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= -0.978 USER MOD Set 1.2: A 25 GLN : amide:sc= 0 K(o=-0.98,f=-2.1!) USER MOD Single : A 1 MET CE :methyl -156:sc= -0.188 (180deg=-1.44!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A -1 GLY N :NH3+ -131:sc= 0.0752 (180deg=0) USER MOD Single : A 11 CYS SG : rot -164:sc= -7.88! USER MOD Single : A 17 CYS SG : rot 180:sc= -0.171 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 32 SER OG : rot 180:sc= -0.576 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0571 USER MOD Single : A 44 ASN : amide:sc= -1.38 K(o=-1.4,f=-2!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.552 K(o=-0.55,f=-1.3) USER MOD Single : A 52 ASN : amide:sc= -0.202 X(o=-0.2,f=-0.0033) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.422 USER MOD Single : A 60 THR OG1 : rot 140:sc= -0.892 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= -0.544 K(o=-0.54,f=-1.3) USER MOD Single : A 78 HIS : no HD1:sc= -2.23 K(o=-2.2,f=-0.85) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00531 USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 43:sc= 1.08 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= -0.903 K(o=-0.9,f=-0.28) USER MOD Single : A 97 SER OG : rot -112:sc= 0.159 USER MOD Single : A 98 ASN : amide:sc= -0.0313 K(o=-0.031,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 94.029 10.862 -12.297 1.00 0.00 N ATOM 2 CA GLY A -1 94.692 12.163 -11.997 1.00 0.00 C ATOM 3 C GLY A -1 95.645 11.989 -10.812 1.00 0.00 C ATOM 4 O GLY A -1 96.132 10.904 -10.552 1.00 0.00 O ATOM 0 H1 GLY A -1 94.099 10.663 -13.315 1.00 0.00 H new ATOM 0 H2 GLY A -1 94.497 10.102 -11.763 1.00 0.00 H new ATOM 0 H3 GLY A -1 93.027 10.911 -12.022 1.00 0.00 H new ATOM 0 HA2 GLY A -1 95.241 12.513 -12.871 1.00 0.00 H new ATOM 0 HA3 GLY A -1 93.943 12.921 -11.767 1.00 0.00 H new ATOM 10 N ALA A 0 95.911 13.055 -10.095 1.00 0.00 N ATOM 11 CA ALA A 0 96.837 12.965 -8.920 1.00 0.00 C ATOM 12 C ALA A 0 96.262 12.015 -7.867 1.00 0.00 C ATOM 13 O ALA A 0 96.993 11.349 -7.157 1.00 0.00 O ATOM 14 CB ALA A 0 96.928 14.388 -8.362 1.00 0.00 C ATOM 0 H ALA A 0 95.527 13.983 -10.272 1.00 0.00 H new ATOM 0 HA ALA A 0 97.817 12.578 -9.202 1.00 0.00 H new ATOM 0 HB1 ALA A 0 97.591 14.398 -7.497 1.00 0.00 H new ATOM 0 HB2 ALA A 0 97.322 15.055 -9.129 1.00 0.00 H new ATOM 0 HB3 ALA A 0 95.936 14.725 -8.062 1.00 0.00 H new ATOM 20 N MET A 1 94.957 11.952 -7.764 1.00 0.00 N ATOM 21 CA MET A 1 94.315 11.051 -6.758 1.00 0.00 C ATOM 22 C MET A 1 92.958 10.572 -7.279 1.00 0.00 C ATOM 23 O MET A 1 92.361 11.193 -8.139 1.00 0.00 O ATOM 24 CB MET A 1 94.137 11.900 -5.496 1.00 0.00 C ATOM 25 CG MET A 1 95.506 12.300 -4.940 1.00 0.00 C ATOM 26 SD MET A 1 95.295 13.053 -3.308 1.00 0.00 S ATOM 27 CE MET A 1 94.226 14.419 -3.825 1.00 0.00 C ATOM 0 H MET A 1 94.306 12.489 -8.337 1.00 0.00 H new ATOM 0 HA MET A 1 94.917 10.165 -6.559 1.00 0.00 H new ATOM 0 HB2 MET A 1 93.554 12.792 -5.726 1.00 0.00 H new ATOM 0 HB3 MET A 1 93.580 11.339 -4.746 1.00 0.00 H new ATOM 0 HG2 MET A 1 96.152 11.425 -4.868 1.00 0.00 H new ATOM 0 HG3 MET A 1 95.995 13.002 -5.616 1.00 0.00 H new ATOM 0 HE1 MET A 1 94.308 15.236 -3.108 1.00 0.00 H new ATOM 0 HE2 MET A 1 94.533 14.769 -4.811 1.00 0.00 H new ATOM 0 HE3 MET A 1 93.192 14.076 -3.868 1.00 0.00 H new ATOM 37 N GLY A 2 92.470 9.470 -6.760 1.00 0.00 N ATOM 38 CA GLY A 2 91.155 8.933 -7.221 1.00 0.00 C ATOM 39 C GLY A 2 91.356 7.532 -7.823 1.00 0.00 C ATOM 40 O GLY A 2 91.586 7.411 -9.010 1.00 0.00 O ATOM 0 H GLY A 2 92.929 8.919 -6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 2 90.457 8.885 -6.385 1.00 0.00 H new ATOM 0 HA3 GLY A 2 90.718 9.600 -7.964 1.00 0.00 H new ATOM 44 N PRO A 3 91.265 6.505 -6.995 1.00 0.00 N ATOM 45 CA PRO A 3 91.444 5.120 -7.503 1.00 0.00 C ATOM 46 C PRO A 3 90.380 4.794 -8.556 1.00 0.00 C ATOM 47 O PRO A 3 89.230 5.172 -8.423 1.00 0.00 O ATOM 48 CB PRO A 3 91.268 4.235 -6.267 1.00 0.00 C ATOM 49 CG PRO A 3 90.619 5.101 -5.235 1.00 0.00 C ATOM 50 CD PRO A 3 90.993 6.522 -5.547 1.00 0.00 C ATOM 0 HA PRO A 3 92.411 4.973 -7.984 1.00 0.00 H new ATOM 0 HB2 PRO A 3 90.650 3.366 -6.493 1.00 0.00 H new ATOM 0 HB3 PRO A 3 92.229 3.860 -5.915 1.00 0.00 H new ATOM 0 HG2 PRO A 3 89.536 4.975 -5.253 1.00 0.00 H new ATOM 0 HG3 PRO A 3 90.955 4.826 -4.235 1.00 0.00 H new ATOM 0 HD2 PRO A 3 90.186 7.211 -5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 3 91.868 6.839 -4.979 1.00 0.00 H new ATOM 58 N THR A 4 90.759 4.096 -9.599 1.00 0.00 N ATOM 59 CA THR A 4 89.768 3.694 -10.645 1.00 0.00 C ATOM 60 C THR A 4 90.143 2.334 -11.256 1.00 0.00 C ATOM 61 O THR A 4 89.706 2.000 -12.343 1.00 0.00 O ATOM 62 CB THR A 4 89.837 4.795 -11.705 1.00 0.00 C ATOM 63 OG1 THR A 4 91.174 4.919 -12.167 1.00 0.00 O ATOM 64 CG2 THR A 4 89.377 6.120 -11.098 1.00 0.00 C ATOM 0 H THR A 4 91.716 3.787 -9.771 1.00 0.00 H new ATOM 0 HA THR A 4 88.765 3.585 -10.233 1.00 0.00 H new ATOM 0 HB THR A 4 89.186 4.539 -12.541 1.00 0.00 H new ATOM 0 HG1 THR A 4 91.221 5.623 -12.848 1.00 0.00 H new ATOM 0 HG21 THR A 4 89.427 6.903 -11.854 1.00 0.00 H new ATOM 0 HG22 THR A 4 88.351 6.021 -10.745 1.00 0.00 H new ATOM 0 HG23 THR A 4 90.025 6.382 -10.262 1.00 0.00 H new ATOM 72 N ASP A 5 90.944 1.552 -10.569 1.00 0.00 N ATOM 73 CA ASP A 5 91.370 0.228 -11.122 1.00 0.00 C ATOM 74 C ASP A 5 90.263 -0.812 -10.931 1.00 0.00 C ATOM 75 O ASP A 5 89.485 -0.736 -9.998 1.00 0.00 O ATOM 76 CB ASP A 5 92.615 -0.161 -10.318 1.00 0.00 C ATOM 77 CG ASP A 5 93.737 0.854 -10.568 1.00 0.00 C ATOM 78 OD1 ASP A 5 93.770 1.425 -11.648 1.00 0.00 O ATOM 79 OD2 ASP A 5 94.545 1.042 -9.674 1.00 0.00 O ATOM 0 H ASP A 5 91.321 1.775 -9.648 1.00 0.00 H new ATOM 0 HA ASP A 5 91.575 0.279 -12.191 1.00 0.00 H new ATOM 0 HB2 ASP A 5 92.376 -0.197 -9.255 1.00 0.00 H new ATOM 0 HB3 ASP A 5 92.946 -1.159 -10.604 1.00 0.00 H new ATOM 84 N GLN A 6 90.191 -1.782 -11.811 1.00 0.00 N ATOM 85 CA GLN A 6 89.190 -2.886 -11.646 1.00 0.00 C ATOM 86 C GLN A 6 89.571 -3.836 -10.500 1.00 0.00 C ATOM 87 O GLN A 6 88.831 -4.749 -10.179 1.00 0.00 O ATOM 88 CB GLN A 6 89.190 -3.634 -12.982 1.00 0.00 C ATOM 89 CG GLN A 6 88.728 -2.691 -14.095 1.00 0.00 C ATOM 90 CD GLN A 6 88.775 -3.418 -15.443 1.00 0.00 C ATOM 91 OE1 GLN A 6 89.463 -4.409 -15.592 1.00 0.00 O ATOM 92 NE2 GLN A 6 88.065 -2.962 -16.439 1.00 0.00 N ATOM 0 H GLN A 6 90.783 -1.858 -12.638 1.00 0.00 H new ATOM 0 HA GLN A 6 88.207 -2.488 -11.392 1.00 0.00 H new ATOM 0 HB2 GLN A 6 90.190 -4.010 -13.201 1.00 0.00 H new ATOM 0 HB3 GLN A 6 88.530 -4.499 -12.926 1.00 0.00 H new ATOM 0 HG2 GLN A 6 87.714 -2.344 -13.893 1.00 0.00 H new ATOM 0 HG3 GLN A 6 89.367 -1.808 -14.125 1.00 0.00 H new ATOM 0 HE21 GLN A 6 87.487 -2.131 -16.315 1.00 0.00 H new ATOM 0 HE22 GLN A 6 88.088 -3.437 -17.341 1.00 0.00 H new ATOM 101 N ASP A 7 90.711 -3.635 -9.882 1.00 0.00 N ATOM 102 CA ASP A 7 91.085 -4.459 -8.690 1.00 0.00 C ATOM 103 C ASP A 7 90.171 -4.122 -7.505 1.00 0.00 C ATOM 104 O ASP A 7 89.976 -4.934 -6.619 1.00 0.00 O ATOM 105 CB ASP A 7 92.539 -4.092 -8.373 1.00 0.00 C ATOM 106 CG ASP A 7 93.449 -4.509 -9.536 1.00 0.00 C ATOM 107 OD1 ASP A 7 93.114 -5.465 -10.218 1.00 0.00 O ATOM 108 OD2 ASP A 7 94.465 -3.862 -9.724 1.00 0.00 O ATOM 0 H ASP A 7 91.400 -2.933 -10.153 1.00 0.00 H new ATOM 0 HA ASP A 7 90.976 -5.526 -8.883 1.00 0.00 H new ATOM 0 HB2 ASP A 7 92.623 -3.019 -8.201 1.00 0.00 H new ATOM 0 HB3 ASP A 7 92.857 -4.588 -7.456 1.00 0.00 H new ATOM 113 N TRP A 8 89.613 -2.932 -7.484 1.00 0.00 N ATOM 114 CA TRP A 8 88.743 -2.525 -6.337 1.00 0.00 C ATOM 115 C TRP A 8 87.360 -3.180 -6.423 1.00 0.00 C ATOM 116 O TRP A 8 86.620 -3.171 -5.460 1.00 0.00 O ATOM 117 CB TRP A 8 88.611 -1.006 -6.425 1.00 0.00 C ATOM 118 CG TRP A 8 89.668 -0.269 -5.667 1.00 0.00 C ATOM 119 CD1 TRP A 8 90.319 0.829 -6.124 1.00 0.00 C ATOM 120 CD2 TRP A 8 90.207 -0.547 -4.340 1.00 0.00 C ATOM 121 NE1 TRP A 8 91.231 1.250 -5.169 1.00 0.00 N ATOM 122 CE2 TRP A 8 91.215 0.445 -4.050 1.00 0.00 C ATOM 123 CE3 TRP A 8 89.936 -1.558 -3.345 1.00 0.00 C ATOM 124 CZ2 TRP A 8 91.936 0.441 -2.818 1.00 0.00 C ATOM 125 CZ3 TRP A 8 90.660 -1.567 -2.103 1.00 0.00 C ATOM 126 CH2 TRP A 8 91.659 -0.570 -1.842 1.00 0.00 C ATOM 0 H TRP A 8 89.724 -2.227 -8.213 1.00 0.00 H new ATOM 0 HA TRP A 8 89.181 -2.842 -5.391 1.00 0.00 H new ATOM 0 HB2 TRP A 8 88.651 -0.706 -7.472 1.00 0.00 H new ATOM 0 HB3 TRP A 8 87.632 -0.712 -6.046 1.00 0.00 H new ATOM 0 HD1 TRP A 8 90.153 1.301 -7.081 1.00 0.00 H new ATOM 0 HE1 TRP A 8 91.842 2.059 -5.281 1.00 0.00 H new ATOM 0 HE3 TRP A 8 89.186 -2.311 -3.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 92.685 1.195 -2.623 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 90.452 -2.326 -1.364 1.00 0.00 H new ATOM 0 HH2 TRP A 8 92.202 -0.582 -0.909 1.00 0.00 H new ATOM 137 N ILE A 9 86.994 -3.753 -7.551 1.00 0.00 N ATOM 138 CA ILE A 9 85.578 -4.227 -7.729 1.00 0.00 C ATOM 139 C ILE A 9 85.196 -5.205 -6.603 1.00 0.00 C ATOM 140 O ILE A 9 85.938 -6.112 -6.274 1.00 0.00 O ATOM 141 CB ILE A 9 85.539 -4.920 -9.105 1.00 0.00 C ATOM 142 CG1 ILE A 9 85.911 -3.924 -10.222 1.00 0.00 C ATOM 143 CG2 ILE A 9 84.132 -5.470 -9.373 1.00 0.00 C ATOM 144 CD1 ILE A 9 84.959 -2.722 -10.213 1.00 0.00 C ATOM 0 H ILE A 9 87.609 -3.912 -8.349 1.00 0.00 H new ATOM 0 HA ILE A 9 84.864 -3.405 -7.683 1.00 0.00 H new ATOM 0 HB ILE A 9 86.260 -5.737 -9.098 1.00 0.00 H new ATOM 0 HG12 ILE A 9 86.937 -3.583 -10.085 1.00 0.00 H new ATOM 0 HG13 ILE A 9 85.867 -4.422 -11.190 1.00 0.00 H new ATOM 0 HG21 ILE A 9 84.112 -5.958 -10.347 1.00 0.00 H new ATOM 0 HG22 ILE A 9 83.870 -6.192 -8.600 1.00 0.00 H new ATOM 0 HG23 ILE A 9 83.413 -4.651 -9.363 1.00 0.00 H new ATOM 0 HD11 ILE A 9 85.238 -2.031 -11.008 1.00 0.00 H new ATOM 0 HD12 ILE A 9 83.937 -3.066 -10.373 1.00 0.00 H new ATOM 0 HD13 ILE A 9 85.024 -2.214 -9.251 1.00 0.00 H new ATOM 156 N GLY A 10 84.039 -5.013 -6.021 1.00 0.00 N ATOM 157 CA GLY A 10 83.600 -5.877 -4.886 1.00 0.00 C ATOM 158 C GLY A 10 84.156 -5.381 -3.537 1.00 0.00 C ATOM 159 O GLY A 10 83.875 -5.976 -2.511 1.00 0.00 O ATOM 0 H GLY A 10 83.374 -4.287 -6.288 1.00 0.00 H new ATOM 0 HA2 GLY A 10 82.511 -5.896 -4.845 1.00 0.00 H new ATOM 0 HA3 GLY A 10 83.931 -6.901 -5.060 1.00 0.00 H new ATOM 163 N CYS A 11 84.933 -4.311 -3.513 1.00 0.00 N ATOM 164 CA CYS A 11 85.439 -3.790 -2.196 1.00 0.00 C ATOM 165 C CYS A 11 84.386 -2.878 -1.537 1.00 0.00 C ATOM 166 O CYS A 11 83.551 -2.303 -2.209 1.00 0.00 O ATOM 167 CB CYS A 11 86.779 -3.061 -2.499 1.00 0.00 C ATOM 168 SG CYS A 11 86.546 -1.386 -3.181 1.00 0.00 S ATOM 0 H CYS A 11 85.232 -3.787 -4.335 1.00 0.00 H new ATOM 0 HA CYS A 11 85.616 -4.589 -1.476 1.00 0.00 H new ATOM 0 HB2 CYS A 11 87.365 -2.995 -1.582 1.00 0.00 H new ATOM 0 HB3 CYS A 11 87.358 -3.657 -3.205 1.00 0.00 H new ATOM 0 HG CYS A 11 87.657 -0.977 -3.718 1.00 0.00 H new ATOM 174 N ALA A 12 84.430 -2.748 -0.234 1.00 0.00 N ATOM 175 CA ALA A 12 83.385 -1.956 0.486 1.00 0.00 C ATOM 176 C ALA A 12 83.818 -0.493 0.599 1.00 0.00 C ATOM 177 O ALA A 12 84.843 -0.195 1.184 1.00 0.00 O ATOM 178 CB ALA A 12 83.296 -2.594 1.872 1.00 0.00 C ATOM 0 H ALA A 12 85.147 -3.158 0.364 1.00 0.00 H new ATOM 0 HA ALA A 12 82.426 -1.966 -0.033 1.00 0.00 H new ATOM 0 HB1 ALA A 12 82.548 -2.069 2.467 1.00 0.00 H new ATOM 0 HB2 ALA A 12 83.011 -3.641 1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 