USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 935 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 81 ASN : amide:sc= -3.74! C(o=-4.2!,f=-11!) USER MOD Set 1.2: A 124 GLN : amide:sc= -0.422 X(o=-4.2,f=-3.8) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.0407 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.0271 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0267 USER MOD Single : A 28 SER OG : rot -53:sc= 0.119 USER MOD Single : A 29 THR OG1 : rot -13:sc= -0.232! USER MOD Single : A 40 SER OG : rot 71:sc= -1.33 USER MOD Single : A 42 GLN : amide:sc= -0.422 K(o=-0.42,f=-5.2!) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -2.64! C(o=-2.6!,f=-2.4!) USER MOD Single : A 58 THR OG1 : rot 103:sc= 0.0923 USER MOD Single : A 59 THR OG1 : rot 180:sc=0.000121 USER MOD Single : A 60 TYR OH : rot 30:sc= -1.7! USER MOD Single : A 61 THR OG1 : rot 180:sc= -2.28! USER MOD Single : A 64 TYR OH : rot 180:sc= -0.55 USER MOD Single : A 65 THR OG1 : rot 180:sc= -1.55! USER MOD Single : A 67 THR OG1 : rot 143:sc= -2.27! USER MOD Single : A 69 SER OG : rot 180:sc= 0.0215 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -8.38! C(o=-8.4!,f=-12!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0941 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= -0.165 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.307 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.676 K(o=-0.68,f=-0.0032) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.212 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 60:sc= 0.104 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 112 TYR OH : rot 5:sc= -4.13! USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 133 SER OG : rot -139:sc= 0.723 USER MOD Single : A 138 THR OG1 : rot -87:sc= -1.45! USER MOD Single : A 148 SER OG : rot 64:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -9.432 5.687 8.474 1.00 0.00 N ATOM 25 CA PRO A 3 -8.608 5.414 7.275 1.00 0.00 C ATOM 26 C PRO A 3 -7.230 4.892 7.692 1.00 0.00 C ATOM 27 O PRO A 3 -7.057 4.357 8.769 1.00 0.00 O ATOM 28 CB PRO A 3 -8.499 6.780 6.600 1.00 0.00 C ATOM 29 CG PRO A 3 -8.694 7.777 7.697 1.00 0.00 C ATOM 30 CD PRO A 3 -9.532 7.120 8.763 1.00 0.00 C ATOM 0 HA PRO A 3 -9.034 4.656 6.617 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.528 6.906 6.121 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.255 6.897 5.823 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -7.733 8.091 8.104 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.188 8.672 7.318 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -9.158 7.351 9.761 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.566 7.462 8.723 1.00 0.00 H new ATOM 38 N ILE A 4 -6.248 5.044 6.848 1.00 0.00 N ATOM 39 CA ILE A 4 -4.882 4.557 7.196 1.00 0.00 C ATOM 40 C ILE A 4 -4.048 5.699 7.783 1.00 0.00 C ATOM 41 O ILE A 4 -2.834 5.680 7.739 1.00 0.00 O ATOM 42 CB ILE A 4 -4.283 4.081 5.873 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.941 5.293 5.003 1.00 0.00 C ATOM 44 CG2 ILE A 4 -5.295 3.199 5.140 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.366 4.818 3.668 1.00 0.00 C ATOM 0 H ILE A 4 -6.331 5.484 5.932 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.904 3.763 7.943 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.378 3.507 6.071 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.834 5.895 4.833 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -3.220 5.930 5.515 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.866 2.860 4.197 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.540 2.335 5.758 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -6.201 3.772 4.942 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.123 5.681 3.049 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.463 4.234 3.848 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.102 4.199 3.154 1.00 0.00 H new ATOM 57 N GLY A 5 -4.691 6.693 8.331 1.00 0.00 N ATOM 58 CA GLY A 5 -3.935 7.835 8.918 1.00 0.00 C ATOM 59 C GLY A 5 -3.804 8.948 7.878 1.00 0.00 C ATOM 60 O GLY A 5 -3.628 10.103 8.209 1.00 0.00 O ATOM 0 H GLY A 5 -5.706 6.764 8.398 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -4.449 8.209 9.803 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -2.947 7.504 9.239 1.00 0.00 H new ATOM 64 N GLU A 6 -3.890 8.609 6.620 1.00 0.00 N ATOM 65 CA GLU A 6 -3.771 9.648 5.559 1.00 0.00 C ATOM 66 C GLU A 6 -2.605 10.589 5.869 1.00 0.00 C ATOM 67 O GLU A 6 -2.797 11.719 6.272 1.00 0.00 O ATOM 68 CB GLU A 6 -5.098 10.407 5.599 1.00 0.00 C ATOM 69 CG GLU A 6 -5.739 10.390 4.210 1.00 0.00 C ATOM 70 CD GLU A 6 -7.241 10.650 4.339 1.00 0.00 C ATOM 71 OE1 GLU A 6 -7.609 11.494 5.139 1.00 0.00 O ATOM 72 OE2 GLU A 6 -7.997 10.002 3.634 1.00 0.00 O ATOM 0 H GLU A 6 -4.037 7.658 6.282 1.00 0.00 H new ATOM 0 HA GLU A 6 -3.577 9.216 4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -5.769 9.949 6.326 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.931 11.435 5.922 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.281 11.150 3.577 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -5.566 9.427 3.729 1.00 0.00 H new ATOM 79 N GLY A 7 -1.396 10.133 5.684 1.00 0.00 N ATOM 80 CA GLY A 7 -0.221 11.004 5.970 1.00 0.00 C ATOM 81 C GLY A 7 1.024 10.423 5.300 1.00 0.00 C ATOM 82 O GLY A 7 0.937 9.582 4.427 1.00 0.00 O ATOM 0 H GLY A 7 -1.172 9.197 5.348 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.406 12.013 5.603 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.065 11.080 7.046 1.00 0.00 H new ATOM 86 N THR A 8 2.184 10.866 5.700 1.00 0.00 N ATOM 87 CA THR A 8 3.436 10.339 5.085 1.00 0.00 C ATOM 88 C THR A 8 4.289 9.630 6.140 1.00 0.00 C ATOM 89 O THR A 8 5.502 9.660 6.093 1.00 0.00 O ATOM 90 CB THR A 8 4.164 11.574 4.551 1.00 0.00 C ATOM 91 OG1 THR A 8 4.674 12.328 5.642 1.00 0.00 O ATOM 92 CG2 THR A 8 3.190 12.434 3.744 1.00 0.00 C ATOM 0 H THR A 8 2.320 11.570 6.426 1.00 0.00 H new ATOM 0 HA THR A 8 3.234 9.611 4.299 1.00 0.00 H new ATOM 0 HB THR A 8 4.987 11.262 3.908 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.142 13.119 5.302 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.710 13.314 3.364 1.00 0.00 H new ATOM 0 HG22 THR A 8 2.799 11.854 2.908 1.00 0.00 H new ATOM 0 HG23 THR A 8 2.366 12.748 4.384 1.00 0.00 H new ATOM 100 N PHE A 9 3.665 8.991 7.091 1.00 0.00 N ATOM 101 CA PHE A 9 4.444 8.281 8.145 1.00 0.00 C ATOM 102 C PHE A 9 5.329 9.273 8.905 1.00 0.00 C ATOM 103 O PHE A 9 6.505 9.045 9.105 1.00 0.00 O ATOM 104 CB PHE A 9 5.304 7.269 7.386 1.00 0.00 C ATOM 105 CG PHE A 9 4.443 6.517 6.399 1.00 0.00 C ATOM 106 CD1 PHE A 9 3.249 5.923 6.824 1.00 0.00 C ATOM 107 CD2 PHE A 9 4.840 6.411 5.061 1.00 0.00 C ATOM 108 CE1 PHE A 9 2.451 5.223 5.910 1.00 0.00 C ATOM 109 CE2 PHE A 9 4.042 5.712 4.147 1.00 0.00 C ATOM 110 CZ PHE A 9 2.848 5.118 4.572 1.00 0.00 C ATOM 0 H PHE A 9 2.651 8.930 7.184 1.00 0.00 H new ATOM 0 HA PHE A 9 3.801 7.799 8.881 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.112 7.781 6.864 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.767 6.573 8.085 1.00 0.00 H new ATOM 0 HD1 PHE A 9 2.943 6.004 7.857 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.762 6.868 4.733 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.530 4.764 6.238 1.00 0.00 H new ATOM 0 HE2 PHE A 9 4.348 5.631 3.114 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.233 4.578 3.867 1.00 0.00 H new ATOM 120 N ASP A 10 4.772 10.375 9.328 1.00 0.00 N ATOM 121 CA ASP A 10 5.582 11.382 10.073 1.00 0.00 C ATOM 122 C ASP A 10 5.532 11.098 11.576 1.00 0.00 C ATOM 123 O ASP A 10 5.589 12.002 12.387 1.00 0.00 O ATOM 124 CB ASP A 10 4.927 12.727 9.758 1.00 0.00 C ATOM 125 CG ASP A 10 5.645 13.837 10.528 1.00 0.00 C ATOM 126 OD1 ASP A 10 6.787 14.114 10.201 1.00 0.00 O ATOM 127 OD2 ASP A 10 5.041 14.390 11.432 1.00 0.00 O ATOM 0 H ASP A 10 3.792 10.622 9.190 1.00 0.00 H new ATOM 0 HA ASP A 10 6.633 11.362 9.784 