699 -14.750 1.00 0.00 C ATOM 463 O ARG A 31 25.674 2.507 -14.566 1.00 0.00 O ATOM 464 CB ARG A 31 27.318 0.809 -16.963 1.00 0.00 C ATOM 465 CG ARG A 31 27.258 -0.273 -18.033 1.00 0.00 C ATOM 466 CD ARG A 31 27.975 -1.546 -17.605 1.00 0.00 C ATOM 467 NE ARG A 31 27.263 -2.271 -16.552 1.00 0.00 N ATOM 468 CZ ARG A 31 27.782 -3.292 -15.873 1.00 0.00 C ATOM 469 NH1 ARG A 31 29.022 -3.696 -16.126 1.00 0.00 N ATOM 470 NH2 ARG A 31 27.054 -3.909 -14.946 1.00 0.00 N ATOM 0 H ARG A 31 24.663 1.383 -16.545 1.00 0.00 H new ATOM 0 HA ARG A 31 26.686 -0.388 -15.299 1.00 0.00 H new ATOM 0 HB2 ARG A 31 27.048 1.764 -17.415 1.00 0.00 H new ATOM 0 HB3 ARG A 31 28.347 0.900 -16.615 1.00 0.00 H new ATOM 0 HG2 ARG A 31 26.216 -0.503 -18.257 1.00 0.00 H new ATOM 0 HG3 ARG A 31 27.706 0.103 -18.953 1.00 0.00 H new ATOM 0 HD2 ARG A 31 28.096 -2.198 -18.470 1.00 0.00 H new ATOM 0 HD3 ARG A 31 28.975 -1.293 -17.253 1.00 0.00 H new ATOM 0 HE ARG A 31 26.313 -1.977 -16.325 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.576 -3.224 -16.840 1.00 0.00 H new ATOM 0 HH12 ARG A 31 29.420 -4.478 -15.606 1.00 0.00 H new ATOM 0 HH21 ARG A 31 26.101 -3.600 -14.757 1.00 0.00 H new ATOM 0 HH22 ARG A 31 27.449 -4.691 -14.424 1.00 0.00 H new ATOM 484 N PHE A 32 27.728 1.763 -14.100 1.00 0.00 N ATOM 485 CA PHE A 32 28.018 2.865 -13.194 1.00 0.00 C ATOM 486 C PHE A 32 29.230 3.647 -13.672 1.00 0.00 C ATOM 487 O PHE A 32 29.602 4.666 -13.090 1.00 0.00 O ATOM 488 CB PHE A 32 28.211 2.367 -11.760 1.00 0.00 C ATOM 489 CG PHE A 32 26.911 2.190 -11.027 1.00 0.00 C ATOM 490 CD1 PHE A 32 26.138 1.056 -11.214 1.00 0.00 C ATOM 491 CD2 PHE A 32 26.454 3.172 -10.163 1.00 0.00 C ATOM 492 CE1 PHE A 32 24.937 0.903 -10.551 1.00 0.00 C ATOM 493 CE2 PHE A 32 25.252 3.025 -9.497 1.00 0.00 C ATOM 494 CZ PHE A 32 24.493 1.889 -9.691 1.00 0.00 C ATOM 0 H PHE A 32 28.472 1.070 -14.179 1.00 0.00 H new ATOM 0 HA PHE A 32 27.160 3.537 -13.194 1.00 0.00 H new ATOM 0 HB2 PHE A 32 28.745 1.417 -11.779 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.837 3.074 -11.215 1.00 0.00 H new ATOM 0 HD1 PHE A 32 26.479 0.283 -11.886 1.00 0.00 H new ATOM 0 HD2 PHE A 32 27.044 4.063 -10.008 1.00 0.00 H new ATOM 0 HE1 PHE A 32 24.345 0.013 -10.704 1.00 0.00 H new ATOM 0 HE2 PHE A 32 24.907 3.798 -8.826 1.00 0.00 H new ATOM 0 HZ PHE A 32 23.554 1.771 -9.172 1.00 0.00 H new ATOM 504 N SER A 33 29.845 3.161 -14.737 1.00 0.00 N ATOM 505 CA SER A 33 30.902 3.897 -15.401 1.00 0.00 C ATOM 506 C SER A 33 30.352 4.514 -16.682 1.00 0.00 C ATOM 507 O SER A 33 29.837 3.802 -17.549 1.00 0.00 O ATOM 508 CB SER A 33 32.072 2.971 -15.727 1.00 0.00 C ATOM 509 OG SER A 33 32.418 2.162 -14.613 1.00 0.00 O ATOM 0 H SER A 33 29.628 2.258 -15.159 1.00 0.00 H new ATOM 0 HA SER A 33 31.262 4.685 -14.740 1.00 0.00 H new ATOM 0 HB2 SER A 33 31.810 2.335 -16.573 1.00 0.00 H new ATOM 0 HB3 SER A 33 32.935 3.565 -16.029 1.00 0.00 H new ATOM 0 HG SER A 33 33.168 1.579 -14.853 1.00 0.00 H new ATOM 515 N GLU A 34 30.447 5.830 -16.795 1.00 0.00 N ATOM 516 CA GLU A 34 29.924 6.541 -17.956 1.00 0.00 C ATOM 517 C GLU A 34 30.677 6.143 -19.227 1.00 0.00 C ATOM 518 O GLU A 34 30.104 6.105 -20.312 1.00 0.00 O ATOM 519 CB GLU A 34 30.022 8.049 -17.729 1.00 0.00 C ATOM 520 CG GLU A 34 29.387 8.884 -18.829 1.00 0.00 C ATOM 521 CD GLU A 34 29.527 10.370 -18.577 1.00 0.00 C ATOM 522 OE1 GLU A 34 30.608 10.925 -18.866 1.00 0.00 O ATOM 523 OE2 GLU A 34 28.568 10.988 -18.078 1.00 0.00 O ATOM 0 H GLU A 34 30.883 6.431 -16.095 1.00 0.00 H new ATOM 0 HA GLU A 34 28.877 6.267 -18.086 1.00 0.00 H new ATOM 0 HB2 GLU A 34 29.545 8.295 -16.780 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.073 8.325 -17.639 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.850 8.635 -19.784 1.00 0.00 H new ATOM 0 HG3 GLU A 34 28.330 8.630 -18.911 1.00 0.00 H new ATOM 530 N ASP A 35 31.957 5.829 -19.079 1.00 0.00 N ATOM 531 CA ASP A 35 32.787 5.441 -20.217 1.00 0.00 C ATOM 532 C ASP A 35 33.081 3.939 -20.172 1.00 0.00 C ATOM 533 O ASP A 35 34.141 3.479 -20.596 1.00 0.00 O ATOM 534 CB ASP A 35 34.088 6.254 -20.224 1.00 0.00 C ATOM 535 CG ASP A 35 34.887 6.080 -21.506 1.00 0.00 C ATOM 536 OD1 ASP A 35 34.370 6.422 -22.590 1.00 0.00 O ATOM 537 OD2 ASP A 35 36.045 5.616 -21.432 1.00 0.00 O ATOM 0 H ASP A 35 32.445 5.835 -18.183 1.00 0.00 H new ATOM 0 HA ASP A 35 32.246 5.654 -21.139 1.00 0.00 H new ATOM 0 HB2 ASP A 35 33.852 7.310 -20.089 1.00 0.00 H new ATOM 0 HB3 ASP A 35 34.703 5.954 -19.375 1.00 0.00 H new ATOM 542 N SER A 36 32.129 3.175 -19.648 1.00 0.00 N ATOM 543 CA SER A 36 32.259 1.723 -19.585 1.00 0.00 C ATOM 544 C SER A 36 32.410 1.137 -20.988 1.00 0.00 C ATOM 545 O SER A 36 33.239 0.254 -21.223 1.00 0.00 O ATOM 546 CB SER A 36 31.044 1.119 -18.880 1.00 0.00 C ATOM 547 OG SER A 36 29.845 1.744 -19.311 1.00 0.00 O ATOM 0 H SER A 36 31.258 3.537 -19.260 1.00 0.00 H new ATOM 0 HA SER A 36 33.154 1.476 -19.014 1.00 0.00 H new ATOM 0 HB2 SER A 36 30.995 0.049 -19.084 1.00 0.00 H new ATOM 0 HB3 SER A 36 31.151 1.233 -17.801 1.00 0.00 H new ATOM 0 HG SER A 36 29.598 2.450 -18.678 1.00 0.00 H new ATOM 553 N PHE A 37 31.616 1.646 -21.916 1.00 0.00 N ATOM 554 CA PHE A 37 31.717 1.250 -23.309 1.00 0.00 C ATOM 555 C PHE A 37 32.543 2.275 -24.069 1.00 0.00 C ATOM 556 O PHE A 37 32.244 3.467 -24.030 1.00 0.00 O ATOM 557 CB PHE A 37 30.328 1.128 -23.939 1.00 0.00 C ATOM 558 CG PHE A 37 29.438 0.133 -23.252 1.00 0.00 C ATOM 559 CD1 PHE A 37 29.599 -1.225 -23.468 1.00 0.00 C ATOM 560 CD2 PHE A 37 28.442 0.558 -22.387 1.00 0.00 C ATOM 561 CE1 PHE A 37 28.783 -2.142 -22.835 1.00 0.00 C ATOM 562 CE2 PHE A 37 27.624 -0.354 -21.750 1.00 0.00 C ATOM 563 CZ PHE A 37 27.795 -1.706 -21.974 1.00 0.00 C ATOM 0 H PHE A 37 30.891 2.338 -21.727 1.00 0.00 H new ATOM 0 HA PHE A 37 32.204 0.276 -23.363 1.00 0.00 H new ATOM 0 HB2 PHE A 37 29.845 2.105 -23.924 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.437 0.843 -24.985 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.371 -1.571 -24.139 1.00 0.00 H new ATOM 0 HD2 PHE A 37 28.304 1.614 -22.209 1.00 0.00 H new ATOM 0 HE1 PHE A 37 28.917 -3.199 -23.013 1.00 0.00 H new ATOM 0 HE2 PHE A 37 26.852 -0.011 -21.078 1.00 0.00 H new ATOM 0 HZ PHE A 37 27.157 -2.421 -21.477 1.00 0.00 H new ATOM 573 N GLY A 38 33.584 1.817 -24.745 1.00 0.00 N ATOM 574 CA GLY A 38 34.444 2.731 -25.468 1.00 0.00 C ATOM 575 C GLY A 38 34.190 2.683 -26.956 1.00 0.00 C ATOM 576 O GLY A 38 33.244 3.294 -27.451 1.00 0.00 O ATOM 0 H GLY A 38 33.849 0.834 -24.807 1.00 0.00 H new ATOM 0 HA2 GLY A 38 34.283 3.746 -25.104 1.00 0.00 H new ATOM 0 HA3 GLY A 38 35.487 2.483 -25.269 1.00 0.00 H new ATOM 580 N MET A 39 35.026 1.941 -27.666 1.00 0.00 N ATOM 581 CA MET A 39 34.852 1.743 -29.100 1.00 0.00 C ATOM 582 C MET A 39 33.703 0.774 -29.356 1.00 0.00 C ATOM 583 O MET A 39 33.251 0.602 -30.488 1.00 0.00 O ATOM 584 CB MET A 39 36.140 1.194 -29.722 1.00 0.00 C ATOM 585 CG MET A 39 36.541 -0.174 -29.186 1.00 0.00 C ATOM 586 SD MET A 39 37.982 -0.864 -30.028 1.00 0.00 S ATOM 587 CE MET A 39 39.214 0.380 -29.654 1.00 0.00 C ATOM 0 H MET A 39 35.836 1.463 -27.272 1.00 0.00 H new ATOM 0 HA MET A 39 34.621 2.704 -29.559 1.00 0.00 H new ATOM 0 HB2 MET A 39 36.013 1.128 -30.803 1.00 0.00 H new ATOM 0 HB3 MET A 39 36.951 1.899 -29.539 1.00 0.00 H new ATOM 0 HG2 MET A 39 36.754 -0.093 -28.120 1.00 0.00 H new ATOM 0 HG3 MET A 39 35.701 -0.861 -29.292 1.00 0.00 H new ATOM 0 HE1 MET A 39 40.209 -0.028 -29.833 1.00 0.00 H new ATOM 0 HE2 MET A 39 39.058 1.250 -30.292 1.00 0.00 H new ATOM 0 HE3 MET A 39 39.126 0.676 -28.609 1.00 0.00 H new ATOM 597 N ASP A 40 33.251 0.139 -28.284 1.00 0.00 N ATOM 598 CA ASP A 40 32.196 -0.859 -28.352 1.00 0.00 C ATOM 599 C ASP A 40 30.858 -0.200 -28.639 1.00 0.00 C ATOM 600 O ASP A 40 30.187 -0.525 -29.617 1.00 0.00 O ATOM 601 CB ASP A 40 32.104 -1.619 -27.027 1.00 0.00 C ATOM 602 CG ASP A 40 33.464 -1.908 -26.433 1.00 0.00 C ATOM 603 OD1 ASP A 40 34.065 -2.944 -26.784 1.00 0.00 O ATOM 604 OD2 ASP A 40 33.943 -1.084 -25.624 1.00 0.00 O ATOM 0 H ASP A 40 33.607 0.302 -27.342 1.00 0.00 H new ATOM 0 HA ASP A 40 32.436 -1.553 -29.157 1.00 0.00 H new ATOM 0 HB2 ASP A 40 31.517 -1.036 -26.317 1.00 0.00 H new ATOM 0 HB3 ASP A 40 31.573 -2.558 -27.186 1.00 0.00 H new ATOM 609 N VAL A 41 30.473 0.720 -27.770 1.00 0.00 N ATOM 610 CA VAL A 41 29.196 1.404 -27.886 1.00 0.00 C ATOM 611 C VAL A 41 29.397 2.892 -27.654 1.00 0.00 C ATOM 612 O VAL A 41 30.180 3.285 -26.789 1.00 0.00 O ATOM 613 CB VAL A 41 28.164 0.855 -26.871 1.00 0.00 C ATOM 614 CG1 VAL A 41 26.817 1.547 -27.024 1.00 0.00 C ATOM 615 CG2 VAL A 41 28.007 -0.650 -27.022 1.00 0.00 C ATOM 0 H VAL A 41 31.033 1.012 -26.969 1.00 0.00 H new ATOM 0 HA VAL A 41 28.807 1.230 -28.889 1.00 0.00 H new ATOM 0 HB VAL A 41 28.540 1.066 -25.870 1.00 0.00 H new ATOM 0 HG11 VAL A 41 26.114 1.140 -26.297 1.00 0.00 H new ATOM 0 HG12 VAL A 41 26.936 2.617 -26.853 1.00 0.00 H new ATOM 0 HG13 VAL A 41 26.435 1.381 -28.031 1.00 0.00 H new ATOM 0 HG21 VAL A 41 27.277 -1.014 -26.299 1.00 0.00 H new ATOM 0 HG22 VAL A 41 27.665 -0.881 -28.031 