12 84.265 -2.527 2.366 1.00 0.00 H new ATOM 184 N VAL A 13 83.047 0.416 0.050 1.00 0.00 N ATOM 185 CA VAL A 13 83.441 1.858 0.084 1.00 0.00 C ATOM 186 C VAL A 13 82.241 2.740 0.443 1.00 0.00 C ATOM 187 O VAL A 13 81.099 2.346 0.281 1.00 0.00 O ATOM 188 CB VAL A 13 83.949 2.176 -1.329 1.00 0.00 C ATOM 189 CG1 VAL A 13 85.157 1.292 -1.645 1.00 0.00 C ATOM 190 CG2 VAL A 13 82.843 1.908 -2.359 1.00 0.00 C ATOM 0 H VAL A 13 82.163 0.220 -0.419 1.00 0.00 H new ATOM 0 HA VAL A 13 84.203 2.051 0.839 1.00 0.00 H new ATOM 0 HB VAL A 13 84.236 3.227 -1.376 1.00 0.00 H new ATOM 0 HG11 VAL A 13 85.519 1.516 -2.648 1.00 0.00 H new ATOM 0 HG12 VAL A 13 85.949 1.486 -0.921 1.00 0.00 H new ATOM 0 HG13 VAL A 13 84.865 0.243 -1.591 1.00 0.00 H new ATOM 0 HG21 VAL A 13 83.213 2.137 -3.358 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.549 0.860 -2.312 1.00 0.00 H new ATOM 0 HG23 VAL A 13 81.981 2.537 -2.139 1.00 0.00 H new ATOM 200 N SER A 14 82.501 3.928 0.929 1.00 0.00 N ATOM 201 CA SER A 14 81.398 4.894 1.200 1.00 0.00 C ATOM 202 C SER A 14 81.640 6.173 0.410 1.00 0.00 C ATOM 203 O SER A 14 82.764 6.621 0.278 1.00 0.00 O ATOM 204 CB SER A 14 81.459 5.164 2.702 1.00 0.00 C ATOM 205 OG SER A 14 80.557 6.214 3.028 1.00 0.00 O ATOM 0 H SER A 14 83.436 4.270 1.150 1.00 0.00 H new ATOM 0 HA SER A 14 80.421 4.510 0.906 1.00 0.00 H new ATOM 0 HB2 SER A 14 81.200 4.262 3.256 1.00 0.00 H new ATOM 0 HB3 SER A 14 82.473 5.437 2.993 1.00 0.00 H new ATOM 0 HG SER A 14 80.593 6.388 3.992 1.00 0.00 H new ATOM 211 N ILE A 15 80.597 6.763 -0.116 1.00 0.00 N ATOM 212 CA ILE A 15 80.780 7.926 -1.035 1.00 0.00 C ATOM 213 C ILE A 15 80.041 9.143 -0.483 1.00 0.00 C ATOM 214 O ILE A 15 78.837 9.113 -0.297 1.00 0.00 O ATOM 215 CB ILE A 15 80.172 7.503 -2.389 1.00 0.00 C ATOM 216 CG1 ILE A 15 80.676 6.106 -2.836 1.00 0.00 C ATOM 217 CG2 ILE A 15 80.559 8.535 -3.451 1.00 0.00 C ATOM 218 CD1 ILE A 15 82.208 6.034 -2.810 1.00 0.00 C ATOM 0 H ILE A 15 79.628 6.490 0.051 1.00 0.00 H new ATOM 0 HA ILE A 15 81.831 8.195 -1.140 1.00 0.00 H new ATOM 0 HB ILE A 15 79.090 7.450 -2.272 1.00 0.00 H new ATOM 0 HG12 ILE A 15 80.262 5.340 -2.180 1.00 0.00 H new ATOM 0 HG13 ILE A 15 80.316 5.892 -3.842 1.00 0.00 H new ATOM 0 HG21 ILE A 15 80.134 8.245 -4.412 1.00 0.00 H new ATOM 0 HG22 ILE A 15 80.174 9.514 -3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 15 81.645 8.582 -3.534 1.00 0.00 H new ATOM 0 HD11 ILE A 15 82.531 5.043 -3.128 1.00 0.00 H new ATOM 0 HD12 ILE A 15 82.619 6.784 -3.486 1.00 0.00 H new ATOM 0 HD13 ILE A 15 82.564 6.224 -1.797 1.00 0.00 H new ATOM 230 N ALA A 16 80.757 10.209 -0.225 1.00 0.00 N ATOM 231 CA ALA A 16 80.101 11.468 0.226 1.00 0.00 C ATOM 232 C ALA A 16 79.905 12.394 -0.973 1.00 0.00 C ATOM 233 O ALA A 16 80.855 12.924 -1.519 1.00 0.00 O ATOM 234 CB ALA A 16 81.070 12.087 1.234 1.00 0.00 C ATOM 0 H ALA A 16 81.772 10.258 -0.309 1.00 0.00 H new ATOM 0 HA ALA A 16 79.121 11.296 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 16 80.654 13.021 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 16 81.223 11.396 2.063 1.00 0.00 H new ATOM 0 HB3 ALA A 16 82.024 12.286 0.746 1.00 0.00 H new ATOM 240 N CYS A 17 78.679 12.581 -1.388 1.00 0.00 N ATOM 241 CA CYS A 17 78.387 13.498 -2.529 1.00 0.00 C ATOM 242 C CYS A 17 78.014 14.880 -1.990 1.00 0.00 C ATOM 243 O CYS A 17 77.756 15.038 -0.810 1.00 0.00 O ATOM 244 CB CYS A 17 77.199 12.879 -3.276 1.00 0.00 C ATOM 245 SG CYS A 17 77.602 11.195 -3.823 1.00 0.00 S ATOM 0 H CYS A 17 77.859 12.132 -0.980 1.00 0.00 H new ATOM 0 HA CYS A 17 79.247 13.618 -3.188 1.00 0.00 H new ATOM 0 HB2 CYS A 17 76.324 12.857 -2.626 1.00 0.00 H new ATOM 0 HB3 CYS A 17 76.941 13.496 -4.137 1.00 0.00 H new ATOM 0 HG CYS A 17 76.583 10.687 -4.451 1.00 0.00 H new ATOM 251 N ASP A 18 77.983 15.878 -2.839 1.00 0.00 N ATOM 252 CA ASP A 18 77.678 17.267 -2.363 1.00 0.00 C ATOM 253 C ASP A 18 76.295 17.301 -1.693 1.00 0.00 C ATOM 254 O ASP A 18 75.543 16.349 -1.759 1.00 0.00 O ATOM 255 CB ASP A 18 77.705 18.153 -3.612 1.00 0.00 C ATOM 256 CG ASP A 18 79.113 18.156 -4.219 1.00 0.00 C ATOM 257 OD1 ASP A 18 80.066 18.000 -3.472 1.00 0.00 O ATOM 258 OD2 ASP A 18 79.213 18.315 -5.425 1.00 0.00 O ATOM 0 H ASP A 18 78.155 15.793 -3.841 1.00 0.00 H new ATOM 0 HA ASP A 18 78.399 17.613 -1.622 1.00 0.00 H new ATOM 0 HB2 ASP A 18 76.985 17.787 -4.344 1.00 0.00 H new ATOM 0 HB3 ASP A 18 77.409 19.170 -3.354 1.00 0.00 H new ATOM 263 N GLU A 19 75.965 18.393 -1.053 1.00 0.00 N ATOM 264 CA GLU A 19 74.800 18.401 -0.103 1.00 0.00 C ATOM 265 C GLU A 19 73.514 17.904 -0.776 1.00 0.00 C ATOM 266 O GLU A 19 72.690 17.267 -0.144 1.00 0.00 O ATOM 267 CB GLU A 19 74.638 19.862 0.325 1.00 0.00 C ATOM 268 CG GLU A 19 75.871 20.305 1.117 1.00 0.00 C ATOM 269 CD GLU A 19 75.669 21.734 1.621 1.00 0.00 C ATOM 270 OE1 GLU A 19 75.779 22.646 0.819 1.00 0.00 O ATOM 271 OE2 GLU A 19 75.405 21.893 2.802 1.00 0.00 O ATOM 0 H GLU A 19 76.451 19.285 -1.144 1.00 0.00 H new ATOM 0 HA GLU A 19 74.980 17.735 0.740 1.00 0.00 H new ATOM 0 HB2 GLU A 19 74.510 20.496 -0.552 1.00 0.00 H new ATOM 0 HB3 GLU A 19 73.742 19.976 0.935 1.00 0.00 H new ATOM 0 HG2 GLU A 19 76.037 19.632 1.958 1.00 0.00 H new ATOM 0 HG3 GLU A 19 76.759 20.253 0.487 1.00 0.00 H new ATOM 278 N VAL A 20 73.337 18.188 -2.043 1.00 0.00 N ATOM 279 CA VAL A 20 72.059 17.804 -2.729 1.00 0.00 C ATOM 280 C VAL A 20 72.035 16.292 -3.004 1.00 0.00 C ATOM 281 O VAL A 20 70.979 15.695 -3.114 1.00 0.00 O ATOM 282 CB VAL A 20 72.049 18.602 -4.041 1.00 0.00 C ATOM 283 CG1 VAL A 20 70.780 18.282 -4.838 1.00 0.00 C ATOM 284 CG2 VAL A 20 72.082 20.101 -3.729 1.00 0.00 C ATOM 0 H VAL A 20 74.018 18.667 -2.632 1.00 0.00 H new ATOM 0 HA VAL A 20 71.182 18.024 -2.120 1.00 0.00 H new ATOM 0 HB VAL A 20 72.925 18.328 -4.630 1.00 0.00 H new ATOM 0 HG11 VAL A 20 70.780 18.852 -5.767 1.00 0.00 H new ATOM 0 HG12 VAL A 20 70.753 17.216 -5.066 1.00 0.00 H new ATOM 0 HG13 VAL A 20 69.903 18.550 -4.249 1.00 0.00 H new ATOM 0 HG21 VAL A 20 72.075 20.667 -4.661 1.00 0.00 H new ATOM 0 HG22 VAL A 20 71.208 20.368 -3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 20 72.987 20.336 -3.169 1.00 0.00 H new ATOM 294 N LEU A 21 73.187 15.674 -3.115 1.00 0.00 N ATOM 295 CA LEU A 21 73.241 14.209 -3.407 1.00 0.00 C ATOM 296 C LEU A 21 73.268 13.374 -2.115 1.00 0.00 C ATOM 297 O LEU A 21 73.016 12.183 -2.142 1.00 0.00 O ATOM 298 CB LEU A 21 74.541 14.035 -4.185 1.00 0.00 C ATOM 299 CG LEU A 21 74.421 14.720 -5.550 1.00 0.00 C ATOM 300 CD1 LEU A 21 75.768 14.653 -6.272 1.00 0.00 C ATOM 301 CD2 LEU A 21 73.360 14.005 -6.391 1.00 0.00 C ATOM 0 H LEU A 21 74.096 16.125 -3.015 1.00 0.00 H new ATOM 0 HA LEU A 21 72.365 13.869 -3.959 1.00 0.00 H new ATOM 0 HB2 LEU A 21 75.372 14.463 -3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 21 74.758 12.975 -4.317 1.00 0.00 H new ATOM 0 HG LEU A 21 74.132 15.761 -5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 21 75.685 15.140 -7.244 1.00 0.00 H new ATOM 0 HD12 LEU A 21 76.526 15.161 -5.676 1.00 0.00 H new ATOM 0 HD13 LEU A 21 76.054 13.611 -6.412 1.00 0.00 H new ATOM 0 HD21 LEU A 21 73.275 14.493 -7.362 1.00 0.00 H new ATOM 0 HD22 LEU A 21 73.649 12.964 -6.532 1.00 0.00 H new ATOM 0 HD23 LEU A 21 72.399 14.048 -5.878 1.00 0.00 H new ATOM 313 N GLY A 22 73.567 13.983 -0.989 1.00 0.00 N ATOM 314 CA GLY A 22 73.618 13.221 0.298 1.00 0.00 C ATOM 315 C GLY A 22 74.744 12.182 0.256 1.00 0.00 C ATOM 316 O GLY A 22 75.736 12.354 -0.429 1.00 0.00 O ATOM 0 H GLY A 22 73.778 14.978 -0.908 1.00 0.00 H new ATOM 0 HA2 GLY A 22 73.778 13.908 1.129 1.00 0.00 H new ATOM 0 HA3 GLY A 22 72.663 12.726 0.473 1.00 0.00 H new ATOM 320 N VAL A 23 74.595 11.104 0.988 1.00 0.00 N ATOM 321 CA VAL A 23 75.692 10.086 1.075 1.00 0.00 C ATOM 322 C VAL A 23 75.125 8.682 0.859 1.00 0.00 C ATOM 323 O VAL A 23 74.050 8.366 1.334 1.00 0.00 O ATOM 324 CB VAL A 23 76.261 10.201 2.497 1.00 0.00 C ATOM 325 CG1 VAL A 23 77.458 9.254 2.649 1.00 0.00 C ATOM 326 CG2 VAL A 23 76.715 11.639 2.769 1.00 0.00 C ATOM 0 H VAL A 23 73.760 10.884 1.530 1.00 0.00 H new ATOM 0 HA VAL A 23 76.456 10.257 0.317 1.00 0.00 H new ATOM 0 HB VAL A 23 75.484 9.930 3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 23 77.861 9.336 3.658 1.00 0.00 H new ATOM 0 HG12 VAL A 23 77.136 8.228 2.470 1.00 0.00 H new ATOM 0 HG13 VAL A 23 78.229 9.523 1.927 1.00 0.00 H new ATOM 0 HG21 VAL A 23 77.117 11.709 3.780 1.00 0.00 H new ATOM 0 HG22 VAL A 23 77.487 11.919 2.052 1.00 0.00 H new ATOM 0 HG23 VAL A 23 75.865 12.314 2.669 1.00 0.00 H new ATOM 336 N PHE A 24 75.842 7.842 0.150 1.00 0.00 N ATOM 337 CA PHE A 24 75.423 6.411 0.041 1.00 0.00 C ATOM 338 C PHE A 24 76.615 5.488 0.314 1.00 0.00 C ATOM 339 O PHE A 24 77.758 5.888 0.210 1.00 0.00 O ATOM 340 CB PHE A 24 74.900 6.216 -1.391 1.00 0.00 C ATOM 341 CG PHE A 24 75.960 6.323 -2.469 1.00 0.00 C ATOM 342 CD1 PHE A 24 76.691 5.151 -2.856 1.00 0.00 C ATOM 343 CD2 PHE A 24 76.255 7.587 -3.085 1.00 0.00 C ATOM 344 CE1 PHE A 24 77.709 5.239 -3.863 1.00 0.00 C ATOM 345 CE2 PHE A 24 77.276 7.672 -4.089 1.00 0.00 C ATOM 346 CZ PHE A 24 78.000 6.499 -4.480 1.00 0.00 C ATOM 0 H PHE A 24 76.694 8.085 -0.355 1.00 0.00 H new ATOM 0 HA PHE A 24 74.652 6.166 0.772 1.00 0.00 H new ATOM 0 HB2 PHE A 24 74.427 5.237 -1.461 1.00 0.00 H new ATOM 0 HB3 PHE A 24 74.126 6.959 -1.586 1.00 0.00 H new ATOM 0 HD1 PHE A 24 76.475 4.202 -2.389 1.00 0.00 H new ATOM 0 HD2 PHE A 24 75.709 8.472 -2.793 1.00 0.00 H new ATOM 0 HE1 PHE A 24 78.256 4.355 -4.156 1.00 0.00 H new ATOM 0 HE2 PHE A 24 77.499 8.622 -4.551 1.00 0.00 H new ATOM 0 HZ PHE A 24 78.765 6.565 -5.240 1.00 0.00 H new ATOM 356 N GLN A 25 76.347 4.257 0.664 1.00 0.00 N ATOM 357 CA GLN A 25 77.443 3.271 0.899 1.00 0.00 C ATOM 358 C GLN A 25 77.078 1.937 0.245 1.00 0.00 C ATOM 359 O GLN A 25 75.919 1.564 0.198 1.00 0.00 O ATOM 360 CB GLN A 25 77.529 3.133 2.420 1.00 0.00 C ATOM 361 CG GLN A 25 77.905 4.488 3.030 1.00 0.00 C ATOM 362 CD GLN A 25 77.961 4.386 4.558 1.00 0.00 C ATOM 363 OE1 GLN A 25 77.933 3.305 5.116 1.00 0.00 O ATOM 364 NE2 GLN A 25 78.038 5.480 5.266 1.00 0.00 N ATOM 0 H GLN A 25 75.405 3.889 0.798 1.00 0.00 H new ATOM 0 HA GLN A 25 78.396 3.585 0.473 1.00 0.00 H new ATOM 0 HB2 GLN A 25 76.574 2.793 2.821 1.00 0.00 H new ATOM 0 HB3 GLN A 25 78.272 2.382 2.687 1.00 0.00 H new ATOM 0 HG2 GLN A 25 78.872 4.812 2.645 1.00 0.00 H new ATOM 0 HG3 GLN A 25 77.175 5.242 2.736 1.00 0.00 H new ATOM 0 HE21 GLN A 25 78.062 6.388 4.801 1.00 0.00 H new ATOM 0 HE22 GLN A 25 78.075 5.427 6.284 1.00 0.00 H new ATOM 373 N GLY A 26 78.054 1.222 -0.261 1.00 0.00 N ATOM 374 CA GLY A 26 77.756 -0.039 -1.004 1.00 0.00 C ATOM 375 C GLY A 26 79.059 -0.727 -1.409 1.00 0.00 C ATOM 376 O GLY A 26 80.132 -0.163 -1.291 1.00 0.00 O ATOM 0 H GLY A 26 79.044 1.459 -0.191 1.00 0.00 H new ATOM 0 HA2 GLY A 26 77.161 -0.706 -0.380 1.00 0.00 H new ATOM 0 HA3 GLY A 26 77.162 0.183 -1.890 1.00 0.00 H new ATOM 380 N LEU A 27 78.969 -1.945 -1.881 1.00 0.00 N ATOM 381 CA LEU A 27 80.167 -2.619 -2.463 1.00 0.00 C ATOM 382 C LEU A 27 80.254 -2.323 -3.961 1.00 0.00 C ATOM 383 O LEU A 27 79.269 -2.378 -4.673 1.00 0.00 O ATOM 384 CB LEU A 27 79.943 -4.113 -2.223 1.00 0.00 C ATOM 385 CG LEU A 27 80.021 -4.409 -0.725 1.00 0.00 C ATOM 386 CD1 LEU A 27 79.438 -5.796 -0.448 1.00 0.00 C ATOM 387 CD2 LEU A 27 81.486 -4.372 -0.273 1.00 0.00 C ATOM 0 H LEU A 27 78.115 -2.502 -1.888 1.00 0.00 H new ATOM 0 HA LEU A 27 81.097 -2.273 -2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 27 78.970 -4.412 -2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 27 80.694 -4.694 -2.758 1.00 0.00 H new ATOM 0 HG LEU A 27 79.451 -3.659 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 27 79.493 -6.007 0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 27 78.397 -5.824 -0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 27 80.008 -6.546 -0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 27 81.543 -4.583 0.795 1.00 0.00 H new ATOM 0 HD22 LEU A 27 82.055 -5.122 -0.822 1.00 0.00 H new ATOM 0 HD23 LEU A 27 81.903 -3.384 -0.470 1.00 0.00 H new ATOM 399 N ILE A 28 81.431 -2.010 -4.433 1.00 0.00 N ATOM 400 CA ILE A 28 81.599 -1.628 -5.871 1.00 0.00 C ATOM 401 C ILE A 28 81.313 -2.832 -6.776 1.00 0.00 C ATOM 402 O ILE A 28 81.733 -3.940 -6.503 1.00 0.00 O ATOM 403 CB ILE A 28 83.066 -1.180 -5.999 1.00 0.00 C ATOM 404 CG1 ILE A 28 83.303 0.033 -5.087 1.00 0.00 C ATOM 405 CG2 ILE A 28 83.389 -0.804 -7.454 1.00 0.00 C ATOM 406 CD1 ILE A 28 84.786 0.415 -5.106 1.00 0.00 C ATOM 0 H ILE A 28 82.290 -2.002 -3.883 1.00 0.00 H new ATOM 0 HA ILE A 28 80.910 -0.839 -6.173 1.00 0.00 H new ATOM 0 HB ILE A 28 83.717 -2.002 -5.701 1.00 0.00 H new ATOM 0 HG12 ILE A 28 82.697 0.875 -5.422 1.00 0.00 H new ATOM 0 HG13 ILE A 28 82.991 -0.200 -4.069 1.00 0.00 H new ATOM 0 HG21 ILE A 28 84.430 -0.490 -7.526 1.00 0.00 H new ATOM 0 HG22 ILE A 28 83.225 -1.668 -8.098 1.00 0.00 H new ATOM 0 HG23 ILE A 28 82.741 0.013 -7.771 1.00 0.00 H new ATOM 0 HD11 ILE A 28 84.948 1.276 -4.457 1.00 0.00 H new ATOM 0 HD12 ILE A 28 85.383 -0.425 -4.750 1.00 0.00 H new ATOM 0 HD13 ILE A 28 85.084 0.666 -6.124 1.00 0.00 H new ATOM 418 N LYS A 29 80.595 -2.613 -7.850 1.00 0.00 N ATOM 419 CA LYS A 29 80.372 -3.698 -8.850 1.00 0.00 C ATOM 420 C LYS A 29 81.154 -3.398 -10.132 1.00 0.00 C ATOM 421 O LYS A 29 81.547 -4.298 -10.852 1.00 0.00 O ATOM 422 CB LYS A 29 78.868 -3.688 -9.122 1.00 0.00 C ATOM 423 CG LYS A 29 78.514 -4.836 -10.067 1.00 0.00 C ATOM 424 CD LYS A 29 78.561 -6.161 -9.303 1.00 0.00 C ATOM 425 CE LYS A 29 78.168 -7.306 -10.239 1.00 0.00 C ATOM 426 NZ LYS A 29 77.481 -8.297 -9.366 1.00 0.00 N ATOM 0 H LYS A 29 80.152 -1.723 -8.076 1.00 0.00 H new ATOM 0 HA LYS A 29 80.711 -4.669 -8.489 1.00 0.00 H new ATOM 0 HB2 LYS A 29 78.318 -3.790 -8.187 1.00 0.00 H new ATOM 0 HB3 LYS A 29 78.574 -2.736 -9.563 1.00 0.00 H new ATOM 0 HG2 LYS A 29 77.520 -4.682 -10.487 1.00 0.00 H new ATOM 0 HG3 LYS A 29 79.213 -4.861 -10.903 1.00 0.00 H new ATOM 0 HD2 LYS A 29 79.562 -6.329 -8.907 1.00 0.00 H new ATOM 0 HD3 LYS A 29 77.883 -6.125 -8.450 1.00 0.00 H new ATOM 0 HE2 LYS A 29 77.510 -6.957 -11.035 1.00 0.00 H new ATOM 0 HE3 LYS A 29 79.044 -7.743 -10.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 77.181 -9.113 -9.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 78.134 -8.616 -8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 76.647 -7.855 -8.929 1.00 0.00 H new ATOM 440 N GLN A 30 81.381 -2.137 -10.420 1.00 0.00 N ATOM 441 CA GLN A 30 82.147 -1.765 -11.647 1.00 0.00 C ATOM 442 C GLN A 30 82.719 -0.354 -11.493 1.00 0.00 C ATOM 443 O GLN A 30 82.122 0.495 -10.859 1.00 0.00 O ATOM 444 CB GLN A 30 81.128 -1.814 -12.786 1.00 0.00 C ATOM 445 CG GLN A 30 81.838 -1.569 -14.119 1.00 0.00 C ATOM 446 CD GLN A 30 80.802 -1.484 -15.242 1.00 0.00 C ATOM 447 OE1 GLN A 30 79.929 -0.640 -15.215 1.00 0.00 O ATOM 448 NE2 GLN A 30 80.862 -2.329 -16.234 1.00 0.00 N ATOM 0 H GLN A 30 81.066 -1.349 -9.854 1.00 0.00 H new ATOM 0 HA GLN A 30 82.988 -2.434 -11.832 1.00 0.00 H new ATOM 0 HB2 GLN A 30 80.630 -2.783 -12.800 1.00 0.00 H new ATOM 0 HB3 GLN A 30 80.356 -1.061 -12.630 1.00 0.00 H new ATOM 0 HG2 GLN A 30 82.415 -0.645 -14.071 1.00 0.00 H new ATOM 0 HG3 GLN A 30 82.543 -2.375 -14.321 1.00 0.00 H new ATOM 0 HE21 GLN A 30 81.595 -3.038 -16.257 1.00 0.00 H new ATOM 0 HE22 GLN A 30 80.176 -2.281 -16.987 1.00 0.00 H new ATOM 457 N ILE A 31 83.870 -0.101 -12.067 1.00 0.00 N ATOM 458 CA ILE A 31 84.504 1.248 -11.930 1.00 0.00 C ATOM 459 C ILE A 31 85.086 1.692 -13.274 1.00 0.00 C ATOM 460 O ILE A 31 85.695 0.917 -13.988 1.00 0.00 O ATOM 461 CB ILE A 31 85.611 1.090 -10.875 1.00 0.00 C ATOM 462 CG1 ILE A 31 84.995 0.615 -9.551 1.00 0.00 C ATOM 463 CG2 ILE A 31 86.320 2.436 -10.658 1.00 0.00 C ATOM 464 CD1 ILE A 31 86.101 0.360 -8.522 1.00 0.00 C ATOM 0 H ILE A 31 84.399 -0.771 -12.625 1.00 0.00 H new ATOM 0 HA ILE A 31 83.783 2.008 -11.628 1.00 0.00 H new ATOM 0 HB ILE A 31 86.336 0.355 -11.224 1.00 0.00 H new ATOM 0 HG12 ILE A 31 84.301 1.366 -9.173 1.00 0.00 H new ATOM 0 HG13 ILE A 31 84.421 -0.297 -9.714 1.00 0.00 H new ATOM 0 HG21 ILE A 31 87.103 2.318 -9.909 1.00 0.00 H new ATOM 0 HG22 ILE A 31 86.762 2.770 -11.597 1.00 0.00 H new ATOM 0 HG23 ILE A 31 85.598 3.176 -10.314 1.00 0.00 H new ATOM 0 HD11 ILE A 31 85.656 0.023 -7.586 1.00 0.00 H new ATOM 0 HD12 ILE A 31 86.778 -0.407 -8.898 1.00 0.00 H new ATOM 0 HD13 ILE A 31 86.657 1.282 -8.349 1.00 0.00 H new ATOM 476 N SER A 32 84.896 2.941 -13.616 1.00 0.00 N ATOM 477 CA SER A 32 85.525 3.502 -14.846 1.00 0.00 C ATOM 478 C SER A 32 85.876 4.970 -14.611 1.00 0.00 C ATOM 479 O SER A 32 85.312 5.618 -13.750 1.00 0.00 O ATOM 480 CB SER A 32 84.468 3.367 -15.940 1.00 0.00 C ATOM 481 OG SER A 32 83.360 4.201 -15.626 1.00 0.00 O ATOM 0 H SER A 32 84.325 3.602 -13.088 1.00 0.00 H new ATOM 0 HA SER A 32 86.445 2.985 -15.119 1.00 0.00 H new ATOM 0 HB2 SER A 32 84.889 3.649 -16.905 1.00 0.00 H new ATOM 0 HB3 SER A 32 84.145 2.329 -16.024 1.00 0.00 H new ATOM 0 HG SER A 32 82.680 4.119 -16.327 1.00 0.00 H new ATOM 487 N ALA A 33 86.794 5.503 -15.378 1.00 0.00 N ATOM 488 CA ALA A 33 87.333 6.873 -15.083 1.00 0.00 C ATOM 489 C ALA A 33 86.207 7.914 -15.006 1.00 0.00 C ATOM 490 O ALA A 33 86.358 8.946 -14.376 1.00 0.00 O ATOM 491 CB ALA A 33 88.274 7.197 -16.245 1.00 0.00 C ATOM 0 H ALA A 33 87.196 5.050 -16.198 1.00 0.00 H new ATOM 0 HA ALA A 33 87.841 6.897 -14.119 1.00 0.00 H new ATOM 0 HB1 ALA A 33 88.707 8.187 -16.098 1.00 0.00 H new ATOM 0 HB2 ALA A 33 89.071 6.455 -16.285 1.00 0.00 H new ATOM 0 HB3 ALA A 33 87.715 7.181 -17.181 1.00 0.00 H new ATOM 497 N GLU A 34 85.086 7.654 -15.637 1.00 0.00 N ATOM 498 CA GLU A 34 84.005 8.687 -15.710 1.00 0.00 C ATOM 499 C GLU A 34 83.002 8.523 -14.559 1.00 0.00 C ATOM 500 O GLU A 34 82.360 9.477 -14.158 1.00 0.00 O ATOM 501 CB GLU A 34 83.321 8.452 -17.059 1.00 0.00 C ATOM 502 CG GLU A 34 84.317 8.714 -18.196 1.00 0.00 C ATOM 503 CD GLU A 34 84.760 10.185 -18.190 1.00 0.00 C ATOM 504 OE1 GLU A 34 84.031 11.011 -17.663 1.00 0.00 O ATOM 505 OE2 GLU A 34 85.827 10.458 -18.714 1.00 0.00 O ATOM 0 H GLU A 34 84.874 6.772 -16.104 1.00 0.00 H new ATOM 0 HA GLU A 34 84.406 9.697 -15.622 1.00 0.00 H new ATOM 0 HB2 GLU A 34 82.950 7.429 -17.116 1.00 0.00 H new ATOM 0 HB3 GLU A 34 82.458 9.110 -17.160 1.00 0.00 H new ATOM 0 HG2 GLU A 34 85.186 8.065 -18.084 1.00 0.00 H new ATOM 0 HG3 GLU A 34 83.858 8.469 -19.154 1.00 0.00 H new ATOM 512 N GLU A 35 82.862 7.331 -14.027 1.00 0.00 N ATOM 513 CA GLU A 35 81.782 7.079 -13.020 1.00 0.00 C ATOM 514 C GLU A 35 82.131 5.882 -12.125 1.00 0.00 C ATOM 515 O GLU A 35 82.908 5.022 -12.496 1.00 0.00 O ATOM 516 CB GLU A 35 80.520 6.800 -13.845 1.00 0.00 C ATOM 517 CG GLU A 35 80.739 5.582 -14.750 1.00 0.00 C ATOM 518 CD GLU A 35 79.522 5.393 -15.657 1.00 0.00 C ATOM 519 OE1 GLU A 35 79.139 6.351 -16.308 1.00 0.00 O ATOM 520 OE2 GLU A 35 78.994 4.293 -15.685 1.00 0.00 O ATOM 0 H GLU A 35 83.447 6.525 -14.246 1.00 0.00 H new ATOM 0 HA GLU A 35 81.648 7.928 -12.349 1.00 0.00 H new ATOM 0 HB2 GLU A 35 79.674 6.622 -13.181 1.00 0.00 H new ATOM 0 HB3 GLU A 35 80.272 7.672 -14.450 1.00 0.00 H new ATOM 0 HG2 GLU A 35 81.637 5.720 -15.353 1.00 0.00 H new ATOM 0 HG3 GLU A 35 80.896 4.690 -14.144 1.00 0.00 H new ATOM 527 N ILE A 36 81.557 5.829 -10.949 1.00 0.00 N ATOM 528 CA ILE A 36 81.699 4.614 -10.084 1.00 0.00 C ATOM 529 C ILE A 36 80.332 3.941 -9.915 1.00 0.00 C ATOM 530 O ILE A 36 79.328 4.610 -9.750 1.00 0.00 O ATOM 531 CB ILE A 36 82.212 5.134 -8.732 1.00 0.00 C ATOM 532 CG1 ILE A 36 83.533 5.907 -8.918 1.00 0.00 C ATOM 533 CG2 ILE A 36 82.440 3.954 -7.783 1.00 0.00 C ATOM 534 CD1 ILE A 36 84.602 5.007 -9.557 1.00 0.00 C ATOM 0 H ILE A 36 80.993 6.578 -10.548 1.00 0.00 H new ATOM 0 HA ILE A 36 82.377 3.876 -10.513 1.00 0.00 H new ATOM 0 HB ILE A 36 81.467 5.808 -8.310 1.00 0.00 H new ATOM 0 HG12 ILE A 36 83.363 6.781 -9.546 1.00 0.00 H new ATOM 0 HG13 ILE A 36 83.886 6.271 -7.953 1.00 0.00 H new ATOM 0 HG21 ILE A 36 82.804 4.323 -6.824 1.00 0.00 H new ATOM 0 HG22 ILE A 36 81.501 3.420 -7.634 1.00 0.00 H new ATOM 0 HG23 ILE A 36 83.177 3.277 -8.215 1.00 0.00 H new ATOM 0 HD11 ILE A 36 85.527 5.571 -9.680 1.00 0.00 H new ATOM 0 HD12 ILE A 36 84.785 4.146 -8.914 1.00 0.00 H new ATOM 0 HD13 ILE A 36 84.254 4.664 -10.531 1.00 0.00 H new ATOM 546 N THR A 37 80.287 2.628 -9.956 1.00 0.00 N ATOM 547 CA THR A 37 78.975 1.915 -9.863 1.00 0.00 C ATOM 548 C THR A 37 79.009 0.877 -8.733 1.00 0.00 C ATOM 549 O THR A 37 79.949 0.114 -8.612 1.00 0.00 O ATOM 550 CB THR A 37 78.806 1.223 -11.217 1.00 0.00 C ATOM 551 OG1 THR A 37 78.880 2.193 -12.254 1.00 0.00 O ATOM 552 CG2 THR A 37 77.449 0.518 -11.271 1.00 0.00 C ATOM 0 H THR A 37 81.102 2.022 -10.050 1.00 0.00 H new ATOM 0 HA THR A 37 78.152 2.595 -9.643 1.00 0.00 H new ATOM 0 HB THR A 37 79.598 0.486 -11.349 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.774 1.752 -13.123 1.00 0.00 H new ATOM 0 HG21 THR A 37 77.333 0.026 -12.237 1.00 0.00 H new ATOM 0 HG22 THR A 37 77.394 -0.226 -10.476 1.00 0.00 H new ATOM 0 HG23 THR A 37 76.653 1.251 -11.138 1.00 0.00 H new ATOM 560 N ILE A 38 77.985 0.844 -7.913 1.00 0.00 N ATOM 561 CA ILE A 38 77.950 -0.124 -6.765 1.00 0.00 C ATOM 562 C ILE A 38 76.572 -0.794 -6.678 1.00 0.00 C ATOM 563 O ILE A 38 75.653 -0.434 -7.387 1.00 0.00 O ATOM 564 CB ILE A 38 78.210 0.691 -5.489 1.00 0.00 C ATOM 565 CG1 ILE A 38 77.200 1.844 -5.400 1.00 0.00 C ATOM 566 CG2 ILE A 38 79.641 1.247 -5.495 1.00 0.00 C ATOM 567 CD1 ILE A 38 76.923 2.176 -3.935 1.00 0.00 C ATOM 0 H ILE A 38 77.167 1.448 -7.988 1.00 0.00 H new ATOM 0 HA ILE A 38 78.697 -0.907 -6.895 1.00 0.00 H new ATOM 0 HB ILE A 38 78.093 0.041 -4.622 1.00 0.00 H new ATOM 0 HG12 ILE A 38 77.590 2.722 -5.914 1.00 0.00 H new ATOM 0 HG13 ILE A 38 76.273 1.567 -5.901 1.00 0.00 H new ATOM 0 HG21 ILE A 38 79.812 1.822 -4.585 1.00 0.00 H new ATOM 0 HG22 ILE A 38 80.352 0.422 -5.541 1.00 0.00 H new ATOM 0 HG23 ILE A 38 79.777 1.892 -6.363 1.00 0.00 H new ATOM 0 HD11 ILE A 38 76.206 2.995 -3.877 1.00 0.00 H new ATOM 0 HD12 ILE A 38 76.514 1.299 -3.434 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.852 2.472 -3.447 1.00 0.00 H new ATOM 579 N VAL A 39 76.432 -1.761 -5.805 1.00 0.00 N ATOM 580 CA VAL A 39 75.139 -2.513 -5.697 1.00 0.00 C ATOM 581 C VAL A 39 74.636 -2.519 -4.247 1.00 0.00 C ATOM 582 O VAL A 39 75.375 -2.233 -3.326 1.00 0.00 O ATOM 583 CB VAL A 39 75.448 -3.937 -6.175 1.00 0.00 C ATOM 584 CG1 VAL A 39 75.901 -3.891 -7.634 1.00 0.00 C ATOM 585 CG2 VAL A 39 76.559 -4.550 -5.315 1.00 0.00 C ATOM 0 H VAL A 39 77.160 -2.065 -5.159 1.00 0.00 H new ATOM 0 HA VAL A 39 74.353 -2.053 -6.296 