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.973 12.924 8.687 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.872 12.703 10.032 1.00 0.00 H new ATOM 132 N ASP A 11 5.430 9.846 11.950 1.00 0.00 N ATOM 133 CA ASP A 11 5.375 9.478 13.401 1.00 0.00 C ATOM 134 C ASP A 11 4.808 8.065 13.561 1.00 0.00 C ATOM 135 O ASP A 11 4.066 7.784 14.480 1.00 0.00 O ATOM 136 CB ASP A 11 4.433 10.493 14.057 1.00 0.00 C ATOM 137 CG ASP A 11 5.243 11.450 14.933 1.00 0.00 C ATOM 138 OD1 ASP A 11 6.055 10.969 15.707 1.00 0.00 O ATOM 139 OD2 ASP A 11 5.038 12.646 14.815 1.00 0.00 O ATOM 0 H ASP A 11 5.382 9.056 11.307 1.00 0.00 H new ATOM 0 HA ASP A 11 6.365 9.494 13.856 1.00 0.00 H new ATOM 0 HB2 ASP A 11 3.894 11.052 13.292 1.00 0.00 H new ATOM 0 HB3 ASP A 11 3.686 9.976 14.659 1.00 0.00 H new ATOM 144 N GLY A 12 5.153 7.174 12.672 1.00 0.00 N ATOM 145 CA GLY A 12 4.634 5.781 12.773 1.00 0.00 C ATOM 146 C GLY A 12 3.970 5.386 11.452 1.00 0.00 C ATOM 147 O GLY A 12 3.229 6.156 10.875 1.00 0.00 O ATOM 0 H GLY A 12 5.772 7.351 11.880 1.00 0.00 H new ATOM 0 HA2 GLY A 12 5.449 5.094 13.002 1.00 0.00 H new ATOM 0 HA3 GLY A 12 3.916 5.708 13.589 1.00 0.00 H new ATOM 151 N PRO A 13 4.261 4.189 11.017 1.00 0.00 N ATOM 152 CA PRO A 13 3.686 3.678 9.750 1.00 0.00 C ATOM 153 C PRO A 13 2.213 3.303 9.939 1.00 0.00 C ATOM 154 O PRO A 13 1.562 2.833 9.028 1.00 0.00 O ATOM 155 CB PRO A 13 4.525 2.439 9.451 1.00 0.00 C ATOM 156 CG PRO A 13 5.045 1.989 10.780 1.00 0.00 C ATOM 157 CD PRO A 13 5.146 3.210 11.659 1.00 0.00 C ATOM 0 HA PRO A 13 3.711 4.412 8.944 1.00 0.00 H new ATOM 0 HB2 PRO A 13 3.925 1.661 8.979 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.341 2.671 8.767 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.377 1.250 11.224 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.019 1.513 10.670 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.828 2.994 12.679 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.171 3.576 11.716 1.00 0.00 H new ATOM 165 N GLU A 14 1.684 3.506 11.116 1.00 0.00 N ATOM 166 CA GLU A 14 0.253 3.160 11.370 1.00 0.00 C ATOM 167 C GLU A 14 0.059 1.641 11.330 1.00 0.00 C ATOM 168 O GLU A 14 0.064 0.980 12.350 1.00 0.00 O ATOM 169 CB GLU A 14 -0.537 3.841 10.248 1.00 0.00 C ATOM 170 CG GLU A 14 -1.435 4.926 10.846 1.00 0.00 C ATOM 171 CD GLU A 14 -0.874 6.305 10.497 1.00 0.00 C ATOM 172 OE1 GLU A 14 -0.798 6.611 9.318 1.00 0.00 O ATOM 173 OE2 GLU A 14 -0.529 7.032 11.414 1.00 0.00 O ATOM 0 H GLU A 14 2.182 3.898 11.915 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.081 3.494 12.352 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.147 4.279 9.521 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -1.141 3.106 9.715 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -2.449 4.826 10.460 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.493 4.809 11.928 1.00 0.00 H new ATOM 180 N GLY A 15 -0.115 1.080 10.165 1.00 0.00 N ATOM 181 CA GLY A 15 -0.310 -0.395 10.072 1.00 0.00 C ATOM 182 C GLY A 15 0.502 -0.953 8.901 1.00 0.00 C ATOM 183 O GLY A 15 0.415 -2.120 8.575 1.00 0.00 O ATOM 0 H GLY A 15 -0.131 1.578 9.275 1.00 0.00 H new ATOM 0 HA2 GLY A 15 0.001 -0.871 11.002 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.367 -0.623 9.935 1.00 0.00 H new ATOM 187 N TRP A 16 1.290 -0.131 8.265 1.00 0.00 N ATOM 188 CA TRP A 16 2.104 -0.618 7.114 1.00 0.00 C ATOM 189 C TRP A 16 3.140 -1.639 7.592 1.00 0.00 C ATOM 190 O TRP A 16 4.135 -1.290 8.194 1.00 0.00 O ATOM 191 CB TRP A 16 2.801 0.629 6.567 1.00 0.00 C ATOM 192 CG TRP A 16 1.897 1.326 5.600 1.00 0.00 C ATOM 193 CD1 TRP A 16 1.211 2.462 5.861 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.573 0.957 4.228 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.486 2.814 4.737 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.676 1.918 3.704 1.00 0.00 C ATOM 197 CE3 TRP A 16 1.966 -0.107 3.396 1.00 0.00 C ATOM 198 CZ2 TRP A 16 0.186 1.827 2.401 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.474 -0.201 2.083 1.00 0.00 C ATOM 200 CH2 TRP A 16 0.586 0.764 1.587 1.00 0.00 C ATOM 0 H TRP A 16 1.406 0.857 8.492 1.00 0.00 H new ATOM 0 HA TRP A 16 1.494 -1.112 6.358 1.00 0.00 H new ATOM 0 HB2 TRP A 16 3.062 1.300 7.385 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.732 0.351 6.074 1.00 0.00 H new ATOM 0 HD1 TRP A 16 1.227 3.005 6.794 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -0.116 3.636 4.678 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.650 -0.856 3.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.498 2.573 2.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 1.782 -1.022 1.452 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.212 0.686 0.577 1.00 0.00 H new ATOM 211 N VAL A 17 2.918 -2.897 7.326 1.00 0.00 N ATOM 212 CA VAL A 17 3.900 -3.932 7.766 1.00 0.00 C ATOM 213 C VAL A 17 4.561 -4.572 6.543 1.00 0.00 C ATOM 214 O VAL A 17 3.976 -4.651 5.483 1.00 0.00 O ATOM 215 CB VAL A 17 3.091 -4.976 8.564 1.00 0.00 C ATOM 216 CG1 VAL A 17 1.928 -4.298 9.296 1.00 0.00 C ATOM 217 CG2 VAL A 17 2.536 -6.054 7.621 1.00 0.00 C ATOM 0 H VAL A 17 2.104 -3.253 6.826 1.00 0.00 H new ATOM 0 HA VAL A 17 4.695 -3.506 8.378 1.00 0.00 H new ATOM 0 HB VAL A 17 3.755 -5.441 9.292 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.365 -5.045 9.855 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.319 -3.548 9.984 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.272 -3.818 8.570 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.968 -6.784 8.197 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.885 -5.589 6.881 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.361 -6.555 7.115 1.00 0.00 H new ATOM 227 N ALA A 18 5.767 -5.041 6.684 1.00 0.00 N ATOM 228 CA ALA A 18 6.448 -5.686 5.528 1.00 0.00 C ATOM 229 C ALA A 18 7.094 -6.997 5.977 1.00 0.00 C ATOM 230 O ALA A 18 7.686 -7.081 7.034 1.00 0.00 O ATOM 231 CB ALA A 18 7.498 -4.682 5.066 1.00 0.00 C ATOM 0 H ALA A 18 6.310 -5.006 7.547 1.00 0.00 H new ATOM 0 HA ALA A 18 5.759 -5.933 4.720 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.042 -5.090 4.214 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.009 -3.753 4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.195 -4.484 5.880 1.00 0.00 H new ATOM 237 N TYR A 19 6.963 -8.025 5.189 1.00 0.00 N ATOM 238 CA TYR A 19 7.546 -9.341 5.575 1.00 0.00 C ATOM 239 C TYR A 19 8.416 -9.899 4.445 1.00 0.00 C ATOM 240 O TYR A 19 8.156 -9.673 3.280 1.00 0.00 O ATOM 241 CB TYR A 19 6.328 -10.235 5.799 1.00 0.00 C ATOM 242 CG TYR A 19 5.399 -10.105 4.615 1.00 0.00 C ATOM 243 CD1 TYR A 19 5.551 -10.956 3.515 1.00 0.00 C ATOM 244 CD2 TYR A 19 4.392 -9.130 4.611 1.00 0.00 C ATOM 245 CE1 TYR A 19 4.699 -10.837 2.411 1.00 0.00 C ATOM 246 CE2 TYR A 19 3.540 -9.010 3.506 1.00 0.00 C ATOM 247 CZ TYR A 19 3.694 -9.864 2.406 1.00 0.00 C ATOM 248 OH TYR A 19 2.853 -9.745 1.318 1.00 0.00 O ATOM 0 H TYR A 19 6.477 -8.012 4.292 1.00 0.00 H new ATOM 0 HA TYR A 19 8.187 -9.272 6.454 1.00 0.00 H new ATOM 0 HB2 TYR A 19 6.640 -11.272 5.921 1.00 0.00 H new ATOM 0 HB3 TYR A 19 5.813 -9.947 6.715 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.328 -11.707 3.518 1.00 0.00 H new ATOM 0 HD2 TYR A 19 4.273 -8.472 5.459 1.00 0.00 H new ATOM 0 HE1 TYR A 19 4.817 -11.496 1.564 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.764 -8.259 3.502 1.00 0.00 H new ATOM 0 HH TYR A 19 2.212 -9.021 1.478 1.00 0.00 H new ATOM 258 N GLY A 20 9.440 -10.635 4.781 1.00 0.00 N ATOM 259 CA GLY A 20 10.318 -11.217 3.727 1.00 0.00 C ATOM 260 C GLY A 20 11.514 -10.297 3.476 1.00 0.00 C ATOM 261 O GLY A 20 12.104 -10.310 2.413 1.00 0.00 O ATOM 0 H GLY A 20 9.706 -10.858 5.740 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.666 -12.203 4.035 1.00 0.00 H new ATOM 0 HA3 GLY A 20 9.753 -11.352 2.805 1.00 0.00 H new ATOM 265 N THR A 21 11.882 -9.498 4.440 1.00 0.00 N ATOM 266 CA THR A 21 13.044 -8.585 4.241 1.00 0.00 C ATOM 267 C THR A 21 13.965 -8.615 5.464 1.00 0.00 C ATOM 268 O THR A 21 14.091 -9.620 6.135 1.00 0.00 O ATOM 269 CB THR A 21 12.439 -7.191 4.064 1.00 0.00 C ATOM 270 OG1 THR A 21 11.919 -6.741 5.307 1.00 0.00 O ATOM 271 CG2 THR A 21 11.317 -7.239 3.026 1.00 0.00 C ATOM 0 H THR A 21 11.431 -9.438 5.353 1.00 0.00 H new ATOM 0 HA THR A 21 13.647 -8.879 3.382 1.00 0.00 H new ATOM 0 HB THR A 21 13.213 -6.504 3.721 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.533 -5.847 5.196 1.00 0.00 H new ATOM 0 HG21 THR A 21 10.891 -6.243 2.905 1.00 0.00 H new ATOM 0 HG22 THR A 21 11.718 -7.580 2.072 1.00 0.00 H new ATOM 0 HG23 THR A 21 10.541 -7.928 3.360 1.00 0.00 H new ATOM 279 N ASP A 22 14.613 -7.519 5.754 1.00 0.00 N ATOM 280 CA ASP A 22 15.530 -7.482 6.930 1.00 0.00 C ATOM 281 C ASP A 22 15.028 -6.473 7.966 1.00 0.00 C ATOM 282 O ASP A 22 14.625 -5.376 7.634 1.00 0.00 O ATOM 283 CB ASP A 22 16.879 -7.039 6.362 1.00 0.00 C ATOM 284 CG ASP A 22 18.000 -7.844 7.022 1.00 0.00 C ATOM 285 OD1 ASP A 22 18.173 -8.994 6.653 1.00 0.00 O ATOM 286 OD2 ASP A 22 18.666 -7.297 7.885 1.00 0.00 O ATOM 0 H ASP A 22 14.547 -6.648 5.228 1.00 0.00 H new ATOM 0 HA ASP A 22 15.593 -8.446 7.434 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.897 -7.188 5.282 1.00 0.00 H new ATOM 0 HB3 ASP A 22 17.028 -5.974 6.540 1.00 0.00 H new ATOM 291 N GLY A 23 15.055 -6.834 9.220 1.00 0.00 N ATOM 292 CA GLY A 23 14.585 -5.896 10.279 1.00 0.00 C ATOM 293 C GLY A 23 13.187 -5.382 9.930 1.00 0.00 C ATOM 294 O GLY A 23 12.666 -5.664 8.869 1.00 0.00 O ATOM 0 H GLY A 23 15.383 -7.739 9.557 1.00 0.00 H new ATOM 0 HA2 GLY A 23 14.566 -6.402 11.244 1.00 0.00 H new ATOM 0 HA3 GLY A 23 15.278 -5.060 10.371 1.00 0.00 H new ATOM 298 N PRO A 24 12.627 -4.639 10.845 1.00 0.00 N ATOM 299 CA PRO A 24 11.272 -4.070 10.644 1.00 0.00 C ATOM 300 C PRO A 24 11.320 -2.919 9.634 1.00 0.00 C ATOM 301 O PRO A 24 12.239 -2.809 8.847 1.00 0.00 O ATOM 302 CB PRO A 24 10.889 -3.562 12.031 1.00 0.00 C ATOM 303 CG PRO A 24 12.189 -3.308 12.726 1.00 0.00 C ATOM 304 CD PRO A 24 13.199 -4.263 12.142 1.00 0.00 C ATOM 0 HA PRO A 24 10.558 -4.791 10.247 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.292 -2.652 11.967 1.00 0.00 H new ATOM 0 HB3 PRO A 24 10.291 -4.298 12.569 1.00 0.00 H new ATOM 0 HG2 PRO A 24 12.507 -2.275 12.582 1.00 0.00 H new ATOM 0 HG3 PRO A 24 12.088 -3.464 13.800 1.00 0.00 H new ATOM 0 HD2 PRO A 24 14.174 -3.790 12.026 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.341 -5.133 12.782 1.00 0.00 H new ATOM 312 N LEU A 25 10.337 -2.061 9.650 1.00 0.00 N ATOM 313 CA LEU A 25 10.327 -0.918 8.691 1.00 0.00 C ATOM 314 C LEU A 25 10.973 0.314 9.329 1.00 0.00 C ATOM 315 O LEU A 25 10.845 0.550 10.514 1.00 0.00 O ATOM 316 CB LEU A 25 8.848 -0.655 8.400 1.00 0.00 C ATOM 317 CG LEU A 25 8.123 -1.982 8.174 1.00 0.00 C ATOM 318 CD1 LEU A 25 6.652 -1.713 7.854 1.00 0.00 C ATOM 319 CD2 LEU A 25 8.772 -2.724 7.004 1.00 0.00 C ATOM 0 H LEU A 25 9.540 -2.101 10.285 1.00 0.00 H new ATOM 0 HA LEU A 25 10.889 -1.138 7.783 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.393 -0.119 9.233 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.748 -0.020 7.519 1.00 0.00 H new ATOM 0 HG LEU A 25 8.192 -2.591 9.075 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.136 -2.659 7.693 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.189 -1.184 8.687 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.581 -1.103 6.953 1.00 0.00 H new ATOM 0 HD21 LEU A 25 8.256 -3.670 6.842 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.703 -2.114 6.103 1.00 0.00 H new ATOM 0 HD23 LEU A 25 9.820 -2.917 7.232 1.00 0.00 H new ATOM 331 N ASP A 26 11.660 1.105 8.552 1.00 0.00 N ATOM 332 CA ASP A 26 12.308 2.325 9.113 1.00 0.00 C ATOM 333 C ASP A 26 11.422 3.546 8.860 1.00 0.00 C ATOM 334 O ASP A 26 11.129 3.888 7.732 1.00 0.00 O ATOM 335 CB ASP A 26 13.631 2.455 8.358 1.00 0.00 C ATOM 336 CG ASP A 26 14.514 1.243 8.661 1.00 0.00 C ATOM 337 OD1 ASP A 26 14.000 0.283 9.211 1.00 0.00 O ATOM 338 OD2 ASP A 26 15.690 1.295 8.338 1.00 0.00 O ATOM 0 H ASP A 26 11.801 0.960 7.552 1.00 0.00 H new ATOM 0 HA ASP A 26 12.462 2.257 10.190 1.00 0.00 H new ATOM 0 HB2 ASP A 26 13.445 2.524 7.286 1.00 0.00 H new ATOM 0 HB3 ASP A 26 14.141 3.372 8.652 1.00 0.00 H new ATOM 343 N THR A 27 10.986 4.203 9.898 1.00 0.00 N ATOM 344 CA THR A 27 10.112 5.394 9.706 1.00 0.00 C ATOM 345 C THR A 27 10.769 6.642 10.299 1.00 0.00 C ATOM 346 O THR A 27 10.776 7.696 9.694 1.00 0.00 O ATOM 347 CB THR A 27 8.825 5.057 10.458 1.00 0.00 C ATOM 348 OG1 THR A 27 9.132 4.230 11.571 1.00 0.00 O ATOM 349 CG2 THR A 27 7.864 4.322 9.523 1.00 0.00 C ATOM 0 H THR A 27 11.196 3.968 10.868 1.00 0.00 H new ATOM 0 HA THR A 27 9.930 5.607 8.653 1.00 0.00 H new ATOM 0 HB THR A 27 8.356 5.977 10.807 1.00 0.00 H new ATOM 0 HG1 THR A 27 8.308 4.014 12.055 1.00 0.00 H new ATOM 0 HG21 THR A 27 6.946 4.082 10.060 1.00 0.00 H new ATOM 0 HG22 THR A 27 7.629 4.958 8.669 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.330 3.401 9.172 1.00 0.00 H new ATOM 357 N SER A 28 11.318 6.536 11.478 1.00 0.00 N ATOM 358 CA SER A 28 11.968 7.723 12.102 1.00 0.00 C ATOM 359 C SER A 28 11.086 8.959 11.912 1.00 0.00 C ATOM 360 O SER A 28 11.570 10.054 11.711 1.00 0.00 O ATOM 361 CB SER A 28 13.292 7.889 11.356 1.00 0.00 C ATOM 362 OG SER A 28 14.138 8.763 12.091 1.00 0.00 O ATOM 0 H SER A 28 11.345 5.682 12.035 1.00 0.00 H new ATOM 0 HA SER A 28 12.120 7.598 13.174 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.774 6.920 11.227 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.113 8.291 10.359 1.00 0.00 H new ATOM 0 HG SER A 28 13.661 9.598 12.279 1.00 0.00 H new ATOM 368 N THR A 29 9.792 8.785 11.967 1.00 0.00 N ATOM 369 CA THR A 29 8.866 9.942 11.785 1.00 0.00 C ATOM 370 C THR A 29 9.179 10.663 10.473 1.00 0.00 C ATOM 371 O THR A 29 9.507 11.833 10.458 1.00 0.00 O ATOM 372 CB THR A 29 9.115 10.868 12.983 1.00 0.00 C ATOM 373 OG1 THR A 29 10.263 11.666 12.736 1.00 0.00 O ATOM 374 CG2 THR A 29 9.330 10.036 14.250 1.00 0.00 C ATOM 0 H THR A 29 9.335 7.888 12.131 1.00 0.00 H new ATOM 0 HA THR A 29 7.824 9.625 11.738 1.00 0.00 H new ATOM 0 HB THR A 29 8.247 11.513 13.123 1.00 0.00 H new ATOM 0 HG1 THR A 29 10.754 11.304 11.969 1.00 0.00 H new ATOM 0 HG21 THR A 29 9.506 10.700 15.096 1.00 0.00 H new ATOM 0 HG22 THR A 29 8.444 9.431 14.442 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.193 9.384 14.115 1.00 0.00 H new ATOM 382 N GLY A 30 9.080 9.972 9.370 1.00 0.00 N ATOM 383 CA GLY A 30 9.371 10.615 8.059 1.00 0.00 C ATOM 384 C GLY A 30 8.710 9.812 6.937 1.00 0.00 C ATOM 385 O GLY A 30 7.748 10.246 6.335 1.00 0.00 O ATOM 0 H GLY A 30 8.810 8.990 9.321 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.999 11.640 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.448 10.666 7.898 1.00 0.00 H new ATOM 389 N ALA A 31 9.219 8.645 6.649 1.00 0.00 N ATOM 390 CA ALA A 31 8.617 7.818 5.562 1.00 0.00 C ATOM 391 C ALA A 31 8.827 6.327 5.845 1.00 0.00 C ATOM 392 O ALA A 31 9.694 5.947 6.607 1.00 0.00 O ATOM 393 CB ALA A 31 9.363 8.231 4.293 1.00 0.00 C ATOM 0 H ALA A 31 10.024 8.228 7.117 1.00 0.00 H new ATOM 0 HA ALA A 31 7.542 7.974 5.475 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.978 7.666 3.444 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.217 9.297 4.116 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.427 8.025 4.413 1.00 0.00 H new ATOM 399 N LEU A 32 8.045 5.480 5.231 1.00 0.00 N ATOM 400 CA LEU A 32 8.208 4.014 5.459 1.00 0.00 C ATOM 401 C LEU A 32 9.221 3.443 4.464 1.00 0.00 C ATOM 402 O LEU A 32 8.972 3.388 3.276 1.00 0.00 O ATOM 403 CB LEU A 32 6.822 3.415 5.215 1.00 0.00 C ATOM 404 CG LEU A 32 6.851 1.918 5.531 1.00 0.00 C ATOM 405 CD1 LEU A 32 5.883 1.619 6.676 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.433 1.126 4.290 1.00 0.00 C ATOM 0 H LEU A 32 7.301 5.739 4.582 1.00 0.00 H new ATOM 0 HA LEU A 32 8.576 3.788 6.460 