1.00 0.00 H new ATOM 0 HG23 VAL A 41 28.967 -1.136 -26.845 1.00 0.00 H new ATOM 625 N ALA A 42 28.711 3.707 -28.442 1.00 0.00 N ATOM 626 CA ALA A 42 28.815 5.153 -28.329 1.00 0.00 C ATOM 627 C ALA A 42 28.399 5.627 -26.944 1.00 0.00 C ATOM 628 O ALA A 42 27.390 5.176 -26.400 1.00 0.00 O ATOM 629 CB ALA A 42 27.962 5.831 -29.392 1.00 0.00 C ATOM 0 H ALA A 42 28.073 3.388 -29.171 1.00 0.00 H new ATOM 0 HA ALA A 42 29.859 5.427 -28.484 1.00 0.00 H new ATOM 0 HB1 ALA A 42 28.051 6.913 -29.294 1.00 0.00 H new ATOM 0 HB2 ALA A 42 28.304 5.527 -30.381 1.00 0.00 H new ATOM 0 HB3 ALA A 42 26.920 5.539 -29.263 1.00 0.00 H new ATOM 635 N ASP A 43 29.180 6.545 -26.383 1.00 0.00 N ATOM 636 CA ASP A 43 28.868 7.140 -25.083 1.00 0.00 C ATOM 637 C ASP A 43 27.543 7.896 -25.144 1.00 0.00 C ATOM 638 O ASP A 43 26.896 8.125 -24.124 1.00 0.00 O ATOM 639 CB ASP A 43 29.995 8.078 -24.617 1.00 0.00 C ATOM 640 CG ASP A 43 30.312 9.182 -25.612 1.00 0.00 C ATOM 641 OD1 ASP A 43 29.507 10.126 -25.744 1.00 0.00 O ATOM 642 OD2 ASP A 43 31.374 9.112 -26.272 1.00 0.00 O ATOM 0 H ASP A 43 30.038 6.896 -26.809 1.00 0.00 H new ATOM 0 HA ASP A 43 28.778 6.331 -24.358 1.00 0.00 H new ATOM 0 HB2 ASP A 43 29.713 8.527 -23.665 1.00 0.00 H new ATOM 0 HB3 ASP A 43 30.896 7.491 -24.438 1.00 0.00 H new ATOM 647 N ASP A 44 27.137 8.255 -26.356 1.00 0.00 N ATOM 648 CA ASP A 44 25.859 8.920 -26.587 1.00 0.00 C ATOM 649 C ASP A 44 24.699 7.969 -26.307 1.00 0.00 C ATOM 650 O ASP A 44 23.583 8.395 -26.010 1.00 0.00 O ATOM 651 CB ASP A 44 25.793 9.417 -28.032 1.00 0.00 C ATOM 652 CG ASP A 44 24.475 10.079 -28.370 1.00 0.00 C ATOM 653 OD1 ASP A 44 24.162 11.130 -27.775 1.00 0.00 O ATOM 654 OD2 ASP A 44 23.761 9.568 -29.261 1.00 0.00 O ATOM 0 H ASP A 44 27.681 8.095 -27.204 1.00 0.00 H new ATOM 0 HA ASP A 44 25.777 9.769 -25.908 1.00 0.00 H new ATOM 0 HB2 ASP A 44 26.604 10.125 -28.204 1.00 0.00 H new ATOM 0 HB3 ASP A 44 25.955 8.577 -28.707 1.00 0.00 H new ATOM 659 N SER A 45 24.979 6.676 -26.382 1.00 0.00 N ATOM 660 CA SER A 45 23.977 5.654 -26.120 1.00 0.00 C ATOM 661 C SER A 45 24.025 5.225 -24.656 1.00 0.00 C ATOM 662 O SER A 45 23.403 4.241 -24.259 1.00 0.00 O ATOM 663 CB SER A 45 24.208 4.458 -27.041 1.00 0.00 C ATOM 664 OG SER A 45 24.164 4.865 -28.399 1.00 0.00 O ATOM 0 H SER A 45 25.899 6.308 -26.624 1.00 0.00 H new ATOM 0 HA SER A 45 22.987 6.065 -26.320 1.00 0.00 H new ATOM 0 HB2 SER A 45 25.174 4.003 -26.822 1.00 0.00 H new ATOM 0 HB3 SER A 45 23.449 3.698 -26.858 1.00 0.00 H new ATOM 0 HG SER A 45 24.315 4.089 -28.978 1.00 0.00 H new ATOM 670 N ILE A 46 24.779 5.972 -23.864 1.00 0.00 N ATOM 671 CA ILE A 46 24.850 5.751 -22.432 1.00 0.00 C ATOM 672 C ILE A 46 24.200 6.930 -21.717 1.00 0.00 C ATOM 673 O ILE A 46 24.723 8.041 -21.730 1.00 0.00 O ATOM 674 CB ILE A 46 26.311 5.581 -21.958 1.00 0.00 C ATOM 675 CG1 ILE A 46 26.991 4.458 -22.748 1.00 0.00 C ATOM 676 CG2 ILE A 46 26.355 5.285 -20.466 1.00 0.00 C ATOM 677 CD1 ILE A 46 28.464 4.295 -22.438 1.00 0.00 C ATOM 0 H ILE A 46 25.356 6.745 -24.196 1.00 0.00 H new ATOM 0 HA ILE A 46 24.319 4.830 -22.193 1.00 0.00 H new ATOM 0 HB ILE A 46 26.849 6.512 -22.138 1.00 0.00 H new ATOM 0 HG12 ILE A 46 26.480 3.519 -22.539 1.00 0.00 H new ATOM 0 HG13 ILE A 46 26.874 4.654 -23.814 1.00 0.00 H new ATOM 0 HG21 ILE A 46 27.391 5.168 -20.149 1.00 0.00 H new ATOM 0 HG22 ILE A 46 25.898 6.109 -19.918 1.00 0.00 H new ATOM 0 HG23 ILE A 46 25.807 4.365 -20.261 1.00 0.00 H new ATOM 0 HD11 ILE A 46 28.874 3.481 -23.036 1.00 0.00 H new ATOM 0 HD12 ILE A 46 28.990 5.220 -22.675 1.00 0.00 H new ATOM 0 HD13 ILE A 46 28.590 4.067 -21.380 1.00 0.00 H new ATOM 689 N THR A 47 23.046 6.692 -21.120 1.00 0.00 N ATOM 690 CA THR A 47 22.257 7.761 -20.538 1.00 0.00 C ATOM 691 C THR A 47 22.022 7.526 -19.049 1.00 0.00 C ATOM 692 O THR A 47 21.557 6.458 -18.648 1.00 0.00 O ATOM 693 CB THR A 47 20.902 7.878 -21.260 1.00 0.00 C ATOM 694 OG1 THR A 47 21.119 7.945 -22.677 1.00 0.00 O ATOM 695 CG2 THR A 47 20.135 9.112 -20.803 1.00 0.00 C ATOM 0 H THR A 47 22.634 5.764 -21.026 1.00 0.00 H new ATOM 0 HA THR A 47 22.815 8.689 -20.659 1.00 0.00 H new ATOM 0 HB THR A 47 20.308 6.998 -21.014 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.257 8.018 -23.137 1.00 0.00 H new ATOM 0 HG21 THR A 47 19.183 9.165 -21.332 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.951 9.050 -19.730 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.721 10.005 -21.020 1.00 0.00 H new ATOM 703 N PRO A 48 22.366 8.515 -18.212 1.00 0.00 N ATOM 704 CA PRO A 48 22.109 8.457 -16.772 1.00 0.00 C ATOM 705 C PRO A 48 20.631 8.223 -16.476 1.00 0.00 C ATOM 706 O PRO A 48 19.766 8.913 -17.017 1.00 0.00 O ATOM 707 CB PRO A 48 22.533 9.839 -16.267 1.00 0.00 C ATOM 708 CG PRO A 48 23.464 10.370 -17.302 1.00 0.00 C ATOM 709 CD PRO A 48 23.038 9.765 -18.610 1.00 0.00 C ATOM 0 HA PRO A 48 22.646 7.637 -16.294 1.00 0.00 H new ATOM 0 HB2 PRO A 48 21.670 10.493 -16.142 1.00 0.00 H new ATOM 0 HB3 PRO A 48 23.023 9.769 -15.296 1.00 0.00 H new ATOM 0 HG2 PRO A 48 23.417 11.458 -17.344 1.00 0.00 H new ATOM 0 HG3 PRO A 48 24.495 10.104 -17.069 1.00 0.00 H new ATOM 0 HD2 PRO A 48 22.365 10.425 -19.157 1.00 0.00 H new ATOM 0 HD3 PRO A 48 23.892 9.572 -19.259 1.00 0.00 H new ATOM 717 N THR A 49 20.342 7.265 -15.605 1.00 0.00 N ATOM 718 CA THR A 49 18.964 6.908 -15.290 1.00 0.00 C ATOM 719 C THR A 49 18.238 8.068 -14.605 1.00 0.00 C ATOM 720 O THR A 49 17.010 8.093 -14.543 1.00 0.00 O ATOM 721 CB THR A 49 18.895 5.644 -14.404 1.00 0.00 C ATOM 722 OG1 THR A 49 17.533 5.269 -14.179 1.00 0.00 O ATOM 723 CG2 THR A 49 19.588 5.869 -13.069 1.00 0.00 C ATOM 0 H THR A 49 21.044 6.721 -15.103 1.00 0.00 H new ATOM 0 HA THR A 49 18.464 6.691 -16.234 1.00 0.00 H new ATOM 0 HB THR A 49 19.411 4.841 -14.931 1.00 0.00 H new ATOM 0 HG1 THR A 49 16.951 6.041 -14.337 1.00 0.00 H new ATOM 0 HG21 THR A 49 19.523 4.962 -12.468 1.00 0.00 H new ATOM 0 HG22 THR A 49 20.636 6.116 -13.240 1.00 0.00 H new ATOM 0 HG23 THR A 49 19.103 6.690 -12.541 1.00 0.00 H new ATOM 731 N SER A 50 19.008 9.032 -14.117 1.00 0.00 N ATOM 732 CA SER A 50 18.462 10.221 -13.483 1.00 0.00 C ATOM 733 C SER A 50 17.632 11.031 -14.478 1.00 0.00 C ATOM 734 O SER A 50 16.667 11.696 -14.106 1.00 0.00 O ATOM 735 CB SER A 50 19.612 11.075 -12.960 1.00 0.00 C ATOM 736 OG SER A 50 20.706 10.258 -12.571 1.00 0.00 O ATOM 0 H SER A 50 20.027 9.010 -14.150 1.00 0.00 H new ATOM 0 HA SER A 50 17.814 9.920 -12.660 1.00 0.00 H new ATOM 0 HB2 SER A 50 19.931 11.776 -13.731 1.00 0.00 H new ATOM 0 HB3 SER A 50 19.274 11.668 -12.110 1.00 0.00 H new ATOM 0 HG SER A 50 20.660 10.087 -11.607 1.00 0.00 H new ATOM 742 N GLU A 51 18.018 10.963 -15.748 1.00 0.00 N ATOM 743 CA GLU A 51 17.358 11.732 -16.792 1.00 0.00 C ATOM 744 C GLU A 51 16.704 10.800 -17.811 1.00 0.00 C ATOM 745 O GLU A 51 15.844 11.211 -18.586 1.00 0.00 O ATOM 746 CB GLU A 51 18.376 12.654 -17.471 1.00 0.00 C ATOM 747 CG GLU A 51 17.763 13.695 -18.394 1.00 0.00 C ATOM 748 CD GLU A 51 18.786 14.699 -18.880 1.00 0.00 C ATOM 749 OE1 GLU A 51 19.430 14.450 -19.916 1.00 0.00 O ATOM 750 OE2 GLU A 51 18.970 15.737 -18.208 1.00 0.00 O ATOM 0 H GLU A 51 18.788 10.380 -16.078 1.00 0.00 H new ATOM 0 HA GLU A 51 16.573 12.343 -16.346 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.955 13.164 -16.702 1.00 0.00 H new ATOM 0 HB3 GLU A 51 19.075 12.044 -18.044 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.309 13.197 -19.251 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.963 14.218 -17.869 1.00 0.00 H new ATOM 757 N PHE A 52 17.106 9.532 -17.785 1.00 0.00 N ATOM 758 CA PHE A 52 16.564 8.524 -18.694 1.00 0.00 C ATOM 759 C PHE A 52 15.080 8.288 -18.415 1.00 0.00 C ATOM 760 O PHE A 52 14.331 7.844 -19.283 1.00 0.00 O ATOM 761 CB PHE A 52 17.347 7.212 -18.548 1.00 0.00 C ATOM 762 CG PHE A 52 16.981 6.163 -19.561 1.00 0.00 C ATOM 763 CD1 PHE A 52 17.386 6.292 -20.879 1.00 0.00 C ATOM 764 CD2 PHE A 52 16.235 5.052 -19.196 1.00 0.00 C ATOM 765 CE1 PHE A 52 17.054 5.334 -21.816 1.00 0.00 C ATOM 766 CE2 PHE A 52 15.900 4.092 -20.131 1.00 0.00 C ATOM 767 CZ PHE A 52 16.310 4.233 -21.442 1.00 0.00 C ATOM 0 H PHE A 52 17.811 9.176 -17.139 1.00 0.00 H new ATOM 0 HA PHE A 52 16.666 8.887 -19.717 1.00 0.00 H new ATOM 0 HB2 PHE A 52 18.413 7.426 -18.631 1.00 0.00 H new ATOM 0 HB3 PHE A 52 17.180 6.811 -17.548 1.00 0.00 H new ATOM 0 HD1 PHE A 52 17.968 7.152 -21.177 1.00 0.00 H new ATOM 0 HD2 PHE A 52 15.913 4.937 -18.172 1.00 0.00 H new ATOM 0 HE1 PHE A 52 17.376 5.446 -22.841 1.00 0.00 H new ATOM 0 HE2 PHE A 52 15.318 3.231 -19.837 1.00 0.00 H new ATOM 0 HZ PHE A 52 16.049 3.483 -22.174 1.00 0.00 H new ATOM 777 N VAL A 53 14.664 8.608 -17.197 1.00 0.00 N ATOM 778 CA VAL A 53 13.277 8.442 -16.792 1.00 0.00 C ATOM 779 C VAL A 53 12.409 9.584 -17.320 1.00 0.00 C ATOM 780 O VAL A 53 11.180 9.535 -17.231 1.00 0.00 O ATOM 781 CB VAL A 53 13.146 8.379 -15.256 1.00 0.00 C ATOM 782 CG1 VAL A 53 13.904 7.188 -14.697 1.00 0.00 C ATOM 783 CG2 VAL A 53 13.639 9.670 -14.620 1.00 0.00 C ATOM 0 H VAL A 53 15.272 8.986 -16.470 1.00 0.00 H new ATOM 