1.00 0.00 H new ATOM 0 HB VAL A 39 74.550 -4.549 -6.085 1.00 0.00 H new ATOM 0 HG11 VAL A 39 76.122 -4.901 -7.978 1.00 0.00 H new ATOM 0 HG12 VAL A 39 75.108 -3.464 -8.248 1.00 0.00 H new ATOM 0 HG13 VAL A 39 76.797 -3.275 -7.718 1.00 0.00 H new ATOM 0 HG21 VAL A 39 76.772 -5.561 -5.662 1.00 0.00 H new ATOM 0 HG22 VAL A 39 77.460 -3.942 -5.396 1.00 0.00 H new ATOM 0 HG23 VAL A 39 76.237 -4.584 -4.274 1.00 0.00 H new ATOM 595 N ARG A 40 73.375 -2.839 -4.045 1.00 0.00 N ATOM 596 CA ARG A 40 72.763 -2.776 -2.671 1.00 0.00 C ATOM 597 C ARG A 40 72.915 -1.369 -2.088 1.00 0.00 C ATOM 598 O ARG A 40 73.626 -1.154 -1.123 1.00 0.00 O ATOM 599 CB ARG A 40 73.507 -3.811 -1.812 1.00 0.00 C ATOM 600 CG ARG A 40 73.382 -5.195 -2.452 1.00 0.00 C ATOM 601 CD ARG A 40 71.921 -5.647 -2.413 1.00 0.00 C ATOM 602 NE ARG A 40 71.937 -7.047 -2.941 1.00 0.00 N ATOM 603 CZ ARG A 40 72.083 -7.304 -4.230 1.00 0.00 C ATOM 604 NH1 ARG A 40 72.224 -6.345 -5.120 1.00 0.00 N ATOM 605 NH2 ARG A 40 72.087 -8.546 -4.631 1.00 0.00 N ATOM 0 H ARG A 40 72.737 -3.144 -4.780 1.00 0.00 H new ATOM 0 HA ARG A 40 71.696 -2.996 -2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 40 74.558 -3.535 -1.721 1.00 0.00 H new ATOM 0 HB3 ARG A 40 73.093 -3.827 -0.804 1.00 0.00 H new ATOM 0 HG2 ARG A 40 73.736 -5.164 -3.482 1.00 0.00 H new ATOM 0 HG3 ARG A 40 74.009 -5.911 -1.921 1.00 0.00 H new ATOM 0 HD2 ARG A 40 71.523 -5.612 -1.399 1.00 0.00 H new ATOM 0 HD3 ARG A 40 71.291 -5.001 -3.025 1.00 0.00 H new ATOM 0 HE ARG A 40 71.832 -7.824 -2.289 1.00 0.00 H new ATOM 0 HH11 ARG A 40 72.223 -5.369 -4.823 1.00 0.00 H new ATOM 0 HH12 ARG A 40 72.335 -6.577 -6.107 1.00 0.00 H new ATOM 0 HH21 ARG A 40 71.979 -9.301 -3.954 1.00 0.00 H new ATOM 0 HH22 ARG A 40 72.199 -8.762 -5.622 1.00 0.00 H new ATOM 619 N ALA A 41 72.243 -0.412 -2.677 1.00 0.00 N ATOM 620 CA ALA A 41 72.424 1.017 -2.264 1.00 0.00 C ATOM 621 C ALA A 41 71.869 1.270 -0.858 1.00 0.00 C ATOM 622 O ALA A 41 70.709 1.020 -0.580 1.00 0.00 O ATOM 623 CB ALA A 41 71.629 1.830 -3.288 1.00 0.00 C ATOM 0 H ALA A 41 71.572 -0.558 -3.431 1.00 0.00 H new ATOM 0 HA ALA A 41 73.479 1.288 -2.235 1.00 0.00 H new ATOM 0 HB1 ALA A 41 71.712 2.891 -3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 41 72.027 1.647 -4.286 1.00 0.00 H new ATOM 0 HB3 ALA A 41 70.581 1.532 -3.255 1.00 0.00 H new ATOM 629 N PHE A 42 72.694 1.767 0.028 1.00 0.00 N ATOM 630 CA PHE A 42 72.176 2.325 1.313 1.00 0.00 C ATOM 631 C PHE A 42 72.461 3.828 1.363 1.00 0.00 C ATOM 632 O PHE A 42 73.563 4.259 1.091 1.00 0.00 O ATOM 633 CB PHE A 42 72.934 1.589 2.421 1.00 0.00 C ATOM 634 CG PHE A 42 72.250 0.322 2.892 1.00 0.00 C ATOM 635 CD1 PHE A 42 72.374 -0.899 2.142 1.00 0.00 C ATOM 636 CD2 PHE A 42 71.476 0.343 4.101 1.00 0.00 C ATOM 637 CE1 PHE A 42 71.722 -2.092 2.602 1.00 0.00 C ATOM 638 CE2 PHE A 42 70.826 -0.851 4.559 1.00 0.00 C ATOM 639 CZ PHE A 42 70.949 -2.068 3.810 1.00 0.00 C ATOM 0 H PHE A 42 73.707 1.810 -0.084 1.00 0.00 H new ATOM 0 HA PHE A 42 71.100 2.191 1.422 1.00 0.00 H new ATOM 0 HB2 PHE A 42 73.932 1.340 2.062 1.00 0.00 H new ATOM 0 HB3 PHE A 42 73.059 2.260 3.270 1.00 0.00 H new ATOM 0 HD1 PHE A 42 72.957 -0.918 1.233 1.00 0.00 H new ATOM 0 HD2 PHE A 42 71.383 1.259 4.666 1.00 0.00 H new ATOM 0 HE1 PHE A 42 71.813 -3.009 2.038 1.00 0.00 H new ATOM 0 HE2 PHE A 42 70.244 -0.834 5.468 1.00 0.00 H new ATOM 0 HZ PHE A 42 70.459 -2.966 4.156 1.00 0.00 H new ATOM 649 N ARG A 43 71.480 4.625 1.709 1.00 0.00 N ATOM 650 CA ARG A 43 71.663 6.109 1.683 1.00 0.00 C ATOM 651 C ARG A 43 71.096 6.732 2.960 1.00 0.00 C ATOM 652 O ARG A 43 70.095 6.284 3.484 1.00 0.00 O ATOM 653 CB ARG A 43 70.876 6.583 0.463 1.00 0.00 C ATOM 654 CG ARG A 43 71.113 8.081 0.250 1.00 0.00 C ATOM 655 CD ARG A 43 70.353 8.547 -0.995 1.00 0.00 C ATOM 656 NE ARG A 43 68.906 8.497 -0.613 1.00 0.00 N ATOM 657 CZ ARG A 43 67.990 9.197 -1.262 1.00 0.00 C ATOM 658 NH1 ARG A 43 68.297 9.975 -2.277 1.00 0.00 N ATOM 659 NH2 ARG A 43 66.743 9.112 -0.885 1.00 0.00 N ATOM 0 H ARG A 43 70.557 4.310 2.009 1.00 0.00 H new ATOM 0 HA ARG A 43 72.713 6.395 1.627 1.00 0.00 H new ATOM 0 HB2 ARG A 43 71.186 6.026 -0.421 1.00 0.00 H new ATOM 0 HB3 ARG A 43 69.813 6.389 0.605 1.00 0.00 H new ATOM 0 HG2 ARG A 43 70.779 8.641 1.124 1.00 0.00 H new ATOM 0 HG3 ARG A 43 72.179 8.278 0.134 1.00 0.00 H new ATOM 0 HD2 ARG A 43 70.650 9.556 -1.283 1.00 0.00 H new ATOM 0 HD3 ARG A 43 70.558 7.899 -1.847 1.00 0.00 H new ATOM 0 HE ARG A 43 68.619 7.908 0.168 1.00 0.00 H new ATOM 0 HH11 ARG A 43 69.266 10.052 -2.586 1.00 0.00 H new ATOM 0 HH12 ARG A 43 67.566 10.501 -2.756 1.00 0.00 H new ATOM 0 HH21 ARG A 43 66.487 8.512 -0.101 1.00 0.00 H new ATOM 0 HH22 ARG A 43 66.025 9.645 -1.375 1.00 0.00 H new ATOM 673 N ASN A 44 71.732 7.761 3.468 1.00 0.00 N ATOM 674 CA ASN A 44 71.223 8.453 4.705 1.00 0.00 C ATOM 675 C ASN A 44 70.979 7.447 5.842 1.00 0.00 C ATOM 676 O ASN A 44 70.007 7.543 6.569 1.00 0.00 O ATOM 677 CB ASN A 44 69.907 9.123 4.291 1.00 0.00 C ATOM 678 CG ASN A 44 70.165 10.110 3.147 1.00 0.00 C ATOM 679 OD1 ASN A 44 69.434 10.135 2.176 1.00 0.00 O ATOM 680 ND2 ASN A 44 71.178 10.929 3.221 1.00 0.00 N ATOM 0 H ASN A 44 72.588 8.157 3.079 1.00 0.00 H new ATOM 0 HA ASN A 44 71.948 9.176 5.081 1.00 0.00 H new ATOM 0 HB2 ASN A 44 69.187 8.368 3.977 1.00 0.00 H new ATOM 0 HB3 ASN A 44 69.470 9.645 5.142 1.00 0.00 H new ATOM 0 HD21 ASN A 44 71.356 11.590 2.464 1.00 0.00 H new ATOM 0 HD22 ASN A 44 71.792 10.909 4.035 1.00 0.00 H new ATOM 687 N GLY A 45 71.857 6.486 5.993 1.00 0.00 N ATOM 688 CA GLY A 45 71.751 5.525 7.134 1.00 0.00 C ATOM 689 C GLY A 45 70.443 4.725 7.062 1.00 0.00 C ATOM 690 O GLY A 45 69.979 4.207 8.062 1.00 0.00 O ATOM 0 H GLY A 45 72.648 6.325 5.370 1.00 0.00 H new ATOM 0 HA2 GLY A 45 72.600 4.842 7.118 1.00 0.00 H new ATOM 0 HA3 GLY A 45 71.797 6.069 8.077 1.00 0.00 H new ATOM 694 N VAL A 46 69.845 4.620 5.897 1.00 0.00 N ATOM 695 CA VAL A 46 68.637 3.749 5.743 1.00 0.00 C ATOM 696 C VAL A 46 68.667 3.051 4.365 1.00 0.00 C ATOM 697 O VAL A 46 69.233 3.581 3.430 1.00 0.00 O ATOM 698 CB VAL A 46 67.444 4.708 5.872 1.00 0.00 C ATOM 699 CG1 VAL A 46 66.127 3.973 5.590 1.00 0.00 C ATOM 700 CG2 VAL A 46 67.409 5.254 7.297 1.00 0.00 C ATOM 0 H VAL A 46 70.142 5.100 5.048 1.00 0.00 H new ATOM 0 HA VAL A 46 68.585 2.954 6.486 1.00 0.00 H new ATOM 0 HB VAL A 46 67.557 5.517 5.150 1.00 0.00 H new ATOM 0 HG11 VAL A 46 65.294 4.669 5.686 1.00 0.00 H new ATOM 0 HG12 VAL A 46 66.146 3.568 4.578 1.00 0.00 H new ATOM 0 HG13 VAL A 46 66.004 3.159 6.305 1.00 0.00 H new ATOM 0 HG21 VAL A 46 66.566 5.937 7.404 1.00 0.00 H new ATOM 0 HG22 VAL A 46 67.299 4.429 8.000 1.00 0.00 H new ATOM 0 HG23 VAL A 46 68.337 5.787 7.505 1.00 0.00 H new ATOM 710 N PRO A 47 68.060 1.880 4.272 1.00 0.00 N ATOM 711 CA PRO A 47 68.137 1.098 3.012 1.00 0.00 C ATOM 712 C PRO A 47 67.295 1.762 1.916 1.00 0.00 C ATOM 713 O PRO A 47 66.176 2.180 2.154 1.00 0.00 O ATOM 714 CB PRO A 47 67.561 -0.277 3.381 1.00 0.00 C ATOM 715 CG PRO A 47 67.362 -0.261 4.868 1.00 0.00 C ATOM 716 CD PRO A 47 67.261 1.177 5.286 1.00 0.00 C ATOM 0 HA PRO A 47 69.153 1.031 2.623 1.00 0.00 H new ATOM 0 HB2 PRO A 47 66.618 -0.456 2.864 1.00 0.00 H new ATOM 0 HB3 PRO A 47 68.242 -1.076 3.088 1.00 0.00 H new ATOM 0 HG2 PRO A 47 66.458 -0.806 5.141 1.00 0.00 H new ATOM 0 HG3 PRO A 47 68.194 -0.751 5.373 1.00 0.00 H new ATOM 0 HD2 PRO A 47 66.227 1.522 5.294 1.00 0.00 H new ATOM 0 HD3 PRO A 47 67.657 1.333 6.290 1.00 0.00 H new ATOM 724 N LEU A 48 67.828 1.860 0.720 1.00 0.00 N ATOM 725 CA LEU A 48 67.032 2.412 -0.420 1.00 0.00 C ATOM 726 C LEU A 48 66.067 1.354 -0.957 1.00 0.00 C ATOM 727 O LEU A 48 66.343 0.170 -0.907 1.00 0.00 O ATOM 728 CB LEU A 48 68.062 2.786 -1.489 1.00 0.00 C ATOM 729 CG LEU A 48 68.969 3.901 -0.963 1.00 0.00 C ATOM 730 CD1 LEU A 48 70.081 4.180 -1.980 1.00 0.00 C ATOM 731 CD2 LEU A 48 68.141 5.174 -0.747 1.00 0.00 C ATOM 0 H LEU A 48 68.781 1.581 0.486 1.00 0.00 H new ATOM 0 HA LEU A 48 66.430 3.269 -0.118 1.00 0.00 H new ATOM 0 HB2 LEU A 48 68.659 1.913 -1.754 1.00 0.00 H new ATOM 0 HB3 LEU A 48 67.556 3.114 -2.397 1.00 0.00 H new ATOM 0 HG LEU A 48 69.413 3.591 -0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 48 70.726 4.974 -1.605 1.00 0.00 H new ATOM 0 HD12 LEU A 48 70.670 3.276 -2.133 1.00 0.00 H new ATOM 0 HD13 LEU A 48 69.639 4.489 -2.927 1.00 0.00 H new ATOM 0 HD21 LEU A 48 68.786 5.969 -0.372 1.00 0.00 H new ATOM 0 HD22 LEU A 48 67.696 5.483 -1.693 1.00 0.00 H new ATOM 0 HD23 LEU A 48 67.351 4.976 -0.022 1.00 0.00 H new ATOM 743 N ARG A 49 64.935 1.777 -1.468 1.00 0.00 N ATOM 744 CA ARG A 49 63.989 0.811 -2.116 1.00 0.00 C ATOM 745 C ARG A 49 64.673 0.134 -3.307 1.00 0.00 C ATOM 746 O ARG A 49 65.566 0.693 -3.915 1.00 0.00 O ATOM 747 CB ARG A 49 62.801 1.655 -2.587 1.00 0.00 C ATOM 748 CG ARG A 49 62.093 2.262 -1.375 1.00 0.00 C ATOM 749 CD ARG A 49 60.841 3.012 -1.837 1.00 0.00 C ATOM 750 NE ARG A 49 60.350 3.731 -0.619 1.00 0.00 N ATOM 751 CZ ARG A 49 59.677 3.108 0.333 1.00 0.00 C ATOM 752 NH1 ARG A 49 59.402 1.822 0.266 1.00 0.00 N ATOM 753 NH2 ARG A 49 59.275 3.788 1.372 1.00 0.00 N ATOM 0 H ARG A 49 64.625 2.749 -1.465 1.00 0.00 H new ATOM 0 HA ARG A 49 63.673 0.023 -1.433 1.00 0.00 H new ATOM 0 HB2 ARG A 49 63.145 2.446 -3.254 1.00 0.00 H new ATOM 0 HB3 ARG A 49 62.106 1.038 -3.156 1.00 0.00 H new ATOM 0 HG2 ARG A 49 61.820 1.477 -0.669 1.00 0.00 H new ATOM 0 HG3 ARG A 49 62.765 2.942 -0.851 1.00 0.00 H new ATOM 0 HD2 ARG A 49 61.073 3.710 -2.641 1.00 0.00 H new ATOM 0 HD3 ARG A 49 60.087 2.324 -2.220 1.00 0.00 H new ATOM 0 HE ARG A 49 60.540 4.728 -0.521 1.00 0.00 H new ATOM 0 HH11 ARG A 49 59.711 1.276 -0.538 1.00 0.00 H new ATOM 0 HH12 ARG A 49 58.880 1.372 1.018 1.00 0.00 H new ATOM 0 HH21 ARG A 49 59.481 4.785 1.440 1.00 0.00 H new ATOM 0 HH22 ARG A 49 58.754 3.323 2.116 1.00 0.00 H new ATOM 767 N LYS A 50 64.261 -1.068 -3.643 1.00 0.00 N ATOM 768 CA LYS A 50 64.914 -1.824 -4.769 1.00 0.00 C ATOM 769 C LYS A 50 66.420 -1.965 -4.513 1.00 0.00 C ATOM 770 O LYS A 50 67.238 -1.500 -5.282 1.00 0.00 O ATOM 771 CB LYS A 50 64.651 -1.014 -6.050 1.00 0.00 C ATOM 772 CG LYS A 50 63.143 -0.817 -6.241 1.00 0.00 C ATOM 773 CD LYS A 50 62.474 -2.173 -6.473 1.00 0.00 C ATOM 774 CE LYS A 50 61.000 -1.962 -6.826 1.00 0.00 C ATOM 775 NZ LYS A 50 60.615 -3.171 -7.605 1.00 0.00 N ATOM 0 H LYS A 50 63.496 -1.563 -3.184 1.00 0.00 H new ATOM 0 HA LYS A 50 64.509 -2.832 -4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 50 65.148 -0.046 -5.987 1.00 0.00 H new ATOM 0 HB3 LYS A 50 65.071 -1.533 -6.912 1.00 0.00 H new ATOM 0 HG2 LYS A 50 62.715 -0.334 -5.362 1.00 0.00 H new ATOM 0 HG3 LYS A 50 62.957 -0.158 -7.089 1.00 0.00 H new ATOM 0 HD2 LYS A 50 62.979 -2.706 -7.278 1.00 0.00 H new ATOM 0 HD3 LYS A 50 62.560 -2.790 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 50 60.390 -1.859 -5.929 1.00 0.00 H new ATOM 0 HE3 LYS A 50 60.860 -1.054 -7.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 59.616 -3.101 -7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 61.208 -3.239 -8.