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.083 3.915 5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.523 3.573 4.179 1.00 0.00 H new ATOM 0 HG LEU A 32 7.860 1.629 5.824 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.904 0.553 6.901 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.181 2.182 7.560 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.874 1.909 6.384 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.454 0.060 4.515 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.424 1.415 3.996 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.123 1.338 3.474 1.00 0.00 H new ATOM 418 N CYS A 33 10.363 3.023 4.936 1.00 0.00 N ATOM 419 CA CYS A 33 11.389 2.465 4.010 1.00 0.00 C ATOM 420 C CYS A 33 11.712 1.014 4.375 1.00 0.00 C ATOM 421 O CYS A 33 12.383 0.743 5.351 1.00 0.00 O ATOM 422 CB CYS A 33 12.620 3.351 4.206 1.00 0.00 C ATOM 423 SG CYS A 33 12.364 4.934 3.365 1.00 0.00 S ATOM 0 H CYS A 33 10.630 3.042 5.920 1.00 0.00 H new ATOM 0 HA CYS A 33 11.046 2.459 2.975 1.00 0.00 H new ATOM 0 HB2 CYS A 33 12.797 3.516 5.269 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.505 2.855 3.809 1.00 0.00 H new ATOM 428 N VAL A 34 11.248 0.078 3.592 1.00 0.00 N ATOM 429 CA VAL A 34 11.539 -1.355 3.891 1.00 0.00 C ATOM 430 C VAL A 34 12.838 -1.774 3.197 1.00 0.00 C ATOM 431 O VAL A 34 13.155 -1.308 2.120 1.00 0.00 O ATOM 432 CB VAL A 34 10.349 -2.135 3.333 1.00 0.00 C ATOM 433 CG1 VAL A 34 9.102 -1.817 4.160 1.00 0.00 C ATOM 434 CG2 VAL A 34 10.110 -1.734 1.875 1.00 0.00 C ATOM 0 H VAL A 34 10.681 0.242 2.760 1.00 0.00 H new ATOM 0 HA VAL A 34 11.670 -1.539 4.957 1.00 0.00 H new ATOM 0 HB VAL A 34 10.559 -3.203 3.384 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.252 -2.372 3.764 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.271 -2.104 5.198 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.894 -0.748 4.108 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.261 -2.291 1.479 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.900 -0.666 1.821 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.999 -1.959 1.285 1.00 0.00 H new ATOM 444 N ALA A 35 13.597 -2.640 3.812 1.00 0.00 N ATOM 445 CA ALA A 35 14.884 -3.076 3.195 1.00 0.00 C ATOM 446 C ALA A 35 14.707 -4.381 2.414 1.00 0.00 C ATOM 447 O ALA A 35 14.849 -5.460 2.953 1.00 0.00 O ATOM 448 CB ALA A 35 15.833 -3.288 4.375 1.00 0.00 C ATOM 0 H ALA A 35 13.382 -3.065 4.714 1.00 0.00 H new ATOM 0 HA ALA A 35 15.260 -2.340 2.484 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.806 -3.611 4.006 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.945 -2.353 4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.425 -4.051 5.038 1.00 0.00 H new ATOM 454 N VAL A 36 14.418 -4.293 1.144 1.00 0.00 N ATOM 455 CA VAL A 36 14.256 -5.534 0.335 1.00 0.00 C ATOM 456 C VAL A 36 15.628 -6.187 0.128 1.00 0.00 C ATOM 457 O VAL A 36 16.579 -5.526 -0.243 1.00 0.00 O ATOM 458 CB VAL A 36 13.664 -5.070 -0.997 1.00 0.00 C ATOM 459 CG1 VAL A 36 13.415 -6.281 -1.894 1.00 0.00 C ATOM 460 CG2 VAL A 36 12.335 -4.353 -0.742 1.00 0.00 C ATOM 0 H VAL A 36 14.288 -3.419 0.634 1.00 0.00 H new ATOM 0 HA VAL A 36 13.615 -6.273 0.816 1.00 0.00 H new ATOM 0 HB VAL A 36 14.362 -4.389 -1.485 1.00 0.00 H new ATOM 0 HG11 VAL A 36 12.993 -5.950 -2.843 1.00 0.00 H new ATOM 0 HG12 VAL A 36 14.357 -6.799 -2.076 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.717 -6.960 -1.404 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.912 -4.022 -1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.640 -5.037 -0.254 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.505 -3.489 -0.099 1.00 0.00 H new ATOM 470 N PRO A 37 15.687 -7.464 0.393 1.00 0.00 N ATOM 471 CA PRO A 37 16.962 -8.215 0.257 1.00 0.00 C ATOM 472 C PRO A 37 17.346 -8.391 -1.216 1.00 0.00 C ATOM 473 O PRO A 37 16.507 -8.368 -2.095 1.00 0.00 O ATOM 474 CB PRO A 37 16.655 -9.560 0.911 1.00 0.00 C ATOM 475 CG PRO A 37 15.170 -9.710 0.813 1.00 0.00 C ATOM 476 CD PRO A 37 14.583 -8.323 0.835 1.00 0.00 C ATOM 0 HA PRO A 37 17.806 -7.703 0.718 1.00 0.00 H new ATOM 0 HB2 PRO A 37 17.168 -10.374 0.399 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.986 -9.578 1.950 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.895 -10.230 -0.105 1.00 0.00 H new ATOM 0 HG3 PRO A 37 14.787 -10.304 1.643 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.724 -8.243 0.169 1.00 0.00 H new ATOM 0 HD3 PRO A 37 14.240 -8.050 1.833 1.00 0.00 H new ATOM 484 N ALA A 38 18.614 -8.564 -1.489 1.00 0.00 N ATOM 485 CA ALA A 38 19.057 -8.738 -2.903 1.00 0.00 C ATOM 486 C ALA A 38 18.111 -9.676 -3.643 1.00 0.00 C ATOM 487 O ALA A 38 18.059 -10.860 -3.380 1.00 0.00 O ATOM 488 CB ALA A 38 20.453 -9.346 -2.821 1.00 0.00 C ATOM 0 H ALA A 38 19.360 -8.592 -0.794 1.00 0.00 H new ATOM 0 HA ALA A 38 19.059 -7.793 -3.446 1.00 0.00 H new ATOM 0 HB1 ALA A 38 20.842 -9.502 -3.827 1.00 0.00 H new ATOM 0 HB2 ALA A 38 21.113 -8.670 -2.278 1.00 0.00 H new ATOM 0 HB3 ALA A 38 20.404 -10.302 -2.299 1.00 0.00 H new ATOM 494 N GLY A 39 17.367 -9.150 -4.569 1.00 0.00 N ATOM 495 CA GLY A 39 16.418 -9.999 -5.337 1.00 0.00 C ATOM 496 C GLY A 39 15.435 -10.662 -4.373 1.00 0.00 C ATOM 497 O GLY A 39 15.816 -11.436 -3.519 1.00 0.00 O ATOM 0 H GLY A 39 17.374 -8.164 -4.830 1.00 0.00 H new ATOM 0 HA2 GLY A 39 15.878 -9.393 -6.065 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.964 -10.759 -5.897 1.00 0.00 H new ATOM 501 N SER A 40 14.172 -10.367 -4.504 1.00 0.00 N ATOM 502 CA SER A 40 13.168 -10.989 -3.597 1.00 0.00 C ATOM 503 C SER A 40 12.746 -12.348 -4.156 1.00 0.00 C ATOM 504 O SER A 40 11.576 -12.655 -4.265 1.00 0.00 O ATOM 505 CB SER A 40 11.989 -10.021 -3.584 1.00 0.00 C ATOM 506 OG SER A 40 12.366 -8.831 -2.903 1.00 0.00 O ATOM 0 H SER A 40 13.792 -9.724 -5.198 1.00 0.00 H new ATOM 0 HA SER A 40 13.557 -11.159 -2.593 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.683 -9.789 -4.604 1.00 0.00 H new ATOM 0 HB3 SER A 40 11.132 -10.480 -3.091 1.00 0.00 H new ATOM 0 HG SER A 40 13.003 -8.328 -3.452 1.00 0.00 H new ATOM 512 N ALA A 41 13.699 -13.161 -4.513 1.00 0.00 N ATOM 513 CA ALA A 41 13.372 -14.503 -5.073 1.00 0.00 C ATOM 514 C ALA A 41 13.270 -15.531 -3.952 1.00 0.00 C ATOM 515 O ALA A 41 14.258 -15.983 -3.412 1.00 0.00 O ATOM 516 CB ALA A 41 14.527 -14.847 -6.003 1.00 0.00 C ATOM 0 H ALA A 41 14.695 -12.954 -4.441 1.00 0.00 H new ATOM 0 HA ALA A 41 12.416 -14.503 -5.597 1.00 0.00 H new ATOM 0 HB1 ALA A 41 14.354 -15.825 -6.452 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.598 -14.094 -6.788 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.457 -14.868 -5.435 1.00 0.00 H new ATOM 522 N GLN A 42 12.071 -15.892 -3.612 1.00 0.00 N ATOM 523 CA GLN A 42 11.837 -16.889 -2.523 1.00 0.00 C ATOM 524 C GLN A 42 10.351 -16.880 -2.163 1.00 0.00 C ATOM 525 O GLN A 42 9.515 -16.557 -2.983 1.00 0.00 O ATOM 526 CB GLN A 42 12.686 -16.412 -1.336 1.00 0.00 C ATOM 527 CG GLN A 42 12.446 -14.920 -1.093 1.00 0.00 C ATOM 528 CD GLN A 42 13.789 -14.212 -0.904 1.00 0.00 C ATOM 529 OE1 GLN A 42 14.073 -13.235 -1.568 1.00 0.00 O ATOM 530 NE2 GLN A 42 14.633 -14.667 -0.019 1.00 0.00 N ATOM 0 H GLN A 42 11.221 -15.534 -4.048 1.00 0.00 H new ATOM 0 HA GLN A 42 12.108 -17.904 -2.812 1.00 0.00 H new ATOM 0 HB2 GLN A 42 12.430 -16.981 -0.442 1.00 0.00 H new ATOM 0 HB3 GLN A 42 13.742 -16.592 -1.537 1.00 0.00 H new ATOM 0 HG2 GLN A 42 11.909 -14.485 -1.936 1.00 0.00 H new ATOM 0 HG3 GLN A 42 11.822 -14.780 -0.211 1.00 0.00 H new ATOM 0 HE21 GLN A 42 14.395 -15.487 0.539 1.00 0.00 H new ATOM 0 HE22 GLN A 42 15.531 -14.202 0.115 1.00 0.00 H new ATOM 539 N TYR A 43 10.010 -17.214 -0.949 1.00 0.00 N ATOM 540 CA TYR A 43 8.572 -17.199 -0.556 1.00 0.00 C ATOM 541 C TYR A 43 7.902 -15.935 -1.108 1.00 0.00 C ATOM 542 O TYR A 43 6.713 -15.907 -1.355 1.00 0.00 O ATOM 543 CB TYR A 43 8.567 -17.191 0.975 1.00 0.00 C ATOM 544 CG TYR A 43 9.632 -16.251 1.485 1.00 0.00 C ATOM 545 CD1 