0 HA VAL A 53 12.932 7.500 -17.219 1.00 0.00 H new ATOM 0 HB VAL A 53 12.091 8.257 -15.013 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.797 7.165 -13.613 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.501 6.268 -15.121 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.959 7.275 -14.955 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.538 9.604 -13.537 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.687 9.826 -14.878 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.046 10.507 -14.989 1.00 0.00 H new ATOM 793 N TRP A 54 13.053 10.602 -17.878 1.00 0.00 N ATOM 794 CA TRP A 54 12.348 11.782 -18.351 1.00 0.00 C ATOM 795 C TRP A 54 12.169 11.747 -19.862 1.00 0.00 C ATOM 796 O TRP A 54 13.084 11.401 -20.611 1.00 0.00 O ATOM 797 CB TRP A 54 13.090 13.054 -17.938 1.00 0.00 C ATOM 798 CG TRP A 54 13.158 13.241 -16.453 1.00 0.00 C ATOM 799 CD1 TRP A 54 14.206 12.939 -15.635 1.00 0.00 C ATOM 800 CD2 TRP A 54 12.127 13.764 -15.607 1.00 0.00 C ATOM 801 NE1 TRP A 54 13.895 13.244 -14.334 1.00 0.00 N ATOM 802 CE2 TRP A 54 12.624 13.752 -14.290 1.00 0.00 C ATOM 803 CE3 TRP A 54 10.832 14.241 -15.834 1.00 0.00 C ATOM 804 CZ2 TRP A 54 11.870 14.198 -13.206 1.00 0.00 C ATOM 805 CZ3 TRP A 54 10.088 14.684 -14.758 1.00 0.00 C ATOM 806 CH2 TRP A 54 10.609 14.661 -13.460 1.00 0.00 C ATOM 0 H TRP A 54 14.064 10.632 -18.013 1.00 0.00 H new ATOM 0 HA TRP A 54 11.360 11.786 -17.891 1.00 0.00 H new ATOM 0 HB2 TRP A 54 14.102 13.023 -18.341 1.00 0.00 H new ATOM 0 HB3 TRP A 54 12.595 13.917 -18.384 1.00 0.00 H new ATOM 0 HD1 TRP A 54 15.146 12.520 -15.964 1.00 0.00 H new ATOM 0 HE1 TRP A 54 14.510 13.114 -13.531 1.00 0.00 H new ATOM 0 HE3 TRP A 54 10.421 14.263 -16.833 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 12.267 14.179 -12.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 9.087 15.055 -14.922 1.00 0.00 H new ATOM 0 HH2 TRP A 54 10.002 15.017 -12.641 1.00 0.00 H new ATOM 817 N SER A 55 10.976 12.099 -20.297 1.00 0.00 N ATOM 818 CA SER A 55 10.645 12.139 -21.707 1.00 0.00 C ATOM 819 C SER A 55 10.281 13.565 -22.109 1.00 0.00 C ATOM 820 O SER A 55 9.278 14.111 -21.650 1.00 0.00 O ATOM 821 CB SER A 55 9.486 11.179 -21.987 1.00 0.00 C ATOM 822 OG SER A 55 9.102 11.195 -23.350 1.00 0.00 O ATOM 0 H SER A 55 10.207 12.366 -19.682 1.00 0.00 H new ATOM 0 HA SER A 55 11.506 11.825 -22.298 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.777 10.167 -21.704 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.632 11.451 -21.366 1.00 0.00 H new ATOM 0 HG SER A 55 8.607 10.376 -23.560 1.00 0.00 H new ATOM 828 N SER A 56 11.114 14.175 -22.935 1.00 0.00 N ATOM 829 CA SER A 56 10.890 15.543 -23.374 1.00 0.00 C ATOM 830 C SER A 56 9.689 15.613 -24.316 1.00 0.00 C ATOM 831 O SER A 56 9.655 14.945 -25.352 1.00 0.00 O ATOM 832 CB SER A 56 12.145 16.086 -24.062 1.00 0.00 C ATOM 833 OG SER A 56 12.016 17.465 -24.360 1.00 0.00 O ATOM 0 H SER A 56 11.955 13.743 -23.317 1.00 0.00 H new ATOM 0 HA SER A 56 10.675 16.160 -22.501 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.011 15.931 -23.418 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.328 15.529 -24.981 1.00 0.00 H new ATOM 0 HG SER A 56 12.833 17.783 -24.797 1.00 0.00 H new ATOM 839 N VAL A 57 8.699 16.414 -23.941 1.00 0.00 N ATOM 840 CA VAL A 57 7.483 16.555 -24.734 1.00 0.00 C ATOM 841 C VAL A 57 7.344 17.973 -25.273 1.00 0.00 C ATOM 842 O VAL A 57 6.349 18.313 -25.914 1.00 0.00 O ATOM 843 CB VAL A 57 6.223 16.190 -23.921 1.00 0.00 C ATOM 844 CG1 VAL A 57 6.205 14.704 -23.606 1.00 0.00 C ATOM 845 CG2 VAL A 57 6.145 17.010 -22.639 1.00 0.00 C ATOM 0 H VAL A 57 8.714 16.977 -23.091 1.00 0.00 H new ATOM 0 HA VAL A 57 7.569 15.859 -25.568 1.00 0.00 H new ATOM 0 HB VAL A 57 5.348 16.426 -24.527 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.310 14.464 -23.032 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.203 14.135 -24.536 1.00 0.00 H new ATOM 0 HG13 VAL A 57 7.089 14.445 -23.024 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.248 16.734 -22.084 1.00 0.00 H new ATOM 0 HG22 VAL A 57 7.025 16.813 -22.027 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.106 18.071 -22.887 1.00 0.00 H new ATOM 855 N ARG A 58 8.354 18.789 -25.011 1.00 0.00 N ATOM 856 CA ARG A 58 8.383 20.165 -25.479 1.00 0.00 C ATOM 857 C ARG A 58 9.807 20.691 -25.435 1.00 0.00 C ATOM 858 O ARG A 58 10.743 19.936 -25.185 1.00 0.00 O ATOM 859 CB ARG A 58 7.465 21.054 -24.631 1.00 0.00 C ATOM 860 CG ARG A 58 6.252 21.576 -25.387 1.00 0.00 C ATOM 861 CD ARG A 58 6.663 22.463 -26.551 1.00 0.00 C ATOM 862 NE ARG A 58 5.526 22.864 -27.374 1.00 0.00 N ATOM 863 CZ ARG A 58 5.580 23.811 -28.309 1.00 0.00 C ATOM 864 NH1 ARG A 58 6.707 24.481 -28.519 1.00 0.00 N ATOM 865 NH2 ARG A 58 4.504 24.088 -29.035 1.00 0.00 N ATOM 0 H ARG A 58 9.174 18.516 -24.469 1.00 0.00 H new ATOM 0 HA ARG A 58 8.020 20.188 -26.507 1.00 0.00 H new ATOM 0 HB2 ARG A 58 7.126 20.488 -23.763 1.00 0.00 H new ATOM 0 HB3 ARG A 58 8.040 21.900 -24.255 1.00 0.00 H new ATOM 0 HG2 ARG A 58 5.663 20.737 -25.757 1.00 0.00 H new ATOM 0 HG3 ARG A 58 5.612 22.139 -24.707 1.00 0.00 H new ATOM 0 HD2 ARG A 58 7.162 23.353 -26.167 1.00 0.00 H new ATOM 0 HD3 ARG A 58 7.387 21.933 -27.170 1.00 0.00 H new ATOM 0 HE ARG A 58 4.635 22.390 -27.224 1.00 0.00 H new ATOM 0 HH11 ARG A 58 7.536 24.271 -27.963 1.00 0.00 H new ATOM 0 HH12 ARG A 58 6.744 25.205 -29.236 1.00 0.00 H new ATOM 0 HH21 ARG A 58 3.636 23.576 -28.877 1.00 0.00 H new ATOM 0 HH22 ARG A 58 4.545 24.813 -29.751 1.00 0.00 H new ATOM 879 N ASP A 59 9.961 21.983 -25.678 1.00 0.00 N ATOM 880 CA ASP A 59 11.269 22.625 -25.675 1.00 0.00 C ATOM 881 C ASP A 59 11.950 22.455 -24.322 1.00 0.00 C ATOM 882 O ASP A 59 13.118 22.079 -24.242 1.00 0.00 O ATOM 883 CB ASP A 59 11.115 24.114 -25.987 1.00 0.00 C ATOM 884 CG ASP A 59 10.252 24.368 -27.206 1.00 0.00 C ATOM 885 OD1 ASP A 59 9.011 24.392 -27.060 1.00 0.00 O ATOM 886 OD2 ASP A 59 10.804 24.549 -28.309 1.00 0.00 O ATOM 0 H ASP A 59 9.187 22.615 -25.882 1.00 0.00 H new ATOM 0 HA ASP A 59 11.887 22.153 -26.439 1.00 0.00 H new ATOM 0 HB2 ASP A 59 10.678 24.619 -25.125 1.00 0.00 H new ATOM 0 HB3 ASP A 59 12.100 24.552 -26.147 1.00 0.00 H new ATOM 891 N ASP A 60 11.203 22.726 -23.262 1.00 0.00 N ATOM 892 CA ASP A 60 11.740 22.668 -21.905 1.00 0.00 C ATOM 893 C ASP A 60 10.939 21.704 -21.029 1.00 0.00 C ATOM 894 O ASP A 60 11.439 21.189 -20.029 1.00 0.00 O ATOM 895 CB ASP A 60 11.726 24.074 -21.298 1.00 0.00 C ATOM 896 CG ASP A 60 12.153 24.105 -19.845 1.00 0.00 C ATOM 897 OD1 ASP A 60 13.371 24.073 -19.570 1.00 0.00 O ATOM 898 OD2 ASP A 60 11.272 24.198 -18.971 1.00 0.00 O ATOM 0 H ASP A 60 10.219 22.990 -23.313 1.00 0.00 H new ATOM 0 HA ASP A 60 12.764 22.296 -21.951 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.387 24.719 -21.877 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.722 24.489 -21.383 1.00 0.00 H new ATOM 903 N VAL A 61 9.697 21.449 -21.421 1.00 0.00 N ATOM 904 CA VAL A 61 8.803 20.615 -20.628 1.00 0.00 C ATOM 905 C VAL A 61 9.087 19.133 -20.853 1.00 0.00 C ATOM 906 O VAL A 61 8.986 18.630 -21.975 1.00 0.00 O ATOM 907 CB VAL A 61 7.324 20.900 -20.963 1.00 0.00 C ATOM 908 CG1 VAL A 61 6.399 20.136 -20.027 1.00 0.00 C ATOM 909 CG2 VAL A 61 7.036 22.391 -20.903 1.00 0.00 C ATOM 0 H VAL A 61 9.286 21.808 -22.283 1.00 0.00 H new ATOM 0 HA VAL A 61 8.986 20.862 -19.582 1.00 0.00 H new ATOM 0 HB VAL A 61 7.136 20.557 -21.980 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.362 20.353 -20.283 1.00 0.00 H new ATOM 0 HG12 VAL A 61 6.581 19.066 -20.129 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.590 20.441 -18.998 1.00 0.00 H new ATOM 0 HG21 VAL A 61 5.988 22.569 -21.143 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.247 22.762 -19.900 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.666 22.913 -21.623 1.00 0.00 H new ATOM 919 N MET A 62 9.449 18.441 -19.783 1.00 0.00 N ATOM 920 CA MET A 62 9.670 17.003 -19.834 1.00 0.00 C ATOM 921 C MET A 62 8.628 16.289 -18.984 1.00 0.00 C ATOM 922 O MET A 62 8.023 16.894 -18.104 1.00 0.00 O ATOM 923 CB MET A 62 11.076 16.650 -19.340 1.00 0.00 C ATOM 924 CG MET A 62 12.191 17.227 -20.198 1.00 0.00 C ATOM 925 SD MET A 62 13.832 16.747 -19.625 1.00 0.00 S ATOM 926 CE MET A 62 14.862 17.576 -20.833 1.00 0.00 C ATOM 0 H MET A 62 9.597 18.855 -18.863 1.00 0.00 H new ATOM 0 HA MET A 62 9.577 16.677 -20.870 1.00 0.00 H new ATOM 0 HB2 MET A 62 11.193 17.011 -18.318 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.178 15.565 -19.309 1.00 0.00 H new ATOM 0 HG2 MET A 62 12.059 16.896 -21.228 1.00 0.00 H new ATOM 0 HG3 MET A 62 12.116 18.314 -20.201 1.00 0.00 H new ATOM 0 HE1 MET A 62 15.911 17.376 -20.615 1.00 0.00 H new ATOM 0 HE2 MET A 62 14.622 17.207 -21.830 1.00 0.00 H new ATOM 0 HE3 MET A 62 14.681 18.650 -20.790 1.00 0.00 H new ATOM 936 N ARG A 63 8.409 15.014 -19.255 1.00 0.00 N ATOM 937 CA ARG A 63 7.450 14.224 -18.493 1.00 0.00 C ATOM 938 C ARG A 63 8.139 13.016 -17.871 1.00 0.00 C ATOM 939 O ARG A 63 9.132 12.523 -18.404 1.00 0.00 O ATOM 940 CB ARG A 63 6.309 