USER MOD reduce.3.24.130724 H: found=0, std=0, add=801, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 799 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 14 SER OG : rot 180:sc= -0.862 USER MOD Set 1.2: A 25 GLN : amide:sc= 0 K(o=-0.86,f=-2.1!) USER MOD Single : A 1 MET CE :methyl 150:sc= -0.157 (180deg=-0.973) USER MOD Single : A 4 THR OG1 : rot 22:sc= 0.294 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 CYS SG : rot -163:sc= -7.67! USER MOD Single : A 17 CYS SG : rot 180:sc= -0.246 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 32 SER OG : rot -160:sc= -0.683 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -1.23 X(o=-1.2,f=-1.7) USER MOD Single : A 50 LYS NZ :NH3+ 177:sc= -0.393 (180deg=-0.405) USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 52 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.5 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 78 HIS : no HD1:sc= 0.0281 K(o=0.028,f=-0.61) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -1.17 K(o=-1.2,f=-3.7!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0281 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= -0.522 X(o=-0.52,f=-0.52) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.907 K(o=-0.91,f=-8.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 100.141 15.470 -13.218 1.00 0.00 N ATOM 2 CA GLY A -1 100.227 14.254 -12.360 1.00 0.00 C ATOM 3 C GLY A -1 98.949 14.124 -11.530 1.00 0.00 C ATOM 4 O GLY A -1 98.892 14.558 -10.393 1.00 0.00 O ATOM 0 H1 GLY A -1 101.010 15.559 -13.783 1.00 0.00 H new ATOM 0 H2 GLY A -1 99.322 15.389 -13.854 1.00 0.00 H new ATOM 0 H3 GLY A -1 100.031 16.312 -12.617 1.00 0.00 H new ATOM 0 HA2 GLY A -1 100.363 13.368 -12.980 1.00 0.00 H new ATOM 0 HA3 GLY A -1 101.095 14.320 -11.703 1.00 0.00 H new ATOM 10 N ALA A 0 97.926 13.527 -12.092 1.00 0.00 N ATOM 11 CA ALA A 0 96.641 13.360 -11.347 1.00 0.00 C ATOM 12 C ALA A 0 96.500 11.916 -10.855 1.00 0.00 C ATOM 13 O ALA A 0 96.908 10.984 -11.521 1.00 0.00 O ATOM 14 CB ALA A 0 95.549 13.689 -12.364 1.00 0.00 C ATOM 0 H ALA A 0 97.927 13.147 -13.039 1.00 0.00 H new ATOM 0 HA ALA A 0 96.586 14.002 -10.468 1.00 0.00 H new ATOM 0 HB1 ALA A 0 94.571 13.589 -11.893 1.00 0.00 H new ATOM 0 HB2 ALA A 0 95.678 14.712 -12.719 1.00 0.00 H new ATOM 0 HB3 ALA A 0 95.618 13.001 -13.207 1.00 0.00 H new ATOM 20 N MET A 1 95.923 11.734 -9.692 1.00 0.00 N ATOM 21 CA MET A 1 95.748 10.356 -9.140 1.00 0.00 C ATOM 22 C MET A 1 94.434 9.747 -9.635 1.00 0.00 C ATOM 23 O MET A 1 93.414 10.410 -9.682 1.00 0.00 O ATOM 24 CB MET A 1 95.714 10.541 -7.623 1.00 0.00 C ATOM 25 CG MET A 1 97.064 11.075 -7.143 1.00 0.00 C ATOM 26 SD MET A 1 97.090 11.109 -5.332 1.00 0.00 S ATOM 27 CE MET A 1 97.211 9.322 -5.074 1.00 0.00 C ATOM 0 H MET A 1 95.565 12.484 -9.100 1.00 0.00 H new ATOM 0 HA MET A 1 96.546 9.682 -9.453 1.00 0.00 H new ATOM 0 HB2 MET A 1 94.919 11.234 -7.348 1.00 0.00 H new ATOM 0 HB3 MET A 1 95.492 9.592 -7.135 1.00 0.00 H new ATOM 0 HG2 MET A 1 97.871 10.444 -7.517 1.00 0.00 H new ATOM 0 HG3 MET A 1 97.233 12.077 -7.539 1.00 0.00 H new ATOM 0 HE1 MET A 1 97.753 9.124 -4.149 1.00 0.00 H new ATOM 0 HE2 MET A 1 96.210 8.896 -5.006 1.00 0.00 H new ATOM 0 HE3 MET A 1 97.743 8.869 -5.911 1.00 0.00 H new ATOM 37 N GLY A 2 94.457 8.489 -10.004 1.00 0.00 N ATOM 38 CA GLY A 2 93.211 7.816 -10.481 1.00 0.00 C ATOM 39 C GLY A 2 92.983 6.528 -9.673 1.00 0.00 C ATOM 40 O GLY A 2 93.209 5.447 -10.179 1.00 0.00 O ATOM 0 H GLY A 2 95.289 7.899 -9.995 1.00 0.00 H new ATOM 0 HA2 GLY A 2 92.358 8.485 -10.368 1.00 0.00 H new ATOM 0 HA3 GLY A 2 93.295 7.582 -11.542 1.00 0.00 H new ATOM 44 N PRO A 3 92.538 6.669 -8.436 1.00 0.00 N ATOM 45 CA PRO A 3 92.296 5.471 -7.591 1.00 0.00 C ATOM 46 C PRO A 3 91.069 4.699 -8.095 1.00 0.00 C ATOM 47 O PRO A 3 90.061 4.607 -7.418 1.00 0.00 O ATOM 48 CB PRO A 3 92.044 6.045 -6.197 1.00 0.00 C ATOM 49 CG PRO A 3 91.603 7.456 -6.424 1.00 0.00 C ATOM 50 CD PRO A 3 92.226 7.918 -7.714 1.00 0.00 C ATOM 0 HA PRO A 3 93.128 4.767 -7.607 1.00 0.00 H new ATOM 0 HB2 PRO A 3 91.280 5.474 -5.669 1.00 0.00 H new ATOM 0 HB3 PRO A 3 92.947 6.009 -5.588 1.00 0.00 H new ATOM 0 HG2 PRO A 3 90.516 7.515 -6.480 1.00 0.00 H new ATOM 0 HG3 PRO A 3 91.915 8.094 -5.597 1.00 0.00 H new ATOM 0 HD2 PRO A 3 91.541 8.546 -8.284 1.00 0.00 H new ATOM 0 HD3 PRO A 3 93.124 8.508 -7.533 1.00 0.00 H new ATOM 58 N THR A 4 91.153 4.145 -9.281 1.00 0.00 N ATOM 59 CA THR A 4 90.012 3.351 -9.831 1.00 0.00 C ATOM 60 C THR A 4 90.536 2.232 -10.734 1.00 0.00 C ATOM 61 O THR A 4 91.349 2.461 -11.610 1.00 0.00 O ATOM 62 CB THR A 4 89.183 4.353 -10.638 1.00 0.00 C ATOM 63 OG1 THR A 4 89.999 4.931 -11.649 1.00 0.00 O ATOM 64 CG2 THR A 4 88.658 5.450 -9.713 1.00 0.00 C ATOM 0 H THR A 4 91.966 4.210 -9.893 1.00 0.00 H new ATOM 0 HA THR A 4 89.422 2.876 -9.047 1.00 0.00 H new ATOM 0 HB THR A 4 88.339 3.840 -11.099 1.00 0.00 H new ATOM 0 HG1 THR A 4 90.756 4.338 -11.837 1.00 0.00 H new ATOM 0 HG21 THR A 4 88.068 6.162 -10.291 1.00 0.00 H new ATOM 0 HG22 THR A 4 88.033 5.005 -8.939 1.00 0.00 H new ATOM 0 HG23 THR A 4 89.498 5.967 -9.249 1.00 0.00 H new ATOM 72 N ASP A 5 90.072 1.024 -10.521 1.00 0.00 N ATOM 73 CA ASP A 5 90.522 -0.121 -11.371 1.00 0.00 C ATOM 74 C ASP A 5 89.611 -1.334 -11.159 1.00 0.00 C ATOM 75 O ASP A 5 88.799 -1.358 -10.251 1.00 0.00 O ATOM 76 CB ASP A 5 91.955 -0.427 -10.911 1.00 0.00 C ATOM 77 CG ASP A 5 91.997 -0.744 -9.404 1.00 0.00 C ATOM 78 OD1 ASP A 5 90.945 -0.931 -8.810 1.00 0.00 O ATOM 79 OD2 ASP A 5 93.092 -0.793 -8.867 1.00 0.00 O ATOM 0 H ASP A 5 89.400 0.782 -9.793 1.00 0.00 H new ATOM 0 HA ASP A 5 90.483 0.117 -12.434 1.00 0.00 H new ATOM 0 HB2 ASP A 5 92.349 -1.273 -11.475 1.00 0.00 H new ATOM 0 HB3 ASP A 5 92.599 0.426 -11.125 1.00 0.00 H new ATOM 84 N GLN A 6 89.742 -2.337 -11.992 1.00 0.00 N ATOM 85 CA GLN A 6 88.927 -3.582 -11.812 1.00 0.00 C ATOM 86 C GLN A 6 89.331 -4.335 -10.537 1.00 0.00 C ATOM 87 O GLN A 6 88.603 -5.187 -10.060 1.00 0.00 O ATOM 88 CB GLN A 6 89.192 -4.434 -13.058 1.00 0.00 C ATOM 89 CG GLN A 6 88.661 -3.706 -14.296 1.00 0.00 C ATOM 90 CD GLN A 6 88.962 -4.532 -15.550 1.00 0.00 C ATOM 91 OE1 GLN A 6 89.850 -5.362 -15.550 1.00 0.00 O ATOM 92 NE2 GLN A 6 88.251 -4.339 -16.628 1.00 0.00 N ATOM 0 H GLN A 6 90.378 -2.349 -12.789 1.00 0.00 H new ATOM 0 HA GLN A 6 87.868 -3.349 -11.701 1.00 0.00 H new ATOM 0 HB2 GLN A 6 90.261 -4.621 -13.163 1.00 0.00 H new ATOM 0 HB3 GLN A 6 88.707 -5.405 -12.958 1.00 0.00 H new ATOM 0 HG2 GLN A 6 87.587 -3.547 -14.203 1.00 0.00 H new ATOM 0 HG3 GLN A 6 89.123 -2.722 -14.377 1.00 0.00 H new ATOM 0 HE21 GLN A 6 87.506 -3.643 -16.629 1.00 0.00 H new ATOM 0 HE22 GLN A 6 88.441 -4.884 -17.469 1.00 0.00 H new ATOM 101 N ASP A 7 90.478 -4.028 -9.986 1.00 0.00 N ATOM 102 CA ASP A 7 90.942 -4.735 -8.749 1.00 0.00 C ATOM 103 C ASP A 7 90.049 -4.357 -7.564 1.00 0.00 C ATOM 104 O ASP A 7 89.858 -5.139 -6.649 1.00 0.00 O ATOM 105 CB ASP A 7 92.378 -4.261 -8.517 1.00 0.00 C ATOM 106 CG ASP A 7 93.007 -5.069 -7.380 1.00 0.00 C ATOM 107 OD1 ASP A 7 93.500 -6.151 -7.653 1.00 0.00 O ATOM 108 OD2 ASP A 7 92.983 -4.592 -6.257 1.00 0.00 O ATOM 0 H ASP A 7 91.117 -3.316 -10.340 1.00 0.00 H new ATOM 0 HA ASP A 7 90.894 -5.819 -8.854 1.00 0.00 H new ATOM 0 HB2 ASP A 7 92.963 -4.381 -9.429 1.00 0.00 H new ATOM 0 HB3 ASP A 7 92.386 -3.199 -8.270 1.00 0.00 H new ATOM 113 N TRP A 8 89.505 -3.164 -7.576 1.00 0.00 N ATOM 114 CA TRP A 8 88.648 -2.709 -6.438 1.00 0.00 C ATOM 115 C TRP A 8 87.246 -3.326 -6.508 1.00 0.00 C ATOM 116 O TRP A 8 86.507 -3.273 -5.547 1.00 0.00 O ATOM 117 CB TRP A 8 88.570 -1.188 -6.552 1.00 0.00 C ATOM 118 CG TRP A 8 89.654 -0.484 -5.801 1.00 0.00 C ATOM 119 CD1 TRP A 8 90.368 0.568 -6.272 1.00 0.00 C ATOM 120 CD2 TRP A 8 90.161 -0.762 -4.462 1.00 0.00 C ATOM 121 NE1 TRP A 8 91.288 0.962 -5.311 1.00 0.00 N ATOM 122 CE2 TRP A 8 91.214 0.183 -4.178 1.00 0.00 C ATOM 123 CE3 TRP A 8 89.826 -1.737 -3.451 1.00 0.00 C ATOM 124 CZ2 TRP A 8 91.917 0.167 -2.935 1.00 0.00 C ATOM 125 CZ3 TRP A 8 90.531 -1.759 -2.199 1.00 0.00 C ATOM 126 CH2 TRP A 8 91.576 -0.808 -1.942 1.00 0.00 C ATOM 0 H TRP A 8 89.619 -2.484 -8.328 1.00 0.00 H new ATOM 0 HA TRP A 8 89.073 -3.022 -5.484 1.00 0.00 H new ATOM 0 HB2 TRP A 8 88.623 -0.906 -7.604 1.00 0.00 H new ATOM 0 HB3 TRP A 8 87.602 -0.852 -6.180 1.00 0.00 H new ATOM 0 HD1 TRP A 8 90.241 1.027 -7.241 1.00 0.00 H new ATOM 0 HE1 TRP A 8 91.941 1.736 -5.430 1.00 0.00 H new ATOM 0 HE3 TRP A 8 89.040 -2.454 -3.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 92.701 0.885 -2.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 90.274 -2.493 -1.449 1.00 0.00 H new ATOM 0 HH2 TRP A 8 92.105 -0.828 -1.000 1.00 0.00 H new ATOM 137 N ILE A 9 86.865 -3.914 -7.623 1.00 0.00 N ATOM 138 CA ILE A 9 85.439 -4.364 -7.787 1.00 0.00 C ATOM 139 C ILE A 9 85.042 -5.308 -6.639 1.00 0.00 C ATOM 140 O ILE A 9 85.765 -6.225 -6.295 1.00 0.00 O ATOM 141 CB ILE A 9 85.382 -5.093 -9.145 1.00 0.00 C ATOM 142 CG1 ILE A 9 85.789 -4.145 -10.291 1.00 0.00 C ATOM 143 CG2 ILE A 9 83.958 -5.602 -9.401 1.00 0.00 C ATOM 144 CD1 ILE A 9 84.884 -2.905 -10.311 1.00 0.00 C ATOM 0 H ILE A 9 87.474 -4.101 -8.420 1.00 0.00 H new ATOM 0 HA ILE A 9 84.743 -3.525 -7.760 1.00 0.00 H new ATOM 0 HB ILE A 9 86.078 -5.931 -9.112 1.00 0.00 H new ATOM 0 HG12 ILE A 9 86.829 -3.842 -10.168 1.00 0.00 H new ATOM 0 HG13 ILE A 9 85.720 -4.668 -11.245 1.00 0.00 H new ATOM 0 HG21 ILE A 9 83.923 -6.116 -10.361 1.00 0.00 H new ATOM 0 HG22 ILE A 9 83.671 -6.293 -8.609 1.00 0.00 H new ATOM 0 HG23 ILE A 9 83.267 -4.759 -9.415 1.00 0.00 H new ATOM 0 HD11 ILE A 9 85.186 -2.247 -11.126 1.00 0.00 H new ATOM 0 HD12 ILE A 9 83.849 -3.213 -10.457 1.00 0.00 H new ATOM 0 HD13 ILE A 9 84.974 -2.373 -9.364 1.00 0.00 H new ATOM 156 N GLY A 10 83.893 -5.077 -6.054 1.00 0.00 N ATOM 157 CA GLY A 10 83.444 -5.907 -4.897 1.00 0.00 C ATOM 158 C GLY A 10 84.022 -5.395 -3.566 1.00 0.00 C ATOM 159 O GLY A 10 83.737 -5.960 -2.523 1.00 0.00 O ATOM 0 H GLY A 10 83.242 -4.342 -6.332 1.00 0.00 H new ATOM 0 HA2 GLY A 10 82.355 -5.901 -4.846 1.00 0.00 H new ATOM 0 HA3 GLY A 10 83.750 -6.942 -5.052 1.00 0.00 H new ATOM 163 N CYS A 11 84.824 -4.342 -3.572 1.00 0.00 N ATOM 164 CA CYS A 11 85.364 -3.811 -2.273 1.00 0.00 C ATOM 165 C CYS A 11 84.335 -2.881 -1.604 1.00 0.00 C ATOM 166 O CYS A 11 83.491 -2.306 -2.265 1.00 0.00 O ATOM 167 CB CYS A 11 86.705 -3.103 -2.613 1.00 0.00 C ATOM 168 SG CYS A 11 86.476 -1.432 -3.309 1.00 0.00 S ATOM 0 H CYS A 11 85.121 -3.838 -4.407 1.00 0.00 H new ATOM 0 HA CYS A 11 85.548 -4.603 -1.547 1.00 0.00 H new ATOM 0 HB2 CYS A 11 87.312 -3.034 -1.710 1.00 0.00 H new ATOM 0 HB3 CYS A 11 87.261 -3.713 -3.325 1.00 0.00 H new ATOM 0 HG CYS A 11 87.571 -1.053 -3.898 1.00 0.00 H new ATOM 174 N ALA A 12 84.408 -2.736 -0.304 1.00 0.00 N ATOM 175 CA ALA A 12 83.383 -1.933 0.430 1.00 0.00 C ATOM 176 C ALA A 12 83.830 -0.474 0.529 1.00 0.00 C ATOM 177 O ALA A 12 84.855 -0.179 1.115 1.00 0.00 O ATOM 178 CB ALA A 12 83.317 -2.564 1.821 1.00 0.00 C ATOM 0 H ALA A 12 85.137 -3.142 0.283 1.00 0.00 H new ATOM 0 HA ALA A 12 82.415 -1.937 -0.071 1.00 0.00 H new ATOM 0 HB1 ALA A 12 82.584 -2.032 2.428 1.00 0.00 H new ATOM 0 HB2 ALA A 12 83.024 -3.610 1.732 1.00 0.00 H new ATOM 0 HB3 ALA A 12 84.296 -2.501 2.296 