TYR A 43 9.402 -14.872 1.490 1.00 0.00 C ATOM 546 CD2 TYR A 43 10.849 -16.761 1.951 1.00 0.00 C ATOM 547 CE1 TYR A 43 10.390 -14.000 1.963 1.00 0.00 C ATOM 548 CE2 TYR A 43 11.838 -15.890 2.424 1.00 0.00 C ATOM 549 CZ TYR A 43 11.608 -14.509 2.430 1.00 0.00 C ATOM 550 OH TYR A 43 12.582 -13.650 2.896 1.00 0.00 O ATOM 0 H TYR A 43 10.660 -17.495 -0.215 1.00 0.00 H new ATOM 0 HA TYR A 43 8.024 -18.055 -0.949 1.00 0.00 H new ATOM 0 HB2 TYR A 43 7.589 -16.881 1.343 1.00 0.00 H new ATOM 0 HB3 TYR A 43 8.746 -18.197 1.354 1.00 0.00 H new ATOM 0 HD1 TYR A 43 8.463 -14.480 1.129 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.025 -17.826 1.946 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.213 -12.935 1.968 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.777 -16.283 2.784 1.00 0.00 H new ATOM 0 HH TYR A 43 13.364 -14.167 3.183 1.00 0.00 H new ATOM 560 N GLY A 44 8.666 -14.893 -1.314 1.00 0.00 N ATOM 561 CA GLY A 44 8.084 -13.635 -1.863 1.00 0.00 C ATOM 562 C GLY A 44 8.019 -12.572 -0.767 1.00 0.00 C ATOM 563 O GLY A 44 7.505 -12.807 0.308 1.00 0.00 O ATOM 0 H GLY A 44 9.668 -14.861 -1.125 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.690 -13.276 -2.695 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.085 -13.827 -2.256 1.00 0.00 H new ATOM 567 N VAL A 45 8.519 -11.394 -1.034 1.00 0.00 N ATOM 568 CA VAL A 45 8.463 -10.319 -0.007 1.00 0.00 C ATOM 569 C VAL A 45 7.158 -9.543 -0.189 1.00 0.00 C ATOM 570 O VAL A 45 6.389 -9.829 -1.086 1.00 0.00 O ATOM 571 CB VAL A 45 9.680 -9.429 -0.286 1.00 0.00 C ATOM 572 CG1 VAL A 45 9.981 -8.577 0.947 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.908 -10.297 -0.609 1.00 0.00 C ATOM 0 H VAL A 45 8.961 -11.133 -1.915 1.00 0.00 H new ATOM 0 HA VAL A 45 8.486 -10.696 1.016 1.00 0.00 H new ATOM 0 HB VAL A 45 9.459 -8.786 -1.138 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.846 -7.944 0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 45 9.118 -7.951 1.176 1.00 0.00 H new ATOM 0 HG13 VAL A 45 10.193 -9.227 1.796 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.766 -9.654 -0.805 1.00 0.00 H new ATOM 0 HG22 VAL A 45 11.127 -10.947 0.238 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.702 -10.906 -1.489 1.00 0.00 H new ATOM 583 N GLY A 46 6.882 -8.573 0.640 1.00 0.00 N ATOM 584 CA GLY A 46 5.610 -7.820 0.463 1.00 0.00 C ATOM 585 C GLY A 46 5.337 -6.913 1.662 1.00 0.00 C ATOM 586 O GLY A 46 6.119 -6.821 2.588 1.00 0.00 O ATOM 0 H GLY A 46 7.470 -8.274 1.418 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.662 -7.221 -0.446 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.784 -8.520 0.337 1.00 0.00 H new ATOM 590 N VAL A 47 4.216 -6.244 1.639 1.00 0.00 N ATOM 591 CA VAL A 47 3.842 -5.332 2.753 1.00 0.00 C ATOM 592 C VAL A 47 2.317 -5.272 2.851 1.00 0.00 C ATOM 593 O VAL A 47 1.637 -5.015 1.877 1.00 0.00 O ATOM 594 CB VAL A 47 4.418 -3.968 2.366 1.00 0.00 C ATOM 595 CG1 VAL A 47 4.296 -3.001 3.545 1.00 0.00 C ATOM 596 CG2 VAL A 47 5.894 -4.124 1.992 1.00 0.00 C ATOM 0 H VAL A 47 3.534 -6.293 0.882 1.00 0.00 H new ATOM 0 HA VAL A 47 4.223 -5.659 3.720 1.00 0.00 H new ATOM 0 HB VAL A 47 3.863 -3.574 1.515 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.707 -2.031 3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.246 -2.886 3.814 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.848 -3.396 4.398 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.304 -3.152 1.716 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.445 -4.522 2.844 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.985 -4.809 1.149 1.00 0.00 H new ATOM 606 N VAL A 48 1.769 -5.521 4.005 1.00 0.00 N ATOM 607 CA VAL A 48 0.282 -5.490 4.133 1.00 0.00 C ATOM 608 C VAL A 48 -0.156 -4.438 5.152 1.00 0.00 C ATOM 609 O VAL A 48 0.380 -4.346 6.238 1.00 0.00 O ATOM 610 CB VAL A 48 -0.105 -6.892 4.606 1.00 0.00 C ATOM 611 CG1 VAL A 48 0.242 -7.911 3.520 1.00 0.00 C ATOM 612 CG2 VAL A 48 0.664 -7.231 5.885 1.00 0.00 C ATOM 0 H VAL A 48 2.278 -5.743 4.860 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.201 -5.226 3.192 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.176 -6.923 4.806 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.034 -8.910 3.857 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.305 -7.672 2.608 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.313 -7.879 3.319 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.388 -8.230 6.222 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.735 -7.199 5.685 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.418 -6.506 6.661 1.00 0.00 H new ATOM 622 N LEU A 49 -1.136 -3.645 4.807 1.00 0.00 N ATOM 623 CA LEU A 49 -1.619 -2.598 5.753 1.00 0.00 C ATOM 624 C LEU A 49 -3.116 -2.781 6.020 1.00 0.00 C ATOM 625 O LEU A 49 -3.951 -2.243 5.321 1.00 0.00 O ATOM 626 CB LEU A 49 -1.360 -1.269 5.044 1.00 0.00 C ATOM 627 CG LEU A 49 -2.091 -0.146 5.782 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.515 -0.004 7.191 1.00 0.00 C ATOM 629 CD2 LEU A 49 -1.906 1.168 5.021 1.00 0.00 C ATOM 0 H LEU A 49 -1.622 -3.678 3.911 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.114 -2.648 6.717 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.290 -1.063 5.014 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.703 -1.323 4.011 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.153 -0.383 5.845 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.035 0.796 7.718 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.645 -0.940 7.733 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.453 0.234 7.128 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.427 1.969 5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.844 1.406 4.958 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.315 1.067 4.016 1.00 0.00 H new ATOM 641 N ASN A 50 -3.461 -3.537 7.026 1.00 0.00 N ATOM 642 CA ASN A 50 -4.904 -3.755 7.335 1.00 0.00 C ATOM 643 C ASN A 50 -5.508 -2.495 7.962 1.00 0.00 C ATOM 644 O ASN A 50 -5.157 -2.108 9.058 1.00 0.00 O ATOM 645 CB ASN A 50 -4.925 -4.912 8.333 1.00 0.00 C ATOM 646 CG ASN A 50 -4.009 -4.584 9.513 1.00 0.00 C ATOM 647 OD1 ASN A 50 -4.399 -3.879 10.423 1.00 0.00 O ATOM 648 ND2 ASN A 50 -2.797 -5.068 9.537 1.00 0.00 N ATOM 0 H ASN A 50 -2.807 -4.013 7.647 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.488 -3.976 6.442 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.942 -5.084 8.685 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -4.596 -5.831 7.848 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -2.178 -4.854 10.319 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -2.469 -5.660 8.774 1.00 0.00 H new ATOM 655 N GLY A 51 -6.415 -1.855 7.276 1.00 0.00 N ATOM 656 CA GLY A 51 -7.039 -0.623 7.838 1.00 0.00 C ATOM 657 C GLY A 51 -7.530 0.274 6.700 1.00 0.00 C ATOM 658 O GLY A 51 -7.033 1.364 6.498 1.00 0.00 O ATOM 0 H GLY A 51 -6.750 -2.131 6.353 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.872 -0.890 8.488 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.316 -0.085 8.451 1.00 0.00 H new ATOM 662 N VAL A 52 -8.506 -0.172 5.956 1.00 0.00 N ATOM 663 CA VAL A 52 -9.029 0.661 4.835 1.00 0.00 C ATOM 664 C VAL A 52 -10.516 0.958 5.053 1.00 0.00 C ATOM 665 O VAL A 52 -11.133 0.439 5.962 1.00 0.00 O ATOM 666 CB VAL A 52 -8.824 -0.189 3.580 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.416 0.533 2.369 1.00 0.00 C ATOM 668 CG2 VAL A 52 -7.328 -0.409 3.356 1.00 0.00 C ATOM 0 H VAL A 52 -8.963 -1.076 6.076 1.00 0.00 H new ATOM 0 HA VAL A 52 -8.521 1.623 4.758 1.00 0.00 H new ATOM 0 HB VAL A 52 -9.322 -1.150 3.708 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.269 -0.074 1.476 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.482 0.694 2.527 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.919 1.495 2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.179 -1.015 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.834 0.554 3.228 