13.745 -19.398 1.00 0.00 C ATOM 941 CG ARG A 63 6.758 12.721 -20.429 1.00 0.00 C ATOM 942 CD ARG A 63 5.604 12.191 -21.261 1.00 0.00 C ATOM 943 NE ARG A 63 6.038 11.116 -22.152 1.00 0.00 N ATOM 944 CZ ARG A 63 5.219 10.208 -22.678 1.00 0.00 C ATOM 945 NH1 ARG A 63 3.906 10.326 -22.528 1.00 0.00 N ATOM 946 NH2 ARG A 63 5.714 9.200 -23.386 1.00 0.00 N ATOM 0 H ARG A 63 8.882 14.500 -19.998 1.00 0.00 H new ATOM 0 HA ARG A 63 7.040 14.855 -17.704 1.00 0.00 H new ATOM 0 HB2 ARG A 63 5.522 13.311 -18.782 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.875 14.603 -19.911 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.499 13.174 -21.088 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.248 11.890 -19.922 1.00 0.00 H new ATOM 0 HD2 ARG A 63 4.817 11.824 -20.602 1.00 0.00 H new ATOM 0 HD3 ARG A 63 5.175 13.002 -21.849 1.00 0.00 H new ATOM 0 HE ARG A 63 7.029 11.058 -22.385 1.00 0.00 H new ATOM 0 HH11 ARG A 63 3.521 11.115 -22.008 1.00 0.00 H new ATOM 0 HH12 ARG A 63 3.282 9.628 -22.933 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.721 9.122 -23.527 1.00 0.00 H new ATOM 0 HH22 ARG A 63 5.087 8.504 -23.789 1.00 0.00 H new ATOM 960 N LEU A 64 7.623 12.552 -16.746 1.00 0.00 N ATOM 961 CA LEU A 64 8.107 11.321 -16.142 1.00 0.00 C ATOM 962 C LEU A 64 7.515 10.138 -16.902 1.00 0.00 C ATOM 963 O LEU A 64 6.299 9.940 -16.906 1.00 0.00 O ATOM 964 CB LEU A 64 7.716 11.271 -14.656 1.00 0.00 C ATOM 965 CG LEU A 64 8.578 10.368 -13.756 1.00 0.00 C ATOM 966 CD1 LEU A 64 8.387 8.896 -14.091 1.00 0.00 C ATOM 967 CD2 LEU A 64 10.045 10.755 -13.872 1.00 0.00 C ATOM 0 H LEU A 64 6.869 13.008 -16.232 1.00 0.00 H new ATOM 0 HA LEU A 64 9.195 11.278 -16.201 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.752 12.285 -14.258 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.681 10.937 -14.585 1.00 0.00 H new ATOM 0 HG LEU A 64 8.253 10.516 -12.726 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.012 8.290 -13.435 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.341 8.624 -13.950 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.671 8.719 -15.128 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.644 10.109 -13.230 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.370 10.642 -14.906 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.173 11.792 -13.563 1.00 0.00 H new ATOM 979 N GLY A 65 8.374 9.370 -17.555 1.00 0.00 N ATOM 980 CA GLY A 65 7.909 8.293 -18.401 1.00 0.00 C ATOM 981 C GLY A 65 7.826 6.966 -17.682 1.00 0.00 C ATOM 982 O GLY A 65 8.758 6.570 -16.995 1.00 0.00 O ATOM 0 H GLY A 65 9.388 9.475 -17.513 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.925 8.548 -18.795 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.579 8.195 -19.255 1.00 0.00 H new ATOM 986 N ARG A 66 6.700 6.283 -17.836 1.00 0.00 N ATOM 987 CA ARG A 66 6.528 4.938 -17.294 1.00 0.00 C ATOM 988 C ARG A 66 7.394 3.921 -18.036 1.00 0.00 C ATOM 989 O ARG A 66 7.657 2.831 -17.532 1.00 0.00 O ATOM 990 CB ARG A 66 5.055 4.525 -17.359 1.00 0.00 C ATOM 991 CG ARG A 66 4.199 5.229 -16.323 1.00 0.00 C ATOM 992 CD ARG A 66 2.719 4.918 -16.482 1.00 0.00 C ATOM 993 NE ARG A 66 2.135 5.574 -17.653 1.00 0.00 N ATOM 994 CZ ARG A 66 1.710 6.840 -17.662 1.00 0.00 C ATOM 995 NH1 ARG A 66 1.898 7.616 -16.601 1.00 0.00 N ATOM 996 NH2 ARG A 66 1.122 7.339 -18.743 1.00 0.00 N ATOM 0 H ARG A 66 5.885 6.640 -18.335 1.00 0.00 H new ATOM 0 HA ARG A 66 6.849 4.954 -16.253 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.665 4.742 -18.354 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.978 3.447 -17.215 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.524 4.933 -15.326 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.351 6.305 -16.401 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.584 3.840 -16.568 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.185 5.236 -15.586 1.00 0.00 H new ATOM 0 HE ARG A 66 2.048 5.032 -18.513 1.00 0.00 H new ATOM 0 HH11 ARG A 66 2.369 7.246 -15.775 1.00 0.00 H new ATOM 0 HH12 ARG A 66 1.572 8.582 -16.612 1.00 0.00 H new ATOM 0 HH21 ARG A 66 0.994 6.755 -19.569 1.00 0.00 H new ATOM 0 HH22 ARG A 66 0.798 8.306 -18.747 1.00 0.00 H new ATOM 1010 N GLU A 67 7.848 4.293 -19.227 1.00 0.00 N ATOM 1011 CA GLU A 67 8.589 3.383 -20.096 1.00 0.00 C ATOM 1012 C GLU A 67 9.958 3.018 -19.519 1.00 0.00 C ATOM 1013 O GLU A 67 10.509 1.965 -19.839 1.00 0.00 O ATOM 1014 CB GLU A 67 8.739 3.995 -21.487 1.00 0.00 C ATOM 1015 CG GLU A 67 7.403 4.313 -22.137 1.00 0.00 C ATOM 1016 CD GLU A 67 7.535 4.721 -23.587 1.00 0.00 C ATOM 1017 OE1 GLU A 67 7.712 3.828 -24.441 1.00 0.00 O ATOM 1018 OE2 GLU A 67 7.444 5.930 -23.884 1.00 0.00 O ATOM 0 H GLU A 67 7.715 5.226 -19.617 1.00 0.00 H new ATOM 0 HA GLU A 67 8.017 2.458 -20.168 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.330 4.908 -21.415 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.293 3.306 -22.124 1.00 0.00 H new ATOM 0 HG2 GLU A 67 6.755 3.440 -22.068 1.00 0.00 H new ATOM 0 HG3 GLU A 67 6.917 5.115 -21.582 1.00 0.00 H new ATOM 1025 N GLN A 68 10.497 3.880 -18.663 1.00 0.00 N ATOM 1026 CA GLN A 68 11.781 3.610 -18.013 1.00 0.00 C ATOM 1027 C GLN A 68 11.682 2.363 -17.136 1.00 0.00 C ATOM 1028 O GLN A 68 12.621 1.570 -17.045 1.00 0.00 O ATOM 1029 CB GLN A 68 12.232 4.825 -17.183 1.00 0.00 C ATOM 1030 CG GLN A 68 11.204 5.298 -16.165 1.00 0.00 C ATOM 1031 CD GLN A 68 11.476 4.826 -14.748 1.00 0.00 C ATOM 1032 OE1 GLN A 68 12.071 3.779 -14.525 1.00 0.00 O ATOM 1033 NE2 GLN A 68 11.025 5.602 -13.774 1.00 0.00 N ATOM 0 H GLN A 68 10.069 4.769 -18.402 1.00 0.00 H new ATOM 0 HA GLN A 68 12.529 3.428 -18.785 1.00 0.00 H new ATOM 0 HB2 GLN A 68 13.155 4.573 -16.661 1.00 0.00 H new ATOM 0 HB3 GLN A 68 12.463 5.648 -17.859 1.00 0.00 H new ATOM 0 HG2 GLN A 68 11.173 6.388 -16.174 1.00 0.00 H new ATOM 0 HG3 GLN A 68 10.218 4.948 -16.470 1.00 0.00 H new ATOM 0 HE21 GLN A 68 10.534 6.467 -13.998 1.00 0.00 H new ATOM 0 HE22 GLN A 68 11.169 5.334 -12.800 1.00 0.00 H new ATOM 1042 N LEU A 69 10.513 2.182 -16.531 1.00 0.00 N ATOM 1043 CA LEU A 69 10.269 1.071 -15.624 1.00 0.00 C ATOM 1044 C LEU A 69 10.301 -0.252 -16.373 1.00 0.00 C ATOM 1045 O LEU A 69 10.751 -1.264 -15.841 1.00 0.00 O ATOM 1046 CB LEU A 69 8.913 1.252 -14.938 1.00 0.00 C ATOM 1047 CG LEU A 69 8.787 2.512 -14.077 1.00 0.00 C ATOM 1048 CD1 LEU A 69 7.329 2.798 -13.762 1.00 0.00 C ATOM 1049 CD2 LEU A 69 9.585 2.361 -12.791 1.00 0.00 C ATOM 0 H LEU A 69 9.711 2.800 -16.656 1.00 0.00 H new ATOM 0 HA LEU A 69 11.056 1.058 -14.870 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.136 1.273 -15.702 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.720 0.381 -14.311 1.00 0.00 H new ATOM 0 HG LEU A 69 9.192 3.353 -14.640 1.00 0.00 H new ATOM 0 HD11 LEU A 69 7.259 3.697 -13.149 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.779 2.948 -14.691 1.00 0.00 H new ATOM 0 HD13 LEU A 69 6.902 1.955 -13.219 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.484 3.266 -12.192 1.00 0.00 H new ATOM 0 HD22 LEU A 69 9.208 1.508 -12.227 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.636 2.201 -13.032 1.00 0.00 H new ATOM 1061 N GLN A 70 9.841 -0.223 -17.618 1.00 0.00 N ATOM 1062 CA GLN A 70 9.787 -1.416 -18.454 1.00 0.00 C ATOM 1063 C GLN A 70 11.187 -1.989 -18.646 1.00 0.00 C ATOM 1064 O GLN A 70 11.391 -3.201 -18.610 1.00 0.00 O ATOM 1065 CB GLN A 70 9.176 -1.078 -19.818 1.00 0.00 C ATOM 1066 CG GLN A 70 7.890 -0.265 -19.734 1.00 0.00 C ATOM 1067 CD GLN A 70 6.747 -1.010 -19.071 1.00 0.00 C ATOM 1068 OE1 GLN A 70 6.682 -2.315 -19.278 1.00 0.00 O flip ATOM 1069 NE2 GLN A 70 5.908 -0.406 -18.405 1.00 0.00 N flip ATOM 0 H GLN A 70 9.497 0.622 -18.074 1.00 0.00 H new ATOM 0 HA GLN A 70 9.163 -2.159 -17.958 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.907 -0.523 -20.405 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.974 -2.005 -20.354 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.085 0.653 -19.180 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.588 0.028 -20.740 1.00 0.00 H new ATOM 0 HE21 GLN A 70 5.994 0.601 -18.269 1.00 0.00 H new ATOM 0 HE22 GLN A 70 5.126 -0.912 -17.989 1.00 0.00 H new ATOM 1078 N ILE A 71 12.149 -1.100 -18.841 1.00 0.00 N ATOM 1079 CA ILE A 71 13.533 -1.502 -19.036 1.00 0.00 C ATOM 1080 C ILE A 71 14.168 -1.937 -17.716 1.00 0.00 C ATOM 1081 O ILE A 71 14.851 -2.963 -17.651 1.00 0.00 O ATOM 1082 CB ILE A 71 14.358 -0.357 -19.666 1.00 0.00 C ATOM 1083 CG1 ILE A 71 13.754 0.028 -21.022 1.00 0.00 C ATOM 1084 CG2 ILE A 71 15.822 -0.762 -19.822 1.00 0.00 C ATOM 1085 CD1 ILE A 71 14.468 1.171 -21.708 1.00 0.00 C ATOM 0 H ILE A 71 11.995 -0.092 -18.868 1.00 0.00 H new ATOM 0 HA ILE A 71 13.536 -2.351 -19.720 1.00 0.00 H new ATOM 0 HB ILE A 71 14.322 0.508 -19.003 1.00 0.00 H new ATOM 0 HG12 ILE A 71 13.771 -0.843 -21.677 1.00 0.00 H new ATOM 0 HG13 ILE A 71 12.708 0.299 -20.879 1.00 0.00 H new ATOM 0 HG21 ILE A 71 16.382 0.061 -20.267 1.00 0.00 H new ATOM 0 HG22 ILE A 71 16.241 -0.998 -18.844 1.00 0.00 H new ATOM 0 HG23 ILE A 71 15.890 -1.638 -20.467 1.00 0.00 H new ATOM 0 