1.00 0.00 H new ATOM 184 N VAL A 13 83.069 0.435 -0.034 1.00 0.00 N ATOM 185 CA VAL A 13 83.475 1.875 -0.012 1.00 0.00 C ATOM 186 C VAL A 13 82.286 2.765 0.365 1.00 0.00 C ATOM 187 O VAL A 13 81.140 2.381 0.216 1.00 0.00 O ATOM 188 CB VAL A 13 83.957 2.184 -1.435 1.00 0.00 C ATOM 189 CG1 VAL A 13 85.154 1.295 -1.770 1.00 0.00 C ATOM 190 CG2 VAL A 13 82.831 1.919 -2.444 1.00 0.00 C ATOM 0 H VAL A 13 82.186 0.241 -0.507 1.00 0.00 H new ATOM 0 HA VAL A 13 84.253 2.066 0.727 1.00 0.00 H new ATOM 0 HB VAL A 13 84.247 3.233 -1.491 1.00 0.00 H new ATOM 0 HG11 VAL A 13 85.498 1.513 -2.781 1.00 0.00 H new ATOM 0 HG12 VAL A 13 85.960 1.489 -1.063 1.00 0.00 H new ATOM 0 HG13 VAL A 13 84.859 0.248 -1.705 1.00 0.00 H new ATOM 0 HG21 VAL A 13 83.185 2.142 -3.451 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.531 0.873 -2.388 1.00 0.00 H new ATOM 0 HG23 VAL A 13 81.977 2.554 -2.211 1.00 0.00 H new ATOM 200 N SER A 14 82.562 3.950 0.853 1.00 0.00 N ATOM 201 CA SER A 14 81.469 4.919 1.148 1.00 0.00 C ATOM 202 C SER A 14 81.695 6.199 0.352 1.00 0.00 C ATOM 203 O SER A 14 82.815 6.647 0.196 1.00 0.00 O ATOM 204 CB SER A 14 81.562 5.190 2.649 1.00 0.00 C ATOM 205 OG SER A 14 80.714 6.282 2.982 1.00 0.00 O ATOM 0 H SER A 14 83.503 4.286 1.059 1.00 0.00 H new ATOM 0 HA SER A 14 80.486 4.536 0.875 1.00 0.00 H new ATOM 0 HB2 SER A 14 81.268 4.302 3.209 1.00 0.00 H new ATOM 0 HB3 SER A 14 82.592 5.416 2.926 1.00 0.00 H new ATOM 0 HG SER A 14 80.770 6.458 3.945 1.00 0.00 H new ATOM 211 N ILE A 15 80.640 6.786 -0.153 1.00 0.00 N ATOM 212 CA ILE A 15 80.800 7.948 -1.076 1.00 0.00 C ATOM 213 C ILE A 15 80.057 9.157 -0.517 1.00 0.00 C ATOM 214 O ILE A 15 78.852 9.119 -0.331 1.00 0.00 O ATOM 215 CB ILE A 15 80.178 7.518 -2.423 1.00 0.00 C ATOM 216 CG1 ILE A 15 80.676 6.121 -2.870 1.00 0.00 C ATOM 217 CG2 ILE A 15 80.553 8.542 -3.496 1.00 0.00 C ATOM 218 CD1 ILE A 15 82.208 6.052 -2.868 1.00 0.00 C ATOM 0 H ILE A 15 79.676 6.511 0.034 1.00 0.00 H new ATOM 0 HA ILE A 15 81.847 8.226 -1.195 1.00 0.00 H new ATOM 0 HB ILE A 15 79.097 7.467 -2.291 1.00 0.00 H new ATOM 0 HG12 ILE A 15 80.274 5.358 -2.203 1.00 0.00 H new ATOM 0 HG13 ILE A 15 80.301 5.901 -3.869 1.00 0.00 H new ATOM 0 HG21 ILE A 15 80.117 8.245 -4.450 1.00 0.00 H new ATOM 0 HG22 ILE A 15 80.171 9.523 -3.212 1.00 0.00 H new ATOM 0 HG23 ILE A 15 81.638 8.589 -3.591 1.00 0.00 H new ATOM 0 HD11 ILE A 15 82.528 5.060 -3.186 1.00 0.00 H new ATOM 0 HD12 ILE A 15 82.607 6.799 -3.554 1.00 0.00 H new ATOM 0 HD13 ILE A 15 82.580 6.248 -1.862 1.00 0.00 H new ATOM 230 N ALA A 16 80.765 10.224 -0.249 1.00 0.00 N ATOM 231 CA ALA A 16 80.102 11.477 0.208 1.00 0.00 C ATOM 232 C ALA A 16 79.908 12.411 -0.984 1.00 0.00 C ATOM 233 O ALA A 16 80.858 12.950 -1.519 1.00 0.00 O ATOM 234 CB ALA A 16 81.061 12.091 1.228 1.00 0.00 C ATOM 0 H ALA A 16 81.780 10.279 -0.328 1.00 0.00 H new ATOM 0 HA ALA A 16 79.120 11.298 0.645 1.00 0.00 H new ATOM 0 HB1 ALA A 16 80.639 13.020 1.610 1.00 0.00 H new ATOM 0 HB2 ALA A 16 81.210 11.394 2.053 1.00 0.00 H new ATOM 0 HB3 ALA A 16 82.018 12.297 0.749 1.00 0.00 H new ATOM 240 N CYS A 17 78.683 12.596 -1.404 1.00 0.00 N ATOM 241 CA CYS A 17 78.394 13.523 -2.538 1.00 0.00 C ATOM 242 C CYS A 17 78.008 14.896 -1.987 1.00 0.00 C ATOM 243 O CYS A 17 77.739 15.039 -0.807 1.00 0.00 O ATOM 244 CB CYS A 17 77.217 12.903 -3.303 1.00 0.00 C ATOM 245 SG CYS A 17 77.627 11.222 -3.852 1.00 0.00 S ATOM 0 H CYS A 17 77.863 12.139 -1.005 1.00 0.00 H new ATOM 0 HA CYS A 17 79.258 13.656 -3.189 1.00 0.00 H new ATOM 0 HB2 CYS A 17 76.334 12.878 -2.664 1.00 0.00 H new ATOM 0 HB3 CYS A 17 76.969 13.523 -4.165 1.00 0.00 H new ATOM 0 HG CYS A 17 76.616 10.717 -4.495 1.00 0.00 H new ATOM 251 N ASP A 18 77.978 15.905 -2.824 1.00 0.00 N ATOM 252 CA ASP A 18 77.690 17.289 -2.327 1.00 0.00 C ATOM 253 C ASP A 18 76.306 17.336 -1.665 1.00 0.00 C ATOM 254 O ASP A 18 75.571 16.367 -1.675 1.00 0.00 O ATOM 255 CB ASP A 18 77.750 18.200 -3.562 1.00 0.00 C ATOM 256 CG ASP A 18 76.761 17.727 -4.642 1.00 0.00 C ATOM 257 OD1 ASP A 18 75.894 16.922 -4.334 1.00 0.00 O ATOM 258 OD2 ASP A 18 76.889 18.184 -5.765 1.00 0.00 O ATOM 0 H ASP A 18 78.140 15.831 -3.828 1.00 0.00 H new ATOM 0 HA ASP A 18 78.408 17.610 -1.572 1.00 0.00 H new ATOM 0 HB2 ASP A 18 77.517 19.225 -3.274 1.00 0.00 H new ATOM 0 HB3 ASP A 18 78.762 18.204 -3.967 1.00 0.00 H new ATOM 263 N GLU A 19 75.950 18.459 -1.092 1.00 0.00 N ATOM 264 CA GLU A 19 74.772 18.500 -0.161 1.00 0.00 C ATOM 265 C GLU A 19 73.501 17.962 -0.832 1.00 0.00 C ATOM 266 O GLU A 19 72.690 17.314 -0.194 1.00 0.00 O ATOM 267 CB GLU A 19 74.592 19.979 0.194 1.00 0.00 C ATOM 268 CG GLU A 19 75.810 20.469 0.986 1.00 0.00 C ATOM 269 CD GLU A 19 75.620 21.935 1.409 1.00 0.00 C ATOM 270 OE1 GLU A 19 74.789 22.612 0.822 1.00 0.00 O ATOM 271 OE2 GLU A 19 76.316 22.357 2.319 1.00 0.00 O ATOM 0 H GLU A 19 76.423 19.352 -1.227 1.00 0.00 H new ATOM 0 HA GLU A 19 74.944 17.876 0.716 1.00 0.00 H new ATOM 0 HB2 GLU A 19 74.474 20.570 -0.714 1.00 0.00 H new ATOM 0 HB3 GLU A 19 73.684 20.115 0.782 1.00 0.00 H new ATOM 0 HG2 GLU A 19 75.953 19.845 1.868 1.00 0.00 H new ATOM 0 HG3 GLU A 19 76.710 20.373 0.378 1.00 0.00 H new ATOM 278 N VAL A 20 73.324 18.220 -2.105 1.00 0.00 N ATOM 279 CA VAL A 20 72.051 17.815 -2.786 1.00 0.00 C ATOM 280 C VAL A 20 72.043 16.302 -3.055 1.00 0.00 C ATOM 281 O VAL A 20 70.993 15.693 -3.161 1.00 0.00 O ATOM 282 CB VAL A 20 72.030 18.608 -4.101 1.00 0.00 C ATOM 283 CG1 VAL A 20 70.765 18.266 -4.899 1.00 0.00 C ATOM 284 CG2 VAL A 20 72.038 20.109 -3.794 1.00 0.00 C ATOM 0 H VAL A 20 74.003 18.692 -2.702 1.00 0.00 H new ATOM 0 HA VAL A 20 71.173 18.025 -2.175 1.00 0.00 H new ATOM 0 HB VAL A 20 72.910 18.345 -4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 20 70.758 18.833 -5.830 1.00 0.00 H new ATOM 0 HG12 VAL A 20 70.754 17.199 -5.123 1.00 0.00 H new ATOM 0 HG13 VAL A 20 69.884 18.523 -4.311 1.00 0.00 H new ATOM 0 HG21 VAL A 20 72.023 20.671 -4.728 1.00 0.00 H new ATOM 0 HG22 VAL A 20 71.159 20.364 -3.203 1.00 0.00 H new ATOM 0 HG23 VAL A 20 72.938 20.361 -3.233 1.00 0.00 H new ATOM 294 N LEU A 21 73.201 15.696 -3.165 1.00 0.00 N ATOM 295 CA LEU A 21 73.270 14.235 -3.474 1.00 0.00 C ATOM 296 C LEU A 21 73.293 13.385 -2.192 1.00 0.00 C ATOM 297 O LEU A 21 73.077 12.187 -2.241 1.00 0.00 O ATOM 298 CB LEU A 21 74.576 14.083 -4.246 1.00 0.00 C ATOM 299 CG LEU A 21 74.467 14.802 -5.593 1.00 0.00 C ATOM 300 CD1 LEU A 21 75.819 14.755 -6.307 1.00 0.00 C ATOM 301 CD2 LEU A 21 73.411 14.111 -6.461 1.00 0.00 C ATOM 0 H LEU A 21 74.105 16.154 -3.053 1.00 0.00 H new ATOM 0 HA LEU A 21 72.401 13.893 -4.036 1.00 0.00 H new ATOM 0 HB2 LEU A 21 75.402 14.498 -3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 21 74.796 13.027 -4.403 1.00 0.00 H new ATOM 0 HG LEU A 21 74.177 15.839 -5.426 1.00 0.00 H new ATOM 0 HD11 LEU A 21 75.742 15.267 -7.266 1.00 0.00 H new ATOM 0 HD12 LEU A 21 76.572 15.248 -5.692 1.00 0.00 H new ATOM 0 HD13 LEU A 21 76.107 13.717 -6.472 1.00 0.00 H new ATOM 0 HD21 LEU A 21 73.335 14.625 -7.419 1.00 0.00 H new ATOM 0 HD22 LEU A 21 73.699 13.073 -6.627 1.00 0.00 H new ATOM 0 HD23 LEU A 21 72.446 14.143 -5.955 1.00 0.00 H new ATOM 313 N GLY A 22 73.552 13.987 -1.052 1.00 0.00 N ATOM 314 CA GLY A 22 73.583 13.210 0.227 1.00 0.00 C ATOM 315 C GLY A 22 74.721 12.184 0.197 1.00 0.00 C ATOM 316 O GLY A 22 75.723 12.371 -0.469 1.00 0.00 O ATOM 0 H GLY A 22 73.743 14.984 -0.955 1.00 0.00 H new ATOM 0 HA2 GLY A 22 73.718 13.888 1.070 1.00 0.00 H new ATOM 0 HA3 GLY A 22 72.630 12.702 0.376 1.00 0.00 H new ATOM 320 N VAL A 23 74.572 11.099 0.921 1.00 0.00 N ATOM 321 CA VAL A 23 75.679 10.094 1.020 1.00 0.00 C ATOM 322 C VAL A 23 75.129 8.683 0.818 1.00 0.00 C ATOM 323 O VAL A 23 74.043 8.367 1.272 1.00 0.00 O ATOM 324 CB VAL A 23 76.245 10.225 2.442 1.00 0.00 C ATOM 325 CG1 VAL A 23 77.465 9.307 2.592 1.00 0.00 C ATOM 326 CG2 VAL A 23 76.663 11.674 2.716 1.00 0.00 C ATOM 0 H VAL A 23 73.730 10.866 1.448 1.00 0.00 H new ATOM 0 HA VAL A 23 76.441 10.269 0.261 1.00 0.00 H new ATOM 0 HB VAL A 23 75.475 9.937 3.157 1.00 0.00 H new ATOM 0 HG11 VAL A 23 77.868 9.399 3.601 1.00 0.00 H new ATOM 0 HG12 VAL A 23 77.167 8.274 2.413 1.00 0.00 H new ATOM 0 HG13 VAL A 23 78.228 9.595 1.869 1.00 0.00 H new ATOM 0 HG21 VAL A 23 77.062 11.752 3.727 1.00 0.00 H new ATOM 0 HG22 VAL A 23 77.428 11.974 2.000 1.00 0.00 H new ATOM 0 HG23 VAL A 23 75.796 12.328 2.616 1.00 0.00 H new ATOM 336 N PHE A 24 75.870 7.834 0.146 1.00 0.00 N ATOM 337 CA PHE A 24 75.472 6.397 0.065 1.00 0.00 C ATOM 338 C PHE A 24 76.682 5.494 0.332 1.00 0.00 C ATOM 339 O PHE A 24 77.816 5.906 0.197 1.00 0.00 O ATOM 340 CB PHE A 24 74.935 6.174 -1.357 1.00 0.00 C ATOM 341 CG PHE A 24 75.977 6.300 -2.448 1.00 0.00 C ATOM 342 CD1 PHE A 24 76.733 5.145 -2.838 1.00 0.00 C ATOM 343 CD2 PHE A 24 76.229 7.567 -3.076 1.00 0.00 C ATOM 344 CE1 PHE A 24 77.732 5.252 -3.860 1.00 0.00 C ATOM 345 CE2 PHE A 24 77.233 7.672 -4.095 1.00 0.00 C ATOM 346 CZ PHE A 24 77.982 6.516 -4.489 1.00 0.00 C ATOM 0 H PHE A 24 76.730 8.075 -0.347 1.00 0.00 H new ATOM 0 HA PHE A 24 74.716 6.153 0.811 1.00 0.00 H new ATOM 0 HB2 PHE A 24 74.488 5.181 -1.412 1.00 0.00 H new ATOM 0 HB3 PHE A 24 74.138 6.893 -1.548 1.00 0.00 H new ATOM 0 HD1 PHE A 24 76.549 4.194 -2.361 1.00 0.00 H new ATOM 0 HD2 PHE A 24 75.664 8.439 -2.782 1.00 0.00 H new ATOM 0 HE1 PHE A 24 78.297 4.380 -4.156 1.00 0.00 H new ATOM 0 HE2 PHE A 24 77.425 8.625 -4.566 1.00 0.00 H new ATOM 0 HZ PHE A 24 78.735 6.597 -5.259 1.00 0.00 H new ATOM 356 N GLN A 25 76.436 4.267 0.712 1.00 0.00 N ATOM 357 CA GLN A 25 77.550 3.294 0.927 1.00 0.00 C ATOM 358 C GLN A 25 77.166 1.942 0.321 1.00 0.00 C ATOM 359 O GLN A 25 76.014 1.553 0.356 1.00 0.00 O ATOM 360 CB GLN A 25 77.697 3.190 2.446 1.00 0.00 C ATOM 361 CG GLN A 25 78.082 4.562 3.012 1.00 0.00 C ATOM 362 CD GLN A 25 78.212 4.488 4.538 1.00 0.00 C ATOM 363 OE1 GLN A 25 78.243 3.416 5.112 1.00 0.00 O ATOM 364 NE2 GLN A 25 78.285 5.596 5.224 1.00 0.00 N ATOM 0 H GLN A 25 75.503 3.894 0.884 1.00 0.00 H new ATOM 0 HA GLN A 25 78.483 3.605 0.457 1.00 0.00 H new ATOM 0 HB2 GLN A 25 76.762 2.849 2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 25 78.458 2.452 2.700 1.00 0.00 H new ATOM 0 HG2 GLN A 25 79.024 4.892 2.575 1.00 0.00 H new ATOM 0 HG3 GLN A 25 77.328 5.301 2.739 1.00 0.00 H new ATOM 0 HE21 GLN A 25 78.259 6.496 4.744 1.00 0.00 H new ATOM 0 HE22 GLN A 25 78.368 5.562 6.240 1.00 0.00 H new ATOM 373 N GLY A 26 78.117 1.230 -0.234 1.00 0.00 N ATOM 374 CA GLY A 26 77.782 -0.035 -0.956 1.00 0.00 C ATOM 375 C GLY A 26 79.061 -0.728 -1.428 1.00 0.00 C ATOM 376 O GLY A 26 80.141 -0.167 -1.369 1.00 0.00 O ATOM 0 H GLY A 26 79.108 1.470 -0.218 1.00 0.00 H new ATOM 0 HA2 GLY A 26 77.221 -0.700 -0.299 1.00 0.00 H new ATOM 0 HA3 GLY A 26 77.142 0.184 -1.811 1.00 0.00 H new ATOM 380 N LEU A 27 78.941 -1.949 -1.889 1.00 0.00 N ATOM 381 CA LEU A 27 80.113 -2.644 -2.498 1.00 0.00 C ATOM 382 C LEU A 27 80.166 -2.361 -4.001 1.00 0.00 C ATOM 383 O LEU A 27 79.164 -2.404 -4.690 1.00 0.00 O ATOM 384 CB LEU A 27 79.879 -4.133 -2.238 1.00 0.00 C ATOM 385 CG LEU A 27 79.968 -4.410 -0.737 1.00 0.00 C ATOM 386 CD1 LEU A 27 79.409 -5.804 -0.442 1.00 0.00 C ATOM 387 CD2 LEU A 27 81.435 -4.344 -0.292 1.00 0.00 C