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.903 -0.924 4.218 1.00 0.00 H new ATOM 678 N ALA A 53 -11.098 1.793 4.233 1.00 0.00 N ATOM 679 CA ALA A 53 -12.543 2.118 4.407 1.00 0.00 C ATOM 680 C ALA A 53 -13.226 2.290 3.046 1.00 0.00 C ATOM 681 O ALA A 53 -13.165 3.341 2.438 1.00 0.00 O ATOM 682 CB ALA A 53 -12.559 3.435 5.184 1.00 0.00 C ATOM 0 H ALA A 53 -10.637 2.262 3.453 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.081 1.326 4.928 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.590 3.745 5.354 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.059 3.298 6.143 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.040 4.202 4.610 1.00 0.00 H new ATOM 688 N ILE A 54 -13.883 1.268 2.569 1.00 0.00 N ATOM 689 CA ILE A 54 -14.579 1.370 1.253 1.00 0.00 C ATOM 690 C ILE A 54 -15.955 0.702 1.340 1.00 0.00 C ATOM 691 O ILE A 54 -16.206 -0.104 2.213 1.00 0.00 O ATOM 692 CB ILE A 54 -13.682 0.625 0.264 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.234 1.092 0.432 1.00 0.00 C ATOM 694 CG2 ILE A 54 -14.148 0.912 -1.164 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.080 2.509 -0.124 1.00 0.00 C ATOM 0 H ILE A 54 -13.968 0.364 3.034 1.00 0.00 H new ATOM 0 HA ILE A 54 -14.741 2.404 0.949 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.742 -0.446 0.458 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -11.956 1.072 1.486 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.560 0.412 -0.088 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.509 0.381 -1.869 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -15.178 0.577 -1.285 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -14.090 1.983 -1.357 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.048 2.837 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -12.340 2.515 -1.182 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -12.742 3.186 0.416 1.00 0.00 H new ATOM 707 N GLU A 55 -16.850 1.031 0.448 1.00 0.00 N ATOM 708 CA GLU A 55 -18.206 0.410 0.496 1.00 0.00 C ATOM 709 C GLU A 55 -18.783 0.260 -0.916 1.00 0.00 C ATOM 710 O GLU A 55 -18.712 1.165 -1.722 1.00 0.00 O ATOM 711 CB GLU A 55 -19.054 1.380 1.320 1.00 0.00 C ATOM 712 CG GLU A 55 -19.642 0.646 2.527 1.00 0.00 C ATOM 713 CD GLU A 55 -19.123 1.285 3.816 1.00 0.00 C ATOM 714 OE1 GLU A 55 -19.271 2.488 3.959 1.00 0.00 O ATOM 715 OE2 GLU A 55 -18.587 0.561 4.639 1.00 0.00 O ATOM 0 H GLU A 55 -16.703 1.699 -0.308 1.00 0.00 H new ATOM 0 HA GLU A 55 -18.183 -0.589 0.931 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.444 2.220 1.653 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.855 1.792 0.706 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -20.731 0.692 2.499 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -19.366 -0.408 2.495 1.00 0.00 H new ATOM 722 N GLU A 56 -19.356 -0.881 -1.206 1.00 0.00 N ATOM 723 CA GLU A 56 -19.955 -1.125 -2.556 1.00 0.00 C ATOM 724 C GLU A 56 -19.154 -0.416 -3.656 1.00 0.00 C ATOM 725 O GLU A 56 -17.978 -0.149 -3.509 1.00 0.00 O ATOM 726 CB GLU A 56 -21.391 -0.584 -2.457 1.00 0.00 C ATOM 727 CG GLU A 56 -21.451 0.881 -2.901 1.00 0.00 C ATOM 728 CD GLU A 56 -22.437 1.644 -2.017 1.00 0.00 C ATOM 729 OE1 GLU A 56 -22.442 1.401 -0.821 1.00 0.00 O ATOM 730 OE2 GLU A 56 -23.172 2.459 -2.550 1.00 0.00 O ATOM 0 H GLU A 56 -19.436 -1.664 -0.557 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.942 -2.181 -2.826 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -22.055 -1.185 -3.079 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -21.748 -0.673 -1.431 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -20.461 1.333 -2.834 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -21.759 0.943 -3.945 1.00 0.00 H new ATOM 737 N GLY A 57 -19.787 -0.115 -4.758 1.00 0.00 N ATOM 738 CA GLY A 57 -19.069 0.571 -5.869 1.00 0.00 C ATOM 739 C GLY A 57 -19.040 2.078 -5.610 1.00 0.00 C ATOM 740 O GLY A 57 -19.834 2.826 -6.145 1.00 0.00 O ATOM 0 H GLY A 57 -20.771 -0.315 -4.936 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -18.052 0.186 -5.950 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -19.565 0.365 -6.818 1.00 0.00 H new ATOM 744 N THR A 58 -18.128 2.529 -4.794 1.00 0.00 N ATOM 745 CA THR A 58 -18.044 3.989 -4.501 1.00 0.00 C ATOM 746 C THR A 58 -16.791 4.580 -5.158 1.00 0.00 C ATOM 747 O THR A 58 -15.951 3.866 -5.670 1.00 0.00 O ATOM 748 CB THR A 58 -17.971 4.075 -2.969 1.00 0.00 C ATOM 749 OG1 THR A 58 -19.289 4.103 -2.440 1.00 0.00 O ATOM 750 CG2 THR A 58 -17.224 5.343 -2.539 1.00 0.00 C ATOM 0 H THR A 58 -17.437 1.950 -4.317 1.00 0.00 H new ATOM 0 HA THR A 58 -18.891 4.552 -4.891 1.00 0.00 H new ATOM 0 HB THR A 58 -17.434 3.205 -2.590 1.00 0.00 H new ATOM 0 HG1 THR A 58 -19.516 3.220 -2.081 1.00 0.00 H new ATOM 0 HG21 THR A 58 -17.181 5.389 -1.451 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.211 5.323 -2.941 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.748 6.220 -2.919 1.00 0.00 H new ATOM 758 N THR A 59 -16.660 5.878 -5.146 1.00 0.00 N ATOM 759 CA THR A 59 -15.464 6.513 -5.770 1.00 0.00 C ATOM 760 C THR A 59 -14.342 6.654 -4.738 1.00 0.00 C ATOM 761 O THR A 59 -14.586 6.802 -3.557 1.00 0.00 O ATOM 762 CB THR A 59 -15.941 7.891 -6.231 1.00 0.00 C ATOM 763 OG1 THR A 59 -17.307 7.813 -6.615 1.00 0.00 O ATOM 764 CG2 THR A 59 -15.098 8.353 -7.421 1.00 0.00 C ATOM 0 H THR A 59 -17.329 6.527 -4.731 1.00 0.00 H new ATOM 0 HA THR A 59 -15.067 5.922 -6.595 1.00 0.00 H new ATOM 0 HB THR A 59 -15.834 8.606 -5.415 1.00 0.00 H new ATOM 0 HG1 THR A 59 -17.615 8.696 -6.909 1.00 0.00 H new ATOM 0 HG21 THR A 59 -15.439 9.335 -7.749 1.00 0.00 H new ATOM 0 HG22 THR A 59 -14.051 8.413 -7.124 1.00 0.00 H new ATOM 0 HG23 THR A 59 -15.203 7.641 -8.239 1.00 0.00 H new ATOM 772 N TYR A 60 -13.113 6.612 -5.175 1.00 0.00 N ATOM 773 CA TYR A 60 -11.978 6.746 -4.219 1.00 0.00 C ATOM 774 C TYR A 60 -10.741 7.287 -4.939 1.00 0.00 C ATOM 775 O TYR A 60 -10.715 7.405 -6.148 1.00 0.00 O ATOM 776 CB TYR A 60 -11.720 5.329 -3.706 1.00 0.00 C ATOM 777 CG TYR A 60 -12.825 4.928 -2.760 1.00 0.00 C ATOM 778 CD1 TYR A 60 -12.849 5.434 -1.455 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.825 4.049 -3.188 1.00 0.00 C ATOM 780 CE1 TYR A 60 -13.876 5.061 -0.579 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.850 3.676 -2.312 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.876 4.181 -1.008 1.00 0.00 C ATOM 783 OH TYR A 60 -15.888 3.813 -0.144 1.00 0.00 O ATOM 0 H TYR A 60 -12.846 6.491 -6.152 1.00 0.00 H new ATOM 0 HA TYR A 60 -12.203 7.439 -3.408 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -11.671 4.631 -4.542 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -10.757 5.285 -3.197 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.076 6.112 -1.124 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -13.806 3.658 -4.195 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.896 5.452 0.427 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -15.622 2.997 -2.643 1.00 0.00 H new ATOM 0 HH TYR A 60 -16.059 4.541 0.489 1.00 0.00 H new ATOM 793 N THR A 61 -9.715 7.615 -4.204 1.00 0.00 N ATOM 794 CA THR A 61 -8.478 8.147 -4.843 1.00 0.00 C ATOM 795 C THR A 61 -7.241 7.621 -4.112 1.00 0.00 C ATOM 796 O THR A 61 -7.007 7.937 -2.962 1.00 0.00 O ATOM 797 CB THR A 61 -8.580 9.666 -4.700 1.00 0.00 C ATOM 798 OG1 THR A 61 -9.595 10.154 -5.566 1.00 0.00 O ATOM 799 CG2 THR A 61 -7.241 10.307 -5.068 1.00 0.00 C ATOM 0 H THR A 61 -9.679 7.538 -3.188 1.00 0.00 H new ATOM 0 HA THR A 61 -8.386 7.842 -5.885 1.00 0.00 H new ATOM 0 HB THR A 61 -8.829 9.918 -3.669 1.00 0.00 H new ATOM 0 HG1 THR A 61 -9.663 11.127 -5.474 1.00 0.00 H new ATOM 0 HG21 THR A 61 -7.316 11.390 -4.966 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.463 9.932 -4.403 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.989 10.057 -6.098 1.00 0.00 H new ATOM 807 N LEU A 62 -6.444 6.823 -4.769 1.00 0.00 N ATOM 808 CA LEU A 62 -5.223 6.283 -4.106 1.00 0.00 C ATOM 