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 60.752 -4.019 -7.019 1.00 0.00 H new ATOM 789 N GLN A 51 66.783 -2.610 -3.428 1.00 0.00 N ATOM 790 CA GLN A 51 68.234 -2.759 -3.074 1.00 0.00 C ATOM 791 C GLN A 51 69.010 -3.420 -4.220 1.00 0.00 C ATOM 792 O GLN A 51 70.201 -3.218 -4.369 1.00 0.00 O ATOM 793 CB GLN A 51 68.260 -3.652 -1.831 1.00 0.00 C ATOM 794 CG GLN A 51 67.587 -2.923 -0.663 1.00 0.00 C ATOM 795 CD GLN A 51 67.564 -3.833 0.570 1.00 0.00 C ATOM 796 OE1 GLN A 51 67.660 -5.038 0.455 1.00 0.00 O ATOM 797 NE2 GLN A 51 67.439 -3.299 1.754 1.00 0.00 N ATOM 0 H GLN A 51 66.135 -3.042 -2.769 1.00 0.00 H new ATOM 0 HA GLN A 51 68.703 -1.792 -2.893 1.00 0.00 H new ATOM 0 HB2 GLN A 51 67.744 -4.590 -2.034 1.00 0.00 H new ATOM 0 HB3 GLN A 51 69.289 -3.903 -1.572 1.00 0.00 H new ATOM 0 HG2 GLN A 51 68.126 -2.003 -0.438 1.00 0.00 H new ATOM 0 HG3 GLN A 51 66.571 -2.639 -0.936 1.00 0.00 H new ATOM 0 HE21 GLN A 51 67.358 -2.287 1.851 1.00 0.00 H new ATOM 0 HE22 GLN A 51 67.422 -3.894 2.582 1.00 0.00 H new ATOM 806 N ASN A 52 68.340 -4.208 -5.026 1.00 0.00 N ATOM 807 CA ASN A 52 69.032 -4.889 -6.168 1.00 0.00 C ATOM 808 C ASN A 52 69.394 -3.880 -7.271 1.00 0.00 C ATOM 809 O ASN A 52 70.194 -4.177 -8.141 1.00 0.00 O ATOM 810 CB ASN A 52 68.026 -5.915 -6.697 1.00 0.00 C ATOM 811 CG ASN A 52 67.693 -6.922 -5.595 1.00 0.00 C ATOM 812 OD1 ASN A 52 66.539 -7.212 -5.348 1.00 0.00 O ATOM 813 ND2 ASN A 52 68.663 -7.473 -4.918 1.00 0.00 N ATOM 0 H ASN A 52 67.344 -4.410 -4.943 1.00 0.00 H new ATOM 0 HA ASN A 52 69.965 -5.354 -5.850 1.00 0.00 H new ATOM 0 HB2 ASN A 52 67.118 -5.411 -7.030 1.00 0.00 H new ATOM 0 HB3 ASN A 52 68.440 -6.432 -7.563 1.00 0.00 H new ATOM 0 HD21 ASN A 52 68.452 -8.147 -4.182 1.00 0.00 H new ATOM 0 HD22 ASN A 52 69.632 -7.230 -5.125 1.00 0.00 H new ATOM 820 N ALA A 53 68.818 -2.695 -7.245 1.00 0.00 N ATOM 821 CA ALA A 53 69.157 -1.669 -8.283 1.00 0.00 C ATOM 822 C ALA A 53 70.554 -1.100 -8.018 1.00 0.00 C ATOM 823 O ALA A 53 70.942 -0.894 -6.883 1.00 0.00 O ATOM 824 CB ALA A 53 68.095 -0.578 -8.140 1.00 0.00 C ATOM 0 H ALA A 53 68.131 -2.398 -6.552 1.00 0.00 H new ATOM 0 HA ALA A 53 69.166 -2.089 -9.289 1.00 0.00 H new ATOM 0 HB1 ALA A 53 68.281 0.209 -8.871 1.00 0.00 H new ATOM 0 HB2 ALA A 53 67.108 -1.007 -8.311 1.00 0.00 H new ATOM 0 HB3 ALA A 53 68.138 -0.157 -7.135 1.00 0.00 H new ATOM 830 N GLU A 54 71.305 -0.846 -9.061 1.00 0.00 N ATOM 831 CA GLU A 54 72.702 -0.341 -8.884 1.00 0.00 C ATOM 832 C GLU A 54 72.722 1.195 -8.806 1.00 0.00 C ATOM 833 O GLU A 54 71.898 1.868 -9.397 1.00 0.00 O ATOM 834 CB GLU A 54 73.483 -0.856 -10.110 1.00 0.00 C ATOM 835 CG GLU A 54 72.994 -0.189 -11.407 1.00 0.00 C ATOM 836 CD GLU A 54 73.773 -0.757 -12.596 1.00 0.00 C ATOM 837 OE1 GLU A 54 73.844 -1.970 -12.707 1.00 0.00 O ATOM 838 OE2 GLU A 54 74.285 0.031 -13.374 1.00 0.00 O ATOM 0 H GLU A 54 71.010 -0.967 -10.030 1.00 0.00 H new ATOM 0 HA GLU A 54 73.149 -0.694 -7.954 1.00 0.00 H new ATOM 0 HB2 GLU A 54 74.546 -0.658 -9.976 1.00 0.00 H new ATOM 0 HB3 GLU A 54 73.368 -1.937 -10.189 1.00 0.00 H new ATOM 0 HG2 GLU A 54 71.927 -0.366 -11.540 1.00 0.00 H new ATOM 0 HG3 GLU A 54 73.134 0.890 -11.349 1.00 0.00 H new ATOM 845 N VAL A 55 73.664 1.742 -8.078 1.00 0.00 N ATOM 846 CA VAL A 55 73.832 3.229 -8.041 1.00 0.00 C ATOM 847 C VAL A 55 75.009 3.621 -8.934 1.00 0.00 C ATOM 848 O VAL A 55 76.104 3.115 -8.769 1.00 0.00 O ATOM 849 CB VAL A 55 74.147 3.566 -6.576 1.00 0.00 C ATOM 850 CG1 VAL A 55 74.339 5.078 -6.412 1.00 0.00 C ATOM 851 CG2 VAL A 55 72.993 3.111 -5.679 1.00 0.00 C ATOM 0 H VAL A 55 74.327 1.220 -7.505 1.00 0.00 H new ATOM 0 HA VAL A 55 72.948 3.759 -8.394 1.00 0.00 H new ATOM 0 HB VAL A 55 75.063 3.050 -6.289 1.00 0.00 H new ATOM 0 HG11 VAL A 55 74.562 5.306 -5.370 1.00 0.00 H new ATOM 0 HG12 VAL A 55 75.165 5.410 -7.041 1.00 0.00 H new ATOM 0 HG13 VAL A 55 73.427 5.595 -6.709 1.00 0.00 H new ATOM 0 HG21 VAL A 55 73.222 3.353 -4.641 1.00 0.00 H new ATOM 0 HG22 VAL A 55 72.077 3.622 -5.977 1.00 0.00 H new ATOM 0 HG23 VAL A 55 72.857 2.034 -5.779 1.00 0.00 H new ATOM 861 N VAL A 56 74.792 4.510 -9.872 1.00 0.00 N ATOM 862 CA VAL A 56 75.919 4.968 -10.742 1.00 0.00 C ATOM 863 C VAL A 56 76.052 6.485 -10.651 1.00 0.00 C ATOM 864 O VAL A 56 75.183 7.221 -11.083 1.00 0.00 O ATOM 865 CB VAL A 56 75.572 4.541 -12.171 1.00 0.00 C ATOM 866 CG1 VAL A 56 76.766 4.854 -13.071 1.00 0.00 C ATOM 867 CG2 VAL A 56 75.291 3.034 -12.223 1.00 0.00 C ATOM 0 H VAL A 56 73.887 4.937 -10.072 1.00 0.00 H new ATOM 0 HA VAL A 56 76.869 4.533 -10.432 1.00 0.00 H new ATOM 0 HB VAL A 56 74.684 5.078 -12.505 1.00 0.00 H new ATOM 0 HG11 VAL A 56 76.538 4.557 -14.095 1.00 0.00 H new ATOM 0 HG12 VAL A 56 76.973 5.924 -13.042 1.00 0.00 H new ATOM 0 HG13 VAL A 56 77.640 4.305 -12.720 1.00 0.00 H new ATOM 0 HG21 VAL A 56 75.046 2.745 -13.245 1.00 0.00 H new ATOM 0 HG22 VAL A 56 76.175 2.488 -11.893 1.00 0.00 H new ATOM 0 HG23 VAL A 56 74.453 2.797 -11.568 1.00 0.00 H new ATOM 877 N LEU A 57 77.134 6.951 -10.093 1.00 0.00 N ATOM 878 CA LEU A 57 77.286 8.412 -9.835 1.00 0.00 C ATOM 879 C LEU A 57 78.615 8.920 -10.399 1.00 0.00 C ATOM 880 O LEU A 57 79.652 8.309 -10.214 1.00 0.00 O ATOM 881 CB LEU A 57 77.213 8.521 -8.314 1.00 0.00 C ATOM 882 CG LEU A 57 75.737 8.563 -7.902 1.00 0.00 C ATOM 883 CD1 LEU A 57 75.562 7.938 -6.522 1.00 0.00 C ATOM 884 CD2 LEU A 57 75.270 10.021 -7.842 1.00 0.00 C ATOM 0 H LEU A 57 77.926 6.379 -9.802 1.00 0.00 H new ATOM 0 HA LEU A 57 76.524 9.023 -10.318 1.00 0.00 H new ATOM 0 HB2 LEU A 57 77.713 7.671 -7.849 1.00 0.00 H new ATOM 0 HB3 LEU A 57 77.728 9.419 -7.973 1.00 0.00 H new ATOM 0 HG LEU A 57 75.149 8.007 -8.632 1.00 0.00 H new ATOM 0 HD11 LEU A 57 74.510 7.972 -6.238 1.00 0.00 H new ATOM 0 HD12 LEU A 57 75.897 6.901 -6.547 1.00 0.00 H new ATOM 0 HD13 LEU A 57 76.153 8.493 -5.794 1.00 0.00 H new ATOM 0 HD21 LEU A 57 74.221 10.055 -7.549 1.00 0.00 H new ATOM 0 HD22 LEU A 57 75.868 10.565 -7.111 1.00 0.00 H new ATOM 0 HD23 LEU A 57 75.388 10.482 -8.823 1.00 0.00 H new ATOM 896 N LYS A 58 78.584 10.034 -11.090 1.00 0.00 N ATOM 897 CA LYS A 58 79.827 10.563 -11.736 1.00 0.00 C ATOM 898 C LYS A 58 80.767 11.155 -10.681 1.00 0.00 C ATOM 899 O LYS A 58 80.340 11.839 -9.771 1.00 0.00 O ATOM 900 CB LYS A 58 79.344 11.651 -12.701 1.00 0.00 C ATOM 901 CG LYS A 58 80.489 12.060 -13.629 1.00 0.00 C ATOM 902 CD LYS A 58 79.997 13.132 -14.604 1.00 0.00 C ATOM 903 CE LYS A 58 81.111 13.468 -15.598 1.00 0.00 C ATOM 904 NZ LYS A 58 80.475 14.373 -16.595 1.00 0.00 N ATOM 0 H LYS A 58 77.749 10.601 -11.235 1.00 0.00 H new ATOM 0 HA LYS A 58 80.386 9.782 -12.251 1.00 0.00 H new ATOM 0 HB2 LYS A 58 78.501 11.284 -13.287 1.00 0.00 H new ATOM 0 HB3 LYS A 58 78.990 12.516 -12.141 1.00 0.00 H new ATOM 0 HG2 LYS A 58 81.326 12.441 -13.045 1.00 0.00 H new ATOM 0 HG3 LYS A 58 80.853 11.192 -14.179 1.00 0.00 H new ATOM 0 HD2 LYS A 58 79.115 12.777 -15.137 1.00 0.00 H new ATOM 0 HD3 LYS A 58 79.701 14.027 -14.057 1.00 0.00 H new ATOM 0 HE2 LYS A 58 81.950 13.955 -15.101 1.00 0.00 H new ATOM 0 HE3 LYS A 58 81.501 12.568 -16.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 81.177 14.648 -17.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 79.684 13.880 -17.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 80.119 15.224 -16.114 1.00 0.00 H new ATOM 918 N CYS A 59 82.047 10.893 -10.802 1.00 0.00 N ATOM 919 CA CYS A 59 83.036 11.407 -9.794 1.00 0.00 C ATOM 920 C CYS A 59 82.912 12.929 -9.616 1.00 0.00 C ATOM 921 O CYS A 59 83.144 13.455 -8.542 1.00 0.00 O ATOM 922 CB CYS A 59 84.423 11.040 -10.352 1.00 0.00 C ATOM 923 SG CYS A 59 84.671 11.788 -11.988 1.00 0.00 S ATOM 0 H CYS A 59 82.453 10.343 -11.559 1.00 0.00 H new ATOM 0 HA CYS A 59 82.862 10.968 -8.811 1.00 0.00 H new ATOM 0 HB2 CYS A 59 85.199 11.383 -9.668 1.00 0.00 H new ATOM 0 HB3 CYS A 59 84.517 9.956 -10.423 1.00 0.00 H new ATOM 0 HG CYS A 59 85.848 11.467 -12.438 1.00 0.00 H new ATOM 929 N THR A 60 82.547 13.631 -10.662 1.00 0.00 N ATOM 930 CA THR A 60 82.417 15.121 -10.567 1.00 0.00 C ATOM 931 C THR A 60 81.296 15.496 -9.593 1.00 0.00 C ATOM 932 O THR A 60 81.305 16.565 -9.011 1.00 0.00 O ATOM 933 CB THR A 60 82.074 15.597 -11.983 1.00 0.00 C ATOM 934 OG1 THR A 60 80.842 15.019 -12.389 1.00 0.00 O ATOM 935 CG2 THR A 60 83.182 15.182 -12.954 1.00 0.00 C ATOM 0 H THR A 60 82.333 13.237 -11.578 1.00 0.00 H new ATOM 0 HA THR A 60 83.332 15.583 -10.197 1.00 0.00 H new ATOM 0 HB THR A 60 81.986 16.683 -11.987 1.00 0.00 H new ATOM 0 HG1 THR A 60 80.313 15.685 -12.876 1.00 0.00 H new ATOM 0 HG21 THR A 60 82.932 15.523 -13.959 1.00 0.00 H new ATOM 0 HG22 THR A 60 84.125 15.630 -12.643 1.00 0.00 H new ATOM 0 HG23 THR A 60 83.279 14.096 -12.953 1.00 0.00 H new ATOM 943 N ASP A 61 80.332 14.623 -9.414 1.00 0.00 N ATOM 944 CA ASP A 61 79.234 14.896 -8.437 1.00 0.00 C ATOM 945 C ASP A 61 79.637 14.404 -7.042 1.00 0.00 C ATOM 946 O ASP A 61 79.146 14.893 -6.040 1.00 0.00 O ATOM 947 CB ASP A 61 78.026 14.117 -8.961 1.00 0.00 C ATOM 948 CG ASP A 61 77.616 14.655 -10.337 1.00 0.00 C ATOM 949 OD1 ASP A 61 77.824 15.834 -10.583 1.00 0.00 O ATOM 950 OD2 ASP A 61 77.099 13.879 -11.123 1.00 0.00 O ATOM 0 H ASP A 61 80.260 13.732 -9.905 1.00 0.00 H new ATOM 0 HA ASP A 61 79.016 15.960 -8.346 1.00 0.00 H new ATOM 0 HB2 ASP A 61 78.269 13.057 -9.033 1.00 0.00 H new ATOM 0 HB3 ASP A 61 77.194 14.207 -8.263 1.00 0.00 H new ATOM 955 N ILE A 62 80.524 13.441 -6.973 1.00 0.00 N ATOM 956 CA ILE A 62 81.035 12.971 -5.649 1.00 0.00 C ATOM 957 C ILE A 62 82.136 13.916 -5.155 1.00 0.00 C ATOM 958 O ILE A 62 82.912 14.435 -5.937 1.00 0.00 O ATOM 959 CB ILE A 62 81.603 11.568 -5.908 1.00 0.00 C ATOM 960 CG1 ILE A 62 80.495 10.655 -6.446 1.00 0.00 C ATOM 961 CG2 ILE A 62 82.147 10.981 -4.602 1.00 0.00 C ATOM 962 CD1 ILE A 62 81.099 9.317 -6.877 1.00 0.00 C ATOM 0 H ILE A 62 80.917 12.959 -7.781 1.00 0.00 H new ATOM 0 HA ILE A 62 80.257 12.953 -4.886 1.00 0.00 H new ATOM 0 HB ILE A 62 82.408 11.639 -6.640 1.00 0.00 H new ATOM 0 HG12 ILE A 62 79.738 10.494 -5.679 1.00 0.00 H new ATOM 0 HG13 ILE A 62 79.996 11.130 -7.291 1.00 0.00 H new ATOM 0 HG21 ILE A 62 82.549 9.985 -4.790 1.00 0.00 H new ATOM 0 HG22 ILE A 62 82.937 11.624 -4.215 1.00 0.00 H new ATOM 0 HG23 ILE A 62 81.342 10.915 -3.870 1.00 0.00 H new ATOM 0 HD11 ILE A 62 80.311 8.668 -7.259 1.00 0.00 H new ATOM 0 HD12 ILE A 62 81.840 9.487 -7.658 1.00 0.00 H new ATOM 0 HD13 ILE A 62 81.577 8.841 -6.021 1.00 0.00 H new ATOM 974 N ARG A 63 82.203 14.142 -3.865 1.00 0.00 N ATOM 975 CA ARG A 63 83.228 15.077 -3.313 1.00 0.00 C ATOM 976 C ARG A 63 84.410 14.291 -2.739 1.00 0.00 C ATOM 977 O ARG A 63 85.541 14.741 -2.793 1.00 0.00 O ATOM 978 CB ARG A 63 82.509 15.855 -2.211 1.00 0.00 C ATOM 979 CG ARG A 63 83.445 16.925 -1.646 1.00 0.00 C ATOM 980 CD ARG A 63 83.619 18.046 -2.675 1.00 0.00 C ATOM 981 NE ARG A 63 84.608 18.989 -2.062 1.00 0.00 N ATOM 982 CZ ARG A 63 85.312 19.834 -2.797 1.00 0.00 C ATOM 983 NH1 ARG A 63 85.181 19.898 -4.104 1.00 0.00 N ATOM 984 NH2 ARG A 63 86.161 20.630 -2.207 1.00 0.00 N ATOM 0 H ARG A 63 81.589 13.717 -3.170 1.00 0.00 H new ATOM 0 HA ARG A 63 83.633 15.741 -4.077 1.00 0.00 H new ATOM 0 HB2 ARG A 63 81.607 16.320 -2.609 1.00 0.00 H new ATOM 0 HB3 ARG A 63 82.195 15.176 -1.418 1.00 0.00 H new ATOM 0 HG2 ARG A 63 83.037 17.328 -0.719 1.00 0.00 H new ATOM 0 HG3 ARG A 63 84.413 16.486 -1.404 1.00 0.00 H new ATOM 0 HD2 ARG A 63 83.983 17.656 -3.625 1.00 0.00 H new ATOM 0 HD3 ARG A 63 82.672 18.545 -2.878 1.00 0.00 H new ATOM 0 HE ARG A 63 84.742 18.979 -1.051 1.00 0.00 H new ATOM 0 HH11 ARG A 63 84.521 