ATOM 0 H LEU A 27 78.079 -2.494 -1.869 1.00 0.00 H new ATOM 0 HA LEU A 27 81.059 -2.306 -2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 27 78.900 -4.429 -2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 27 80.620 -4.727 -2.773 1.00 0.00 H new ATOM 0 HG LEU A 27 79.389 -3.663 -0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 27 79.472 -6.002 0.628 1.00 0.00 H new ATOM 0 HD12 LEU A 27 78.367 -5.853 -0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 27 79.989 -6.551 -0.984 1.00 0.00 H new ATOM 0 HD21 LEU A 27 81.500 -4.541 0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 27 82.014 -5.091 -0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 27 81.835 -3.352 -0.503 1.00 0.00 H new ATOM 399 N ILE A 28 81.336 -2.076 -4.503 1.00 0.00 N ATOM 400 CA ILE A 28 81.483 -1.707 -5.948 1.00 0.00 C ATOM 401 C ILE A 28 81.174 -2.912 -6.847 1.00 0.00 C ATOM 402 O ILE A 28 81.589 -4.023 -6.576 1.00 0.00 O ATOM 403 CB ILE A 28 82.951 -1.268 -6.101 1.00 0.00 C ATOM 404 CG1 ILE A 28 83.209 -0.050 -5.201 1.00 0.00 C ATOM 405 CG2 ILE A 28 83.256 -0.908 -7.564 1.00 0.00 C ATOM 406 CD1 ILE A 28 84.692 0.327 -5.251 1.00 0.00 C ATOM 0 H ILE A 28 82.207 -2.082 -3.972 1.00 0.00 H new ATOM 0 HA ILE A 28 80.791 -0.918 -6.243 1.00 0.00 H new ATOM 0 HB ILE A 28 83.602 -2.091 -5.805 1.00 0.00 H new ATOM 0 HG12 ILE A 28 82.599 0.792 -5.529 1.00 0.00 H new ATOM 0 HG13 ILE A 28 82.916 -0.275 -4.176 1.00 0.00 H new ATOM 0 HG21 ILE A 28 84.298 -0.600 -7.653 1.00 0.00 H new ATOM 0 HG22 ILE A 28 83.079 -1.777 -8.197 1.00 0.00 H new ATOM 0 HG23 ILE A 28 82.608 -0.091 -7.880 1.00 0.00 H new ATOM 0 HD11 ILE A 28 84.869 1.191 -4.611 1.00 0.00 H new ATOM 0 HD12 ILE A 28 85.293 -0.513 -4.902 1.00 0.00 H new ATOM 0 HD13 ILE A 28 84.971 0.571 -6.276 1.00 0.00 H new ATOM 418 N LYS A 29 80.445 -2.688 -7.912 1.00 0.00 N ATOM 419 CA LYS A 29 80.261 -3.753 -8.943 1.00 0.00 C ATOM 420 C LYS A 29 81.135 -3.447 -10.162 1.00 0.00 C ATOM 421 O LYS A 29 81.653 -4.342 -10.805 1.00 0.00 O ATOM 422 CB LYS A 29 78.782 -3.701 -9.323 1.00 0.00 C ATOM 423 CG LYS A 29 78.473 -4.830 -10.310 1.00 0.00 C ATOM 424 CD LYS A 29 77.041 -4.682 -10.830 1.00 0.00 C ATOM 425 CE LYS A 29 76.683 -5.894 -11.693 1.00 0.00 C ATOM 426 NZ LYS A 29 77.069 -5.508 -13.078 1.00 0.00 N ATOM 0 H LYS A 29 79.968 -1.809 -8.112 1.00 0.00 H new ATOM 0 HA LYS A 29 80.546 -4.738 -8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 29 78.162 -3.802 -8.432 1.00 0.00 H new ATOM 0 HB3 LYS A 29 78.543 -2.736 -9.770 1.00 0.00 H new ATOM 0 HG2 LYS A 29 79.177 -4.802 -11.142 1.00 0.00 H new ATOM 0 HG3 LYS A 29 78.595 -5.797 -9.822 1.00 0.00 H new ATOM 0 HD2 LYS A 29 76.346 -4.599 -9.994 1.00 0.00 H new ATOM 0 HD3 LYS A 29 76.948 -3.766 -11.414 1.00 0.00 H new ATOM 0 HE2 LYS A 29 77.221 -6.784 -11.367 1.00 0.00 H new ATOM 0 HE3 LYS A 29 75.619 -6.124 -11.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 76.854 -6.290 -13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 76.536 -4.662 -13.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 78.088 -5.302 -13.110 1.00 0.00 H new ATOM 440 N GLN A 30 81.300 -2.186 -10.480 1.00 0.00 N ATOM 441 CA GLN A 30 82.124 -1.799 -11.669 1.00 0.00 C ATOM 442 C GLN A 30 82.712 -0.403 -11.453 1.00 0.00 C ATOM 443 O GLN A 30 82.142 0.414 -10.753 1.00 0.00 O ATOM 444 CB GLN A 30 81.168 -1.792 -12.869 1.00 0.00 C ATOM 445 CG GLN A 30 80.761 -3.223 -13.235 1.00 0.00 C ATOM 446 CD GLN A 30 79.916 -3.205 -14.512 1.00 0.00 C ATOM 447 OE1 GLN A 30 79.322 -2.199 -14.850 1.00 0.00 O ATOM 448 NE2 GLN A 30 79.838 -4.285 -15.242 1.00 0.00 N ATOM 0 H GLN A 30 80.897 -1.404 -9.964 1.00 0.00 H new ATOM 0 HA GLN A 30 82.952 -2.490 -11.830 1.00 0.00 H new ATOM 0 HB2 GLN A 30 80.281 -1.204 -12.632 1.00 0.00 H new ATOM 0 HB3 GLN A 30 81.649 -1.314 -13.723 1.00 0.00 H new ATOM 0 HG2 GLN A 30 81.649 -3.838 -13.383 1.00 0.00 H new ATOM 0 HG3 GLN A 30 80.195 -3.671 -12.418 1.00 0.00 H new ATOM 0 HE21 GLN A 30 80.336 -5.129 -14.959 1.00 0.00 H new ATOM 0 HE22 GLN A 30 79.279 -4.285 -16.095 1.00 0.00 H new ATOM 457 N ILE A 31 83.848 -0.125 -12.048 1.00 0.00 N ATOM 458 CA ILE A 31 84.482 1.220 -11.878 1.00 0.00 C ATOM 459 C ILE A 31 85.046 1.702 -13.218 1.00 0.00 C ATOM 460 O ILE A 31 85.628 0.942 -13.970 1.00 0.00 O ATOM 461 CB ILE A 31 85.606 1.033 -10.845 1.00 0.00 C ATOM 462 CG1 ILE A 31 85.016 0.511 -9.529 1.00 0.00 C ATOM 463 CG2 ILE A 31 86.305 2.379 -10.593 1.00 0.00 C ATOM 464 CD1 ILE A 31 86.139 0.222 -8.530 1.00 0.00 C ATOM 0 H ILE A 31 84.363 -0.773 -12.644 1.00 0.00 H new ATOM 0 HA ILE A 31 83.765 1.969 -11.542 1.00 0.00 H new ATOM 0 HB ILE A 31 86.330 0.314 -11.229 1.00 0.00 H new ATOM 0 HG12 ILE A 31 84.328 1.247 -9.112 1.00 0.00 H new ATOM 0 HG13 ILE A 31 84.440 -0.396 -9.714 1.00 0.00 H new ATOM 0 HG21 ILE A 31 87.101 2.244 -9.861 1.00 0.00 H new ATOM 0 HG22 ILE A 31 86.729 2.749 -11.526 1.00 0.00 H new ATOM 0 HG23 ILE A 31 85.581 3.100 -10.213 1.00 0.00 H new ATOM 0 HD11 ILE A 31 85.711 -0.148 -7.598 1.00 0.00 H new ATOM 0 HD12 ILE A 31 86.810 -0.530 -8.945 1.00 0.00 H new ATOM 0 HD13 ILE A 31 86.697 1.138 -8.334 1.00 0.00 H new ATOM 476 N SER A 32 84.872 2.964 -13.510 1.00 0.00 N ATOM 477 CA SER A 32 85.498 3.560 -14.725 1.00 0.00 C ATOM 478 C SER A 32 85.868 5.017 -14.443 1.00 0.00 C ATOM 479 O SER A 32 85.318 5.641 -13.556 1.00 0.00 O ATOM 480 CB SER A 32 84.431 3.476 -15.815 1.00 0.00 C ATOM 481 OG SER A 32 83.337 4.314 -15.466 1.00 0.00 O ATOM 0 H SER A 32 84.317 3.613 -12.952 1.00 0.00 H new ATOM 0 HA SER A 32 86.410 3.042 -15.022 1.00 0.00 H new ATOM 0 HB2 SER A 32 84.849 3.784 -16.774 1.00 0.00 H new ATOM 0 HB3 SER A 32 84.093 2.446 -15.931 1.00 0.00 H new ATOM 0 HG SER A 32 82.541 4.037 -15.965 1.00 0.00 H new ATOM 487 N ALA A 33 86.786 5.564 -15.198 1.00 0.00 N ATOM 488 CA ALA A 33 87.342 6.917 -14.862 1.00 0.00 C ATOM 489 C ALA A 33 86.228 7.968 -14.743 1.00 0.00 C ATOM 490 O ALA A 33 86.393 8.977 -14.081 1.00 0.00 O ATOM 491 CB ALA A 33 88.279 7.269 -16.021 1.00 0.00 C ATOM 0 H ALA A 33 87.178 5.134 -16.036 1.00 0.00 H new ATOM 0 HA ALA A 33 87.857 6.904 -13.901 1.00 0.00 H new ATOM 0 HB1 ALA A 33 88.724 8.248 -15.845 1.00 0.00 H new ATOM 0 HB2 ALA A 33 89.067 6.520 -16.092 1.00 0.00 H new ATOM 0 HB3 ALA A 33 87.713 7.290 -16.953 1.00 0.00 H new ATOM 497 N GLU A 34 85.099 7.740 -15.375 1.00 0.00 N ATOM 498 CA GLU A 34 84.028 8.784 -15.405 1.00 0.00 C ATOM 499 C GLU A 34 83.031 8.591 -14.253 1.00 0.00 C ATOM 500 O GLU A 34 82.401 9.537 -13.815 1.00 0.00 O ATOM 501 CB GLU A 34 83.332 8.600 -16.754 1.00 0.00 C ATOM 502 CG GLU A 34 84.330 8.879 -17.886 1.00 0.00 C ATOM 503 CD GLU A 34 83.635 8.769 -19.252 1.00 0.00 C ATOM 504 OE1 GLU A 34 82.576 8.162 -19.324 1.00 0.00 O ATOM 505 OE2 GLU A 34 84.178 9.296 -20.209 1.00 0.00 O ATOM 0 H GLU A 34 84.875 6.877 -15.870 1.00 0.00 H new ATOM 0 HA GLU A 34 84.440 9.786 -15.286 1.00 0.00 H new ATOM 0 HB2 GLU A 34 82.943 7.585 -16.839 1.00 0.00 H new ATOM 0 HB3 GLU A 34 82.480 9.275 -16.831 1.00 0.00 H new ATOM 0 HG2 GLU A 34 84.756 9.875 -17.767 1.00 0.00 H new ATOM 0 HG3 GLU A 34 85.157 8.171 -17.833 1.00 0.00 H new ATOM 512 N GLU A 35 82.884 7.383 -13.759 1.00 0.00 N ATOM 513 CA GLU A 35 81.806 7.106 -12.756 1.00 0.00 C ATOM 514 C GLU A 35 82.150 5.878 -11.902 1.00 0.00 C ATOM 515 O GLU A 35 82.924 5.029 -12.300 1.00 0.00 O ATOM 516 CB GLU A 35 80.539 6.862 -13.584 1.00 0.00 C ATOM 517 CG GLU A 35 80.747 5.670 -14.530 1.00 0.00 C ATOM 518 CD GLU A 35 79.529 5.505 -15.449 1.00 0.00 C ATOM 519 OE1 GLU A 35 78.451 5.935 -15.068 1.00 0.00 O ATOM 520 OE2 GLU A 35 79.698 4.951 -16.522 1.00 0.00 O ATOM 0 H GLU A 35 83.462 6.580 -14.006 1.00 0.00 H new ATOM 0 HA GLU A 35 81.681 7.934 -12.058 1.00 0.00 H new ATOM 0 HB2 GLU A 35 79.695 6.668 -12.922 1.00 0.00 H new ATOM 0 HB3 GLU A 35 80.294 7.755 -14.160 1.00 0.00 H new ATOM 0 HG2 GLU A 35 81.645 5.823 -15.128 1.00 0.00 H new ATOM 0 HG3 GLU A 35 80.901 4.759 -13.951 1.00 0.00 H new ATOM 527 N ILE A 36 81.573 5.788 -10.730 1.00 0.00 N ATOM 528 CA ILE A 36 81.706 4.544 -9.906 1.00 0.00 C ATOM 529 C ILE A 36 80.338 3.867 -9.770 1.00 0.00 C ATOM 530 O ILE A 36 79.329 4.532 -9.607 1.00 0.00 O ATOM 531 CB ILE A 36 82.209 5.014 -8.533 1.00 0.00 C ATOM 532 CG1 ILE A 36 83.531 5.796 -8.680 1.00 0.00 C ATOM 533 CG2 ILE A 36 82.433 3.801 -7.625 1.00 0.00 C ATOM 534 CD1 ILE A 36 84.604 4.930 -9.357 1.00 0.00 C ATOM 0 H ILE A 36 81.012 6.526 -10.305 1.00 0.00 H new ATOM 0 HA ILE A 36 82.386 3.821 -10.356 1.00 0.00 H new ATOM 0 HB ILE A 36 81.459 5.671 -8.093 1.00 0.00 H new ATOM 0 HG12 ILE A 36 83.362 6.698 -9.267 1.00 0.00 H new ATOM 0 HG13 ILE A 36 83.881 6.115 -7.698 1.00 0.00 H new ATOM 0 HG21 ILE A 36 82.790 4.136 -6.651 1.00 0.00 H new ATOM 0 HG22 ILE A 36 81.494 3.261 -7.501 1.00 0.00 H new ATOM 0 HG23 ILE A 36 83.174 3.141 -8.076 1.00 0.00 H new ATOM 0 HD11 ILE A 36 85.527 5.502 -9.450 1.00 0.00 H new ATOM 0 HD12 ILE A 36 84.787 4.040 -8.754 1.00 0.00 H new ATOM 0 HD13 ILE A 36 84.260 4.633 -10.348 1.00 0.00 H new ATOM 546 N THR A 37 80.294 2.555 -9.836 1.00 0.00 N ATOM 547 CA THR A 37 78.981 1.838 -9.781 1.00 0.00 C ATOM 548 C THR A 37 78.973 0.819 -8.634 1.00 0.00 C ATOM 549 O THR A 37 79.881 0.018 -8.505 1.00 0.00 O ATOM 550 CB THR A 37 78.871 1.120 -11.129 1.00 0.00 C ATOM 551 OG1 THR A 37 78.974 2.072 -12.178 1.00 0.00 O ATOM 552 CG2 THR A 37 77.526 0.393 -11.228 1.00 0.00 C ATOM 0 H THR A 37 81.112 1.952 -9.926 1.00 0.00 H new ATOM 0 HA THR A 37 78.148 2.519 -9.605 1.00 0.00 H new ATOM 0 HB THR A 37 79.676 0.390 -11.214 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.906 1.615 -13.042 1.00 0.00 H new ATOM 0 HG21 THR A 37 77.457 -0.115 -12.190 1.00 0.00 H new ATOM 0 HG22 THR A 37 77.448 -0.340 -10.425 1.00 0.00 H new ATOM 0 HG23 THR A 37 76.715 1.115 -11.140 1.00 0.00 H new ATOM 560 N ILE A 38 77.952 0.843 -7.808 1.00 0.00 N ATOM 561 CA ILE A 38 77.879 -0.112 -6.651 1.00 0.00 C ATOM 562 C ILE A 38 76.495 -0.770 -6.590 1.00 0.00 C ATOM 563 O ILE A 38 75.576 -0.364 -7.278 1.00 0.00 O ATOM 564 CB ILE A 38 78.123 0.722 -5.384 1.00 0.00 C ATOM 565 CG1 ILE A 38 77.110 1.870 -5.314 1.00 0.00 C ATOM 566 CG2 ILE A 38 79.543 1.292 -5.393 1.00 0.00 C ATOM 567 CD1 ILE A 38 76.823 2.213 -3.853 1.00 0.00 C ATOM 0 H ILE A 38 77.163 1.485 -7.885 1.00 0.00 H new ATOM 0 HA ILE A 38 78.617 -0.908 -6.751 1.00 0.00 H new ATOM 0 HB ILE A 38 78.003 0.079 -4.512 1.00 0.00 H new ATOM 0 HG12 ILE A 38 77.501 2.745 -5.833 1.00 0.00 H new ATOM 0 HG13 ILE A 38 76.187 1.585 -5.819 1.00 0.00 H new ATOM 0 HG21 ILE A 38 79.704 1.881 -4.490 1.00 0.00 H new ATOM 0 HG22 ILE A 38 80.263 0.474 -5.426 1.00 0.00 H new ATOM 0 HG23 ILE A 38 79.675 1.927 -6.269 1.00 0.00 H new ATOM 0 HD11 ILE A 38 76.102 3.030 -3.806 1.00 0.00 H new ATOM 0 HD12 ILE A 38 76.414 1.338 -3.348 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.748 2.516 -3.362 1.00 0.00 H new ATOM 579 N VAL A 39 76.343 -1.778 -5.764 1.00 0.00 N ATOM 580 CA VAL A 39 75.042 -2.518 -5.693 1.00 0.00 C ATOM 581 C VAL A 39 74.546 -2.608 -4.244 1.00 0.00 C ATOM 582 O VAL A 39 75.295 -2.399 -3.309 1.00 0.00 O ATOM 583 CB VAL A 39 75.332 -3.914 -6.256 1.00 0.00 C ATOM 584 CG1 VAL A 39 75.791 -3.788 -7.708 1.00 0.00 C ATOM 585 CG2 VAL A 39 76.434 -4.595 -5.435 1.00 0.00 C ATOM 0 H VAL A 39 77.067 -2.122 -5.133 1.00 0.00 H new ATOM 0 HA VAL A 39 74.259 -2.011 -6.258 1.00 0.00 H new ATOM 0 HB VAL A 39 74.424 -4.515 -6.204 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.998 -4.779 -8.111 1.00 0.00 H new ATOM 0 HG12 VAL A 39 75.007 -3.313 -8.298 1.00 0.00 H new ATOM 0 HG13 VAL A 39 76.696 -3.182 -7.752 1.00 0.00 H new ATOM 0 HG21 VAL A 39 76.632 -5.586 -5.843 1.00 0.00 H new ATOM 0 HG22 VAL A 39 77.343 -3.996 -5.479 1.00 0.00 H new ATOM 0 HG23 VAL A 39 76.111 -4.688 -4.398 1.00 0.00 H new ATOM 595 N ARG A 40 73.281 -2.918 -4.053 1.00 0.00 N ATOM 596 CA ARG A 40 72.686 -2.950 -2.670 1.00 0.00 C ATOM 597 C ARG A 40 72.975 -1.644 -1.920 1.00 0.00 C ATOM 598 O ARG A 40 73.420 -1.647 -0.788 1.00 0.00 O ATOM 599 CB ARG A 40 73.351 -4.143 -1.979 1.00 0.00 C ATOM 600 CG ARG A 40 72.815 -5.451 -2.582 1.00 0.00 C ATOM 601 CD ARG A 40 73.967 -6.437 -2.786 1.00 0.00 C ATOM 602 NE ARG A 40 74.439 -6.785 -1.407 1.00 0.00 N ATOM 603 CZ ARG A 40 75.646 -7.279 -1.189 1.00 0.00 C ATOM 604 NH1 ARG A 40 76.498 -7.495 -2.168 1.00 0.00 N ATOM 605 NH2 ARG A 40 76.002 -7.565 0.034 1.00 0.00 N ATOM 0 H ARG A 40 72.629 -3.152 -4.802 1.00 0.00 H new ATOM 0 HA ARG A 40 71.601 -3.050 -2.694 1.00 0.00 H new ATOM 0 HB2 ARG A 40 74.433 -4.091 -2.101 1.00 0.00 H new ATOM 0 HB3 ARG A 40 73.150 -4.115 -0.908 1.00 0.00 H new ATOM 0 HG2 ARG A 40 72.064 -5.886 -1.922 1.00 0.00 H new ATOM 0 HG3 ARG A 40 72.324 -5.249 -3.534 1.00 0.00 H new ATOM 0 HD2 ARG A 40 73.634 -7.325 -3.323 1.00 0.00 H new ATOM 0 HD3 ARG A 40 74.768 -5.990 -3.375 1.00 0.00 H new ATOM 0 HE ARG A 40 73.813 -6.637 -0.616 1.00 0.00 H new ATOM 0 HH11 ARG A 40 76.235 -7.280 -3.130 1.00 0.00 H new ATOM 0 HH12 ARG A 40 77.422 -7.877 -1.965 1.00 0.00 H new ATOM 0 HH21 ARG A 40 75.353 -7.407 0.804 1.00 0.00 H new ATOM 0 HH22 ARG A 40 76.930 -7.947 0.219 1.00 0.00 H new ATOM 619 N ALA A 41 72.719 -0.532 -2.560 1.00 0.00 N ATOM 620 CA ALA A 41 73.122 0.789 -1.983 1.00 0.00 C ATOM 621 C ALA A 41 72.308 1.133 -0.730 1.00 0.00 C ATOM 622 O ALA A 41 71.118 0.876 -0.644 1.00 0.00 O ATOM 623 CB ALA A 41 72.843 1.812 -3.085 1.00 0.00 C ATOM 0 H ALA A 41 72.246 -0.480 -3.462 1.00 0.00 H new ATOM 0 HA ALA A 41 74.168 0.778 -1.676 1.00 0.00 H new ATOM 0 HB1 ALA A 41 73.115 2.808 -2.734 1.00 0.00 H new ATOM 0 HB2 ALA A 41 73.432 1.565 -3.968 1.00 0.00 H new ATOM 0 HB3 ALA A 41 71.783 1.793 -3.339 1.00 0.00 H new ATOM 629 N PHE A 42 72.956 1.717 0.241 1.00 0.00 N ATOM 630 CA PHE A 42 72.226 2.328 1.389 1.00 0.00 C ATOM 631 C PHE A 42 72.479 3.837 1.388 1.00 0.00 C ATOM 632 O PHE A 42 73.584 4.277 1.139 1.00 0.00 O ATOM 633 CB PHE A 42 72.820 1.680 2.644 1.00 0.00 C ATOM 634 CG PHE A 42 72.113 0.415 3.092 1.00 0.00 C ATOM 635 CD1 PHE A 42 71.900 -0.678 2.180 1.00 0.00 C ATOM 636 CD2 PHE A 42 71.656 0.309 4.448 1.00 0.00 C ATOM 637 CE1 PHE A 42 71.232 -1.866 2.627 1.00 0.00 C ATOM 638 CE2 PHE A 42 70.988 -0.880 4.895 1.00 0.00 C ATOM 639 CZ PHE A 42 70.776 -1.967 3.983 1.00 0.00 C ATOM 0 H PHE A 42 73.972 1.798 0.288 1.00 0.00 H new ATOM 0 HA PHE A 42 71.149 2.169 1.339 1.00 0.00 H new ATOM 0 HB2 PHE A 42 73.869 1.448 2.457 1.00 0.00 H new ATOM 0 HB3 PHE A 42 72.794 2.404 3.459 1.00 0.00 H new ATOM 0 HD1 PHE A 42 72.243 -0.604 1.159 1.00 0.00 H new ATOM 0 HD2 PHE A 42 71.815 1.127 5.135 1.00 0.00 H new ATOM 0 HE1 PHE A 42 71.072 -2.685 1.942 1.00 0.00 H new ATOM 0 HE2 PHE A 42 70.645 -0.956 5.916 1.00 0.00 H new ATOM 0 HZ PHE A 42 70.273 -2.862 4.318 1.00 0.00 H new ATOM 649 N ARG A 43 71.472 4.628 1.662 1.00 0.00 N ATOM 650 CA ARG A 43 71.632 6.112 1.578 1.00 0.00 C ATOM 651 C ARG A 43 71.010 6.781 2.804 1.00 0.00 C ATOM 652 O ARG A 43 69.991 6.350 3.306 1.00 0.00 O ATOM 653 CB ARG A 43 70.882 6.518 0.308 1.00 0.00 C ATOM 654 CG ARG A 43 71.085 8.012 0.049 1.00 0.00 C ATOM 655 CD ARG A 43 70.291 8.427 -1.193 1.00 0.00 C ATOM 656 NE ARG A 43 70.650 9.863 -1.427 1.00 0.00 N ATOM 657 CZ ARG A 43 69.877 10.667 -2.136 1.00 0.00 C ATOM 658 NH1 ARG A 43 68.753 10.252 -2.681 1.00 0.00 N ATOM 659 NH2 ARG A 43 70.239 11.910 -2.301 1.00 0.00 N ATOM 0 H ARG A 43 70.544 4.309 1.941 1.00 0.00 H new ATOM 0 HA ARG A 43 72.679 6.414 1.549 1.00 0.00 H new ATOM 0 HB2 ARG A 43 71.244 5.939 -0.541 1.00 0.00 H new ATOM 0 HB3 ARG A 43 69.820 6.298 0.414 1.00 0.00 H new ATOM 0 HG2 ARG A 43 70.757 8.590 0.913 1.00 0.00 H new ATOM 0 HG3 ARG A 43 72.144 8.227 -0.095 1.00 0.00 H new ATOM 0 HD2 ARG A 43 70.554 7.810 -2.053 1.00 0.00 H new ATOM 0 HD3 ARG A 43 69.219 8.310 -1.032 1.00 0.00 H new ATOM 0 HE ARG A 43 71.514 10.230 -1.028 1.00 0.00 H new ATOM 0 HH11 ARG A 43 68.456 9.284 -2.562 1.00 0.00 H new ATOM 0 HH12 ARG A 43 68.179 10.899 -3.222 1.00 0.00 H new ATOM 0 HH21 ARG A 43 71.107 12.248 -1.886 1.00 0.00 H new ATOM 0 HH22 ARG A 43 69.654 12.544 -2.845 1.00 0.00 H new ATOM 673 N ASN A 44 71.624 7.833 3.298 1.00 0.00 N ATOM 674 CA ASN A 44 71.074 8.560 4.495 1.00 0.00 C ATOM 675 C ASN A 44 70.819 7.591 5.661 1.00 0.00 C ATOM 676 O ASN A 44 69.815 7.679 6.344 1.00 0.00 O ATOM 677 CB ASN A 44 69.759 9.198 4.027 1.00 0.00 C ATOM 678 CG ASN A 44 70.027 10.135 2.845 1.00 0.00 C ATOM 679 OD1 ASN A 44 69.298 10.125 1.872 1.00 0.00 O ATOM 680 ND2 ASN A 44 71.045 10.951 2.886 1.00 0.00 N ATOM 0 H ASN A 44 72.488 8.223 2.922 1.00 0.00 H new ATOM 0 HA ASN A 44 71.778 9.307 4.861 1.00 0.00 H new ATOM 0 HB2 ASN A 44 69.052 8.422 3.734 1.00 0.00 H new ATOM 0 HB3 ASN A 44 69.302 9.753 4.846 1.00 0.00 H new ATOM 0 HD21 ASN A 44 71.228 11.578 2.103 1.00 0.00 H new ATOM 0 HD22 ASN A 44 71.658 10.961 3.701 1.00 0.00 H new ATOM 687 N GLY A 45 71.724 6.671 5.886 1.00 0.00 N ATOM 688 CA GLY A 45 71.606 5.752 7.059 1.00 0.00 C ATOM 689 C GLY A 45 70.334 4.898 6.968 1.00 0.00 C ATOM 690 O GLY A 45 69.850 4.400 7.968 1.00 0.00 O ATOM 0 H GLY A 45 72.546 6.517 5.302 1.00 0.00 H new ATOM 0 HA2 GLY A 45 72.481 5.103 7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 45 71.592 6.334 7.981 1.00 0.00 H new ATOM 694 N VAL A 46 69.788 4.727 5.785 1.00 0.00 N ATOM 695 CA VAL A 46 68.647 3.776 5.610 1.00 0.00 C ATOM 696 C VAL A 46 68.752 3.083 4.235 1.00 0.00 C ATOM 697 O VAL A 46 69.294 3.652 3.312 1.00 0.00 O ATOM 698 CB VAL A 46 67.387 4.651 5.716 1.00 0.00 C ATOM 699 CG1 VAL A 46 66.130 3.833 5.394 1.00 0.00 C ATOM 700 CG2 VAL A 46 67.279 5.180 7.144 1.00 0.00 C ATOM 0 H VAL A 46 70.085 5.206 4.935 1.00 0.00 H new ATOM 0 HA VAL A 46 68.635 2.979 6.353 1.00 0.00 H new ATOM 0 HB VAL A 46 67.464 5.472 5.003 1.00 0.00 H new ATOM 0 HG11 VAL A 46 65.250 4.471 5.475 1.00 0.00 H new ATOM 0 HG12 VAL A 46 66.201 3.440 4.380 1.00 0.00 H new ATOM 0 HG13 VAL A 46 66.044 3.006 6.098 1.00 0.00 H new ATOM 0 HG21 VAL A 46 66.389 5.803 7.235 1.00 0.00 H new ATOM 0 HG22 VAL A 46 67.208 4.342 7.838 1.00 0.00 H new ATOM 0 HG23 VAL A 46 68.163 5.773 7.380 1.00 0.00 H new ATOM 710 N PRO A 47 68.231 1.872 4.130 1.00 0.00 N ATOM 711 CA PRO A 47 68.380 1.102 2.867 1.00 0.00 C ATOM 712 C PRO A 47 67.498 1.709 1.771 1.00 0.00 C ATOM 713 O PRO A 47 66.451 2.265 2.050 1.00 0.00 O ATOM 714 CB PRO A 47 67.906 -0.314 3.225 1.00 0.00 C ATOM 715 CG PRO A 47 67.664 -0.317 4.706 1.00 0.00 C ATOM 716 CD PRO A 47 67.471 1.111 5.133 1.00 0.00 C ATOM 0 HA PRO A 47 69.401 1.110 2.486 1.00 0.00 H new ATOM 0 HB2 PRO A 47 66.996 -0.568 2.682 1.00 0.00 H new ATOM 0 HB3 PRO A 47 68.657 -1.056 2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 47 66.784 -0.913 4.950 1.00 0.00 H new ATOM 0 HG3 PRO A 47 68.508 -0.764 5.232 1.00 0.00 H new ATOM 0 HD2 PRO A 47 66.417 1.391 5.136 1.00 0.00 H new ATOM 0 HD3 PRO A 47 67.850 1.284 6.140 1.00 0.00 H new ATOM 724 N LEU A 48 67.913 1.606 0.529 1.00 0.00 N ATOM 725 CA LEU A 48 67.041 2.070 -0.596 1.00 0.00 C ATOM 726 C LEU A 48 65.936 1.042 -0.855 1.00 0.00 C ATOM 727 O LEU A 48 66.118 -0.142 -0.645 1.00 0.00 O ATOM 728 CB LEU A 48 67.965 2.186 -1.813 1.00 0.00 C ATOM 729 CG LEU A 48 69.092 3.184 -1.522 1.00 0.00 C ATOM 730 CD1 LEU A 48 70.044 3.233 -2.717 1.00 0.00 C ATOM 731 CD2 LEU A 48 68.501 4.580 -1.292 1.00 0.00 C ATOM 0 H LEU A 48 68.815 1.222 0.248 1.00 0.00 H new ATOM 0 HA LEU A 48 66.555 3.020 -0.374 1.00 0.00 H new ATOM 0 HB2 LEU A 48 68.386 1.210 -2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 48 67.395 2.512 -2.683 1.00 0.00 H new ATOM 0 HG LEU A 48 69.632 2.867 -0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 48 70.847 3.942 -2.514 1.00 0.00 H new ATOM 0 HD12 LEU A 48 70.468 2.243 -2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 48 69.497 3.549 -3.605 1.00 0.00 H new ATOM 0 HD21 LEU A 48 69.305 5.286 -1.086 1.00 0.00 H new ATOM 0 HD22 LEU A 48 67.960 4.897 -2.183 1.00 0.00 H new ATOM 0 HD23 LEU A 48 67.817 4.550 -0.443 1.00 0.00 H new ATOM 743 N ARG A 49 64.789 1.490 -1.313 1.00 0.00 N ATOM 744 CA ARG A 49 63.627 0.558 -1.504 1.00 0.00 C ATOM 745 C ARG A 49 64.010 -0.608 -2.423 1.00 0.00 C ATOM 746 O ARG A 49 63.581 -1.730 -2.221 1.00 0.00 O ATOM 747 CB ARG A 49 62.528 1.406 -2.149 1.00 0.00 C ATOM 748 CG ARG A 49 61.245 0.579 -2.259 1.00 0.00 C ATOM 749 CD ARG A 49 60.111 1.458 -2.795 1.00 0.00 C ATOM 750 NE ARG A 49 60.465 1.723 -4.226 1.00 0.00 N ATOM 751 CZ ARG A 49 59.554 2.084 -5.113 1.00 0.00 C ATOM 752 NH1 ARG A 49 58.286 2.232 -4.790 1.00 0.00 N ATOM 753 NH2 ARG A 49 59.921 2.300 -6.346 1.00 0.00 N ATOM 0 H ARG A 49 64.606 2.462 -1.563 1.00 0.00 H new ATOM 0 HA ARG A 49 63.304 0.120 -0.559 1.00 0.00 H new ATOM 0 HB2 ARG A 49 62.347 2.301 -1.553 1.00 0.00 H new ATOM 0 HB3 ARG A 49 62.844 1.740 -3.137 1.00 0.00 H new ATOM 0 HG2 ARG A 49 61.404 -0.271 -2.922 1.00 0.00 H new ATOM 0 HG3 ARG A 49 60.976 0.176 -1.283 1.00 0.00 H new ATOM 0 HD2 ARG A 49 59.149 0.953 -2.714 1.00 0.00 H new ATOM 0 HD3 ARG A 49 60.032 2.387 -2.230 1.00 0.00 H new ATOM 0 HE ARG A 49 61.435 1.622 -4.524 1.00 0.00 H new ATOM 0 HH11 ARG A 49 57.981 2.067 -3.831 1.00 0.00 H new ATOM 0 HH12 ARG A 49 57.608 2.512 -5.499 1.00 0.00 H new ATOM 0 HH21 ARG A 49 60.899 2.190 -6.614 1.00 0.00 H new ATOM 0 HH22 ARG A 49 59.230 2.579 -7.042 1.00 0.00 H new ATOM 767 N LYS A 50 64.813 -0.349 -3.427 1.00 0.00 N ATOM 768 CA LYS A 50 65.256 -1.444 -4.343 1.00 0.00 C ATOM 769 C LYS A 50 66.615 -1.988 -3.896 1.00 0.00 C ATOM 770 O LYS A 50 67.645 -1.387 -4.148 1.00 0.00 O ATOM 771 CB LYS A 50 65.370 -0.789 -5.720 1.00 0.00 C ATOM 772 CG LYS A 50 63.990 -0.311 -6.177 1.00 0.00 C ATOM 773 CD LYS A 50 64.082 0.223 -7.608 1.00 0.00 C ATOM 774 CE LYS A 50 62.740 0.832 -8.016 1.00 0.00 C ATOM 775 NZ LYS A 50 62.902 2.297 -7.800 1.00 0.00 N ATOM 0 H LYS A 50 65.181 0.576 -3.651 1.00 0.00 H new ATOM 0 HA LYS A 50 64.561 -2.284 -4.348 1.00 0.00 H new ATOM 0 HB2 LYS A 50 66.062 0.052 -5.678 1.00 0.00 H new ATOM 0 HB3 LYS A 50 65.776 -1.500 -6.439 1.00 0.00 H new ATOM 0 HG2 LYS A 50 63.275 -1.132 -6.129 1.00 0.00 H new ATOM 0 HG3 LYS A 50 63.624 0.469 -5.509 1.00 0.00 H new ATOM 0 HD2 LYS A 50 64.869 0.974 -7.677 1.00 0.00 H new ATOM 0 HD3 LYS A 50 64.350 -0.583 -8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 50 62.506 0.610 -9.057 1.00 0.00 H new ATOM 0 HE3 LYS A 50 61.925 0.432 -7.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 62.039 2.791 -8.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 63.068 2.483 -6.