809 C LEU A 62 -4.044 7.231 -4.331 1.00 0.00 C ATOM 810 O LEU A 62 -3.668 7.513 -5.451 1.00 0.00 O ATOM 811 CB LEU A 62 -4.963 4.936 -4.782 1.00 0.00 C ATOM 812 CG LEU A 62 -3.589 4.410 -4.360 1.00 0.00 C ATOM 813 CD1 LEU A 62 -3.667 3.859 -2.935 1.00 0.00 C ATOM 814 CD2 LEU A 62 -3.156 3.294 -5.313 1.00 0.00 C ATOM 0 H LEU A 62 -6.585 6.522 -5.733 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.350 6.177 -3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.738 4.222 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.005 5.047 -5.866 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.864 5.223 -4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.688 3.485 -2.636 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.976 4.652 -2.254 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.393 3.047 -2.898 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -2.178 2.919 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.883 2.482 -5.277 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.099 3.685 -6.329 1.00 0.00 H new ATOM 826 N ARG A 63 -3.460 7.726 -3.276 1.00 0.00 N ATOM 827 CA ARG A 63 -2.307 8.656 -3.435 1.00 0.00 C ATOM 828 C ARG A 63 -1.131 8.197 -2.570 1.00 0.00 C ATOM 829 O ARG A 63 -1.271 7.973 -1.386 1.00 0.00 O ATOM 830 CB ARG A 63 -2.826 10.014 -2.959 1.00 0.00 C ATOM 831 CG ARG A 63 -1.647 10.964 -2.744 1.00 0.00 C ATOM 832 CD ARG A 63 -2.168 12.390 -2.546 1.00 0.00 C ATOM 833 NE ARG A 63 -1.656 12.804 -1.210 1.00 0.00 N ATOM 834 CZ ARG A 63 -1.945 13.986 -0.738 1.00 0.00 C ATOM 835 NH1 ARG A 63 -3.150 14.240 -0.305 1.00 0.00 N ATOM 836 NH2 ARG A 63 -1.028 14.914 -0.697 1.00 0.00 N ATOM 0 H ARG A 63 -3.730 7.528 -2.313 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.947 8.694 -4.463 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -3.513 10.431 -3.695 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.386 9.896 -2.031 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.070 10.653 -1.874 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.976 10.927 -3.602 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.807 13.055 -3.331 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.257 12.421 -2.578 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.080 12.164 -0.664 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.866 13.515 -0.335 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.375 15.164 0.064 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -0.086 14.715 -1.034 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.254 15.838 -0.328 1.00 0.00 H new ATOM 850 N TYR A 64 0.028 8.061 -3.154 1.00 0.00 N ATOM 851 CA TYR A 64 1.216 7.621 -2.367 1.00 0.00 C ATOM 852 C TYR A 64 2.498 7.891 -3.163 1.00 0.00 C ATOM 853 O TYR A 64 2.502 7.863 -4.377 1.00 0.00 O ATOM 854 CB TYR A 64 1.006 6.117 -2.130 1.00 0.00 C ATOM 855 CG TYR A 64 1.491 5.324 -3.326 1.00 0.00 C ATOM 856 CD1 TYR A 64 2.863 5.129 -3.529 1.00 0.00 C ATOM 857 CD2 TYR A 64 0.566 4.787 -4.229 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.308 4.397 -4.637 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.012 4.055 -5.336 1.00 0.00 C ATOM 860 CZ TYR A 64 2.383 3.861 -5.540 1.00 0.00 C ATOM 861 OH TYR A 64 2.823 3.139 -6.631 1.00 0.00 O ATOM 0 H TYR A 64 0.204 8.236 -4.143 1.00 0.00 H new ATOM 0 HA TYR A 64 1.318 8.157 -1.424 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.544 5.804 -1.235 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.050 5.914 -1.954 1.00 0.00 H new ATOM 0 HD1 TYR A 64 3.577 5.543 -2.832 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -0.492 4.937 -4.072 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.366 4.246 -4.795 1.00 0.00 H new ATOM 0 HE2 TYR A 64 0.298 3.640 -6.032 1.00 0.00 H new ATOM 0 HH TYR A 64 2.052 2.837 -7.156 1.00 0.00 H new ATOM 871 N THR A 65 3.584 8.153 -2.490 1.00 0.00 N ATOM 872 CA THR A 65 4.859 8.424 -3.214 1.00 0.00 C ATOM 873 C THR A 65 5.916 7.390 -2.823 1.00 0.00 C ATOM 874 O THR A 65 6.593 7.527 -1.824 1.00 0.00 O ATOM 875 CB THR A 65 5.283 9.823 -2.763 1.00 0.00 C ATOM 876 OG1 THR A 65 4.323 10.772 -3.205 1.00 0.00 O ATOM 877 CG2 THR A 65 6.650 10.161 -3.359 1.00 0.00 C ATOM 0 H THR A 65 3.645 8.191 -1.473 1.00 0.00 H new ATOM 0 HA THR A 65 4.741 8.365 -4.296 1.00 0.00 H new ATOM 0 HB THR A 65 5.347 9.851 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.592 11.669 -2.915 1.00 0.00 H new ATOM 0 HG21 THR A 65 6.951 11.158 -3.037 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.386 9.432 -3.019 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.589 10.134 -4.447 1.00 0.00 H new ATOM 885 N ALA A 66 6.060 6.355 -3.604 1.00 0.00 N ATOM 886 CA ALA A 66 7.070 5.308 -3.277 1.00 0.00 C ATOM 887 C ALA A 66 8.387 5.595 -4.001 1.00 0.00 C ATOM 888 O ALA A 66 8.408 6.198 -5.056 1.00 0.00 O ATOM 889 CB ALA A 66 6.457 3.999 -3.775 1.00 0.00 C ATOM 0 H ALA A 66 5.522 6.189 -4.455 1.00 0.00 H new ATOM 0 HA ALA A 66 7.298 5.273 -2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.142 3.176 -3.571 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.512 3.821 -3.261 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.279 4.066 -4.848 1.00 0.00 H new ATOM 895 N THR A 67 9.486 5.168 -3.443 1.00 0.00 N ATOM 896 CA THR A 67 10.801 5.416 -4.100 1.00 0.00 C ATOM 897 C THR A 67 11.783 4.290 -3.763 1.00 0.00 C ATOM 898 O THR A 67 12.086 4.040 -2.613 1.00 0.00 O ATOM 899 CB THR A 67 11.292 6.744 -3.522 1.00 0.00 C ATOM 900 OG1 THR A 67 10.307 7.745 -3.739 1.00 0.00 O ATOM 901 CG2 THR A 67 12.597 7.150 -4.208 1.00 0.00 C ATOM 0 H THR A 67 9.531 4.658 -2.561 1.00 0.00 H new ATOM 0 HA THR A 67 10.717 5.451 -5.186 1.00 0.00 H new ATOM 0 HB THR A 67 11.468 6.633 -2.452 1.00 0.00 H new ATOM 0 HG1 THR A 67 10.275 8.346 -2.965 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.946 8.097 -3.795 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.351 6.381 -4.040 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.426 7.262 -5.279 1.00 0.00 H new ATOM 909 N ALA A 68 12.286 3.614 -4.759 1.00 0.00 N ATOM 910 CA ALA A 68 13.252 2.509 -4.498 1.00 0.00 C ATOM 911 C ALA A 68 14.620 2.868 -5.077 1.00 0.00 C ATOM 912 O ALA A 68 14.730 3.284 -6.212 1.00 0.00 O ATOM 913 CB ALA A 68 12.676 1.288 -5.221 1.00 0.00 C ATOM 0 H ALA A 68 12.070 3.779 -5.742 1.00 0.00 H new ATOM 0 HA ALA A 68 13.386 2.323 -3.432 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.336 0.433 -5.073 1.00 0.00 H new ATOM 0 HB2 ALA A 68 11.689 1.059 -4.819 1.00 0.00 H new ATOM 0 HB3 ALA A 68 12.593 1.502 -6.287 1.00 0.00 H new ATOM 919 N SER A 69 15.666 2.704 -4.316 1.00 0.00 N ATOM 920 CA SER A 69 17.019 3.031 -4.845 1.00 0.00 C ATOM 921 C SER A 69 17.187 2.403 -6.230 1.00 0.00 C ATOM 922 O SER A 69 17.977 2.849 -7.038 1.00 0.00 O ATOM 923 CB SER A 69 17.998 2.412 -3.849 1.00 0.00 C ATOM 924 OG SER A 69 17.499 1.152 -3.421 1.00 0.00 O ATOM 0 H SER A 69 15.643 2.360 -3.356 1.00 0.00 H new ATOM 0 HA SER A 69 17.183 4.103 -4.951 1.00 0.00 H new ATOM 0 HB2 SER A 69 18.977 2.290 -4.312 1.00 0.00 H new ATOM 0 HB3 SER A 69 18.130 3.073 -2.993 1.00 0.00 H new ATOM 0 HG SER A 69 18.126 0.751 -2.783 1.00 0.00 H new ATOM 930 N THR A 70 16.442 1.366 -6.505 1.00 0.00 N ATOM 931 CA THR A 70 16.542 0.697 -7.831 1.00 0.00 C ATOM 932 C THR A 70 15.233 0.876 -8.611 1.00 0.00 C ATOM 933 O THR A 70 14.236 1.315 -8.073 1.00 0.00 O ATOM 934 CB THR A 70 16.776 -0.783 -7.500 1.00 0.00 C ATOM 935 OG1 THR A 70 17.374 -1.427 -8.615 1.00 0.00 O ATOM 936 CG2 THR A 70 15.441 -1.461 -7.171 1.00 0.00 C ATOM 0 H THR A 70 15.765 0.953 -5.863 1.00 0.00 H new ATOM 0 HA THR A 70 17.338 1.110 -8.451 1.00 0.00 H new ATOM 0 HB THR A 70 17.437 -0.858 -6.637 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.526 -2.372 -8.404 1.00 0.00 H new ATOM 0 HG21 THR A 70 15.614 -2.511 -6.937 1.00 0.00 H new ATOM 0 HG22 THR A 70 14.985 -0.968 -6.312 1.00 0.00 H new ATOM 0 HG23 THR A 70 14.773 -1.386 -8.029 1.00 0.00 H new ATOM 944 