19.284 -4.581 1.00 0.00 H new ATOM 0 HH12 ARG A 63 85.740 20.561 -4.641 1.00 0.00 H new ATOM 0 HH21 ARG A 63 86.274 20.595 -1.194 1.00 0.00 H new ATOM 0 HH22 ARG A 63 86.712 21.288 -2.759 1.00 0.00 H new ATOM 998 N SER A 64 84.159 13.122 -2.190 1.00 0.00 N ATOM 999 CA SER A 64 85.287 12.281 -1.672 1.00 0.00 C ATOM 1000 C SER A 64 84.836 10.833 -1.448 1.00 0.00 C ATOM 1001 O SER A 64 83.826 10.579 -0.820 1.00 0.00 O ATOM 1002 CB SER A 64 85.686 12.928 -0.347 1.00 0.00 C ATOM 1003 OG SER A 64 86.829 12.264 0.174 1.00 0.00 O ATOM 0 H SER A 64 83.229 12.718 -2.079 1.00 0.00 H new ATOM 0 HA SER A 64 86.117 12.239 -2.378 1.00 0.00 H new ATOM 0 HB2 SER A 64 85.902 13.986 -0.496 1.00 0.00 H new ATOM 0 HB3 SER A 64 84.861 12.868 0.363 1.00 0.00 H new ATOM 0 HG SER A 64 87.089 12.678 1.023 1.00 0.00 H new ATOM 1009 N ILE A 65 85.583 9.887 -1.964 1.00 0.00 N ATOM 1010 CA ILE A 65 85.297 8.447 -1.672 1.00 0.00 C ATOM 1011 C ILE A 65 86.262 7.925 -0.601 1.00 0.00 C ATOM 1012 O ILE A 65 87.405 8.337 -0.533 1.00 0.00 O ATOM 1013 CB ILE A 65 85.538 7.700 -2.993 1.00 0.00 C ATOM 1014 CG1 ILE A 65 84.654 8.293 -4.101 1.00 0.00 C ATOM 1015 CG2 ILE A 65 85.196 6.212 -2.806 1.00 0.00 C ATOM 1016 CD1 ILE A 65 84.998 7.633 -5.439 1.00 0.00 C ATOM 0 H ILE A 65 86.381 10.051 -2.577 1.00 0.00 H new ATOM 0 HA ILE A 65 84.281 8.306 -1.302 1.00 0.00 H new ATOM 0 HB ILE A 65 86.585 7.804 -3.278 1.00 0.00 H new ATOM 0 HG12 ILE A 65 83.602 8.134 -3.865 1.00 0.00 H new ATOM 0 HG13 ILE A 65 84.807 9.370 -4.165 1.00 0.00 H new ATOM 0 HG21 ILE A 65 85.366 5.679 -3.742 1.00 0.00 H new ATOM 0 HG22 ILE A 65 85.830 5.788 -2.027 1.00 0.00 H new ATOM 0 HG23 ILE A 65 84.150 6.113 -2.517 1.00 0.00 H new ATOM 0 HD11 ILE A 65 84.370 8.054 -6.224 1.00 0.00 H new ATOM 0 HD12 ILE A 65 86.046 7.815 -5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 65 84.822 6.559 -5.371 1.00 0.00 H new ATOM 1028 N ASP A 66 85.806 7.023 0.235 1.00 0.00 N ATOM 1029 CA ASP A 66 86.717 6.389 1.238 1.00 0.00 C ATOM 1030 C ASP A 66 86.550 4.864 1.218 1.00 0.00 C ATOM 1031 O ASP A 66 85.457 4.358 1.385 1.00 0.00 O ATOM 1032 CB ASP A 66 86.287 6.973 2.590 1.00 0.00 C ATOM 1033 CG ASP A 66 84.823 6.627 2.880 1.00 0.00 C ATOM 1034 OD1 ASP A 66 83.958 7.306 2.353 1.00 0.00 O ATOM 1035 OD2 ASP A 66 84.595 5.690 3.627 1.00 0.00 O ATOM 0 H ASP A 66 84.840 6.698 0.265 1.00 0.00 H new ATOM 0 HA ASP A 66 87.768 6.589 1.030 1.00 0.00 H new ATOM 0 HB2 ASP A 66 86.924 6.580 3.382 1.00 0.00 H new ATOM 0 HB3 ASP A 66 86.417 8.055 2.584 1.00 0.00 H new ATOM 1040 N LEU A 67 87.623 4.136 1.016 1.00 0.00 N ATOM 1041 CA LEU A 67 87.538 2.641 1.064 1.00 0.00 C ATOM 1042 C LEU A 67 87.444 2.173 2.519 1.00 0.00 C ATOM 1043 O LEU A 67 88.374 2.330 3.289 1.00 0.00 O ATOM 1044 CB LEU A 67 88.841 2.147 0.428 1.00 0.00 C ATOM 1045 CG LEU A 67 88.667 2.024 -1.094 1.00 0.00 C ATOM 1046 CD1 LEU A 67 89.929 2.528 -1.800 1.00 0.00 C ATOM 1047 CD2 LEU A 67 88.439 0.556 -1.472 1.00 0.00 C ATOM 0 H LEU A 67 88.551 4.511 0.821 1.00 0.00 H new ATOM 0 HA LEU A 67 86.661 2.258 0.543 1.00 0.00 H new ATOM 0 HB2 LEU A 67 89.652 2.839 0.655 1.00 0.00 H new ATOM 0 HB3 LEU A 67 89.119 1.181 0.850 1.00 0.00 H new ATOM 0 HG LEU A 67 87.809 2.621 -1.402 1.00 0.00 H new ATOM 0 HD11 LEU A 67 89.802 2.439 -2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 67 90.099 3.573 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU A 67 90.785 1.931 -1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 67 88.316 0.473 -2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 67 89.297 -0.038 -1.158 1.00 0.00 H new ATOM 0 HD23 LEU A 67 87.541 0.188 -0.975 1.00 0.00 H new ATOM 1059 N ILE A 68 86.327 1.601 2.897 1.00 0.00 N ATOM 1060 CA ILE A 68 86.155 1.127 4.305 1.00 0.00 C ATOM 1061 C ILE A 68 86.860 -0.220 4.495 1.00 0.00 C ATOM 1062 O ILE A 68 87.606 -0.414 5.438 1.00 0.00 O ATOM 1063 CB ILE A 68 84.639 0.979 4.502 1.00 0.00 C ATOM 1064 CG1 ILE A 68 83.951 2.326 4.253 1.00 0.00 C ATOM 1065 CG2 ILE A 68 84.342 0.523 5.936 1.00 0.00 C ATOM 1066 CD1 ILE A 68 82.432 2.139 4.284 1.00 0.00 C ATOM 0 H ILE A 68 85.524 1.442 2.288 1.00 0.00 H new ATOM 0 HA ILE A 68 86.587 1.818 5.028 1.00 0.00 H new ATOM 0 HB ILE A 68 84.262 0.238 3.797 1.00 0.00 H new ATOM 0 HG12 ILE A 68 84.255 3.047 5.012 1.00 0.00 H new ATOM 0 HG13 ILE A 68 84.258 2.730 3.289 1.00 0.00 H new ATOM 0 HG21 ILE A 68 83.265 0.420 6.069 1.00 0.00 H new ATOM 0 HG22 ILE A 68 84.824 -0.437 6.120 1.00 0.00 H new ATOM 0 HG23 ILE A 68 84.726 1.262 6.640 1.00 0.00 H new ATOM 0 HD11 ILE A 68 81.944 3.097 4.107 1.00 0.00 H new ATOM 0 HD12 ILE A 68 82.137 1.432 3.508 1.00 0.00 H new ATOM 0 HD13 ILE A 68 82.133 1.754 5.259 1.00 0.00 H new ATOM 1078 N GLU A 69 86.624 -1.148 3.601 1.00 0.00 N ATOM 1079 CA GLU A 69 87.209 -2.515 3.750 1.00 0.00 C ATOM 1080 C GLU A 69 87.745 -3.015 2.397 1.00 0.00 C ATOM 1081 O GLU A 69 86.969 -3.430 1.557 1.00 0.00 O ATOM 1082 CB GLU A 69 86.051 -3.392 4.223 1.00 0.00 C ATOM 1083 CG GLU A 69 85.887 -3.249 5.737 1.00 0.00 C ATOM 1084 CD GLU A 69 84.414 -3.433 6.112 1.00 0.00 C ATOM 1085 OE1 GLU A 69 83.625 -2.567 5.772 1.00 0.00 O ATOM 1086 OE2 GLU A 69 84.102 -4.436 6.730 1.00 0.00 O ATOM 0 H GLU A 69 86.048 -1.016 2.770 1.00 0.00 H new ATOM 0 HA GLU A 69 88.045 -2.531 4.449 1.00 0.00 H new ATOM 0 HB2 GLU A 69 85.130 -3.100 3.718 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.241 -4.434 3.964 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.499 -3.990 6.251 1.00 0.00 H new ATOM 0 HG3 GLU A 69 86.235 -2.268 6.060 1.00 0.00 H new ATOM 1093 N PRO A 70 89.053 -2.965 2.212 1.00 0.00 N ATOM 1094 CA PRO A 70 89.644 -3.479 0.950 1.00 0.00 C ATOM 1095 C PRO A 70 89.365 -4.978 0.808 1.00 0.00 C ATOM 1096 O PRO A 70 89.370 -5.711 1.780 1.00 0.00 O ATOM 1097 CB PRO A 70 91.144 -3.216 1.096 1.00 0.00 C ATOM 1098 CG PRO A 70 91.372 -2.970 2.554 1.00 0.00 C ATOM 1099 CD PRO A 70 90.085 -2.443 3.124 1.00 0.00 C ATOM 0 HA PRO A 70 89.228 -3.000 0.064 1.00 0.00 H new ATOM 0 HB2 PRO A 70 91.727 -4.068 0.747 1.00 0.00 H new ATOM 0 HB3 PRO A 70 91.450 -2.356 0.501 1.00 0.00 H new ATOM 0 HG2 PRO A 70 91.667 -3.891 3.058 1.00 0.00 H new ATOM 0 HG3 PRO A 70 92.180 -2.253 2.701 1.00 0.00 H new ATOM 0 HD2 PRO A 70 89.928 -2.791 4.145 1.00 0.00 H new ATOM 0 HD3 PRO A 70 90.078 -1.353 3.154 1.00 0.00 H new ATOM 1107 N ALA A 71 89.122 -5.434 -0.397 1.00 0.00 N ATOM 1108 CA ALA A 71 88.828 -6.882 -0.616 1.00 0.00 C ATOM 1109 C ALA A 71 90.039 -7.583 -1.236 1.00 0.00 C ATOM 1110 O ALA A 71 90.742 -7.016 -2.053 1.00 0.00 O ATOM 1111 CB ALA A 71 87.643 -6.904 -1.581 1.00 0.00 C ATOM 0 H ALA A 71 89.115 -4.861 -1.241 1.00 0.00 H new ATOM 0 HA ALA A 71 88.605 -7.402 0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 71 87.365 -7.937 -1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 71 86.797 -6.386 -1.130 1.00 0.00 H new ATOM 0 HB3 ALA A 71 87.921 -6.405 -2.510 1.00 0.00 H new ATOM 1117 N LYS A 72 90.283 -8.812 -0.851 1.00 0.00 N ATOM 1118 CA LYS A 72 91.431 -9.574 -1.429 1.00 0.00 C ATOM 1119 C LYS A 72 90.945 -10.477 -2.566 1.00 0.00 C ATOM 1120 O LYS A 72 89.854 -11.015 -2.516 1.00 0.00 O ATOM 1121 CB LYS A 72 91.974 -10.413 -0.272 1.00 0.00 C ATOM 1122 CG LYS A 72 92.527 -9.489 0.814 1.00 0.00 C ATOM 1123 CD LYS A 72 93.181 -10.327 1.915 1.00 0.00 C ATOM 1124 CE LYS A 72 93.633 -9.411 3.054 1.00 0.00 C ATOM 1125 NZ LYS A 72 95.070 -9.134 2.777 1.00 0.00 N ATOM 0 H LYS A 72 89.734 -9.321 -0.159 1.00 0.00 H new ATOM 0 HA LYS A 72 92.194 -8.918 -1.848 1.00 0.00 H new ATOM 0 HB2 LYS A 72 91.183 -11.041 0.138 1.00 0.00 H new ATOM 0 HB3 LYS A 72 92.758 -11.081 -0.630 1.00 0.00 H new ATOM 0 HG2 LYS A 72 93.256 -8.801 0.385 1.00 0.00 H new ATOM 0 HG3 LYS A 72 91.724 -8.882 1.233 1.00 0.00 H new ATOM 0 HD2 LYS A 72 92.476 -11.069 2.289 1.00 0.00 H new ATOM 0 HD3 LYS A 72 94.034 -10.873 1.513 1.00 0.00 H new ATOM 0 HE2 LYS A 72 93.050 -8.490 3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 72 93.503 -9.893 4.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 95.452 -8.511 3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 95.601 -10.028 2.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 95.162 -8.669 1.851 1.00 0.00 H new ATOM 1139 N GLN A 73 91.750 -10.646 -3.587 1.00 0.00 N ATOM 1140 CA GLN A 73 91.343 -11.507 -4.739 1.00 0.00 C ATOM 1141 C GLN A 73 92.242 -12.745 -4.819 1.00 0.00 C ATOM 1142 O GLN A 73 93.406 -12.699 -4.466 1.00 0.00 O ATOM 1143 CB GLN A 73 91.532 -10.628 -5.975 1.00 0.00 C ATOM 1144 CG GLN A 73 90.594 -9.421 -5.892 1.00 0.00 C ATOM 1145 CD GLN A 73 90.816 -8.510 -7.103 1.00 0.00 C ATOM 1146 OE1 GLN A 73 91.855 -8.552 -7.732 1.00 0.00 O ATOM 1147 NE2 GLN A 73 89.874 -7.680 -7.460 1.00 0.00 N ATOM 0 H GLN A 73 92.674 -10.223 -3.671 1.00 0.00 H new ATOM 0 HA GLN A 73 90.318 -11.865 -4.645 1.00 0.00 H new ATOM 0 HB2 GLN A 73 92.567 -10.293 -6.041 1.00 0.00 H new ATOM 0 HB3 GLN A 73 91.324 -11.202 -6.878 1.00 0.00 H new ATOM 0 HG2 GLN A 73 89.557 -9.756 -5.862 1.00 0.00 H new ATOM 0 HG3 GLN A 73 90.778 -8.868 -4.971 1.00 0.00 H new ATOM 0 HE21 GLN A 73 89.001 -7.643 -6.934 1.00 0.00 H new ATOM 0 HE22 GLN A 73 90.011 -7.069 -8.265 1.00 0.00 H new ATOM 1156 N ASP A 74 91.704 -13.847 -5.281 1.00 0.00 N ATOM 1157 CA ASP A 74 92.520 -15.097 -5.402 1.00 0.00 C ATOM 1158 C ASP A 74 93.437 -15.016 -6.627 1.00 0.00 C ATOM 1159 O ASP A 74 93.399 -14.057 -7.377 1.00 0.00 O ATOM 1160 CB ASP A 74 91.501 -16.236 -5.551 1.00 0.00 C ATOM 1161 CG ASP A 74 90.627 -16.007 -6.791 1.00 0.00 C ATOM 1162 OD1 ASP A 74 91.050 -16.389 -7.868 1.00 0.00 O ATOM 1163 OD2 ASP A 74 89.550 -15.454 -6.637 1.00 0.00 O ATOM 0 H ASP A 74 90.733 -13.936 -5.580 1.00 0.00 H new ATOM 0 HA ASP A 74 93.166 -15.251 -4.538 1.00 0.00 H new ATOM 0 HB2 ASP A 74 92.021 -17.190 -5.635 1.00 0.00 H new ATOM 0 HB3 ASP A 74 90.874 -16.292 -4.661 1.00 0.00 H new ATOM 1168 N LEU A 75 94.257 -16.017 -6.830 1.00 0.00 N ATOM 1169 CA LEU A 75 95.178 -16.018 -8.008 1.00 0.00 C ATOM 1170 C LEU A 75 94.556 -16.808 -9.163 1.00 0.00 C ATOM 1171 O LEU A 75 94.074 -17.911 -8.981 1.00 0.00 O ATOM 1172 CB LEU A 75 96.453 -16.703 -7.515 1.00 0.00 C ATOM 1173 CG LEU A 75 97.525 -16.632 -8.604 1.00 0.00 C ATOM 1174 CD1 LEU A 75 98.035 -15.196 -8.726 1.00 0.00 C ATOM 1175 CD2 LEU A 75 98.688 -17.556 -8.234 1.00 0.00 C ATOM 0 H LEU A 75 94.328 -16.837 -6.228 1.00 0.00 H new ATOM 0 HA LEU A 75 95.375 -15.012 -8.380 1.00 0.00 H new ATOM 0 HB2 LEU A 75 96.810 -16.219 -6.606 1.00 0.00 H new ATOM 0 HB3 LEU A 75 96.245 -17.743 -7.262 1.00 0.00 H new ATOM 0 HG LEU A 75 97.097 -16.947 -9.556 1.00 0.00 H new ATOM 0 HD11 LEU A 75 98.799 -15.146 -9.502 1.00 0.00 H new ATOM 0 HD12 LEU A 75 97.207 -14.537 -8.988 1.00 0.00 H new ATOM 0 HD13 LEU A 75 98.463 -14.880 -7.775 1.00 0.00 H new ATOM 0 HD21 LEU A 75 99.453 -17.507 -9.009 1.00 0.00 H new ATOM 0 HD22 LEU A 75 99.115 -17.240 -7.282 1.00 0.00 H new ATOM 0 HD23 LEU A 75 98.325 -18.580 -8.147 1.00 0.00 H new ATOM 1187 N ASP A 76 94.566 -16.248 -10.349 1.00 0.00 N ATOM 1188 CA ASP A 76 93.940 -16.940 -11.523 1.00 0.00 C ATOM 1189 C ASP A 76 94.592 -18.309 -11.750 1.00 0.00 C ATOM 1190 O ASP A 76 93.927 -19.273 -12.085 1.00 0.00 O ATOM 1191 CB ASP A 76 94.198 -16.022 -12.724 1.00 0.00 C ATOM 1192 CG ASP A 76 93.461 -14.691 -12.532 1.00 0.00 C ATOM 1193 OD1 ASP A 76 92.437 -14.687 -11.867 1.00 0.00 