HD11 ILE A 71 13.982 1.384 -22.660 1.00 0.00 H new ATOM 0 HD12 ILE A 71 14.429 2.057 -21.074 1.00 0.00 H new ATOM 0 HD13 ILE A 71 15.508 0.897 -21.885 1.00 0.00 H new ATOM 1097 N LEU A 72 13.923 -1.168 -16.660 1.00 0.00 N ATOM 1098 CA LEU A 72 14.535 -1.434 -15.361 1.00 0.00 C ATOM 1099 C LEU A 72 14.011 -2.725 -14.728 1.00 0.00 C ATOM 1100 O LEU A 72 14.754 -3.419 -14.027 1.00 0.00 O ATOM 1101 CB LEU A 72 14.314 -0.258 -14.406 1.00 0.00 C ATOM 1102 CG LEU A 72 14.936 1.069 -14.850 1.00 0.00 C ATOM 1103 CD1 LEU A 72 14.735 2.133 -13.783 1.00 0.00 C ATOM 1104 CD2 LEU A 72 16.417 0.894 -15.158 1.00 0.00 C ATOM 0 H LEU A 72 13.306 -0.356 -16.677 1.00 0.00 H new ATOM 0 HA LEU A 72 15.604 -1.560 -15.536 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.242 -0.113 -14.276 1.00 0.00 H new ATOM 0 HB3 LEU A 72 14.720 -0.522 -13.430 1.00 0.00 H new ATOM 0 HG LEU A 72 14.435 1.394 -15.762 1.00 0.00 H new ATOM 0 HD11 LEU A 72 15.183 3.070 -14.114 1.00 0.00 H new ATOM 0 HD12 LEU A 72 13.669 2.281 -13.613 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.209 1.812 -12.855 1.00 0.00 H new ATOM 0 HD21 LEU A 72 16.839 1.849 -15.471 1.00 0.00 H new ATOM 0 HD22 LEU A 72 16.935 0.544 -14.265 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.538 0.164 -15.958 1.00 0.00 H new ATOM 1116 N LEU A 73 12.744 -3.057 -14.973 1.00 0.00 N ATOM 1117 CA LEU A 73 12.145 -4.252 -14.376 1.00 0.00 C ATOM 1118 C LEU A 73 12.802 -5.523 -14.914 1.00 0.00 C ATOM 1119 O LEU A 73 12.822 -6.556 -14.243 1.00 0.00 O ATOM 1120 CB LEU A 73 10.614 -4.276 -14.582 1.00 0.00 C ATOM 1121 CG LEU A 73 10.101 -4.423 -16.024 1.00 0.00 C ATOM 1122 CD1 LEU A 73 10.112 -5.879 -16.470 1.00 0.00 C ATOM 1123 CD2 LEU A 73 8.697 -3.850 -16.142 1.00 0.00 C ATOM 0 H LEU A 73 12.117 -2.522 -15.574 1.00 0.00 H new ATOM 0 HA LEU A 73 12.328 -4.215 -13.302 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.207 -5.098 -13.993 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.203 -3.354 -14.170 1.00 0.00 H new ATOM 0 HG LEU A 73 10.772 -3.866 -16.678 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.744 -5.949 -17.494 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.130 -6.266 -16.423 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.470 -6.466 -15.813 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.344 -3.960 -17.167 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.028 -4.386 -15.469 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.712 -2.793 -15.874 1.00 0.00 H new ATOM 1135 N GLU A 74 13.347 -5.441 -16.124 1.00 0.00 N ATOM 1136 CA GLU A 74 14.023 -6.580 -16.731 1.00 0.00 C ATOM 1137 C GLU A 74 15.311 -6.917 -15.993 1.00 0.00 C ATOM 1138 O GLU A 74 15.740 -8.072 -15.977 1.00 0.00 O ATOM 1139 CB GLU A 74 14.311 -6.317 -18.207 1.00 0.00 C ATOM 1140 CG GLU A 74 13.160 -6.703 -19.117 1.00 0.00 C ATOM 1141 CD GLU A 74 12.867 -8.188 -19.058 1.00 0.00 C ATOM 1142 OE1 GLU A 74 13.501 -8.957 -19.815 1.00 0.00 O ATOM 1143 OE2 GLU A 74 12.027 -8.602 -18.241 1.00 0.00 O ATOM 0 H GLU A 74 13.333 -4.600 -16.701 1.00 0.00 H new ATOM 0 HA GLU A 74 13.355 -7.438 -16.654 1.00 0.00 H new ATOM 0 HB2 GLU A 74 14.536 -5.259 -18.344 1.00 0.00 H new ATOM 0 HB3 GLU A 74 15.201 -6.873 -18.502 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.268 -6.145 -18.831 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.397 -6.420 -20.143 1.00 0.00 H new ATOM 1150 N GLN A 75 15.925 -5.918 -15.381 1.00 0.00 N ATOM 1151 CA GLN A 75 17.130 -6.145 -14.600 1.00 0.00 C ATOM 1152 C GLN A 75 16.756 -6.552 -13.182 1.00 0.00 C ATOM 1153 O GLN A 75 17.394 -7.422 -12.592 1.00 0.00 O ATOM 1154 CB GLN A 75 18.016 -4.897 -14.588 1.00 0.00 C ATOM 1155 CG GLN A 75 18.390 -4.409 -15.980 1.00 0.00 C ATOM 1156 CD GLN A 75 19.072 -5.475 -16.825 1.00 0.00 C ATOM 1157 OE1 GLN A 75 18.910 -5.506 -18.042 1.00 0.00 O ATOM 1158 NE2 GLN A 75 19.857 -6.337 -16.195 1.00 0.00 N ATOM 0 H GLN A 75 15.612 -4.948 -15.409 1.00 0.00 H new ATOM 0 HA GLN A 75 17.699 -6.952 -15.061 1.00 0.00 H new ATOM 0 HB2 GLN A 75 17.498 -4.098 -14.058 1.00 0.00 H new ATOM 0 HB3 GLN A 75 18.927 -5.112 -14.029 1.00 0.00 H new ATOM 0 HG2 GLN A 75 17.490 -4.069 -16.493 1.00 0.00 H new ATOM 0 HG3 GLN A 75 19.051 -3.547 -15.891 1.00 0.00 H new ATOM 0 HE21 GLN A 75 19.967 -6.281 -15.183 1.00 0.00 H new ATOM 0 HE22 GLN A 75 20.351 -7.057 -16.723 1.00 0.00 H new ATOM 1167 N ASN A 76 15.697 -5.928 -12.666 1.00 0.00 N ATOM 1168 CA ASN A 76 15.156 -6.247 -11.344 1.00 0.00 C ATOM 1169 C ASN A 76 16.221 -6.045 -10.269 1.00 0.00 C ATOM 1170 O ASN A 76 16.529 -6.943 -9.485 1.00 0.00 O ATOM 1171 CB ASN A 76 14.621 -7.683 -11.321 1.00 0.00 C ATOM 1172 CG ASN A 76 13.611 -7.923 -10.214 1.00 0.00 C ATOM 1173 OD1 ASN A 76 13.672 -7.318 -9.141 1.00 0.00 O ATOM 1174 ND2 ASN A 76 12.661 -8.802 -10.476 1.00 0.00 N ATOM 0 H ASN A 76 15.190 -5.188 -13.152 1.00 0.00 H new ATOM 0 HA ASN A 76 14.328 -5.571 -11.132 1.00 0.00 H new ATOM 0 HB2 ASN A 76 14.158 -7.908 -12.282 1.00 0.00 H new ATOM 0 HB3 ASN A 76 15.455 -8.374 -11.200 1.00 0.00 H new ATOM 0 HD21 ASN A 76 11.944 -9.001 -9.779 1.00 0.00 H new ATOM 0 HD22 ASN A 76 12.645 -9.282 -11.376 1.00 0.00 H new ATOM 1181 N ILE A 77 16.773 -4.845 -10.243 1.00 0.00 N ATOM 1182 CA ILE A 77 17.853 -4.499 -9.342 1.00 0.00 C ATOM 1183 C ILE A 77 17.521 -3.196 -8.625 1.00 0.00 C ATOM 1184 O ILE A 77 18.338 -2.278 -8.558 1.00 0.00 O ATOM 1185 CB ILE A 77 19.171 -4.332 -10.117 1.00 0.00 C ATOM 1186 CG1 ILE A 77 18.959 -3.392 -11.304 1.00 0.00 C ATOM 1187 CG2 ILE A 77 19.690 -5.685 -10.580 1.00 0.00 C ATOM 1188 CD1 ILE A 77 20.217 -2.686 -11.737 1.00 0.00 C ATOM 0 H ILE A 77 16.481 -4.080 -10.851 1.00 0.00 H new ATOM 0 HA ILE A 77 17.971 -5.303 -8.615 1.00 0.00 H new ATOM 0 HB ILE A 77 19.920 -3.894 -9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 77 18.563 -3.963 -12.144 1.00 0.00 H new ATOM 0 HG13 ILE A 77 18.206 -2.649 -11.040 1.00 0.00 H new ATOM 0 HG21 ILE A 77 20.623 -5.549 -11.127 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.867 -6.323 -9.714 1.00 0.00 H new ATOM 0 HG23 ILE A 77 18.953 -6.154 -11.232 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.996 -2.035 -12.583 1.00 0.00 H new ATOM 0 HD12 ILE A 77 20.602 -2.089 -10.910 1.00 0.00 H new ATOM 0 HD13 ILE A 77 20.965 -3.423 -12.031 1.00 0.00 H new ATOM 1200 N ASN A 78 16.317 -3.138 -8.083 1.00 0.00 N ATOM 1201 CA ASN A 78 15.770 -1.909 -7.508 1.00 0.00 C ATOM 1202 C ASN A 78 16.689 -1.275 -6.462 1.00 0.00 C ATOM 1203 O ASN A 78 16.870 -0.060 -6.462 1.00 0.00 O ATOM 1204 CB ASN A 78 14.375 -2.143 -6.910 1.00 0.00 C ATOM 1205 CG ASN A 78 14.367 -3.076 -5.710 1.00 0.00 C ATOM 1206 OD1 ASN A 78 15.117 -4.055 -5.651 1.00 0.00 O ATOM 1207 ND2 ASN A 78 13.531 -2.765 -4.734 1.00 0.00 N ATOM 0 H ASN A 78 15.687 -3.938 -8.026 1.00 0.00 H new ATOM 0 HA ASN A 78 15.689 -1.205 -8.336 1.00 0.00 H new ATOM 0 HB2 ASN A 78 13.952 -1.183 -6.614 1.00 0.00 H new ATOM 0 HB3 ASN A 78 13.724 -2.554 -7.682 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.490 -3.343 -3.894 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.927 -1.947 -4.821 1.00 0.00 H new ATOM 1214 N GLU A 79 17.281 -2.078 -5.588 1.00 0.00 N ATOM 1215 CA GLU A 79 18.153 -1.542 -4.548 1.00 0.00 C ATOM 1216 C GLU A 79 19.525 -1.205 -5.124 1.00 0.00 C ATOM 1217 O GLU A 79 20.206 -0.293 -4.656 1.00 0.00 O ATOM 1218 CB GLU A 79 18.285 -2.527 -3.384 1.00 0.00 C ATOM 1219 CG GLU A 79 19.123 -1.990 -2.235 1.00 0.00 C ATOM 1220 CD GLU A 79 19.140 -2.911 -1.035 1.00 0.00 C ATOM 1221 OE1 GLU A 79 19.905 -3.896 -1.046 1.00 0.00 O ATOM 1222 OE2 GLU A 79 18.401 -2.639 -0.064 1.00 0.00 O ATOM 0 H GLU A 79 17.176 -3.093 -5.576 1.00 0.00 H new ATOM 0 HA GLU A 79 17.703 -0.626 -4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 79 17.291 -2.777 -3.014 1.00 0.00 H new ATOM 0 HB3 GLU A 79 18.731 -3.452 -3.749 1.00 0.00 H new ATOM 0 HG2 GLU A 79 20.145 -1.833 -2.580 1.00 0.00 H new ATOM 0 HG3 GLU A 79 18.735 -1.017 -1.934 1.00 0.00 H new ATOM 1229 N ARG A 80 19.919 -1.944 -6.149 1.00 0.00 N ATOM 1230 CA ARG A 80 21.178 -1.697 -6.841 1.00 0.00 C ATOM 1231 C ARG A 80 21.130 -0.382 -7.618 1.00 0.00 C ATOM 1232 O ARG A 80 22.074 0.405 -7.584 1.00 0.00 O ATOM 1233 CB ARG A 80 21.481 -2.854 -7.789 1.00 0.00 C ATOM 1234 CG ARG A 80 22.448 -3.884 -7.229 1.00 0.00 C ATOM 1235 CD ARG A 80 22.873 -4.876 -8.301 1.00 0.00 C ATOM 1236 NE ARG A 80 23.558 -4.207 -9.409 1.00 0.00 N ATOM 1237 CZ ARG A 80 23.614 -4.670 -10.657 1.00 0.00 C ATOM 1238 NH1 ARG A 80 23.085 -5.846 -10.965 1.00 0.00 N ATOM 1239 NH2 ARG A 80 24.231 -3.957 -11.591 1.00 0.00 N ATOM 0 H ARG A 80 19.382 -2.726 -6.524 1.00 0.00 H new ATOM 0 HA ARG A 80 21.970 -1.621 -6.096 1.00 0.00 H new ATOM 0 HB2 ARG A 80 20.546 -3.352 -8.046 1.00 0.00 H new ATOM 0 HB3 ARG A 80 21.893 -2.452 -8.715 1.00 0.00 H new ATOM 0 HG2 ARG A 80 23.327 -3.381 -6.826 1.00 0.00 H new ATOM 0 HG3 ARG A 80 21.978 -4.417 -6.402 1.00 0.00 H new ATOM 0 HD2 ARG A 80 23.532 -5.626 -7.864 1.00 0.00 H new ATOM 0 HD3 ARG A 80 21.997 -5.403 -8.679 1.00 0.00 H new ATOM 0 HE ARG A 80 24.026 -3.323 -9.211 1.00 