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 63.713 2.642 -8.353 1.00 0.00 H new ATOM 789 N GLN A 51 66.621 -3.119 -3.234 1.00 0.00 N ATOM 790 CA GLN A 51 67.915 -3.733 -2.796 1.00 0.00 C ATOM 791 C GLN A 51 68.769 -4.088 -4.015 1.00 0.00 C ATOM 792 O GLN A 51 69.982 -3.980 -3.986 1.00 0.00 O ATOM 793 CB GLN A 51 67.528 -5.000 -2.027 1.00 0.00 C ATOM 794 CG GLN A 51 66.755 -4.614 -0.763 1.00 0.00 C ATOM 795 CD GLN A 51 66.328 -5.880 -0.012 1.00 0.00 C ATOM 796 OE1 GLN A 51 66.251 -6.948 -0.588 1.00 0.00 O ATOM 797 NE2 GLN A 51 66.047 -5.803 1.259 1.00 0.00 N ATOM 0 H GLN A 51 65.785 -3.645 -2.977 1.00 0.00 H new ATOM 0 HA GLN A 51 68.501 -3.051 -2.180 1.00 0.00 H new ATOM 0 HB2 GLN A 51 66.917 -5.648 -2.656 1.00 0.00 H new ATOM 0 HB3 GLN A 51 68.422 -5.564 -1.761 1.00 0.00 H new ATOM 0 HG2 GLN A 51 67.377 -3.991 -0.121 1.00 0.00 H new ATOM 0 HG3 GLN A 51 65.878 -4.023 -1.028 1.00 0.00 H new ATOM 0 HE21 GLN A 51 66.112 -4.907 1.742 1.00 0.00 H new ATOM 0 HE22 GLN A 51 65.763 -6.639 1.770 1.00 0.00 H new ATOM 806 N ASN A 52 68.141 -4.509 -5.084 1.00 0.00 N ATOM 807 CA ASN A 52 68.902 -4.907 -6.307 1.00 0.00 C ATOM 808 C ASN A 52 69.167 -3.703 -7.229 1.00 0.00 C ATOM 809 O ASN A 52 69.743 -3.858 -8.291 1.00 0.00 O ATOM 810 CB ASN A 52 68.003 -5.927 -7.011 1.00 0.00 C ATOM 811 CG ASN A 52 67.795 -7.145 -6.106 1.00 0.00 C ATOM 812 OD1 ASN A 52 68.578 -7.397 -5.211 1.00 0.00 O ATOM 813 ND2 ASN A 52 66.762 -7.917 -6.304 1.00 0.00 N ATOM 0 H ASN A 52 67.128 -4.594 -5.162 1.00 0.00 H new ATOM 0 HA ASN A 52 69.881 -5.312 -6.052 1.00 0.00 H new ATOM 0 HB2 ASN A 52 67.042 -5.473 -7.252 1.00 0.00 H new ATOM 0 HB3 ASN A 52 68.456 -6.235 -7.953 1.00 0.00 H new ATOM 0 HD21 ASN A 52 66.612 -8.731 -5.708 1.00 0.00 H new ATOM 0 HD22 ASN A 52 66.104 -7.706 -7.055 1.00 0.00 H new ATOM 820 N ALA A 53 68.758 -2.510 -6.842 1.00 0.00 N ATOM 821 CA ALA A 53 68.939 -1.326 -7.741 1.00 0.00 C ATOM 822 C ALA A 53 70.408 -0.895 -7.759 1.00 0.00 C ATOM 823 O ALA A 53 71.055 -0.829 -6.729 1.00 0.00 O ATOM 824 CB ALA A 53 68.065 -0.221 -7.143 1.00 0.00 C ATOM 0 H ALA A 53 68.310 -2.311 -5.948 1.00 0.00 H new ATOM 0 HA ALA A 53 68.658 -1.550 -8.770 1.00 0.00 H new ATOM 0 HB1 ALA A 53 68.149 0.679 -7.752 1.00 0.00 H new ATOM 0 HB2 ALA A 53 67.026 -0.550 -7.123 1.00 0.00 H new ATOM 0 HB3 ALA A 53 68.397 -0.004 -6.128 1.00 0.00 H new ATOM 830 N GLU A 54 70.932 -0.604 -8.924 1.00 0.00 N ATOM 831 CA GLU A 54 72.363 -0.176 -9.026 1.00 0.00 C ATOM 832 C GLU A 54 72.484 1.350 -8.890 1.00 0.00 C ATOM 833 O GLU A 54 71.686 2.093 -9.433 1.00 0.00 O ATOM 834 CB GLU A 54 72.838 -0.661 -10.412 1.00 0.00 C ATOM 835 CG GLU A 54 72.123 0.095 -11.546 1.00 0.00 C ATOM 836 CD GLU A 54 72.607 -0.435 -12.896 1.00 0.00 C ATOM 837 OE1 GLU A 54 72.597 -1.642 -13.074 1.00 0.00 O ATOM 838 OE2 GLU A 54 72.980 0.374 -13.729 1.00 0.00 O ATOM 0 H GLU A 54 70.430 -0.644 -9.811 1.00 0.00 H new ATOM 0 HA GLU A 54 72.975 -0.598 -8.229 1.00 0.00 H new ATOM 0 HB2 GLU A 54 73.915 -0.518 -10.500 1.00 0.00 H new ATOM 0 HB3 GLU A 54 72.649 -1.730 -10.510 1.00 0.00 H new ATOM 0 HG2 GLU A 54 71.044 -0.033 -11.459 1.00 0.00 H new ATOM 0 HG3 GLU A 54 72.325 1.163 -11.469 1.00 0.00 H new ATOM 845 N VAL A 55 73.475 1.812 -8.171 1.00 0.00 N ATOM 846 CA VAL A 55 73.728 3.284 -8.079 1.00 0.00 C ATOM 847 C VAL A 55 74.947 3.642 -8.928 1.00 0.00 C ATOM 848 O VAL A 55 76.023 3.112 -8.721 1.00 0.00 O ATOM 849 CB VAL A 55 74.012 3.551 -6.595 1.00 0.00 C ATOM 850 CG1 VAL A 55 74.302 5.041 -6.370 1.00 0.00 C ATOM 851 CG2 VAL A 55 72.791 3.150 -5.761 1.00 0.00 C ATOM 0 H VAL A 55 74.124 1.231 -7.641 1.00 0.00 H new ATOM 0 HA VAL A 55 72.888 3.878 -8.440 1.00 0.00 H new ATOM 0 HB VAL A 55 74.880 2.965 -6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 55 74.502 5.217 -5.313 1.00 0.00 H new ATOM 0 HG12 VAL A 55 75.172 5.335 -6.958 1.00 0.00 H new ATOM 0 HG13 VAL A 55 73.439 5.630 -6.679 1.00 0.00 H new ATOM 0 HG21 VAL A 55 72.992 3.340 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 55 71.927 3.735 -6.076 1.00 0.00 H new ATOM 0 HG23 VAL A 55 72.584 2.090 -5.906 1.00 0.00 H new ATOM 861 N VAL A 56 74.787 4.530 -9.878 1.00 0.00 N ATOM 862 CA VAL A 56 75.956 4.969 -10.700 1.00 0.00 C ATOM 863 C VAL A 56 76.108 6.484 -10.607 1.00 0.00 C ATOM 864 O VAL A 56 75.270 7.232 -11.079 1.00 0.00 O ATOM 865 CB VAL A 56 75.660 4.544 -12.141 1.00 0.00 C ATOM 866 CG1 VAL A 56 76.891 4.846 -12.996 1.00 0.00 C ATOM 867 CG2 VAL A 56 75.360 3.038 -12.200 1.00 0.00 C ATOM 0 H VAL A 56 73.899 4.969 -10.119 1.00 0.00 H new ATOM 0 HA VAL A 56 76.886 4.521 -10.349 1.00 0.00 H new ATOM 0 HB VAL A 56 74.792 5.089 -12.512 1.00 0.00 H new ATOM 0 HG11 VAL A 56 76.699 4.550 -14.027 1.00 0.00 H new ATOM 0 HG12 VAL A 56 77.106 5.914 -12.959 1.00 0.00 H new ATOM 0 HG13 VAL A 56 77.746 4.290 -12.612 1.00 0.00 H new ATOM 0 HG21 VAL A 56 75.151 2.749 -13.230 1.00 0.00 H new ATOM 0 HG22 VAL A 56 76.222 2.481 -11.834 1.00 0.00 H new ATOM 0 HG23 VAL A 56 74.493 2.815 -11.578 1.00 0.00 H new ATOM 877 N LEU A 57 77.171 6.934 -10.002 1.00 0.00 N ATOM 878 CA LEU A 57 77.331 8.391 -9.732 1.00 0.00 C ATOM 879 C LEU A 57 78.689 8.883 -10.239 1.00 0.00 C ATOM 880 O LEU A 57 79.707 8.254 -10.018 1.00 0.00 O ATOM 881 CB LEU A 57 77.197 8.495 -8.215 1.00 0.00 C ATOM 882 CG LEU A 57 75.705 8.540 -7.862 1.00 0.00 C ATOM 883 CD1 LEU A 57 75.472 7.907 -6.494 1.00 0.00 C ATOM 884 CD2 LEU A 57 75.241 9.996 -7.816 1.00 0.00 C ATOM 0 H LEU A 57 77.943 6.350 -9.680 1.00 0.00 H new ATOM 0 HA LEU A 57 76.597 9.015 -10.243 1.00 0.00 H new ATOM 0 HB2 LEU A 57 77.675 7.642 -7.733 1.00 0.00 H new ATOM 0 HB3 LEU A 57 77.700 9.391 -7.850 1.00 0.00 H new ATOM 0 HG LEU A 57 75.145 7.989 -8.618 1.00 0.00 H new ATOM 0 HD11 LEU A 57 74.410 7.944 -6.252 1.00 0.00 H new ATOM 0 HD12 LEU A 57 75.804 6.869 -6.512 1.00 0.00 H new ATOM 0 HD13 LEU A 57 76.035 8.455 -5.739 1.00 0.00 H new ATOM 0 HD21 LEU A 57 74.181 10.032 -7.565 1.00 0.00 H new ATOM 0 HD22 LEU A 57 75.811 10.536 -7.060 1.00 0.00 H new ATOM 0 HD23 LEU A 57 75.400 10.459 -8.790 1.00 0.00 H new ATOM 896 N LYS A 58 78.705 10.003 -10.920 1.00 0.00 N ATOM 897 CA LYS A 58 79.977 10.503 -11.531 1.00 0.00 C ATOM 898 C LYS A 58 80.899 11.085 -10.458 1.00 0.00 C ATOM 899 O LYS A 58 80.450 11.703 -9.510 1.00 0.00 O ATOM 900 CB LYS A 58 79.548 11.599 -12.510 1.00 0.00 C ATOM 901 CG LYS A 58 78.690 10.986 -13.619 1.00 0.00 C ATOM 902 CD LYS A 58 78.365 12.054 -14.664 1.00 0.00 C ATOM 903 CE LYS A 58 77.403 11.477 -15.706 1.00 0.00 C ATOM 904 NZ LYS A 58 77.876 12.022 -17.008 1.00 0.00 N ATOM 0 H LYS A 58 77.889 10.594 -11.080 1.00 0.00 H new ATOM 0 HA LYS A 58 80.530 9.703 -12.024 1.00 0.00 H new ATOM 0 HB2 LYS A 58 78.985 12.371 -11.985 1.00 0.00 H new ATOM 0 HB3 LYS A 58 80.426 12.082 -12.940 1.00 0.00 H new ATOM 0 HG2 LYS A 58 79.220 10.155 -14.086 1.00 0.00 H new ATOM 0 HG3 LYS A 58 77.769 10.581 -13.199 1.00 0.00 H new ATOM 0 HD2 LYS A 58 77.917 12.924 -14.183 1.00 0.00 H new ATOM 0 HD3 LYS A 58 79.280 12.394 -15.148 1.00 0.00 H new ATOM 0 HE2 LYS A 58 77.425 10.387 -15.703 1.00 0.00 H new ATOM 0 HE3 LYS A 58 76.375 11.776 -15.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 77.266 11.671 -17.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 77.838 13.061 -16.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 78.855 11.715 -17.178 1.00 0.00 H new ATOM 918 N CYS A 59 82.189 10.890 -10.603 1.00 0.00 N ATOM 919 CA CYS A 59 83.170 11.491 -9.637 1.00 0.00 C ATOM 920 C CYS A 59 82.975 13.012 -9.532 1.00 0.00 C ATOM 921 O CYS A 59 83.197 13.603 -8.491 1.00 0.00 O ATOM 922 CB CYS A 59 84.562 11.162 -10.205 1.00 0.00 C ATOM 923 SG CYS A 59 84.750 11.842 -11.878 1.00 0.00 S ATOM 0 H CYS A 59 82.608 10.338 -11.352 1.00 0.00 H new ATOM 0 HA CYS A 59 83.037 11.091 -8.632 1.00 0.00 H new ATOM 0 HB2 CYS A 59 85.333 11.571 -9.552 1.00 0.00 H new ATOM 0 HB3 CYS A 59 84.705 10.082 -10.228 1.00 0.00 H new ATOM 0 HG CYS A 59 85.933 11.553 -12.334 1.00 0.00 H new ATOM 929 N THR A 60 82.562 13.640 -10.606 1.00 0.00 N ATOM 930 CA THR A 60 82.343 15.123 -10.583 1.00 0.00 C ATOM 931 C THR A 60 81.203 15.473 -9.623 1.00 0.00 C ATOM 932 O THR A 60 81.160 16.558 -9.072 1.00 0.00 O ATOM 933 CB THR A 60 81.971 15.508 -12.019 1.00 0.00 C ATOM 934 OG1 THR A 60 80.781 14.831 -12.396 1.00 0.00 O ATOM 935 CG2 THR A 60 83.107 15.123 -12.971 1.00 0.00 C ATOM 0 H THR A 60 82.366 13.190 -11.500 1.00 0.00 H new ATOM 0 HA THR A 60 83.228 15.659 -10.241 1.00 0.00 H new ATOM 0 HB THR A 60 81.810 16.585 -12.074 1.00 0.00 H new ATOM 0 HG1 THR A 60 80.541 15.078 -13.314 1.00 0.00 H new ATOM 0 HG21 THR A 60 82.837 15.399 -13.990 1.00 0.00 H new ATOM 0 HG22 THR A 60 84.018 15.648 -12.682 1.00 0.00 H new ATOM 0 HG23 THR A 60 83.276 14.047 -12.919 1.00 0.00 H new ATOM 943 N ASP A 61 80.282 14.561 -9.422 1.00 0.00 N ATOM 944 CA ASP A 61 79.168 14.808 -8.458 1.00 0.00 C ATOM 945 C ASP A 61 79.582 14.359 -7.052 1.00 0.00 C ATOM 946 O ASP A 61 79.084 14.862 -6.061 1.00 0.00 O ATOM 947 CB ASP A 61 77.998 13.968 -8.975 1.00 0.00 C ATOM 948 CG ASP A 61 77.575 14.461 -10.363 1.00 0.00 C ATOM 949 OD1 ASP A 61 77.736 15.642 -10.631 1.00 0.00 O ATOM 950 OD2 ASP A 61 77.098 13.647 -11.136 1.00 0.00 O ATOM 0 H ASP A 61 80.256 13.653 -9.887 1.00 0.00 H new ATOM 0 HA ASP A 61 78.905 15.863 -8.389 1.00 0.00 H new ATOM 0 HB2 ASP A 61 78.287 12.918 -9.025 1.00 0.00 H new ATOM 0 HB3 ASP A 61 77.158 14.035 -8.284 1.00 0.00 H new ATOM 955 N ILE A 62 80.489 13.416 -6.964 1.00 0.00 N ATOM 956 CA ILE A 62 81.004 12.978 -5.629 1.00 0.00 C ATOM 957 C ILE A 62 82.090 13.946 -5.149 1.00 0.00 C ATOM 958 O ILE A 62 82.846 14.481 -5.941 1.00 0.00 O ATOM 959 CB ILE A 62 81.590 11.578 -5.863 1.00 0.00 C ATOM 960 CG1 ILE A 62 80.496 10.641 -6.386 1.00 0.00 C ATOM 961 CG2 ILE A 62 82.140 11.021 -4.546 1.00 0.00 C ATOM 962 CD1 ILE A 62 81.117 9.299 -6.778 1.00 0.00 C ATOM 0 H ILE A 62 80.896 12.929 -7.763 1.00 0.00 H new ATOM 0 HA ILE A 62 80.225 12.965 -4.866 1.00 0.00 H new ATOM 0 HB ILE A 62 82.394 11.647 -6.595 1.00 0.00 H new ATOM 0 HG12 ILE A 62 79.734 10.491 -5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 62 80.000 11.089 -7.247 1.00 0.00 H new ATOM 0 HG21 ILE A 62 82.555 10.028 -4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 62 82.922 11.681 -4.170 1.00 0.00 H new ATOM 0 HG23 ILE A 62 81.335 10.958 -3.814 1.00 0.00 H new ATOM 0 HD11 ILE A 62 80.339 8.633 -7.150 1.00 0.00 H new ATOM 0 HD12 ILE A 62 81.862 9.457 -7.557 1.00 0.00 H new ATOM 0 HD13 ILE A 62 81.593 8.850 -5.906 1.00 0.00 H new ATOM 974 N ARG A 63 82.170 14.173 -3.861 1.00 0.00 N ATOM 975 CA ARG A 63 83.195 15.113 -3.319 1.00 0.00 C ATOM 976 C ARG A 63 84.389 14.331 -2.764 1.00 0.00 C ATOM 977 O ARG A 63 85.517 14.788 -2.830 1.00 0.00 O ATOM 978 CB ARG A 63 82.485 15.880 -2.202 1.00 0.00 C ATOM 979 CG ARG A 63 83.424 16.950 -1.642 1.00 0.00 C ATOM 980 CD ARG A 63 83.581 18.080 -2.665 1.00 0.00 C ATOM 981 NE ARG A 63 84.563 19.030 -2.052 1.00 0.00 N ATOM 982 CZ ARG A 63 84.640 20.294 -2.432 1.00 0.00 C ATOM 983 NH1 ARG A 63 83.862 20.787 -3.372 1.00 0.00 N ATOM 984 NH2 ARG A 63 85.513 21.076 -1.857 1.00 0.00 N ATOM 0 H ARG A 63 81.566 13.745 -3.160 1.00 0.00 H new ATOM 0 HA ARG A 63 83.585 15.784 -4.085 1.00 0.00 H new ATOM 0 HB2 ARG A 63 81.576 16.343 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 63 82.184 15.194 -1.410 1.00 0.00 H new