O ATOM 1194 OD2 ASP A 76 93.936 -13.697 -13.057 1.00 0.00 O ATOM 0 H ASP A 76 94.981 -15.340 -10.556 1.00 0.00 H new ATOM 0 HA ASP A 76 92.876 -17.116 -11.367 1.00 0.00 H new ATOM 0 HB2 ASP A 76 95.268 -15.843 -12.833 1.00 0.00 H new ATOM 0 HB3 ASP A 76 93.861 -16.505 -13.641 1.00 0.00 H new ATOM 1199 N GLY A 77 95.888 -18.396 -11.569 1.00 0.00 N ATOM 1200 CA GLY A 77 96.594 -19.697 -11.765 1.00 0.00 C ATOM 1201 C GLY A 77 98.094 -19.448 -11.933 1.00 0.00 C ATOM 1202 O GLY A 77 98.569 -18.340 -11.767 1.00 0.00 O ATOM 0 H GLY A 77 96.487 -17.618 -11.293 1.00 0.00 H new ATOM 0 HA2 GLY A 77 96.417 -20.350 -10.911 1.00 0.00 H new ATOM 0 HA3 GLY A 77 96.199 -20.207 -12.644 1.00 0.00 H new ATOM 1206 N HIS A 78 98.837 -20.476 -12.261 1.00 0.00 N ATOM 1207 CA HIS A 78 100.310 -20.316 -12.464 1.00 0.00 C ATOM 1208 C HIS A 78 100.689 -20.707 -13.894 1.00 0.00 C ATOM 1209 O HIS A 78 100.110 -21.608 -14.473 1.00 0.00 O ATOM 1210 CB HIS A 78 100.954 -21.272 -11.459 1.00 0.00 C ATOM 1211 CG HIS A 78 100.618 -20.953 -10.027 1.00 0.00 C ATOM 1212 ND1 HIS A 78 101.115 -19.831 -9.383 1.00 0.00 N ATOM 1213 CD2 HIS A 78 99.836 -21.601 -9.103 1.00 0.00 C ATOM 1214 CE1 HIS A 78 100.633 -19.837 -8.127 1.00 0.00 C ATOM 1215 NE2 HIS A 78 99.846 -20.894 -7.903 1.00 0.00 N ATOM 0 H HIS A 78 98.485 -21.423 -12.397 1.00 0.00 H new ATOM 0 HA HIS A 78 100.639 -19.287 -12.317 1.00 0.00 H new ATOM 0 HB2 HIS A 78 100.634 -22.290 -11.681 1.00 0.00 H new ATOM 0 HB3 HIS A 78 102.036 -21.244 -11.585 1.00 0.00 H new ATOM 0 HD2 HIS A 78 99.295 -22.519 -9.280 1.00 0.00 H new ATOM 0 HE1 HIS A 78 100.855 -19.080 -7.389 1.00 0.00 H new ATOM 0 HE2 HIS A 78 99.358 -21.132 -7.039 1.00 0.00 H new ATOM 1223 N THR A 79 101.659 -20.033 -14.467 1.00 0.00 N ATOM 1224 CA THR A 79 102.076 -20.347 -15.874 1.00 0.00 C ATOM 1225 C THR A 79 102.514 -21.812 -15.987 1.00 0.00 C ATOM 1226 O THR A 79 102.215 -22.483 -16.958 1.00 0.00 O ATOM 1227 CB THR A 79 103.253 -19.414 -16.169 1.00 0.00 C ATOM 1228 OG1 THR A 79 102.863 -18.070 -15.924 1.00 0.00 O ATOM 1229 CG2 THR A 79 103.675 -19.567 -17.631 1.00 0.00 C ATOM 0 H THR A 79 102.181 -19.278 -14.021 1.00 0.00 H new ATOM 0 HA THR A 79 101.258 -20.203 -16.580 1.00 0.00 H new ATOM 0 HB THR A 79 104.092 -19.672 -15.523 1.00 0.00 H new ATOM 0 HG1 THR A 79 103.616 -17.472 -16.111 1.00 0.00 H new ATOM 0 HG21 THR A 79 104.513 -18.902 -17.839 1.00 0.00 H new ATOM 0 HG22 THR A 79 103.975 -20.598 -17.817 1.00 0.00 H new ATOM 0 HG23 THR A 79 102.838 -19.310 -18.280 1.00 0.00 H new ATOM 1237 N ALA A 80 103.222 -22.304 -15.000 1.00 0.00 N ATOM 1238 CA ALA A 80 103.656 -23.735 -15.018 1.00 0.00 C ATOM 1239 C ALA A 80 102.600 -24.618 -14.328 1.00 0.00 C ATOM 1240 O ALA A 80 102.010 -24.202 -13.350 1.00 0.00 O ATOM 1241 CB ALA A 80 104.969 -23.759 -14.235 1.00 0.00 C ATOM 0 H ALA A 80 103.519 -21.774 -14.180 1.00 0.00 H new ATOM 0 HA ALA A 80 103.778 -24.118 -16.031 1.00 0.00 H new ATOM 0 HB1 ALA A 80 105.354 -24.778 -14.202 1.00 0.00 H new ATOM 0 HB2 ALA A 80 105.696 -23.112 -14.725 1.00 0.00 H new ATOM 0 HB3 ALA A 80 104.793 -23.404 -13.219 1.00 0.00 H new ATOM 1247 N PRO A 81 102.383 -25.814 -14.848 1.00 0.00 N ATOM 1248 CA PRO A 81 101.385 -26.723 -14.230 1.00 0.00 C ATOM 1249 C PRO A 81 101.877 -27.188 -12.845 1.00 0.00 C ATOM 1250 O PRO A 81 103.042 -27.495 -12.691 1.00 0.00 O ATOM 1251 CB PRO A 81 101.304 -27.903 -15.197 1.00 0.00 C ATOM 1252 CG PRO A 81 102.574 -27.861 -15.987 1.00 0.00 C ATOM 1253 CD PRO A 81 103.024 -26.426 -16.028 1.00 0.00 C ATOM 0 HA PRO A 81 100.417 -26.247 -14.074 1.00 0.00 H new ATOM 0 HB2 PRO A 81 101.208 -28.846 -14.658 1.00 0.00 H new ATOM 0 HB3 PRO A 81 100.434 -27.818 -15.848 1.00 0.00 H new ATOM 0 HG2 PRO A 81 103.335 -28.490 -15.526 1.00 0.00 H new ATOM 0 HG3 PRO A 81 102.413 -28.243 -16.995 1.00 0.00 H new ATOM 0 HD2 PRO A 81 104.110 -26.347 -15.977 1.00 0.00 H new ATOM 0 HD3 PRO A 81 102.711 -25.936 -16.950 1.00 0.00 H new ATOM 1261 N PRO A 82 100.982 -27.229 -11.869 1.00 0.00 N ATOM 1262 CA PRO A 82 101.392 -27.656 -10.506 1.00 0.00 C ATOM 1263 C PRO A 82 101.979 -29.082 -10.525 1.00 0.00 C ATOM 1264 O PRO A 82 103.037 -29.303 -9.970 1.00 0.00 O ATOM 1265 CB PRO A 82 100.106 -27.601 -9.677 1.00 0.00 C ATOM 1266 CG PRO A 82 99.129 -26.806 -10.486 1.00 0.00 C ATOM 1267 CD PRO A 82 99.549 -26.896 -11.928 1.00 0.00 C ATOM 0 HA PRO A 82 102.173 -27.017 -10.094 1.00 0.00 H new ATOM 0 HB2 PRO A 82 99.725 -28.603 -9.480 1.00 0.00 H new ATOM 0 HB3 PRO A 82 100.285 -27.132 -8.710 1.00 0.00 H new ATOM 0 HG2 PRO A 82 98.119 -27.195 -10.357 1.00 0.00 H new ATOM 0 HG3 PRO A 82 99.115 -25.767 -10.156 1.00 0.00 H new ATOM 0 HD2 PRO A 82 98.984 -27.662 -12.460 1.00 0.00 H new ATOM 0 HD3 PRO A 82 99.380 -25.955 -12.451 1.00 0.00 H new ATOM 1275 N PRO A 83 101.289 -30.018 -11.161 1.00 0.00 N ATOM 1276 CA PRO A 83 101.799 -31.415 -11.201 1.00 0.00 C ATOM 1277 C PRO A 83 103.154 -31.468 -11.914 1.00 0.00 C ATOM 1278 O PRO A 83 103.373 -30.779 -12.894 1.00 0.00 O ATOM 1279 CB PRO A 83 100.743 -32.186 -11.997 1.00 0.00 C ATOM 1280 CG PRO A 83 99.534 -31.305 -12.032 1.00 0.00 C ATOM 1281 CD PRO A 83 100.013 -29.888 -11.883 1.00 0.00 C ATOM 0 HA PRO A 83 101.953 -31.831 -10.205 1.00 0.00 H new ATOM 0 HB2 PRO A 83 101.096 -32.405 -13.005 1.00 0.00 H new ATOM 0 HB3 PRO A 83 100.517 -33.141 -11.523 1.00 0.00 H new ATOM 0 HG2 PRO A 83 98.993 -31.432 -12.969 1.00 0.00 H new ATOM 0 HG3 PRO A 83 98.845 -31.565 -11.228 1.00 0.00 H new ATOM 0 HD2 PRO A 83 100.150 -29.409 -12.852 1.00 0.00 H new ATOM 0 HD3 PRO A 83 99.299 -29.282 -11.326 1.00 0.00 H new ATOM 1289 N VAL A 84 104.061 -32.279 -11.427 1.00 0.00 N ATOM 1290 CA VAL A 84 105.388 -32.428 -12.102 1.00 0.00 C ATOM 1291 C VAL A 84 105.628 -33.898 -12.463 1.00 0.00 C ATOM 1292 O VAL A 84 105.514 -34.775 -11.627 1.00 0.00 O ATOM 1293 CB VAL A 84 106.423 -31.946 -11.075 1.00 0.00 C ATOM 1294 CG1 VAL A 84 107.827 -32.030 -11.678 1.00 0.00 C ATOM 1295 CG2 VAL A 84 106.132 -30.492 -10.689 1.00 0.00 C ATOM 0 H VAL A 84 103.939 -32.846 -10.588 1.00 0.00 H new ATOM 0 HA VAL A 84 105.447 -31.856 -13.028 1.00 0.00 H new ATOM 0 HB VAL A 84 106.365 -32.579 -10.190 1.00 0.00 H new ATOM 0 HG11 VAL A 84 108.558 -31.687 -10.946 1.00 0.00 H new ATOM 0 HG12 VAL A 84 108.044 -33.062 -11.952 1.00 0.00 H new ATOM 0 HG13 VAL A 84 107.880 -31.400 -12.566 1.00 0.00 H new ATOM 0 HG21 VAL A 84 106.869 -30.155 -9.960 1.00 0.00 H new ATOM 0 HG22 VAL A 84 106.185 -29.862 -11.577 1.00 0.00 H new ATOM 0 HG23 VAL A 84 105.135 -30.423 -10.255 1.00 0.00 H new ATOM 1305 N VAL A 85 105.957 -34.166 -13.704 1.00 0.00 N ATOM 1306 CA VAL A 85 106.206 -35.580 -14.133 1.00 0.00 C ATOM 1307 C VAL A 85 107.530 -36.084 -13.542 1.00 0.00 C ATOM 1308 O VAL A 85 107.611 -37.190 -13.039 1.00 0.00 O ATOM 1309 CB VAL A 85 106.277 -35.533 -15.667 1.00 0.00 C ATOM 1310 CG1 VAL A 85 106.533 -36.939 -16.221 1.00 0.00 C ATOM 1311 CG2 VAL A 85 104.949 -35.009 -16.223 1.00 0.00 C ATOM 0 H VAL A 85 106.064 -33.467 -14.439 1.00 0.00 H new ATOM 0 HA VAL A 85 105.426 -36.259 -13.789 1.00 0.00 H new ATOM 0 HB VAL A 85 107.091 -34.872 -15.966 1.00 0.00 H new ATOM 0 HG11 VAL A 85 106.582 -36.898 -17.309 1.00 0.00 H new ATOM 0 HG12 VAL A 85 107.477 -37.318 -15.829 1.00 0.00 H new ATOM 0 HG13 VAL A 85 105.722 -37.602 -15.919 1.00 0.00 H new ATOM 0 HG21 VAL A 85 104.998 -34.975 -17.311 1.00 0.00 H new ATOM 0 HG22 VAL A 85 104.140 -35.672 -15.917 1.00 0.00 H new ATOM 0 HG23 VAL A 85 104.763 -34.007 -15.837 1.00 0.00 H new ATOM 1321 N ASN A 86 108.561 -35.277 -13.602 1.00 0.00 N ATOM 1322 CA ASN A 86 109.900 -35.717 -13.101 1.00 0.00 C ATOM 1323 C ASN A 86 110.629 -34.552 -12.424 1.00 0.00 C ATOM 1324 O ASN A 86 111.075 -33.628 -13.079 1.00 0.00 O ATOM 1325 CB ASN A 86 110.658 -36.170 -14.349 1.00 0.00 C ATOM 1326 CG ASN A 86 111.993 -36.796 -13.939 1.00 0.00 C ATOM 1327 OD1 ASN A 86 113.034 -36.191 -14.096 1.00 0.00 O ATOM 1328 ND2 ASN A 86 112.005 -37.991 -13.416 1.00 0.00 N ATOM 0 H ASN A 86 108.532 -34.329 -13.978 1.00 0.00 H new ATOM 0 HA ASN A 86 109.820 -36.511 -12.358 1.00 0.00 H new ATOM 0 HB2 ASN A 86 110.062 -36.892 -14.907 1.00 0.00 H new ATOM 0 HB3 ASN A 86 110.831 -35.321 -15.010 1.00 0.00 H new ATOM 0 HD21 ASN A 86 112.889 -38.418 -13.139 1.00 0.00 H new ATOM 0 HD22 ASN A 86 111.130 -38.499 -13.284 1.00 0.00 H new ATOM 1335 N LYS A 87 110.751 -34.594 -11.119 1.00 0.00 N ATOM 1336 CA LYS A 87 111.494 -33.520 -10.392 1.00 0.00 C ATOM 1337 C LYS A 87 112.974 -33.916 -10.230 1.00 0.00 C ATOM 1338 O LYS A 87 113.266 -35.066 -9.968 1.00 0.00 O ATOM 1339 CB LYS A 87 110.813 -33.420 -9.027 1.00 0.00 C ATOM 1340 CG LYS A 87 111.407 -32.249 -8.243 1.00 0.00 C ATOM 1341 CD LYS A 87 110.773 -30.940 -8.720 1.00 0.00 C ATOM 1342 CE LYS A 87 111.680 -29.766 -8.344 1.00 0.00 C ATOM 1343 NZ LYS A 87 111.261 -29.383 -6.967 1.00 0.00 N ATOM 0 H LYS A 87 110.366 -35.329 -10.525 1.00 0.00 H new ATOM 0 HA LYS A 87 111.475 -32.570 -10.926 1.00 0.00 H new ATOM 0 HB2 LYS A 87 109.740 -33.279 -9.154 1.00 0.00 H new ATOM 0 HB3 LYS A 87 110.949 -34.349 -8.472 1.00 0.00 H new ATOM 0 HG2 LYS A 87 111.228 -32.384 -7.176 1.00 0.00 H new ATOM 0 HG3 LYS A 87 112.487 -32.214 -8.384 1.00 0.00 H new ATOM 0 HD2 LYS A 87 110.625 -30.968 -9.800 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.790 -30.813 -8.267 1.00 0.00 H new ATOM 0 HE2 LYS A 87 112.731 -30.054 -8.371 1.00 0.00 H new ATOM 0 HE3 LYS A 87 111.559 -28.935 -9.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 111.838 -28.583 -6.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 110.258 -29.107 -6.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 111.394 -30.191 -6.326 1.00 0.00 H new ATOM 1357 N PRO A 88 113.874 -32.960 -10.387 1.00 0.00 N ATOM 1358 CA PRO A 88 115.322 -33.271 -10.253 1.00 0.00 C ATOM 1359 C PRO A 88 115.632 -33.773 -8.840 1.00 0.00 C ATOM 1360 O PRO A 88 115.029 -33.343 -7.875 1.00 0.00 O ATOM 1361 CB PRO A 88 116.025 -31.938 -10.519 1.00 0.00 C ATOM 1362 CG PRO A 88 114.970 -30.888 -10.378 1.00 0.00 C ATOM 1363 CD PRO A 88 113.652 -31.536 -10.695 1.00 0.00 C ATOM 0 HA PRO A 88 115.647 -34.054 -10.939 1.00 0.00 H new ATOM 0 HB2 PRO A 88 116.836 -31.775 -9.810 1.00 0.00 H new ATOM 0 HB3 PRO A 88 116.465 -31.920 -11.516 1.00 0.00 H new ATOM 0 HG2 PRO A 88 114.965 -30.481 -9.367 1.00 0.00 H new ATOM 0 HG3 PRO A 88 115.162 -30.056 -11.055 1.00 0.00 H new ATOM 0 HD2 PRO A 88 112.846 -31.118 -10.092 1.00 0.00 H new ATOM 0 HD3 PRO A 88 113.377 -31.391 -11.740 1.00 0.00 H new ATOM 1371 N THR A 89 116.569 -34.683 -8.718 1.00 0.00 N ATOM 1372 CA THR A 89 116.946 -35.210 -7.371 1.00 0.00 C ATOM 1373 C THR A 89 118.447 -34.983 -7.110 1.00 0.00 C ATOM 1374 O THR A 89 119.266 -35.735 -7.599 1.00 0.00 O ATOM 1375 CB THR A 89 116.632 -36.705 -7.430 1.00 0.00 C ATOM 1376 OG1 THR A 89 117.354 -37.297 -8.501 1.00 0.00 O ATOM 1377 CG2 THR A 89 115.133 -36.907 -7.649 1.00 0.00 C ATOM 0 H THR A 89 117.090 -35.084 -9.498 1.00 0.00 H new ATOM 0 HA THR A 89 116.406 -34.711 -6.566 1.00 0.00 H new ATOM 0 HB THR A 89 116.924 -37.174 -6.491 1.00 0.00 H new ATOM 0 HG1 THR A 89 118.268 -36.943 -8.515 1.00 0.00 H new ATOM 0 HG21 THR A 89 114.912 -37.974 -7.691 1.00 0.00 H new ATOM 0 HG22 THR A 89 114.581 -36.454 -6.826 1.00 0.00 H new ATOM 0 HG23 THR A 89 114.836 -36.438 -8.587 1.00 0.00 H new ATOM 1385 N PRO A 90 118.775 -33.954 -6.347 1.00 0.00 N ATOM 1386 CA PRO A 90 120.204 -33.675 -6.042 1.00 0.00 C ATOM 1387 C PRO A 90 120.840 -34.868 -5.319 1.00 0.00 C ATOM 1388 O PRO A 90 122.029 -35.102 -5.421 1.00 0.00 O ATOM 1389 CB PRO A 90 120.166 -32.448 -5.129 1.00 0.00 C ATOM 1390 CG PRO A 90 118.804 -31.855 -5.303 1.00 0.00 C ATOM 1391 CD PRO A 90 117.881 -32.971 -5.710 1.00 0.00 C ATOM 0 HA PRO A 90 120.798 -33.505 -6.940 1.00 0.00 H new ATOM 0 HB2 PRO A 90 120.341 -32.728 -4.090 1.00 0.00 H new ATOM 0 HB3 PRO A 90 120.942 -31.733 -5.402 1.00 0.00 H new ATOM 0 HG2 PRO A 90 118.464 -31.394 -4.376 1.00 0.00 H new ATOM 0 HG3 PRO A 90 118.819 -31.072 -6.062 1.00 0.00 H new ATOM 0 HD2 PRO A 90 117.366 -33.398 -4.849 1.00 0.00 H new ATOM 0 HD3 PRO A 90 117.113 -32.623 -6.401 1.00 0.00 H new ATOM 1399 N VAL A 91 120.050 -35.616 -4.589 1.00 0.00 N ATOM 1400 CA VAL A 91 120.588 -36.810 -3.866 1.00 0.00 C ATOM 1401 C VAL A 91 119.715 -38.039 -4.146 1.00 0.00 C ATOM 1402 O VAL A 91 118.550 -37.917 -4.480 1.00 0.00 O ATOM 1403 CB VAL A 91 120.548 -36.437 -2.377 1.00 0.00 C ATOM 1404 CG1 VAL A 91 121.439 -35.217 -2.133 1.00 0.00 C ATOM 1405 CG2 VAL A 91 119.111 -36.104 -1.954 1.00 0.00 C ATOM 0 H VAL A 91 119.052 -35.450 -4.462 1.00 0.00 H new ATOM 0 HA VAL A 91 121.598 -37.063 -4.187 1.00 0.00 H new ATOM 0 HB VAL A 91 120.908 -37.283 -1.791 1.00 0.00 H new ATOM 0 HG11 VAL A 91 121.411 -34.952 -1.076 1.00 0.00 H new ATOM 0 HG12 VAL A 91 122.464 -35.451 -2.421 1.00 0.00 H new ATOM 0 HG13 VAL A 91 121.078 -34.378 -2.727 1.00 0.00 H new ATOM 0 HG21 VAL A 91 119.095 -35.841 -0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.744 -35.263 -2.543 1.00 0.00 H new ATOM 0 HG23 VAL A 91 118.472 -36.971 -2.122 1.00 0.00 H new ATOM 1415 N LYS A 92 120.274 -39.217 -4.012 1.00 0.00 N ATOM 1416 CA LYS A 92 119.482 -40.466 -4.264 1.00 0.00 C ATOM 1417 C LYS A 92 118.278 -40.532 -3.319 1.00 0.00 C ATOM 1418 O LYS A 92 117.199 -40.943 -3.704 1.00 0.00 O ATOM 1419 CB LYS A 92 120.445 -41.623 -3.984 1.00 0.00 C ATOM 1420 CG LYS A 92 119.772 -42.948 -4.350 1.00 0.00 C ATOM 1421 CD LYS A 92 120.712 -44.108 -4.016 1.00 0.00 C ATOM 1422 CE LYS A 92 120.111 -45.417 -4.532 1.00 0.00 C ATOM 1423 NZ LYS A 92 120.713 -45.612 -5.879 1.00 0.00 N ATOM 0 H LYS A 92 121.245 -39.370 -3.739 1.00 0.00 H new ATOM 0 HA LYS A 92 119.092 -40.502 -5.281 1.00 0.00 H new ATOM 0 HB2 LYS A 92 121.360 -41.496 -4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 92 120.730 -41.626 -2.932 1.00 0.00 H new ATOM 0 HG2 LYS A 92 118.836 -43.056 -3.803 1.00 0.00 H new ATOM 0 HG3 LYS A 92 119.524 -42.961 -5.411 1.00 0.00 H new ATOM 0 HD2 LYS A 92 121.689 -43.940 -4.469 1.00 0.00 H new ATOM 0 HD3 LYS A 92 120.866 -44.166 -2.939 1.00 0.00 H new ATOM 0 HE2 LYS A 92 120.349 -46.249 -3.869 1.00 0.00 H new ATOM 0 HE3 LYS A 92 119.024 -45.357 -4.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 120.349 -46.491 -6.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 120.464 -44.808 -6.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 121.748 -45.673 -5.791 1.00 0.00 H new ATOM 1437 N LEU A 93 118.462 -40.128 -2.086 1.00 0.00 N ATOM 1438 CA LEU A 93 117.333 -40.148 -1.104 1.00 0.00 C ATOM 1439 C LEU A 93 116.949 -38.709 -0.711 1.00 0.00 C ATOM 1440 O LEU A 93 117.707 -38.046 -0.031 1.00 0.00 O ATOM 1441 CB LEU A 93 117.886 -40.905 0.113 1.00 0.00 C ATOM 1442 CG LEU A 93 116.744 -41.549 0.920 1.00 0.00 C ATOM 1443 CD1 LEU A 93 115.773 -40.470 1.413 1.00 0.00 C ATOM 1444 CD2 LEU A 93 115.990 -42.556 0.045 1.00 0.00 C ATOM 0 H LEU A 93 119.348 -39.784 -1.716 1.00 0.00 H new ATOM 0 HA LEU A 93 116.437 -40.619 -1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 93 118.583 -41.675 -0.218 1.00 0.00 H new ATOM 0 HB3 LEU A 93 118.446 -40.220 0.750 1.00 0.00 H new ATOM 0 HG LEU A 93 117.170 -42.066 1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 93 114.969 -40.937 1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 93 116.306 -39.764 2.050 1.00 0.00 H new ATOM 0 HD13 LEU A 93 115.352 -39.941 0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 93 115.183 -43.008 0.623 1.00 0.00 H new ATOM 0 HD22 LEU A 93 115.573 -42.044 -0.822 1.00 0.00 H new ATOM 0 HD23 LEU A 93 116.677 -43.334 -0.289 1.00 0.00 H new ATOM 1456 N PRO A 94 115.782 -38.252 -1.143 1.00 0.00 N ATOM 1457 CA PRO A 94 115.342 -36.875 -0.788 1.00 0.00 C ATOM 1458 C PRO A 94 115.261 -36.709 0.735 1.00 0.00 C ATOM 1459 O PRO A 94 114.829 -37.602 1.440 1.00 0.00 O ATOM 1460 CB PRO A 94 113.953 -36.747 -1.418 1.00 0.00 C ATOM 1461 CG PRO A 94 113.870 -37.839 -2.437 1.00 0.00 C ATOM 1462 CD PRO A 94 114.785 -38.941 -1.980 1.00 0.00 C ATOM 0 HA PRO A 94 116.034 -36.112 -1.145 1.00 0.00 H new ATOM 0 HB2 PRO A 94 113.171 -36.852 -0.666 1.00 0.00 H new ATOM 0 HB3 PRO A 94 113.821 -35.769 -1.880 1.00 0.00 H new ATOM 0 HG2 PRO A 94 112.846 -38.202 -2.530 1.00 0.00 H new ATOM 0 HG3 PRO A 94 114.169 -37.473 -3.419 1.00 0.00 H new ATOM 0 HD2 PRO A 94 114.244 -39.700 -1.414 1.00 0.00 H new ATOM 0 HD3 PRO A 94 115.254 -39.447 -2.824 1.00 0.00 H new ATOM 1470 N HIS A 95 115.678 -35.573 1.238 1.00 0.00 N ATOM 1471 CA HIS A 95 115.663 -35.346 2.717 1.00 0.00 C ATOM 1472 C HIS A 95 114.505 -34.422 3.124 1.00 0.00 C ATOM 1473 O HIS A 95 114.511 -33.862 4.205 1.00 0.00 O ATOM 1474 CB HIS A 95 117.006 -34.683 3.024 1.00 0.00 C ATOM 1475 CG HIS A 95 118.192 -35.518 2.623 1.00 0.00 C ATOM 1476 ND1 HIS A 95 118.538 -36.681 3.293 1.00 0.00 N ATOM 1477 CD2 HIS A 95 119.121 -35.371 1.623 1.00 0.00 C ATOM 1478 CE1 HIS A 95 119.633 -37.184 2.693 1.00 0.00 C ATOM 1479 NE2 HIS A 95 120.029 -36.424 1.669 1.00 0.00 N ATOM 0 H HIS A 95 116.029 -34.790 0.686 1.00 0.00 H new ATOM 0 HA HIS A 95 115.521 -36.276 3.267 1.00 0.00 H new ATOM 0 HB2 HIS A 95 117.055 -33.724 2.508 1.00 0.00 H new ATOM 0 HB3 HIS A 95 117.063 -34.474 4.092 1.00 0.00 H new ATOM 0 HD2 HIS A 95 119.144 -34.561 0.909 1.00 0.00 H new ATOM 0 HE1 HIS A 95 120.130 -38.091 3.002 1.00 0.00 H new ATOM 0 HE2 HIS A 95 120.826 -36.582 1.053 1.00 0.00 H new ATOM 1487 N PHE A 96 113.515 -34.256 2.272 1.00 0.00 N ATOM 1488 CA PHE A 96 112.375 -33.339 2.607 1.00 0.00 C ATOM 1489 C PHE A 96 111.678 -33.803 3.890 1.00 0.00 C ATOM 1490 O PHE A 96 111.261 -32.998 4.703 1.00 0.00 O ATOM 1491 CB PHE A 96 111.415 -33.426 1.418 1.00 0.00 C ATOM 1492 CG PHE A 96 111.976 -32.837 0.145 1.00 0.00 C ATOM 1493 CD1 PHE A 96 111.891 -31.424 -0.090 1.00 0.00 C ATOM 1494 CD2 PHE A 96 112.594 -33.691 -0.828 1.00 0.00 C ATOM 1495 CE1 PHE A 96 112.425 -30.865 -1.299 1.00 0.00 C ATOM 1496 CE2 PHE A 96 113.127 -33.133 -2.037 1.00 0.00 C ATOM 1497 CZ PHE A 96 113.043 -31.719 -2.273 1.00 0.00 C ATOM 0 H PHE A 96 113.448 -34.714 1.363 1.00 0.00 H new ATOM 0 HA PHE A 96 112.714 -32.317 2.778 1.00 0.00 H new ATOM 0 HB2 PHE A 96 111.160 -34.471 1.243 1.00 0.00 H new ATOM 0 HB3 PHE A 96 110.489 -32.909 1.671 1.00 0.00 H new ATOM 0 HD1 PHE A 96 111.425 -30.782 0.643 1.00 0.00 H new ATOM 0 HD2 PHE A 96 112.658 -34.754 -0.650 1.00 0.00 H new ATOM 0 HE1 PHE A 96 112.362 -29.801 -1.476 1.00 0.00 H new ATOM 0 HE2 PHE A 96 113.591 -33.776 -2.770 1.00 0.00 H new ATOM 0 HZ PHE A 96 113.445 -31.298 -3.183 1.00 0.00 H new ATOM 1507 N SER A 97 111.552 -35.095 4.073 1.00 0.00 N ATOM 1508 CA SER A 97 110.894 -35.626 5.305 1.00 0.00 C ATOM 1509 C SER A 97 111.820 -36.619 6.012 1.00 0.00 C ATOM 1510 O SER A 97 112.510 -37.395 5.378 1.00 0.00 O ATOM 1511 CB SER A 97 109.633 -36.330 4.808 1.00 0.00 C ATOM 1512 OG SER A 97 108.871 -36.774 5.923 1.00 0.00 O ATOM 0 H SER A 97 111.878 -35.806 3.419 1.00 0.00 H new ATOM 0 HA SER A 97 110.665 -34.839 6.023 1.00 0.00 H new ATOM 0 HB2 SER A 97 109.041 -35.650 4.196 1.00 0.00 H new ATOM 0 HB3 SER A 97 109.901 -37.177 4.176 1.00 0.00 H new ATOM 0 HG SER A 97 108.878 -37.753 5.955 1.00 0.00 H new ATOM 1518 N ASN A 98 111.837 -36.597 7.324 1.00 0.00 N ATOM 1519 CA ASN A 98 112.708 -37.549 8.090 1.00 0.00 C ATOM 1520 C ASN A 98 112.340 -38.997 7.752 1.00 0.00 C ATOM 1521 O ASN A 98 113.191 -39.867 7.704 1.00 0.00 O ATOM 1522 CB ASN A 98 112.428 -37.259 9.568 1.00 0.00 C ATOM 1523 CG ASN A 98 112.881 -35.837 9.911 1.00 0.00 C ATOM 1524 OD1 ASN A 98 113.701 -35.262 9.222 1.00 0.00 O ATOM 1525 ND2 ASN A 98 112.378 -35.241 10.958 1.00 0.00 N ATOM 0 H ASN A 98 111.285 -35.961 7.899 1.00 0.00 H new ATOM 0 HA ASN A 98 113.762 -37.421 7.845 1.00 0.00 H new ATOM 0 HB2 ASN A 98 111.364 -37.372 9.775 1.00 0.00 H new ATOM 0 HB3 ASN A 98 112.953 -37.979 10.195 1.00 0.00 H new ATOM 0 HD21 ASN A 98 112.673 -34.294 11.197 1.00 0.00 H new ATOM 0 HD22 ASN A 98 111.690 -35.722 11.537 1.00 0.00 H new ATOM 1532 N ILE A 99 111.076 -39.256 7.519 1.00 0.00 N ATOM 1533 CA ILE A 99 110.635 -40.643 7.174 1.00 0.00 C ATOM 1534 C ILE A 99 110.062 -40.675 5.754 1.00 0.00 C ATOM 1535 O ILE A 99 109.284 -39.819 5.374 1.00 0.00 O ATOM 1536 CB ILE A 99 109.548 -40.995 8.203 1.00 0.00 C ATOM 1537 CG1 ILE A 99 110.098 -40.863 9.637 1.00 0.00 C ATOM 1538 CG2 ILE A 99 109.067 -42.431 7.969 1.00 0.00 C ATOM 1539 CD1 ILE A 99 111.308 -41.788 9.838 1.00 0.00 C ATOM 0 H ILE A 99 110.328 -38.563 7.553 1.00 0.00 H new ATOM 0 HA ILE A 99 111.460 -41.354 7.203 1.00 0.00 H new ATOM 0 HB ILE A 99 108.715 -40.303 8.083 1.00 0.00 H new ATOM 0 HG12 ILE A 99 110.387 -39.830 9.828 1.00 0.00 H new ATOM 0 HG13 ILE A 99 109.318 -41.114 10.356 1.00 0.00 H new ATOM 0 HG21 ILE A 99 108.297 -42.680 8.699 1.00 0.00 H new ATOM 0 HG22 ILE A 99 108.656 -42.518 6.963 1.00 0.00 H new ATOM 0 HG23 ILE A 99 109.906 -43.118 8.078 1.00 0.00 H new ATOM 0 HD11 ILE A 99 111.683 -41.681 10.856 1.00 0.00 H new ATOM 0 HD12 ILE A 99 111.008 -42.822 9.669 1.00 0.00 H new ATOM 0 HD13 ILE A 99 112.094 -41.518 9.132 1.00 0.00 H new ATOM 1551 N LEU A 100 110.442 -41.656 4.973 1.00 0.00 N ATOM 1552 CA LEU A 100 109.929 -41.754 3.573 1.00 0.00 C ATOM 1553 C LEU A 100 108.783 -42.768 3.500 1.00 0.00 C ATOM 1554 O LEU A 100 108.896 -43.879 3.986 1.00 0.00 O ATOM 1555 CB LEU A 100 111.122 -42.233 2.747 1.00 0.00 C ATOM 1556 CG LEU A 100 110.792 -42.119 1.258 1.00 0.00 C ATOM 1557 CD1 LEU A 100 112.087 -41.970 0.456 1.00 0.00 C ATOM 1558 CD2 LEU A 100 110.054 -43.379 0.801 1.00 0.00 C ATOM 0 H LEU A 100 111.088 -42.396 5.247 1.00 0.00 H new ATOM 0 HA LEU A 100 109.537 -40.804 3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 100 112.003 -41.636 2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 100 111.361 -43.266 2.999 1.00 0.00 H new ATOM 0 HG LEU A 100 110.160 -41.246 1.093 1.00 0.00 H new ATOM 0 HD11 LEU A 100 111.851 -41.889 -0.605 1.00 0.00 H new ATOM 0 HD12 LEU A 100 112.614 -41.073 0.780 1.00 0.00 H new ATOM 0 HD13 LEU A 100 112.720 -42.842 0.621 1.00 0.00 H new ATOM 0 HD21 LEU A 100 109.819 -43.298 -0.260 1.00 0.00 H new ATOM 0 HD22 LEU A 100 110.686 -44.251 0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 100 109.131 -43.486 1.370 1.00 0.00 H new ATOM 1570 N GLY A 101 107.684 -42.388 2.895 1.00 0.00 N ATOM 1571 CA GLY A 101 106.520 -43.318 2.783 1.00 0.00 C ATOM 1572 C GLY A 101 105.830 -43.439 4.142 1.00 0.00 C ATOM 1573 O GLY A 101 105.162 -42.496 4.532 1.00 0.00 O ATOM 1574 OXT GLY A 101 105.980 -44.475 4.770 1.00 0.00 O ATOM 0 H GLY A 101 107.544 -41.470 2.473 1.00 0.00 H new ATOM 0 HA2 GLY A 101 105.816 -42.948 2.038 1.00 0.00 H new ATOM 0 HA3 GLY A 101 106.856 -44.298 2.445 1.00 0.00 H new TER 1578 GLY A 101