0.00 H new ATOM 0 HH11 ARG A 80 22.630 -6.405 -10.243 1.00 0.00 H new ATOM 0 HH12 ARG A 80 23.133 -6.192 -11.923 1.00 0.00 H new ATOM 0 HH21 ARG A 80 24.658 -3.062 -11.351 1.00 0.00 H new ATOM 0 HH22 ARG A 80 24.279 -4.304 -12.549 1.00 0.00 H new ATOM 1253 N LEU A 81 20.020 -0.156 -8.311 1.00 0.00 N ATOM 1254 CA LEU A 81 19.837 1.042 -9.127 1.00 0.00 C ATOM 1255 C LEU A 81 19.353 2.203 -8.253 1.00 0.00 C ATOM 1256 O LEU A 81 19.488 3.370 -8.619 1.00 0.00 O ATOM 1257 CB LEU A 81 18.837 0.726 -10.257 1.00 0.00 C ATOM 1258 CG LEU A 81 18.779 1.703 -11.445 1.00 0.00 C ATOM 1259 CD1 LEU A 81 17.929 2.924 -11.129 1.00 0.00 C ATOM 1260 CD2 LEU A 81 20.180 2.119 -11.855 1.00 0.00 C ATOM 0 H LEU A 81 19.224 -0.794 -8.324 1.00 0.00 H new ATOM 0 HA LEU A 81 20.784 1.343 -9.574 1.00 0.00 H new ATOM 0 HB2 LEU A 81 19.071 -0.265 -10.647 1.00 0.00 H new ATOM 0 HB3 LEU A 81 17.841 0.669 -9.819 1.00 0.00 H new ATOM 0 HG LEU A 81 18.307 1.183 -12.279 1.00 0.00 H new ATOM 0 HD11 LEU A 81 17.913 3.589 -11.992 1.00 0.00 H new ATOM 0 HD12 LEU A 81 16.912 2.609 -10.895 1.00 0.00 H new ATOM 0 HD13 LEU A 81 18.352 3.450 -10.273 1.00 0.00 H new ATOM 0 HD21 LEU A 81 20.123 2.810 -12.696 1.00 0.00 H new ATOM 0 HD22 LEU A 81 20.674 2.609 -11.016 1.00 0.00 H new ATOM 0 HD23 LEU A 81 20.750 1.237 -12.148 1.00 0.00 H new ATOM 1272 N ASN A 82 18.811 1.853 -7.081 1.00 0.00 N ATOM 1273 CA ASN A 82 18.317 2.827 -6.094 1.00 0.00 C ATOM 1274 C ASN A 82 16.956 3.394 -6.496 1.00 0.00 C ATOM 1275 O ASN A 82 16.665 4.560 -6.223 1.00 0.00 O ATOM 1276 CB ASN A 82 19.302 3.992 -5.867 1.00 0.00 C ATOM 1277 CG ASN A 82 20.573 3.602 -5.128 1.00 0.00 C ATOM 1278 OD1 ASN A 82 21.113 2.431 -5.420 1.00 0.00 O flip ATOM 1279 ND2 ASN A 82 21.083 4.373 -4.316 1.00 0.00 N flip ATOM 0 H ASN A 82 18.701 0.883 -6.787 1.00 0.00 H new ATOM 0 HA ASN A 82 18.218 2.275 -5.159 1.00 0.00 H new ATOM 0 HB2 ASN A 82 19.573 4.416 -6.834 1.00 0.00 H new ATOM 0 HB3 ASN A 82 18.795 4.777 -5.305 1.00 0.00 H new ATOM 0 HD21 ASN A 82 20.639 5.269 -4.115 1.00 0.00 H new ATOM 0 HD22 ASN A 82 21.950 4.116 -3.844 1.00 0.00 H new ATOM 1286 N ILE A 83 16.114 2.568 -7.122 1.00 0.00 N ATOM 1287 CA ILE A 83 14.764 2.996 -7.486 1.00 0.00 C ATOM 1288 C ILE A 83 13.987 3.400 -6.237 1.00 0.00 C ATOM 1289 O ILE A 83 13.814 2.602 -5.312 1.00 0.00 O ATOM 1290 CB ILE A 83 13.975 1.909 -8.262 1.00 0.00 C ATOM 1291 CG1 ILE A 83 14.511 1.766 -9.686 1.00 0.00 C ATOM 1292 CG2 ILE A 83 12.486 2.230 -8.298 1.00 0.00 C ATOM 1293 CD1 ILE A 83 15.411 0.572 -9.876 1.00 0.00 C ATOM 0 H ILE A 83 16.341 1.609 -7.385 1.00 0.00 H new ATOM 0 HA ILE A 83 14.875 3.851 -8.152 1.00 0.00 H new ATOM 0 HB ILE A 83 14.111 0.964 -7.736 1.00 0.00 H new ATOM 0 HG12 ILE A 83 13.670 1.690 -10.376 1.00 0.00 H new ATOM 0 HG13 ILE A 83 15.060 2.670 -9.951 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.959 1.451 -8.848 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.100 2.280 -7.280 1.00 0.00 H new ATOM 0 HG23 ILE A 83 12.333 3.190 -8.791 1.00 0.00 H new ATOM 0 HD11 ILE A 83 15.753 0.535 -10.910 1.00 0.00 H new ATOM 0 HD12 ILE A 83 16.271 0.656 -9.212 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.860 -0.339 -9.643 1.00 0.00 H new ATOM 1305 N GLY A 84 13.536 4.648 -6.229 1.00 0.00 N ATOM 1306 CA GLY A 84 12.854 5.205 -5.078 1.00 0.00 C ATOM 1307 C GLY A 84 11.560 4.496 -4.742 1.00 0.00 C ATOM 1308 O GLY A 84 10.922 3.902 -5.607 1.00 0.00 O ATOM 0 H GLY A 84 13.633 5.293 -7.013 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.518 5.160 -4.215 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.644 6.258 -5.264 1.00 0.00 H new ATOM 1312 N GLU A 85 11.167 4.586 -3.482 1.00 0.00 N ATOM 1313 CA GLU A 85 9.938 3.970 -2.999 1.00 0.00 C ATOM 1314 C GLU A 85 8.697 4.519 -3.724 1.00 0.00 C ATOM 1315 O GLU A 85 7.851 3.736 -4.166 1.00 0.00 O ATOM 1316 CB GLU A 85 9.798 4.152 -1.482 1.00 0.00 C ATOM 1317 CG GLU A 85 10.736 3.277 -0.655 1.00 0.00 C ATOM 1318 CD GLU A 85 12.202 3.622 -0.838 1.00 0.00 C ATOM 1319 OE1 GLU A 85 12.692 4.544 -0.154 1.00 0.00 O ATOM 1320 OE2 GLU A 85 12.872 2.971 -1.660 1.00 0.00 O ATOM 0 H GLU A 85 11.690 5.088 -2.764 1.00 0.00 H new ATOM 0 HA GLU A 85 10.003 2.905 -3.220 1.00 0.00 H new ATOM 0 HB2 GLU A 85 9.983 5.197 -1.235 1.00 0.00 H new ATOM 0 HB3 GLU A 85 8.769 3.934 -1.195 1.00 0.00 H new ATOM 0 HG2 GLU A 85 10.477 3.375 0.399 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.580 2.233 -0.926 1.00 0.00 H new ATOM 1327 N PRO A 86 8.552 5.863 -3.865 1.00 0.00 N ATOM 1328 CA PRO A 86 7.426 6.459 -4.604 1.00 0.00 C ATOM 1329 C PRO A 86 7.401 6.047 -6.077 1.00 0.00 C ATOM 1330 O PRO A 86 6.389 6.195 -6.760 1.00 0.00 O ATOM 1331 CB PRO A 86 7.658 7.970 -4.476 1.00 0.00 C ATOM 1332 CG PRO A 86 9.095 8.115 -4.115 1.00 0.00 C ATOM 1333 CD PRO A 86 9.428 6.906 -3.294 1.00 0.00 C ATOM 0 HA PRO A 86 6.469 6.128 -4.202 1.00 0.00 H new ATOM 0 HB2 PRO A 86 7.433 8.484 -5.411 1.00 0.00 H new ATOM 0 HB3 PRO A 86 7.014 8.404 -3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.720 8.168 -5.007 1.00 0.00 H new ATOM 0 HG3 PRO A 86 9.267 9.032 -3.551 1.00 0.00 H new ATOM 0 HD2 PRO A 86 10.481 6.639 -3.379 1.00 0.00 H new ATOM 0 HD3 PRO A 86 9.224 7.069 -2.236 1.00 0.00 H new ATOM 1341 N LEU A 87 8.516 5.517 -6.558 1.00 0.00 N ATOM 1342 CA LEU A 87 8.614 5.062 -7.938 1.00 0.00 C ATOM 1343 C LEU A 87 7.815 3.773 -8.126 1.00 0.00 C ATOM 1344 O LEU A 87 7.290 3.508 -9.205 1.00 0.00 O ATOM 1345 CB LEU A 87 10.087 4.849 -8.330 1.00 0.00 C ATOM 1346 CG LEU A 87 10.874 6.106 -8.746 1.00 0.00 C ATOM 1347 CD1 LEU A 87 10.369 6.635 -10.080 1.00 0.00 C ATOM 1348 CD2 LEU A 87 10.788 7.191 -7.683 1.00 0.00 C ATOM 0 H LEU A 87 9.368 5.391 -6.012 1.00 0.00 H new ATOM 0 HA LEU A 87 8.194 5.828 -8.590 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.601 4.387 -7.487 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.122 4.136 -9.154 1.00 0.00 H new ATOM 0 HG LEU A 87 11.921 5.821 -8.853 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.937 7.523 -10.358 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.495 5.870 -10.846 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.313 6.892 -9.993 1.00 0.00 H new ATOM 0 HD21 LEU A 87 11.354 8.064 -8.008 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.745 7.470 -7.532 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.203 6.817 -6.747 1.00 0.00 H new ATOM 1360 N LEU A 88 7.717 2.980 -7.061 1.00 0.00 N ATOM 1361 CA LEU A 88 6.951 1.737 -7.099 1.00 0.00 C ATOM 1362 C LEU A 88 5.450 2.013 -7.083 1.00 0.00 C ATOM 1363 O LEU A 88 4.692 1.404 -7.838 1.00 0.00 O ATOM 1364 CB LEU A 88 7.319 0.815 -5.929 1.00 0.00 C ATOM 1365 CG LEU A 88 8.630 0.035 -6.081 1.00 0.00 C ATOM 1366 CD1 LEU A 88 9.833 0.960 -6.007 1.00 0.00 C ATOM 1367 CD2 LEU A 88 8.723 -1.046 -5.016 1.00 0.00 C ATOM 0 H LEU A 88 8.158 3.176 -6.162 1.00 0.00 H new ATOM 0 HA LEU A 88 7.207 1.234 -8.032 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.379 1.417 -5.022 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.508 0.101 -5.785 1.00 0.00 H new ATOM 0 HG LEU A 88 8.633 -0.436 -7.064 1.00 0.00 H new ATOM 0 HD11 LEU A 88 10.747 0.377 -6.118 1.00 0.00 H new ATOM 0 HD12 LEU A 88 9.774 1.698 -6.807 1.00 0.00 H new ATOM 0 HD13 LEU A 88 9.842 1.469 -5.043 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.658 -1.593 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.693 -0.587 -4.028 1.00 0.00 H new ATOM 0 HD23 LEU A 88 7.884 -1.734 -5.122 1.00 0.00 H new ATOM 1379 N VAL A 89 5.025 2.937 -6.226 1.00 0.00 N ATOM 1380 CA VAL A 89 3.606 3.264 -6.101 1.00 0.00 C ATOM 1381 C VAL A 89 3.089 3.893 -7.391 1.00 0.00 C ATOM 1382 O VAL A 89 1.928 3.714 -7.761 1.00 0.00 O ATOM 1383 CB VAL A 89 3.314 4.191 -4.894 1.00 0.00 C ATOM 1384 CG1 VAL A 89 3.831 3.564 -3.611 1.00 0.00 C ATOM 1385 CG2 VAL A 89 3.911 5.576 -5.082 1.00 0.00 C ATOM 0 H VAL A 89 5.638 3.471 -5.610 1.00 0.00 H new ATOM 0 HA VAL A 89 3.078 2.328 -5.920 1.00 0.00 H new ATOM 0 HB VAL A 89 2.232 4.308 -4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.619 4.226 -2.771 1.00 0.00 H new ATOM 0 HG12 VAL A 89 3.338 2.605 -3.450 1.00 0.00 H new ATOM 0 HG13 VAL A 89 4.907 3.410 -3.689 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.682 6.192 -4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.992 5.494 -5.194 1.00 0.00 H new ATOM 0 HG23 VAL A 89 3.488 6.037 -5.975 1.00 0.00 H new ATOM 1395 N TYR A 90 3.966 4.631 -8.062 1.00 0.00 N ATOM 1396 CA TYR A 90 3.668 5.212 -9.364 1.00 0.00 C ATOM 1397 C TYR A 90 3.251 4.130 -10.365 1.00 0.00 C ATOM 1398 O TYR A 90 2.362 4.343 -11.189 1.00 0.00 O ATOM 1399 CB TYR A 90 4.901 5.956 -9.883 1.00 0.00 C ATOM 1400 CG TYR A 90 4.696 6.640 -11.214 1.00 0.00 C ATOM 1401 CD1 TYR A 90 3.945 7.804 -11.311 1.00 0.00 C ATOM 1402 CD2 TYR A 90 5.254 6.120 -12.373 1.00 0.00 C ATOM 1403 CE1 TYR A 90 3.756 8.429 -12.528 1.00 0.00 C ATOM 1404 CE2 TYR A 90 5.071 6.740 -13.590 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.321 7.892 -13.664 1.00 0.00 C ATOM 1406 OH TYR A 90 4.128 8.501 -14.881 1.00 0.00 O ATOM 0 H TYR A 90 4.903 4.843 -7.718 1.00 0.00 H new ATOM 0 HA TYR A 90 2.837 5.909 -9.253 1.00 0.00 H new ATOM 0 HB2 TYR A 90 5.199 6.702 -9.146 1.00 0.00 H new ATOM 0 HB3 TYR A 90 5.726 5.250 -9.973 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.502 8.227 -10.421 1.00 0.00 H new ATOM 0 HD2 TYR A 90 5.841 5.215 -12.321 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.169 9.333 -12.589 1.00 0.00 H new ATOM 0 HE2 TYR A 90 5.514 6.324 -14.482 1.00 0.00 H new ATOM 0 HH TYR A 90 4.901 8.331 -15.458 1.00 0.00 H new ATOM 1416 N LEU A 91 3.904 2.974 -10.287 1.00 0.00 N ATOM 1417 CA LEU A 91 3.601 1.856 -11.176 1.00 0.00 C ATOM 1418 C LEU A 91 2.272 1.215 -10.773 1.00 0.00 C ATOM 1419 O LEU A 91 1.504 0.771 -11.627 1.00 0.00 O ATOM 1420 CB LEU A 91 4.752 0.830 -11.135 1.00 0.00 C ATOM 1421 CG LEU A 91 4.768 -0.241 -12.243 1.00 0.00 C ATOM 1422 CD1 LEU A 91 3.777 -1.359 -11.955 1.00 0.00 C ATOM 1423 CD2 LEU A 91 4.483 0.387 -13.601 1.00 0.00 C ATOM 0 H LEU A 91 4.648 2.786 -9.615 1.00 0.00 H new ATOM 0 HA LEU A 91 3.504 2.219 -12.199 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.695 1.375 -11.176 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.720 0.321 -10.171 1.00 0.00 H new ATOM 0 HG LEU A 91 5.766 -0.679 -12.263 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.816 -2.096 -12.757 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.033 -1.838 -11.010 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.771 -0.945 -11.891 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.499 -0.386 -14.370 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.502 0.862 -13.584 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.244 1.135 -13.823 1.00 0.00 H new ATOM 1435 N ARG A 92 2.010 1.184 -9.469 1.00 0.00 N ATOM 1436 CA ARG A 92 0.767 0.623 -8.938 1.00 0.00 C ATOM 1437 C ARG A 92 -0.449 1.357 -9.496 1.00 0.00 C ATOM 1438 O ARG A 92 -1.365 0.741 -10.046 1.00 0.00 O ATOM 1439 CB ARG A 92 0.753 0.702 -7.409 1.00 0.00 C ATOM 1440 CG ARG A 92 1.760 -0.209 -6.721 1.00 0.00 C ATOM 1441 CD ARG A 92 1.383 -1.677 -6.864 1.00 0.00 C ATOM 1442 NE ARG A 92 1.649 -2.192 -8.206 1.00 0.00 N ATOM 1443 CZ ARG A 92 0.788 -2.921 -8.915 1.00 0.00 C ATOM 1444 NH1 ARG A 92 -0.386 -3.265 -8.393 1.00 0.00 N ATOM 1445 NH2 ARG A 92 1.113 -3.322 -10.139 1.00 0.00 N ATOM 0 H ARG A 92 2.645 1.543 -8.756 1.00 0.00 H new ATOM 0 HA ARG A 92 0.718 -0.421 -9.246 1.00 0.00 H new ATOM 0 HB2 ARG A 92 0.949 1.731 -7.109 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -0.247 0.451 -7.054 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.750 -0.045 -7.147 1.00 0.00 H new ATOM 0 HG3 ARG A 92 1.821 0.049 -5.664 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.940 -2.265 -6.135 1.00 0.00 H new ATOM 0 HD3 ARG A 92 0.325 -1.802 -6.633 1.00 0.00 H new ATOM 0 HE ARG A 92 2.553 -1.979 -8.627 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -0.630 -2.971 -7.447 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -1.043 -3.823 -8.938 1.00 0.00 H new ATOM 0 HH21 ARG A 92 2.020 -3.072 -10.534 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.456 -3.880 -10.684 1.00 0.00 H new ATOM 1459 N ARG A 93 -0.455 2.670 -9.336 1.00 0.00 N ATOM 1460 CA ARG A 93 -1.530 3.503 -9.854 1.00 0.00 C ATOM 1461 C ARG A 93 -1.043 4.937 -9.965 1.00 0.00 C ATOM 1462 O ARG A 93 -0.951 5.645 -8.963 1.00 0.00 O ATOM 1463 CB ARG A 93 -2.761 3.425 -8.934 1.00 0.00 C ATOM 1464 CG ARG A 93 -4.083 3.795 -9.605 1.00 0.00 C ATOM 1465 CD ARG A 93 -4.216 5.287 -9.883 1.00 0.00 C ATOM 1466 NE ARG A 93 -4.270 6.086 -8.657 1.00 0.00 N ATOM 1467 CZ ARG A 93 -4.491 7.402 -8.639 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -4.750 8.042 -9.772 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -4.472 8.077 -7.492 1.00 0.00 N ATOM 0 H ARG A 93 0.277 3.186 -8.848 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.821 3.143 -10.841 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.840 2.412 -8.540 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -2.604 4.087 -8.082 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -4.173 3.247 -10.543 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -4.908 3.475 -8.969 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -3.373 5.616 -10.490 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -5.118 5.465 -10.468 1.00 0.00 H new ATOM 0 HE ARG A 93 -4.131 5.610 -7.766 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -4.780 7.528 -10.653 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.919 9.048 -9.762 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -4.287 7.589 -6.616 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.642 9.083 -7.489 1.00 0.00 H new ATOM 1483 N GLN A 94 -0.706 5.358 -11.176 1.00 0.00 N ATOM 1484 CA GLN A 94 -0.244 6.717 -11.389 1.00 0.00 C ATOM 1485 C GLN A 94 -1.376 7.702 -11.119 1.00 0.00 C ATOM 1486 O GLN A 94 -2.501 7.528 -11.595 1.00 0.00 O ATOM 1487 CB GLN A 94 0.320 6.909 -12.806 1.00 0.00 C ATOM 1488 CG GLN A 94 -0.725 6.976 -13.915 1.00 0.00 C ATOM 1489 CD GLN A 94 -1.435 5.657 -14.163 1.00 0.00 C ATOM 1490 OE1 GLN A 94 -0.870 4.581 -13.967 1.00 0.00 O ATOM 1491 NE2 GLN A 94 -2.681 5.733 -14.601 1.00 0.00 N ATOM 0 H GLN A 94 -0.744 4.782 -12.017 1.00 0.00 H new ATOM 0 HA GLN A 94 0.569 6.911 -10.689 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.907 7.827 -12.825 1.00 0.00 H new ATOM 0 HB3 GLN A 94 1.004 6.089 -13.022 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -1.465 7.735 -13.660 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -0.243 7.298 -14.838 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -3.114 6.644 -14.751 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -3.209 4.880 -14.789 1.00 0.00 H new ATOM 1500 N ASP A 95 -1.079 8.718 -10.330 1.00 0.00 N ATOM 1501 CA ASP A 95 -2.074 9.719 -9.980 1.00 0.00 C ATOM 1502 C ASP A 95 -2.146 10.767 -11.074 1.00 0.00 C ATOM 1503 O ASP A 95 -3.209 11.031 -11.630 1.00 0.00 O ATOM 1504 CB ASP A 95 -1.741 10.364 -8.636 1.00 0.00 C ATOM 1505 CG ASP A 95 -2.832 11.299 -8.159 1.00 0.00 C ATOM 1506 OD1 ASP A 95 -3.926 10.813 -7.799 1.00 0.00 O ATOM 1507 OD2 ASP A 95 -2.594 12.523 -8.125 1.00 0.00 O ATOM 0 H ASP A 95 -0.158 8.873 -9.919 1.00 0.00 H new ATOM 0 HA ASP A 95 -3.046 9.236 -9.887 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.583 9.584 -7.891 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.805 10.916 -8.723 1.00 0.00 H new ATOM 1512 N LEU A 96 -1.001 11.347 -11.391 1.00 0.00 N ATOM 1513 CA LEU A 96 -0.902 12.257 -12.516 1.00 0.00 C ATOM 1514 C LEU A 96 -0.541 11.464 -13.766 1.00 0.00 C ATOM 1515 O LEU A 96 0.416 10.687 -13.750 1.00 0.00 O ATOM 1516 CB LEU A 96 0.150 13.353 -12.266 1.00 0.00 C ATOM 1517 CG LEU A 96 -0.153 14.345 -11.131 1.00 0.00 C ATOM 1518 CD1 LEU A 96 -1.581 14.860 -11.224 1.00 0.00 C ATOM 1519 CD2 LEU A 96 0.113 13.719 -9.768 1.00 0.00 C ATOM 0 H LEU A 96 -0.128 11.203 -10.884 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.865 12.750 -12.649 1.00 0.00 H new ATOM 0 HB2 LEU A 96 1.103 12.869 -12.052 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.280 13.919 -13.189 1.00 0.00 H new ATOM 0 HG LEU A 96 0.519 15.195 -11.244 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.769 15.560 -10.410 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.724 15.367 -12.178 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.275 14.023 -11.151 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.110 14.444 -8.985 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.520 12.841 -9.641 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.160 13.424 -9.701 1.00 0.00 H new ATOM 1531 N PRO A 97 -1.312 11.637 -14.853 1.00 0.00 N ATOM 1532 CA PRO A 97 -1.084 10.916 -16.112 1.00 0.00 C ATOM 1533 C PRO A 97 0.337 11.107 -16.625 1.00 0.00 C ATOM 1534 O PRO A 97 1.034 10.141 -16.937 1.00 0.00 O ATOM 1535 CB PRO A 97 -2.093 11.547 -17.075 1.00 0.00 C ATOM 1536 CG PRO A 97 -3.160 12.105 -16.197 1.00 0.00 C ATOM 1537 CD PRO A 97 -2.469 12.545 -14.938 1.00 0.00 C ATOM 0 HA PRO A 97 -1.208 9.839 -15.998 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -1.629 12.327 -17.678 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -2.496 10.807 -17.766 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -3.664 12.943 -16.679 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -3.922 11.355 -15.983 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.159 13.588 -14.993 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.119 12.451 -14.068 1.00 0.00 H new ATOM 1545 N GLU A 98 0.761 12.358 -16.701 1.00 0.00 N ATOM 1546 CA GLU A 98 2.114 12.688 -17.106 1.00 0.00 C ATOM 1547 C GLU A 98 2.682 13.747 -16.171 1.00 0.00 C ATOM 1548 O GLU A 98 2.308 14.915 -16.250 1.00 0.00 O ATOM 1549 CB GLU A 98 2.137 13.193 -18.553 1.00 0.00 C ATOM 1550 CG GLU A 98 1.630 12.176 -19.565 1.00 0.00 C ATOM 1551 CD GLU A 98 1.605 12.721 -20.977 1.00 0.00 C ATOM 1552 OE1 GLU A 98 0.599 13.357 -21.359 1.00 0.00 O ATOM 1553 OE2 GLU A 98 2.589 12.515 -21.715 1.00 0.00 O ATOM 0 H GLU A 98 0.180 13.168 -16.485 1.00 0.00 H new ATOM 0 HA GLU A 98 2.728 11.789 -17.049 1.00 0.00 H new ATOM 0 HB2 GLU A 98 1.530 14.095 -18.623 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.157 13.474 -18.814 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.264 11.290 -19.533 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.626 11.859 -19.284 1.00 0.00 H new ATOM 1560 N ILE A 99 3.554 13.328 -15.264 1.00 0.00 N ATOM 1561 CA ILE A 99 4.189 14.257 -14.341 1.00 0.00 C ATOM 1562 C ILE A 99 5.216 15.095 -15.089 1.00 0.00 C ATOM 1563 O ILE A 99 6.267 14.592 -15.487 1.00 0.00 O ATOM 1564 CB ILE A 99 4.875 13.524 -13.166 1.00 0.00 C ATOM 1565 CG1 ILE A 99 3.864 12.638 -12.430 1.00 0.00 C ATOM 1566 CG2 ILE A 99 5.504 14.529 -12.207 1.00 0.00 C ATOM 1567 CD1 ILE A 99 4.465 11.844 -11.288 1.00 0.00 C ATOM 0 H ILE A 99 3.837 12.355 -15.148 1.00 0.00 H new ATOM 0 HA ILE A 99 3.411 14.897 -13.925 1.00 0.00 H new ATOM 0 HB ILE A 99 5.666 12.889 -13.565 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.061 13.264 -12.042 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.413 11.947 -13.143 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.983 13.997 -11.385 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.248 15.122 -12.738 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.731 15.187 -11.811 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.689 11.242 -10.816 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.248 11.191 -11.672 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.890 12.528 -10.554 1.00 0.00 H new ATOM 1579 N THR A 100 4.896 16.359 -15.301 1.00 0.00 N ATOM 1580 CA THR A 100 5.732 17.226 -16.102 1.00 0.00 C ATOM 1581 C THR A 100 6.675 18.069 -15.253 1.00 0.00 C ATOM 1582 O THR A 100 6.296 18.610 -14.211 1.00 0.00 O ATOM 1583 CB THR A 100 4.874 18.147 -16.982 1.00 0.00 C ATOM 1584 OG1 THR A 100 3.779 18.671 -16.217 1.00 0.00 O ATOM 1585 CG2 THR A 100 4.349 17.396 -18.196 1.00 0.00 C ATOM 0 H THR A 100 4.059 16.806 -14.927 1.00 0.00 H new ATOM 0 HA THR A 100 6.339 16.577 -16.733 1.00 0.00 H new ATOM 0 HB THR A 100 5.496 18.971 -17.331 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.236 19.259 -16.783 1.00 0.00 H new ATOM 0 HG21 THR A 100 3.744 18.067 -18.805 1.00 0.00 H new ATOM 0 HG22 THR A 100 5.188 17.027 -18.786 1.00 0.00 H new ATOM 0 HG23 THR A 100 3.739 16.555 -17.868 1.00 0.00 H new ATOM 1593 N ALA A 101 7.907 18.166 -15.718 1.00 0.00 N ATOM 1594 CA ALA A 101 8.913 19.002 -15.096 1.00 0.00 C ATOM 1595 C ALA A 101 9.399 20.032 -16.103 1.00 0.00 C ATOM 1596 O ALA A 101 9.737 19.693 -17.238 1.00 0.00 O ATOM 1597 CB ALA A 101 10.074 18.161 -14.585 1.00 0.00 C ATOM 0 H ALA A 101 8.238 17.664 -16.542 1.00 0.00 H new ATOM 0 HA ALA A 101 8.474 19.514 -14.240 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.817 18.810 -14.122 1.00 0.00 H new ATOM 0 HB2 ALA A 101 9.708 17.445 -13.849 1.00 0.00 H new ATOM 0 HB3 ALA A 101 10.529 17.625 -15.418 1.00 0.00 H new ATOM 1603 N GLN A 102 9.406 21.283 -15.690 1.00 0.00 N ATOM 1604 CA GLN A 102 9.782 22.382 -16.559 1.00 0.00 C ATOM 1605 C GLN A 102 10.330 23.519 -15.720 1.00 0.00 C ATOM 1606 O GLN A 102 9.995 23.634 -14.540 1.00 0.00 O ATOM 1607 CB GLN A 102 8.583 22.866 -17.382 1.00 0.00 C ATOM 1608 CG GLN A 102 7.395 23.300 -16.537 1.00 0.00 C ATOM 1609 CD GLN A 102 6.293 23.943 -17.357 1.00 0.00 C ATOM 1610 OE1 GLN A 102 6.549 24.582 -18.379 1.00 0.00 O ATOM 1611 NE2 GLN A 102 5.056 23.767 -16.921 1.00 0.00 N ATOM 0 H GLN A 102 9.152 21.567 -14.744 1.00 0.00 H new ATOM 0 HA GLN A 102 10.548 22.035 -17.252 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.897 23.702 -18.008 1.00 0.00 H new ATOM 0 HB3 GLN A 102 8.268 22.067 -18.053 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.993 22.434 -16.012 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.734 24.004 -15.777 1.00 0.00 H new ATOM 0 HE21 GLN A 102 4.887 23.231 -16.070 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.272 24.167 -17.436 1.00 0.00 H new ATOM 1620 N ARG A 103 11.208 24.316 -16.308 1.00 0.00 N ATOM 1621 CA ARG A 103 11.742 25.488 -15.634 1.00 0.00 C ATOM 1622 C ARG A 103 10.589 26.382 -15.190 1.00 0.00 C ATOM 1623 O ARG A 103 9.850 26.912 -16.025 1.00 0.00 O ATOM 1624 CB ARG A 103 12.676 26.263 -16.565 1.00 0.00 C ATOM 1625 CG ARG A 103 13.403 27.410 -15.884 1.00 0.00 C ATOM 1626 CD ARG A 103 14.137 28.286 -16.888 1.00 0.00 C ATOM 1627 NE ARG A 103 15.135 27.547 -17.661 1.00 0.00 N ATOM 1628 CZ ARG A 103 16.092 28.127 -18.385 1.00 0.00 C ATOM 1629 NH1 ARG A 103 16.208 29.450 -18.403 1.00 0.00 N ATOM 1630 NH2 ARG A 103 16.945 27.385 -19.082 1.00 0.00 N ATOM 0 H ARG A 103 11.566 24.172 -17.252 1.00 0.00 H new ATOM 0 HA ARG A 103 12.314 25.168 -14.763 1.00 0.00 H new ATOM 0 HB2 ARG A 103 13.411 25.575 -16.982 1.00 0.00 H new ATOM 0 HB3 ARG A 103 12.097 26.656 -17.401 1.00 0.00 H new ATOM 0 HG2 ARG A 103 12.687 28.015 -15.328 1.00 0.00 H new ATOM 0 HG3 ARG A 103 14.114 27.012 -15.160 1.00 0.00 H new ATOM 0 HD2 ARG A 103 13.414 28.733 -17.570 1.00 0.00 H new ATOM 0 HD3 ARG A 103 14.626 29.105 -16.360 1.00 0.00 H new ATOM 0 HE ARG A 103 15.096 26.528 -17.645 1.00 0.00 H new ATOM 0 HH11 ARG A 103 15.563 30.026 -17.861 1.00 0.00 H new ATOM 0 HH12 ARG A 103 16.942 29.890 -18.958 1.00 0.00 H new ATOM 0 HH21 ARG A 103 16.869 26.368 -19.064 1.00 0.00 H new ATOM 0 HH22 ARG A 103 17.676 27.832 -19.635 1.00 0.00 H new ATOM 1644 N GLN A 104 10.426 26.517 -13.879 1.00 0.00 N ATOM 1645 CA GLN A 104 9.308 27.260 -13.308 1.00 0.00 C ATOM 1646 C GLN A 104 9.302 28.710 -13.780 1.00 0.00 C ATOM 1647 O GLN A 104 10.356 29.329 -13.958 1.00 0.00 O ATOM 1648 CB GLN A 104 9.346 27.192 -11.779 1.00 0.00 C ATOM 1649 CG GLN A 104 10.612 27.764 -11.164 1.00 0.00 C ATOM 1650 CD GLN A 104 10.681 27.539 -9.668 1.00 0.00 C ATOM 1651 OE1 GLN A 104 9.660 27.468 -8.987 1.00 0.00 O ATOM 1652 NE2 GLN A 104 11.889 27.422 -9.149 1.00 0.00 N ATOM 0 H GLN A 104 11.059 26.118 -13.186 1.00 0.00 H new ATOM 0 HA GLN A 104 8.386 26.795 -13.657 1.00 0.00 H new ATOM 0 HB2 GLN A 104 8.486 27.730 -11.381 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.242 26.152 -11.470 1.00 0.00 H new ATOM 0 HG2 GLN A 104 11.481 27.307 -11.638 1.00 0.00 H new ATOM 0 HG3 GLN A 104 10.662 28.833 -11.370 1.00 0.00 H new ATOM 0 HE21 GLN A 104 12.711 27.487 -9.750 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.001 27.266 -8.147 1.00 0.00 H new ATOM 1661 N LEU A 105 8.108 29.242 -13.980 1.00 0.00 N ATOM 1662 CA LEU A 105 7.942 30.580 -14.521 1.00 0.00 C ATOM 1663 C LEU A 105 8.256 31.627 -13.462 1.00 0.00 C ATOM 1664 O LEU A 105 8.841 32.671 -13.756 1.00 0.00 O ATOM 1665 CB LEU A 105 6.513 30.758 -15.033 1.00 0.00 C ATOM 1666 CG LEU A 105 6.267 32.021 -15.855 1.00 0.00 C ATOM 1667 CD1 LEU A 105 7.059 31.978 -17.153 1.00 0.00 C ATOM 1668 CD2 LEU A 105 4.783 32.184 -16.136 1.00 0.00 C ATOM 0 H LEU A 105 7.232 28.762 -13.773 1.00 0.00 H new ATOM 0 HA LEU A 105 8.637 30.712 -15.350 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.252 29.892 -15.641 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.836 30.763 -14.178 1.00 0.00 H new ATOM 0 HG LEU A 105 6.607 32.882 -15.280 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.870 32.887 -17.725 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.123 31.905 -16.928 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.752 31.111 -17.738 1.00 0.00 H new ATOM 0 HD21 LEU A 105 4.621 33.088 -16.723 1.00 0.00 H new ATOM 0 HD22 LEU A 105 4.421 31.320 -16.693 1.00 0.00 H new ATOM 0 HD23 LEU A 105 4.241 32.261 -15.194 1.00 0.00 H new ATOM 1680 N ARG A 106 7.860 31.340 -12.231 1.00 0.00 N ATOM 1681 CA ARG A 106 8.133 32.225 -11.109 1.00 0.00 C ATOM 1682 C ARG A 106 9.081 31.557 -10.122 1.00 0.00 C ATOM 1683 O ARG A 106 8.597 30.959 -9.138 1.00 0.00 O ATOM 1684 CB ARG A 106 6.832 32.620 -10.405 1.00 0.00 C ATOM 1685 CG ARG A 106 6.011 33.646 -11.167 1.00 0.00 C ATOM 1686 CD ARG A 106 4.699 33.951 -10.460 1.00 0.00 C ATOM 1687 NE ARG A 106 4.891 34.312 -9.052 1.00 0.00 N ATOM 1688 CZ ARG A 106 4.777 35.550 -8.572 1.00 0.00 C ATOM 1689 NH1 ARG A 106 4.513 36.563 -9.386 1.00 0.00 N ATOM 1690 NH2 ARG A 106 4.923 35.771 -7.273 1.00 0.00 N ATOM 1691 OXT ARG A 106 10.308 31.622 -10.342 1.00 0.00 O ATOM 0 H ARG A 106 7.345 30.495 -11.983 1.00 0.00 H new ATOM 0 HA ARG A 106 8.608 33.128 -11.494 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.227 31.726 -10.251 1.00 0.00 H new ATOM 0 HB3 ARG A 106 7.070 33.018 -9.419 1.00 0.00 H new ATOM 0 HG2 ARG A 106 6.587 34.565 -11.278 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.806 33.275 -12.171 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.193 34.768 -10.975 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.045 33.081 -10.523 1.00 0.00 H new ATOM 0 HE ARG A 106 5.127 33.567 -8.397 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.396 36.397 -10.386 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.427 37.508 -9.013 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.122 34.994 -6.643 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.836 36.718 -6.904 1.00 0.00 H new TER 1705 ARG A 106