ATOM 0 HG2 ARG A 63 83.026 17.345 -0.707 1.00 0.00 H new ATOM 0 HG3 ARG A 63 84.396 16.513 -1.415 1.00 0.00 H new ATOM 0 HD2 ARG A 63 83.944 17.699 -3.620 1.00 0.00 H new ATOM 0 HD3 ARG A 63 82.627 18.571 -2.860 1.00 0.00 H new ATOM 0 HE ARG A 63 85.190 18.693 -1.321 1.00 0.00 H new ATOM 0 HH11 ARG A 63 83.174 20.189 -3.830 1.00 0.00 H new ATOM 0 HH12 ARG A 63 83.947 21.767 -3.642 1.00 0.00 H new ATOM 0 HH21 ARG A 63 86.123 20.709 -1.126 1.00 0.00 H new ATOM 0 HH22 ARG A 63 85.585 22.054 -2.139 1.00 0.00 H new ATOM 998 N SER A 64 84.153 13.158 -2.219 1.00 0.00 N ATOM 999 CA SER A 64 85.291 12.314 -1.732 1.00 0.00 C ATOM 1000 C SER A 64 84.847 10.865 -1.512 1.00 0.00 C ATOM 1001 O SER A 64 83.851 10.602 -0.866 1.00 0.00 O ATOM 1002 CB SER A 64 85.716 12.950 -0.410 1.00 0.00 C ATOM 1003 OG SER A 64 86.869 12.282 0.083 1.00 0.00 O ATOM 0 H SER A 64 83.226 12.752 -2.092 1.00 0.00 H new ATOM 0 HA SER A 64 86.106 12.279 -2.455 1.00 0.00 H new ATOM 0 HB2 SER A 64 85.929 14.009 -0.555 1.00 0.00 H new ATOM 0 HB3 SER A 64 84.905 12.884 0.316 1.00 0.00 H new ATOM 0 HG SER A 64 87.145 12.689 0.931 1.00 0.00 H new ATOM 1009 N ILE A 65 85.585 9.924 -2.054 1.00 0.00 N ATOM 1010 CA ILE A 65 85.310 8.481 -1.770 1.00 0.00 C ATOM 1011 C ILE A 65 86.299 7.949 -0.724 1.00 0.00 C ATOM 1012 O ILE A 65 87.435 8.382 -0.661 1.00 0.00 O ATOM 1013 CB ILE A 65 85.521 7.747 -3.103 1.00 0.00 C ATOM 1014 CG1 ILE A 65 84.607 8.347 -4.183 1.00 0.00 C ATOM 1015 CG2 ILE A 65 85.192 6.256 -2.924 1.00 0.00 C ATOM 1016 CD1 ILE A 65 84.921 7.704 -5.535 1.00 0.00 C ATOM 0 H ILE A 65 86.369 10.096 -2.683 1.00 0.00 H new ATOM 0 HA ILE A 65 84.303 8.335 -1.378 1.00 0.00 H new ATOM 0 HB ILE A 65 86.560 7.859 -3.412 1.00 0.00 H new ATOM 0 HG12 ILE A 65 83.562 8.180 -3.923 1.00 0.00 H new ATOM 0 HG13 ILE A 65 84.753 9.426 -4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 65 85.341 5.734 -3.869 1.00 0.00 H new ATOM 0 HG22 ILE A 65 85.847 5.827 -2.166 1.00 0.00 H new ATOM 0 HG23 ILE A 65 84.154 6.148 -2.610 1.00 0.00 H new ATOM 0 HD11 ILE A 65 84.272 8.130 -6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 65 85.962 7.894 -5.795 1.00 0.00 H new ATOM 0 HD13 ILE A 65 84.753 6.629 -5.474 1.00 0.00 H new ATOM 1028 N ASP A 66 85.872 7.017 0.092 1.00 0.00 N ATOM 1029 CA ASP A 66 86.811 6.365 1.056 1.00 0.00 C ATOM 1030 C ASP A 66 86.625 4.842 1.033 1.00 0.00 C ATOM 1031 O ASP A 66 85.526 4.350 1.194 1.00 0.00 O ATOM 1032 CB ASP A 66 86.438 6.947 2.426 1.00 0.00 C ATOM 1033 CG ASP A 66 84.983 6.607 2.772 1.00 0.00 C ATOM 1034 OD1 ASP A 66 84.113 7.389 2.427 1.00 0.00 O ATOM 1035 OD2 ASP A 66 84.769 5.569 3.377 1.00 0.00 O ATOM 0 H ASP A 66 84.910 6.679 0.132 1.00 0.00 H new ATOM 0 HA ASP A 66 87.856 6.552 0.810 1.00 0.00 H new ATOM 0 HB2 ASP A 66 87.104 6.548 3.191 1.00 0.00 H new ATOM 0 HB3 ASP A 66 86.574 8.028 2.418 1.00 0.00 H new ATOM 1040 N LEU A 67 87.690 4.101 0.834 1.00 0.00 N ATOM 1041 CA LEU A 67 87.587 2.607 0.883 1.00 0.00 C ATOM 1042 C LEU A 67 87.479 2.139 2.337 1.00 0.00 C ATOM 1043 O LEU A 67 88.407 2.285 3.111 1.00 0.00 O ATOM 1044 CB LEU A 67 88.887 2.095 0.252 1.00 0.00 C ATOM 1045 CG LEU A 67 88.709 1.959 -1.268 1.00 0.00 C ATOM 1046 CD1 LEU A 67 89.985 2.420 -1.977 1.00 0.00 C ATOM 1047 CD2 LEU A 67 88.440 0.493 -1.626 1.00 0.00 C ATOM 0 H LEU A 67 88.623 4.465 0.640 1.00 0.00 H new ATOM 0 HA LEU A 67 86.707 2.235 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 67 89.704 2.782 0.472 1.00 0.00 H new ATOM 0 HB3 LEU A 67 89.157 1.131 0.684 1.00 0.00 H new ATOM 0 HG LEU A 67 87.868 2.575 -1.586 1.00 0.00 H new ATOM 0 HD11 LEU A 67 89.857 2.323 -3.055 1.00 0.00 H new ATOM 0 HD12 LEU A 67 90.184 3.462 -1.727 1.00 0.00 H new ATOM 0 HD13 LEU A 67 90.824 1.803 -1.654 1.00 0.00 H new ATOM 0 HD21 LEU A 67 88.314 0.399 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 67 89.282 -0.120 -1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 67 87.533 0.156 -1.124 1.00 0.00 H new ATOM 1059 N ILE A 68 86.352 1.582 2.709 1.00 0.00 N ATOM 1060 CA ILE A 68 86.162 1.122 4.121 1.00 0.00 C ATOM 1061 C ILE A 68 86.906 -0.199 4.348 1.00 0.00 C ATOM 1062 O ILE A 68 87.681 -0.331 5.279 1.00 0.00 O ATOM 1063 CB ILE A 68 84.647 0.928 4.287 1.00 0.00 C ATOM 1064 CG1 ILE A 68 83.924 2.250 4.008 1.00 0.00 C ATOM 1065 CG2 ILE A 68 84.335 0.480 5.718 1.00 0.00 C ATOM 1066 CD1 ILE A 68 82.412 2.019 4.008 1.00 0.00 C ATOM 0 H ILE A 68 85.553 1.426 2.094 1.00 0.00 H new ATOM 0 HA ILE A 68 86.555 1.838 4.843 1.00 0.00 H new ATOM 0 HB ILE A 68 84.308 0.168 3.584 1.00 0.00 H new ATOM 0 HG12 ILE A 68 84.189 2.988 4.765 1.00 0.00 H new ATOM 0 HG13 ILE A 68 84.240 2.653 3.046 1.00 0.00 H new ATOM 0 HG21 ILE A 68 83.259 0.344 5.830 1.00 0.00 H new ATOM 0 HG22 ILE A 68 84.843 -0.462 5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 68 84.680 1.239 6.420 1.00 0.00 H new ATOM 0 HD11 ILE A 68 81.900 2.961 3.809 1.00 0.00 H new ATOM 0 HD12 ILE A 68 82.154 1.296 3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 68 82.102 1.636 4.980 1.00 0.00 H new ATOM 1078 N GLU A 69 86.671 -1.171 3.502 1.00 0.00 N ATOM 1079 CA GLU A 69 87.307 -2.511 3.690 1.00 0.00 C ATOM 1080 C GLU A 69 87.814 -3.054 2.339 1.00 0.00 C ATOM 1081 O GLU A 69 87.081 -3.034 1.369 1.00 0.00 O ATOM 1082 CB GLU A 69 86.190 -3.402 4.236 1.00 0.00 C ATOM 1083 CG GLU A 69 86.121 -3.261 5.757 1.00 0.00 C ATOM 1084 CD GLU A 69 84.676 -3.453 6.223 1.00 0.00 C ATOM 1085 OE1 GLU A 69 83.785 -2.982 5.535 1.00 0.00 O ATOM 1086 OE2 GLU A 69 84.485 -4.068 7.260 1.00 0.00 O ATOM 0 H GLU A 69 86.064 -1.093 2.686 1.00 0.00 H new ATOM 0 HA GLU A 69 88.166 -2.471 4.360 1.00 0.00 H new ATOM 0 HB2 GLU A 69 85.236 -3.121 3.791 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.374 -4.441 3.965 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.768 -3.999 6.231 1.00 0.00 H new ATOM 0 HG3 GLU A 69 86.484 -2.278 6.059 1.00 0.00 H new ATOM 1093 N PRO A 70 89.050 -3.531 2.300 1.00 0.00 N ATOM 1094 CA PRO A 70 89.611 -4.052 1.023 1.00 0.00 C ATOM 1095 C PRO A 70 88.755 -5.206 0.487 1.00 0.00 C ATOM 1096 O PRO A 70 88.121 -5.920 1.241 1.00 0.00 O ATOM 1097 CB PRO A 70 91.009 -4.546 1.396 1.00 0.00 C ATOM 1098 CG PRO A 70 91.331 -3.900 2.705 1.00 0.00 C ATOM 1099 CD PRO A 70 90.024 -3.635 3.401 1.00 0.00 C ATOM 0 HA PRO A 70 89.632 -3.295 0.239 1.00 0.00 H new ATOM 0 HB2 PRO A 70 91.031 -5.633 1.480 1.00 0.00 H new ATOM 0 HB3 PRO A 70 91.738 -4.271 0.634 1.00 0.00 H new ATOM 0 HG2 PRO A 70 91.964 -4.549 3.309 1.00 0.00 H new ATOM 0 HG3 PRO A 70 91.881 -2.971 2.551 1.00 0.00 H new ATOM 0 HD2 PRO A 70 89.766 -4.442 4.087 1.00 0.00 H new ATOM 0 HD3 PRO A 70 90.063 -2.717 3.988 1.00 0.00 H new ATOM 1107 N ALA A 71 88.739 -5.388 -0.812 1.00 0.00 N ATOM 1108 CA ALA A 71 87.928 -6.495 -1.414 1.00 0.00 C ATOM 1109 C ALA A 71 88.398 -7.849 -0.877 1.00 0.00 C ATOM 1110 O ALA A 71 89.554 -8.023 -0.539 1.00 0.00 O ATOM 1111 CB ALA A 71 88.171 -6.405 -2.923 1.00 0.00 C ATOM 0 H ALA A 71 89.253 -4.817 -1.483 1.00 0.00 H new ATOM 0 HA ALA A 71 86.870 -6.403 -1.169 1.00 0.00 H new ATOM 0 HB1 ALA A 71 87.607 -7.188 -3.430 1.00 0.00 H new ATOM 0 HB2 ALA A 71 87.846 -5.430 -3.286 1.00 0.00 H new ATOM 0 HB3 ALA A 71 89.234 -6.533 -3.129 1.00 0.00 H new ATOM 1117 N LYS A 72 87.506 -8.807 -0.799 1.00 0.00 N ATOM 1118 CA LYS A 72 87.880 -10.152 -0.260 1.00 0.00 C ATOM 1119 C LYS A 72 88.617 -10.965 -1.327 1.00 0.00 C ATOM 1120 O LYS A 72 88.413 -10.781 -2.512 1.00 0.00 O ATOM 1121 CB LYS A 72 86.554 -10.826 0.106 1.00 0.00 C ATOM 1122 CG LYS A 72 85.810 -9.984 1.150 1.00 0.00 C ATOM 1123 CD LYS A 72 86.617 -9.946 2.449 1.00 0.00 C ATOM 1124 CE LYS A 72 85.800 -9.248 3.538 1.00 0.00 C ATOM 1125 NZ LYS A 72 86.809 -8.571 4.401 1.00 0.00 N ATOM 0 H LYS A 72 86.532 -8.715 -1.087 1.00 0.00 H new ATOM 0 HA LYS A 72 88.546 -10.076 0.600 1.00 0.00 H new ATOM 0 HB2 LYS A 72 85.938 -10.943 -0.785 1.00 0.00 H new ATOM 0 HB3 LYS A 72 86.740 -11.826 0.498 1.00 0.00 H new ATOM 0 HG2 LYS A 72 85.658 -8.972 0.775 1.00 0.00 H new ATOM 0 HG3 LYS A 72 84.822 -10.406 1.336 1.00 0.00 H new ATOM 0 HD2 LYS A 72 86.870 -10.959 2.762 1.00 0.00 H new ATOM 0 HD3 LYS A 72 87.557 -9.418 2.290 1.00 0.00 H new ATOM 0 HE2 LYS A 72 85.102 -8.529 3.109 1.00 0.00 H new ATOM 0 HE3 LYS A 72 85.209 -9.964 4.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 86.325 -8.069 5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 87.456 -9.281 4.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 87.352 -7.890 3.832 1.00 0.00 H new ATOM 1139 N GLN A 73 89.475 -11.863 -0.907 1.00 0.00 N ATOM 1140 CA GLN A 73 90.264 -12.683 -1.886 1.00 0.00 C ATOM 1141 C GLN A 73 89.327 -13.454 -2.822 1.00 0.00 C ATOM 1142 O GLN A 73 89.623 -13.642 -3.988 1.00 0.00 O ATOM 1143 CB GLN A 73 91.084 -13.656 -1.034 1.00 0.00 C ATOM 1144 CG GLN A 73 92.084 -14.400 -1.926 1.00 0.00 C ATOM 1145 CD GLN A 73 92.936 -15.355 -1.081 1.00 0.00 C ATOM 1146 OE1 GLN A 73 92.900 -15.319 0.135 1.00 0.00 O ATOM 1147 NE2 GLN A 73 93.709 -16.217 -1.681 1.00 0.00 N ATOM 0 H GLN A 73 89.665 -12.066 0.074 1.00 0.00 H new ATOM 0 HA GLN A 73 90.898 -12.059 -2.516 1.00 0.00 H new ATOM 0 HB2 GLN A 73 91.613 -13.113 -0.251 1.00 0.00 H new ATOM 0 HB3 GLN A 73 90.423 -14.367 -0.538 1.00 0.00 H new ATOM 0 HG2 GLN A 73 91.551 -14.959 -2.695 1.00 0.00 H new ATOM 0 HG3 GLN A 73 92.727 -13.685 -2.440 1.00 0.00 H new ATOM 0 HE21 GLN A 73 93.742 -16.250 -2.700 1.00 0.00 H new ATOM 0 HE22 GLN A 73 94.281 -16.858 -1.131 1.00 0.00 H new ATOM 1156 N ASP A 74 88.202 -13.899 -2.316 1.00 0.00 N ATOM 1157 CA ASP A 74 87.253 -14.692 -3.162 1.00 0.00 C ATOM 1158 C ASP A 74 86.763 -13.846 -4.340 1.00 0.00 C ATOM 1159 O ASP A 74 86.491 -12.667 -4.196 1.00 0.00 O ATOM 1160 CB ASP A 74 86.085 -15.052 -2.238 1.00 0.00 C ATOM 1161 CG ASP A 74 86.579 -15.944 -1.094 1.00 0.00 C ATOM 1162 OD1 ASP A 74 87.536 -16.673 -1.302 1.00 0.00 O ATOM 1163 OD2 ASP A 74 85.991 -15.882 -0.027 1.00 0.00 O ATOM 0 H ASP A 74 87.899 -13.748 -1.354 1.00 0.00 H new ATOM 0 HA ASP A 74 87.725 -15.581 -3.580 1.00 0.00 H new ATOM 0 HB2 ASP A 74 85.636 -14.144 -1.835 1.00 0.00 H new ATOM 0 HB3 ASP A 74 85.309 -15.568 -2.803 1.00 0.00 H new ATOM 1168 N LEU A 75 86.650 -14.443 -5.501 1.00 0.00 N ATOM 1169 CA LEU A 75 86.196 -13.683 -6.707 1.00 0.00 C ATOM 1170 C LEU A 75 84.708 -13.935 -6.963 1.00 0.00 C ATOM 1171 O LEU A 75 84.218 -15.034 -6.790 1.00 0.00 O ATOM 1172 CB LEU A 75 87.039 -14.224 -7.868 1.00 0.00 C ATOM 1173 CG LEU A 75 88.529 -14.008 -7.582 1.00 0.00 C ATOM 1174 CD1 LEU A 75 89.358 -14.631 -8.706 1.00 0.00 C ATOM 1175 CD2 LEU A 75 88.827 -12.507 -7.510 1.00 0.00 C ATOM 0 H LEU A 75 86.854 -15.429 -5.666 1.00 0.00 H new ATOM 0 HA LEU A 75 86.321 -12.607 -6.583 1.00 0.00 H new ATOM 0 HB2 LEU A 75 86.838 -15.286 -8.010 1.00 0.00 H new ATOM 0 HB3 LEU A 75 86.762 -13.721 -8.794 1.00 0.00 H new ATOM 0 HG LEU A 75 88.785 -14.477 -6.632 1.00 0.00 H new ATOM 0 HD11 LEU A 75 90.418 -14.478 -8.504 1.00 0.00 H new ATOM 0 HD12 LEU A 75 89.150 -15.699 -8.762 1.00 0.00 H new ATOM 0 HD13 LEU A 75 89.098 -14.160 -9.654 1.00 0.00 H new ATOM 0 HD21 LEU A 75 89.887 -12.356 -7.307 1.00 0.00 H new ATOM 0 HD22 LEU A 75 88.570 -12.039 -8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 75 88.237 -12.057 -6.712 1.00 0.00 H new ATOM 1187 N ASP A 76 83.983 -12.918 -7.377 1.00 0.00 N ATOM 1188 CA ASP A 76 82.518 -13.079 -7.674 1.00 0.00 C ATOM 1189 C ASP A 76 81.779 -13.688 -6.476 1.00 0.00 C ATOM 1190 O ASP A 76 80.996 -14.606 -6.623 1.00 0.00 O ATOM 1191 CB ASP A 76 82.441 -14.015 -8.888 1.00 0.00 C ATOM 1192 CG ASP A 76 83.116 -13.359 -10.097 1.00 0.00 C ATOM 1193 OD1 ASP A 76 83.113 -12.140 -10.171 1.00 0.00 O ATOM 1194 OD2 ASP A 76 83.627 -14.089 -10.932 1.00 0.00 O ATOM 0 H ASP A 76 84.346 -11.976 -7.523 1.00 0.00 H new ATOM 0 HA ASP A 76 82.045 -12.118 -7.875 1.00 0.00 H new ATOM 0 HB2 ASP A 76 82.928 -14.963 -8.659 1.00 0.00 H new ATOM 0 HB3 ASP A 76 81.400 -14.239 -9.119 1.00 0.00 H new ATOM 1199 N GLY A 77 82.029 -13.179 -5.294 1.00 0.00 N ATOM 1200 CA GLY A 77 81.353 -13.718 -4.071 1.00 0.00 C ATOM 1201 C GLY A 77 79.832 -13.595 -4.213 1.00 0.00 C ATOM 1202 O GLY A 77 79.086 -14.386 -3.666 1.00 0.00 O ATOM 0 H GLY A 77 82.676 -12.409 -5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 77 81.629 -14.762 -3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 77 81.689 -13.172 -3.190 1.00 0.00 H new ATOM 1206 N HIS A 78 79.371 -12.609 -4.945 1.00 0.00 N ATOM 1207 CA HIS A 78 77.891 -12.397 -5.098 1.00 0.00 C ATOM 1208 C HIS A 78 77.210 -13.662 -5.635 1.00 0.00 C ATOM 1209 O HIS A 78 76.111 -14.000 -5.234 1.00 0.00 O ATOM 1210 CB HIS A 78 77.747 -11.251 -6.103 1.00 0.00 C ATOM 1211 CG HIS A 78 78.320 -9.949 -5.613 1.00 0.00 C ATOM 1212 ND1 HIS A 78 79.628 -9.573 -5.874 1.00 0.00 N ATOM 1213 CD2 HIS A 78 77.775 -8.925 -4.879 1.00 0.00 C ATOM 1214 CE1 HIS A 78 79.825 -8.369 -5.305 1.00 0.00 C ATOM 1215 NE2 HIS A 78 78.728 -7.929 -4.685 1.00 0.00 N ATOM 0 H HIS A 78 79.955 -11.939 -5.445 1.00 0.00 H new ATOM 0 HA HIS A 78 77.419 -12.167 -4.143 1.00 0.00 H new ATOM 0 HB2 HIS A 78 78.242 -11.530 -7.033 1.00 0.00 H new ATOM 0 HB3 HIS A 78 76.691 -11.111 -6.333 1.00 0.00 H new ATOM 0 HD2 HIS A 78 76.761 -8.896 -4.508 1.00 0.00 H new ATOM 0 HE1 HIS A 78 80.757 -7.825 -5.345 1.00 0.00 H new ATOM 0 HE2 HIS A 78 78.613 -7.051 -4.178 1.00 0.00 H new ATOM 1223 N THR A 79 77.857 -14.360 -6.536 1.00 0.00 N ATOM 1224 CA THR A 79 77.253 -15.601 -7.113 1.00 0.00 C ATOM 1225 C THR A 79 78.278 -16.743 -7.121 1.00 0.00 C ATOM 1226 O THR A 79 79.473 -16.514 -7.110 1.00 0.00 O ATOM 1227 CB THR A 79 76.841 -15.214 -8.539 1.00 0.00 C ATOM 1228 OG1 THR A 79 76.225 -16.329 -9.170 1.00 0.00 O ATOM 1229 CG2 THR A 79 78.067 -14.776 -9.347 1.00 0.00 C ATOM 0 H THR A 79 78.781 -14.123 -6.898 1.00 0.00 H new ATOM 0 HA THR A 79 76.403 -15.958 -6.532 1.00 0.00 H new ATOM 0 HB THR A 79 76.137 -14.383 -8.493 1.00 0.00 H new ATOM 0 HG1 THR A 79 75.959 -16.084 -10.081 1.00 0.00 H new ATOM 0 HG21 THR A 79 77.759 -14.504 -10.357 1.00 0.00 H new ATOM 0 HG22 THR A 79 78.532 -13.916 -8.865 1.00 0.00 H new ATOM 0 HG23 THR A 79 78.783 -15.596 -9.394 1.00 0.00 H new ATOM 1237 N ALA A 80 77.812 -17.969 -7.139 1.00 0.00 N ATOM 1238 CA ALA A 80 78.747 -19.135 -7.147 1.00 0.00 C ATOM 1239 C ALA A 80 78.410 -20.081 -8.319 1.00 0.00 C ATOM 1240 O ALA A 80 77.871 -21.150 -8.105 1.00 0.00 O ATOM 1241 CB ALA A 80 78.521 -19.830 -5.802 1.00 0.00 C ATOM 0 H ALA A 80 76.821 -18.211 -7.149 1.00 0.00 H new ATOM 0 HA ALA A 80 79.787 -18.834 -7.278 1.00 0.00 H new ATOM 0 HB1 ALA A 80 79.173 -20.701 -5.728 1.00 0.00 H new ATOM 0 HB2 ALA A 80 78.748 -19.137 -4.992 1.00 0.00 H new ATOM 0 HB3 ALA A 80 77.481 -20.148 -5.727 1.00 0.00 H new ATOM 1247 N PRO A 81 78.736 -19.667 -9.532 1.00 0.00 N ATOM 1248 CA PRO A 81 78.484 -20.538 -10.709 1.00 0.00 C ATOM 1249 C PRO A 81 79.325 -21.825 -10.608 1.00 0.00 C ATOM 1250 O PRO A 81 80.384 -21.810 -10.013 1.00 0.00 O ATOM 1251 CB PRO A 81 78.925 -19.698 -11.910 1.00 0.00 C ATOM 1252 CG PRO A 81 79.072 -18.298 -11.400 1.00 0.00 C ATOM 1253 CD PRO A 81 79.350 -18.389 -9.926 1.00 0.00 C ATOM 0 HA PRO A 81 77.442 -20.849 -10.785 1.00 0.00 H new ATOM 0 HB2 PRO A 81 79.866 -20.065 -12.319 1.00 0.00 H new ATOM 0 HB3 PRO A 81 78.188 -19.746 -12.712 1.00 0.00 H new ATOM 0 HG2 PRO A 81 79.885 -17.785 -11.914 1.00 0.00 H new ATOM 0 HG3 PRO A 81 78.164 -17.724 -11.586 1.00 0.00 H new ATOM 0 HD2 PRO A 81 80.420 -18.379 -9.719 1.00 0.00 H new ATOM 0 HD3 PRO A 81 78.912 -17.551 -9.384 1.00 0.00 H new ATOM 1261 N PRO A 82 78.838 -22.907 -11.191 1.00 0.00 N ATOM 1262 CA PRO A 82 79.599 -24.182 -11.146 1.00 0.00 C ATOM 1263 C PRO A 82 80.940 -24.025 -11.890 1.00 0.00 C ATOM 1264 O PRO A 82 80.948 -23.884 -13.097 1.00 0.00 O ATOM 1265 CB PRO A 82 78.698 -25.187 -11.868 1.00 0.00 C ATOM 1266 CG PRO A 82 77.718 -24.366 -12.645 1.00 0.00 C ATOM 1267 CD PRO A 82 77.570 -23.054 -11.928 1.00 0.00 C ATOM 0 HA PRO A 82 79.837 -24.495 -10.130 1.00 0.00 H new ATOM 0 HB2 PRO A 82 79.280 -25.831 -12.528 1.00 0.00 H new ATOM 0 HB3 PRO A 82 78.188 -25.837 -11.157 1.00 0.00 H new ATOM 0 HG2 PRO A 82 78.070 -24.210 -13.665 1.00 0.00 H new ATOM 0 HG3 PRO A 82 76.758 -24.877 -12.714 1.00 0.00 H new ATOM 0 HD2 PRO A 82 77.417 -22.232 -12.627 1.00 0.00 H new ATOM 0 HD3 PRO A 82 76.714 -23.062 -11.253 1.00 0.00 H new ATOM 1275 N PRO A 83 82.046 -24.050 -11.161 1.00 0.00 N ATOM 1276 CA PRO A 83 83.374 -23.887 -11.814 1.00 0.00 C ATOM 1277 C PRO A 83 83.605 -24.989 -12.853 1.00 0.00 C ATOM 1278 O PRO A 83 83.206 -26.125 -12.663 1.00 0.00 O ATOM 1279 CB PRO A 83 84.379 -24.010 -10.667 1.00 0.00 C ATOM 1280 CG PRO A 83 83.591 -23.805 -9.414 1.00 0.00 C ATOM 1281 CD PRO A 83 82.177 -24.227 -9.705 1.00 0.00 C ATOM 0 HA PRO A 83 83.462 -22.940 -12.346 1.00 0.00 H new ATOM 0 HB2 PRO A 83 84.860 -24.988 -10.671 1.00 0.00 H new ATOM 0 HB3 PRO A 83 85.170 -23.266 -10.758 1.00 0.00 H new ATOM 0 HG2 PRO A 83 84.008 -24.393 -8.597 1.00 0.00 H new ATOM 0 HG3 PRO A 83 83.625 -22.760 -9.104 1.00 0.00 H new ATOM 0 HD2 PRO A 83 82.001 -25.262 -9.411 1.00 0.00 H new ATOM 0 HD3 PRO A 83 81.458 -23.614 -9.162 1.00 0.00 H new ATOM 1289 N VAL A 84 84.246 -24.657 -13.947 1.00 0.00 N ATOM 1290 CA VAL A 84 84.537 -25.685 -14.997 1.00 0.00 C ATOM 1291 C VAL A 84 85.624 -26.656 -14.516 1.00 0.00 C ATOM 1292 O VAL A 84 85.709 -27.778 -14.981 1.00 0.00 O ATOM 1293 CB VAL A 84 85.010 -24.894 -16.226 1.00 0.00 C ATOM 1294 CG1 VAL A 84 83.894 -23.954 -16.685 1.00 0.00 C ATOM 1295 CG2 VAL A 84 86.254 -24.067 -15.878 1.00 0.00 C ATOM 0 H VAL A 84 84.581 -23.717 -14.159 1.00 0.00 H new ATOM 0 HA VAL A 84 83.661 -26.291 -15.226 1.00 0.00 H new ATOM 0 HB VAL A 84 85.258 -25.595 -17.023 1.00 0.00 H new ATOM 0 HG11 VAL A 84 84.228 -23.392 -17.557 1.00 0.00 H new ATOM 0 HG12 VAL A 84 83.011 -24.538 -16.946 1.00 0.00 H new ATOM 0 HG13 VAL A 84 83.647 -23.262 -15.880 1.00 0.00 H new ATOM 0 HG21 VAL A 84 86.579 -23.511 -16.757 1.00 0.00 H new ATOM 0 HG22 VAL A 84 86.014 -23.369 -15.076 1.00 0.00 H new ATOM 0 HG23 VAL A 84 87.054 -24.732 -15.553 1.00 0.00 H new ATOM 1305 N VAL A 85 86.454 -26.231 -13.591 1.00 0.00 N ATOM 1306 CA VAL A 85 87.525 -27.129 -13.061 1.00 0.00 C ATOM 1307 C VAL A 85 87.521 -27.108 -11.526 1.00 0.00 C ATOM 1308 O VAL A 85 87.246 -26.091 -10.915 1.00 0.00 O ATOM 1309 CB VAL A 85 88.835 -26.559 -13.626 1.00 0.00 C ATOM 1310 CG1 VAL A 85 89.036 -25.117 -13.147 1.00 0.00 C ATOM 1311 CG2 VAL A 85 90.012 -27.419 -13.155 1.00 0.00 C ATOM 0 H VAL A 85 86.433 -25.297 -13.181 1.00 0.00 H new ATOM 0 HA VAL A 85 87.384 -28.169 -13.354 1.00 0.00 H new ATOM 0 HB VAL A 85 88.783 -26.568 -14.715 1.00 0.00 H new ATOM 0 HG11 VAL A 85 89.968 -24.725 -13.554 1.00 0.00 H new ATOM 0 HG12 VAL A 85 88.204 -24.501 -13.487 1.00 0.00 H new ATOM 0 HG13 VAL A 85 89.080 -25.098 -12.058 1.00 0.00 H new ATOM 0 HG21 VAL A 85 90.941 -27.015 -13.556 1.00 0.00 H new ATOM 0 HG22 VAL A 85 90.054 -27.413 -12.066 1.00 0.00 H new ATOM 0 HG23 VAL A 85 89.879 -28.442 -13.508 1.00 0.00 H new ATOM 1321 N ASN A 86 87.826 -28.222 -10.908 1.00 0.00 N ATOM 1322 CA ASN A 86 87.822 -28.286 -9.409 1.00 0.00 C ATOM 1323 C ASN A 86 88.813 -27.269 -8.830 1.00 0.00 C ATOM 1324 O ASN A 86 89.914 -27.111 -9.327 1.00 0.00 O ATOM 1325 CB ASN A 86 88.243 -29.719 -9.055 1.00 0.00 C ATOM 1326 CG ASN A 86 89.622 -30.027 -9.649 1.00 0.00 C ATOM 1327 OD1 ASN A 86 90.620 -29.497 -9.206 1.00 0.00 O ATOM 1328 ND2 ASN A 86 89.717 -30.869 -10.642 1.00 0.00 N ATOM 0 H ASN A 86 88.078 -29.093 -11.376 1.00 0.00 H new ATOM 0 HA ASN A 86 86.843 -28.045 -8.995 1.00 0.00 H new ATOM 0 HB2 ASN A 86 88.270 -29.841 -7.972 1.00 0.00 H new ATOM 0 HB3 ASN A 86 87.508 -30.427 -9.437 1.00 0.00 H new ATOM 0 HD21 ASN A 86 90.630 -31.081 -11.045 1.00 0.00 H new ATOM 0 HD22 ASN A 86 88.879 -31.315 -11.015 1.00 0.00 H new ATOM 1335 N LYS A 87 88.424 -26.582 -7.783 1.00 0.00 N ATOM 1336 CA LYS A 87 89.322 -25.556 -7.171 1.00 0.00 C ATOM 1337 C LYS A 87 89.500 -25.834 -5.667 1.00 0.00 C ATOM 1338 O LYS A 87 88.822 -25.236 -4.854 1.00 0.00 O ATOM 1339 CB LYS A 87 88.607 -24.222 -7.394 1.00 0.00 C ATOM 1340 CG LYS A 87 89.642 -23.115 -7.598 1.00 0.00 C ATOM 1341 CD LYS A 87 90.110 -22.595 -6.237 1.00 0.00 C ATOM 1342 CE LYS A 87 91.487 -21.942 -6.384 1.00 0.00 C ATOM 1343 NZ LYS A 87 91.451 -20.763 -5.475 1.00 0.00 N ATOM 0 H LYS A 87 87.519 -26.689 -7.325 1.00 0.00 H new ATOM 0 HA LYS A 87 90.319 -25.561 -7.612 1.00 0.00 H new ATOM 0 HB2 LYS A 87 87.954 -24.289 -8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 87 87.974 -23.989 -6.538 1.00 0.00 H new ATOM 0 HG2 LYS A 87 90.491 -23.497 -8.165 1.00 0.00 H new ATOM 0 HG3 LYS A 87 89.210 -22.302 -8.181 1.00 0.00 H new ATOM 0 HD2 LYS A 87 89.393 -21.873 -5.846 1.00 0.00 H new ATOM 0 HD3 LYS A 87 90.159 -23.415 -5.520 1.00 0.00 H new ATOM 0 HE2 LYS A 87 92.283 -22.632 -6.105 1.00 0.00 H new ATOM 0 HE3 LYS A 87 91.673 -21.641 -7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 92.361 -20.262 -5.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 90.688 -20.121 -5.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 91.279 -21.081 -4.500 1.00 0.00 H new ATOM 1357 N PRO A 88 90.408 -26.734 -5.327 1.00 0.00 N ATOM 1358 CA PRO A 88 90.637 -27.061 -3.895 1.00 0.00 C ATOM 1359 C PRO A 88 91.082 -25.812 -3.126 1.00 0.00 C ATOM 1360 O PRO A 88 91.783 -24.968 -3.653 1.00 0.00 O ATOM 1361 CB PRO A 88 91.751 -28.111 -3.916 1.00 0.00 C ATOM 1362 CG PRO A 88 92.353 -28.038 -5.285 1.00 0.00 C ATOM 1363 CD PRO A 88 91.290 -27.516 -6.210 1.00 0.00 C ATOM 0 HA PRO A 88 89.737 -27.425 -3.400 1.00 0.00 H new ATOM 0 HB2 PRO A 88 92.497 -27.905 -3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 88 91.354 -29.106 -3.716 1.00 0.00 H new ATOM 0 HG2 PRO A 88 93.223 -27.381 -5.288 1.00 0.00 H new ATOM 0 HG3 PRO A 88 92.695 -29.021 -5.608 1.00 0.00 H new ATOM 0 HD2 PRO A 88 91.716 -26.897 -7.000 1.00 0.00 H new ATOM 0 HD3 PRO A 88 90.750 -28.328 -6.697 1.00 0.00 H new ATOM 1371 N THR A 89 90.677 -25.696 -1.884 1.00 0.00 N ATOM 1372 CA THR A 89 91.058 -24.494 -1.073 1.00 0.00 C ATOM 1373 C THR A 89 92.571 -24.509 -0.783 1.00 0.00 C ATOM 1374 O THR A 89 93.132 -25.561 -0.551 1.00 0.00 O ATOM 1375 CB THR A 89 90.262 -24.614 0.230 1.00 0.00 C ATOM 1376 OG1 THR A 89 88.943 -25.055 -0.061 1.00 0.00 O ATOM 1377 CG2 THR A 89 90.207 -23.252 0.924 1.00 0.00 C ATOM 0 H THR A 89 90.099 -26.381 -1.396 1.00 0.00 H new ATOM 0 HA THR A 89 90.840 -23.562 -1.595 1.00 0.00 H new ATOM 0 HB THR A 89 90.748 -25.334 0.888 1.00 0.00 H new ATOM 0 HG1 THR A 89 88.433 -25.134 0.772 1.00 0.00 H new ATOM 0 HG21 THR A 89 89.640 -23.339 1.851 1.00 0.00 H new ATOM 0 HG22 THR A 89 91.220 -22.916 1.148 1.00 0.00 H new ATOM 0 HG23 THR A 89 89.722 -22.529 0.268 1.00 0.00 H new ATOM 1385 N PRO A 90 93.197 -23.344 -0.804 1.00 0.00 N ATOM 1386 CA PRO A 90 94.658 -23.280 -0.539 1.00 0.00 C ATOM 1387 C PRO A 90 94.975 -23.800 0.867 1.00 0.00 C ATOM 1388 O PRO A 90 96.061 -24.289 1.123 1.00 0.00 O ATOM 1389 CB PRO A 90 95.003 -21.792 -0.656 1.00 0.00 C ATOM 1390 CG PRO A 90 93.697 -21.066 -0.574 1.00 0.00 C ATOM 1391 CD PRO A 90 92.633 -22.008 -1.062 1.00 0.00 C ATOM 0 HA PRO A 90 95.233 -23.895 -1.231 1.00 0.00 H new ATOM 0 HB2 PRO A 90 95.674 -21.482 0.145 1.00 0.00 H new ATOM 0 HB3 PRO A 90 95.510 -21.580 -1.597 1.00 0.00 H new ATOM 0 HG2 PRO A 90 93.494 -20.754 0.450 1.00 0.00 H new ATOM 0 HG3 PRO A 90 93.720 -20.163 -1.184 1.00 0.00 H new ATOM 0 HD2 PRO A 90 91.694 -21.861 -0.528 1.00 0.00 H new ATOM 0 HD3 PRO A 90 92.424 -21.860 -2.122 1.00 0.00 H new ATOM 1399 N VAL A 91 94.035 -23.699 1.777 1.00 0.00 N ATOM 1400 CA VAL A 91 94.278 -24.167 3.176 1.00 0.00 C ATOM 1401 C VAL A 91 93.309 -25.303 3.525 1.00 0.00 C ATOM 1402 O VAL A 91 92.128 -25.228 3.243 1.00 0.00 O ATOM 1403 CB VAL A 91 94.024 -22.941 4.065 1.00 0.00 C ATOM 1404 CG1 VAL A 91 94.258 -23.307 5.534 1.00 0.00 C ATOM 1405 CG2 VAL A 91 94.983 -21.808 3.676 1.00 0.00 C ATOM 0 H VAL A 91 93.107 -23.311 1.609 1.00 0.00 H new ATOM 0 HA VAL A 91 95.287 -24.557 3.312 1.00 0.00 H new ATOM 0 HB VAL A 91 92.993 -22.614 3.927 1.00 0.00 H new ATOM 0 HG11 VAL A 91 94.076 -22.433 6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 91 93.577 -24.108 5.822 1.00 0.00 H new ATOM 0 HG13 VAL A 91 95.287 -23.641 5.666 1.00 0.00 H new ATOM 0 HG21 VAL A 91 94.798 -20.941 4.310 1.00 0.00 H new ATOM 0 HG22 VAL A 91 96.012 -22.141 3.808 1.00 0.00 H new ATOM 0 HG23 VAL A 91 94.821 -21.536 2.633 1.00 0.00 H new ATOM 1415 N LYS A 92 93.807 -26.349 4.137 1.00 0.00 N ATOM 1416 CA LYS A 92 92.927 -27.491 4.531 1.00 0.00 C ATOM 1417 C LYS A 92 92.522 -27.363 6.002 1.00 0.00 C ATOM 1418 O LYS A 92 93.224 -26.761 6.795 1.00 0.00 O ATOM 1419 CB LYS A 92 93.779 -28.741 4.315 1.00 0.00 C ATOM 1420 CG LYS A 92 94.106 -28.887 2.828 1.00 0.00 C ATOM 1421 CD LYS A 92 94.857 -30.200 2.596 1.00 0.00 C ATOM 1422 CE LYS A 92 95.289 -30.290 1.131 1.00 0.00 C ATOM 1423 NZ LYS A 92 95.111 -31.722 0.764 1.00 0.00 N ATOM 0 H LYS A 92 94.791 -26.461 4.382 1.00 0.00 H new ATOM 0 HA LYS A 92 92.005 -27.522 3.950 1.00 0.00 H new ATOM 0 HB2 LYS A 92 94.699 -28.671 4.895 1.00 0.00 H new ATOM 0 HB3 LYS A 92 93.245 -29.623 4.669 1.00 0.00 H new ATOM 0 HG2 LYS A 92 93.188 -28.872 2.240 1.00 0.00 H new ATOM 0 HG3 LYS A 92 94.712 -28.045 2.494 1.00 0.00 H new ATOM 0 HD2 LYS A 92 95.730 -30.252 3.247 1.00 0.00 H new ATOM 0 HD3 LYS A 92 94.219 -31.046 2.850 1.00 0.00 H new ATOM 0 HE2 LYS A 92 94.681 -29.642 0.500 1.00 0.00 H new ATOM 0 HE3 LYS A 92 96.325 -29.976 1.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 95.387 -31.863 -0.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 95.707 -32.314 1.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 94.114 -31.991 0.887 1.00 0.00 H new ATOM 1437 N LEU A 93 91.396 -27.926 6.367 1.00 0.00 N ATOM 1438 CA LEU A 93 90.932 -27.844 7.787 1.00 0.00 C ATOM 1439 C LEU A 93 90.977 -29.238 8.442 1.00 0.00 C ATOM 1440 O LEU A 93 91.027 -30.233 7.748 1.00 0.00 O ATOM 1441 CB LEU A 93 89.490 -27.322 7.716 1.00 0.00 C ATOM 1442 CG LEU A 93 88.621 -28.271 6.869 1.00 0.00 C ATOM 1443 CD1 LEU A 93 87.266 -28.479 7.553 1.00 0.00 C ATOM 1444 CD2 LEU A 93 88.400 -27.666 5.476 1.00 0.00 C ATOM 0 H LEU A 93 90.777 -28.440 5.741 1.00 0.00 H new ATOM 0 HA LEU A 93 91.565 -27.191 8.388 1.00 0.00 H new ATOM 0 HB2 LEU A 93 89.076 -27.238 8.721 1.00 0.00 H new ATOM 0 HB3 LEU A 93 89.479 -26.322 7.282 1.00 0.00 H new ATOM 0 HG LEU A 93 89.130 -29.230 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 93 86.654 -29.151 6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 93 87.420 -28.915 8.540 1.00 0.00 H new ATOM 0 HD13 LEU A 93 86.759 -27.520 7.655 1.00 0.00 H new ATOM 0 HD21 LEU A 93 87.785 -28.340 4.880 1.00 0.00 H new ATOM 0 HD22 LEU A 93 87.896 -26.705 5.573 1.00 0.00 H new ATOM 0 HD23 LEU A 93 89.362 -27.523 4.985 1.00 0.00 H new ATOM 1456 N PRO A 94 90.958 -29.279 9.765 1.00 0.00 N ATOM 1457 CA PRO A 94 91.031 -30.585 10.474 1.00 0.00 C ATOM 1458 C PRO A 94 89.857 -31.484 10.071 1.00 0.00 C ATOM 1459 O PRO A 94 88.733 -31.036 9.958 1.00 0.00 O ATOM 1460 CB PRO A 94 90.943 -30.217 11.957 1.00 0.00 C ATOM 1461 CG PRO A 94 91.257 -28.757 12.031 1.00 0.00 C ATOM 1462 CD PRO A 94 90.871 -28.152 10.710 1.00 0.00 C ATOM 0 HA PRO A 94 91.939 -31.138 10.235 1.00 0.00 H new ATOM 0 HB2 PRO A 94 89.949 -30.424 12.353 1.00 0.00 H new ATOM 0 HB3 PRO A 94 91.650 -30.800 12.548 1.00 0.00 H new ATOM 0 HG2 PRO A 94 90.707 -28.286 12.845 1.00 0.00 H new ATOM 0 HG3 PRO A 94 92.317 -28.601 12.231 1.00 0.00 H new ATOM 0 HD2 PRO A 94 89.865 -27.733 10.741 1.00 0.00 H new ATOM 0 HD3 PRO A 94 91.545 -27.342 10.429 1.00 0.00 H new ATOM 1470 N HIS A 95 90.116 -32.755 9.860 1.00 0.00 N ATOM 1471 CA HIS A 95 89.038 -33.709 9.426 1.00 0.00 C ATOM 1472 C HIS A 95 88.338 -33.206 8.156 1.00 0.00 C ATOM 1473 O HIS A 95 88.544 -32.087 7.723 1.00 0.00 O ATOM 1474 CB HIS A 95 88.048 -33.782 10.594 1.00 0.00 C ATOM 1475 CG HIS A 95 86.963 -34.805 10.398 1.00 0.00 C ATOM 1476 ND1 HIS A 95 87.227 -36.166 10.362 1.00 0.00 N ATOM 1477 CD2 HIS A 95 85.606 -34.683 10.224 1.00 0.00 C ATOM 1478 CE1 HIS A 95 86.057 -36.802 10.173 1.00 0.00 C ATOM 1479 NE2 HIS A 95 85.036 -35.944 10.082 1.00 0.00 N ATOM 0 H HIS A 95 91.038 -33.178 9.971 1.00 0.00 H new ATOM 0 HA HIS A 95 89.451 -34.689 9.187 1.00 0.00 H new ATOM 0 HB2 HIS A 95 88.594 -34.014 11.509 1.00 0.00 H new ATOM 0 HB3 HIS A 95 87.591 -32.802 10.735 1.00 0.00 H new ATOM 0 HD2 HIS A 95 85.064 -33.749 10.201 1.00 0.00 H new ATOM 0 HE1 HIS A 95 85.955 -37.875 10.103 1.00 0.00 H new ATOM 0 HE2 HIS A 95 84.051 -36.166 9.939 1.00 0.00 H new ATOM 1487 N PHE A 96 87.516 -34.034 7.560 1.00 0.00 N ATOM 1488 CA PHE A 96 86.764 -33.610 6.340 1.00 0.00 C ATOM 1489 C PHE A 96 85.265 -33.539 6.643 1.00 0.00 C ATOM 1490 O PHE A 96 84.709 -34.425 7.267 1.00 0.00 O ATOM 1491 CB PHE A 96 87.051 -34.695 5.301 1.00 0.00 C ATOM 1492 CG PHE A 96 88.512 -34.809 4.937 1.00 0.00 C ATOM 1493 CD1 PHE A 96 89.368 -35.693 5.676 1.00 0.00 C ATOM 1494 CD2 PHE A 96 89.044 -34.034 3.853 1.00 0.00 C ATOM 1495 CE1 PHE A 96 90.757 -35.801 5.330 1.00 0.00 C ATOM 1496 CE2 PHE A 96 90.432 -34.143 3.507 1.00 0.00 C ATOM 1497 CZ PHE A 96 91.289 -35.026 4.246 1.00 0.00 C ATOM 0 H PHE A 96 87.333 -34.989 7.868 1.00 0.00 H new ATOM 0 HA PHE A 96 87.065 -32.622 5.991 1.00 0.00 H new ATOM 0 HB2 PHE A 96 86.704 -35.655 5.684 1.00 0.00 H new ATOM 0 HB3 PHE A 96 86.475 -34.485 4.399 1.00 0.00 H new ATOM 0 HD1 PHE A 96 88.967 -36.276 6.492 1.00 0.00 H new ATOM 0 HD2 PHE A 96 88.400 -33.369 3.298 1.00 0.00 H new ATOM 0 HE1 PHE A 96 91.402 -36.466 5.886 1.00 0.00 H new ATOM 0 HE2 PHE A 96 90.832 -33.561 2.690 1.00 0.00 H new ATOM 0 HZ PHE A 96 92.334 -35.107 3.986 1.00 0.00 H new ATOM 1507 N SER A 97 84.611 -32.491 6.203 1.00 0.00 N ATOM 1508 CA SER A 97 83.144 -32.356 6.449 1.00 0.00 C ATOM 1509 C SER A 97 82.397 -32.195 5.122 1.00 0.00 C ATOM 1510 O SER A 97 82.895 -31.587 4.192 1.00 0.00 O ATOM 1511 CB SER A 97 82.999 -31.097 7.301 1.00 0.00 C ATOM 1512 OG SER A 97 83.754 -31.249 8.496 1.00 0.00 O ATOM 0 H SER A 97 85.033 -31.722 5.683 1.00 0.00 H new ATOM 0 HA SER A 97 82.727 -33.233 6.944 1.00 0.00 H new ATOM 0 HB2 SER A 97 83.347 -30.226 6.746 1.00 0.00 H new ATOM 0 HB3 SER A 97 81.950 -30.924 7.540 1.00 0.00 H new ATOM 0 HG SER A 97 83.664 -30.442 9.044 1.00 0.00 H new ATOM 1518 N ASN A 98 81.207 -32.738 5.033 1.00 0.00 N ATOM 1519 CA ASN A 98 80.402 -32.601 3.780 1.00 0.00 C ATOM 1520 C ASN A 98 79.008 -32.043 4.095 1.00 0.00 C ATOM 1521 O ASN A 98 78.253 -32.630 4.848 1.00 0.00 O ATOM 1522 CB ASN A 98 80.316 -34.021 3.202 1.00 0.00 C ATOM 1523 CG ASN A 98 79.611 -34.962 4.188 1.00 0.00 C ATOM 1524 OD1 ASN A 98 79.546 -34.691 5.371 1.00 0.00 O ATOM 1525 ND2 ASN A 98 79.075 -36.066 3.745 1.00 0.00 N ATOM 0 H ASN A 98 80.758 -33.272 5.777 1.00 0.00 H new ATOM 0 HA ASN A 98 80.855 -31.907 3.072 1.00 0.00 H new ATOM 0 HB2 ASN A 98 79.774 -34.003 2.257 1.00 0.00 H new ATOM 0 HB3 ASN A 98 81.318 -34.394 2.988 1.00 0.00 H new ATOM 0 HD21 ASN A 98 78.603 -36.699 4.391 1.00 0.00 H new ATOM 0 HD22 ASN A 98 79.128 -36.296 2.753 1.00 0.00 H new ATOM 1532 N ILE A 99 78.670 -30.914 3.523 1.00 0.00 N ATOM 1533 CA ILE A 99 77.323 -30.311 3.767 1.00 0.00 C ATOM 1534 C ILE A 99 76.605 -30.052 2.437 1.00 0.00 C ATOM 1535 O ILE A 99 77.228 -29.968 1.394 1.00 0.00 O ATOM 1536 CB ILE A 99 77.597 -28.997 4.513 1.00 0.00 C ATOM 1537 CG1 ILE A 99 78.477 -28.079 3.656 1.00 0.00 C ATOM 1538 CG2 ILE A 99 78.311 -29.296 5.833 1.00 0.00 C ATOM 1539 CD1 ILE A 99 78.603 -26.713 4.335 1.00 0.00 C ATOM 0 H ILE A 99 79.272 -30.382 2.895 1.00 0.00 H new ATOM 0 HA ILE A 99 76.675 -30.970 4.345 1.00 0.00 H new ATOM 0 HB ILE A 99 76.648 -28.499 4.713 1.00 0.00 H new ATOM 0 HG12 ILE A 99 79.463 -28.523 3.523 1.00 0.00 H new ATOM 0 HG13 ILE A 99 78.043 -27.965 2.663 1.00 0.00 H new ATOM 0 HG21 ILE A 99 78.505 -28.363 6.361 1.00 0.00 H new ATOM 0 HG22 ILE A 99 77.682 -29.938 6.450 1.00 0.00 H new ATOM 0 HG23 ILE A 99 79.255 -29.801 5.630 1.00 0.00 H new ATOM 0 HD11 ILE A 99 79.228 -26.060 3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 99 77.614 -26.269 4.445 1.00 0.00 H new ATOM 0 HD13 ILE A 99 79.057 -26.836 5.318 1.00 0.00 H new ATOM 1551 N LEU A 100 75.301 -29.926 2.473 1.00 0.00 N ATOM 1552 CA LEU A 100 74.529 -29.663 1.221 1.00 0.00 C ATOM 1553 C LEU A 100 74.136 -28.185 1.143 1.00 0.00 C ATOM 1554 O LEU A 100 73.608 -27.626 2.086 1.00 0.00 O ATOM 1555 CB LEU A 100 73.284 -30.544 1.329 1.00 0.00 C ATOM 1556 CG LEU A 100 72.477 -30.449 0.034 1.00 0.00 C ATOM 1557 CD1 LEU A 100 73.213 -31.192 -1.083 1.00 0.00 C ATOM 1558 CD2 LEU A 100 71.100 -31.083 0.245 1.00 0.00 C ATOM 0 H LEU A 100 74.737 -29.994 3.320 1.00 0.00 H new ATOM 0 HA LEU A 100 75.108 -29.886 0.325 1.00 0.00 H new ATOM 0 HB2 LEU A 100 73.573 -31.579 1.515 1.00 0.00 H new ATOM 0 HB3 LEU A 100 72.673 -30.227 2.174 1.00 0.00 H new ATOM 0 HG LEU A 100 72.358 -29.402 -0.244 1.00 0.00 H new ATOM 0 HD11 LEU A 100 72.637 -31.124 -2.006 1.00 0.00 H new ATOM 0 HD12 LEU A 100 74.195 -30.743 -1.234 1.00 0.00 H new ATOM 0 HD13 LEU A 100 73.332 -32.239 -0.806 1.00 0.00 H new ATOM 0 HD21 LEU A 100 70.523 -31.016 -0.678 1.00 0.00 H new ATOM 0 HD22 LEU A 100 71.220 -32.130 0.523 1.00 0.00 H new ATOM 0 HD23 LEU A 100 70.574 -30.555 1.041 1.00 0.00 H new ATOM 1570 N GLY A 101 74.392 -27.554 0.023 1.00 0.00 N ATOM 1571 CA GLY A 101 74.042 -26.111 -0.132 1.00 0.00 C ATOM 1572 C GLY A 101 73.063 -25.944 -1.297 1.00 0.00 C ATOM 1573 O GLY A 101 72.688 -26.950 -1.877 1.00 0.00 O ATOM 1574 OXT GLY A 101 72.707 -24.814 -1.588 1.00 0.00 O ATOM 0 H GLY A 101 74.831 -27.980 -0.793 1.00 0.00 H new ATOM 0 HA2 GLY A 101 73.596 -25.733 0.788 1.00 0.00 H new ATOM 0 HA3 GLY A 101 74.943 -25.525 -0.314 1.00 0.00 H new TER 1578 GLY A 101