N ASP A 71 15.222 0.520 -9.865 1.00 0.00 N ATOM 945 CA ASP A 71 13.969 0.649 -10.662 1.00 0.00 C ATOM 946 C ASP A 71 13.128 -0.615 -10.481 1.00 0.00 C ATOM 947 O ASP A 71 12.936 -1.385 -11.401 1.00 0.00 O ATOM 948 CB ASP A 71 14.429 0.790 -12.114 1.00 0.00 C ATOM 949 CG ASP A 71 13.263 1.278 -12.974 1.00 0.00 C ATOM 950 OD1 ASP A 71 12.942 2.452 -12.891 1.00 0.00 O ATOM 951 OD2 ASP A 71 12.710 0.470 -13.702 1.00 0.00 O ATOM 0 H ASP A 71 16.024 0.146 -10.372 1.00 0.00 H new ATOM 0 HA ASP A 71 13.358 1.498 -10.356 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.260 1.493 -12.177 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.793 -0.168 -12.486 1.00 0.00 H new ATOM 956 N VAL A 72 12.644 -0.846 -9.290 1.00 0.00 N ATOM 957 CA VAL A 72 11.837 -2.072 -9.037 1.00 0.00 C ATOM 958 C VAL A 72 10.366 -1.855 -9.399 1.00 0.00 C ATOM 959 O VAL A 72 9.777 -0.840 -9.087 1.00 0.00 O ATOM 960 CB VAL A 72 11.986 -2.340 -7.536 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.055 -1.419 -6.742 1.00 0.00 C ATOM 962 CG2 VAL A 72 11.620 -3.795 -7.245 1.00 0.00 C ATOM 0 H VAL A 72 12.773 -0.238 -8.482 1.00 0.00 H new ATOM 0 HA VAL A 72 12.179 -2.910 -9.645 1.00 0.00 H new ATOM 0 HB VAL A 72 13.017 -2.148 -7.240 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.169 -1.618 -5.676 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.311 -0.379 -6.947 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.022 -1.604 -7.037 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.725 -3.990 -6.178 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.589 -3.978 -7.548 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.285 -4.456 -7.801 1.00 0.00 H new ATOM 972 N THR A 73 9.769 -2.820 -10.039 1.00 0.00 N ATOM 973 CA THR A 73 8.332 -2.704 -10.408 1.00 0.00 C ATOM 974 C THR A 73 7.567 -3.883 -9.805 1.00 0.00 C ATOM 975 O THR A 73 7.382 -4.903 -10.439 1.00 0.00 O ATOM 976 CB THR A 73 8.304 -2.764 -11.936 1.00 0.00 C ATOM 977 OG1 THR A 73 9.109 -1.719 -12.464 1.00 0.00 O ATOM 978 CG2 THR A 73 6.865 -2.601 -12.429 1.00 0.00 C ATOM 0 H THR A 73 10.218 -3.690 -10.324 1.00 0.00 H new ATOM 0 HA THR A 73 7.871 -1.788 -10.040 1.00 0.00 H new ATOM 0 HB THR A 73 8.693 -3.726 -12.269 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.094 -1.757 -13.443 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.846 -2.644 -13.518 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.248 -3.403 -12.024 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.473 -1.639 -12.097 1.00 0.00 H new ATOM 986 N VAL A 74 7.138 -3.760 -8.580 1.00 0.00 N ATOM 987 CA VAL A 74 6.405 -4.885 -7.935 1.00 0.00 C ATOM 988 C VAL A 74 4.903 -4.769 -8.205 1.00 0.00 C ATOM 989 O VAL A 74 4.485 -4.211 -9.200 1.00 0.00 O ATOM 990 CB VAL A 74 6.710 -4.752 -6.442 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.219 -4.578 -6.243 1.00 0.00 C ATOM 992 CG2 VAL A 74 5.981 -3.532 -5.877 1.00 0.00 C ATOM 0 H VAL A 74 7.263 -2.931 -7.999 1.00 0.00 H new ATOM 0 HA VAL A 74 6.712 -5.856 -8.323 1.00 0.00 H new ATOM 0 HB VAL A 74 6.374 -5.650 -5.923 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.437 -4.483 -5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.741 -5.446 -6.645 1.00 0.00 H new ATOM 0 HG13 VAL A 74 8.554 -3.681 -6.763 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.199 -3.438 -4.813 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.317 -2.635 -6.397 1.00 0.00 H new ATOM 0 HG23 VAL A 74 4.907 -3.652 -6.018 1.00 0.00 H new ATOM 1002 N ARG A 75 4.089 -5.300 -7.336 1.00 0.00 N ATOM 1003 CA ARG A 75 2.616 -5.225 -7.560 1.00 0.00 C ATOM 1004 C ARG A 75 1.916 -4.612 -6.344 1.00 0.00 C ATOM 1005 O ARG A 75 2.168 -4.984 -5.215 1.00 0.00 O ATOM 1006 CB ARG A 75 2.176 -6.675 -7.760 1.00 0.00 C ATOM 1007 CG ARG A 75 2.247 -7.031 -9.246 1.00 0.00 C ATOM 1008 CD ARG A 75 0.899 -7.598 -9.700 1.00 0.00 C ATOM 1009 NE ARG A 75 -0.072 -6.487 -9.498 1.00 0.00 N ATOM 1010 CZ ARG A 75 -1.345 -6.687 -9.710 1.00 0.00 C ATOM 1011 NH1 ARG A 75 -1.966 -7.654 -9.092 1.00 0.00 N ATOM 1012 NH2 ARG A 75 -1.996 -5.919 -10.541 1.00 0.00 N ATOM 0 H ARG A 75 4.377 -5.781 -6.484 1.00 0.00 H new ATOM 0 HA ARG A 75 2.362 -4.597 -8.414 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.817 -7.343 -7.184 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.160 -6.812 -7.391 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.497 -6.146 -9.831 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.038 -7.761 -9.419 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.933 -7.908 -10.744 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.622 -8.475 -9.115 1.00 0.00 H new ATOM 0 HE ARG A 75 0.257 -5.571 -9.194 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -1.457 -8.254 -8.443 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -2.960 -7.810 -9.258 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -1.510 -5.163 -11.024 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.990 -6.075 -10.707 1.00 0.00 H new ATOM 1026 N ALA A 76 1.032 -3.678 -6.570 1.00 0.00 N ATOM 1027 CA ALA A 76 0.307 -3.042 -5.433 1.00 0.00 C ATOM 1028 C ALA A 76 -1.177 -2.882 -5.779 1.00 0.00 C ATOM 1029 O ALA A 76 -1.552 -2.827 -6.934 1.00 0.00 O ATOM 1030 CB ALA A 76 0.968 -1.675 -5.253 1.00 0.00 C ATOM 0 H ALA A 76 0.780 -3.328 -7.494 1.00 0.00 H new ATOM 0 HA ALA A 76 0.359 -3.640 -4.523 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.488 -1.144 -4.431 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.026 -1.809 -5.029 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.862 -1.096 -6.170 1.00 0.00 H new ATOM 1036 N LEU A 77 -2.023 -2.810 -4.785 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.483 -2.660 -5.054 1.00 0.00 C ATOM 1038 C LEU A 77 -4.260 -2.620 -3.731 1.00 0.00 C ATOM 1039 O LEU A 77 -3.772 -2.139 -2.729 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.860 -3.900 -5.869 1.00 0.00 C ATOM 1041 CG LEU A 77 -3.466 -5.162 -5.097 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -4.629 -5.604 -4.209 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -3.130 -6.279 -6.087 1.00 0.00 C ATOM 0 H LEU A 77 -1.766 -2.849 -3.799 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.719 -1.738 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.931 -3.904 -6.069 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.355 -3.880 -6.835 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.596 -4.950 -4.476 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.347 -6.502 -3.660 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.871 -4.809 -3.504 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.500 -5.816 -4.829 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.849 -7.178 -5.539 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.001 -6.489 -6.708 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.300 -5.966 -6.721 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.466 -3.123 -3.721 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.275 -3.121 -2.466 1.00 0.00 C ATOM 1057 C VAL A 78 -7.249 -4.303 -2.489 1.00 0.00 C ATOM 1058 O VAL A 78 -7.454 -4.921 -3.514 1.00 0.00 O ATOM 1059 CB VAL A 78 -7.039 -1.795 -2.481 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.582 -1.500 -1.081 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -6.098 -0.665 -2.905 1.00 0.00 C ATOM 0 H VAL A 78 -5.928 -3.537 -4.531 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.661 -3.218 -1.571 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.867 -1.866 -3.187 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -8.126 -0.555 -1.093 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.254 -2.302 -0.775 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.753 -1.432 -0.376 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.644 0.278 -2.915 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.270 -0.597 -2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.709 -0.870 -3.903 1.00 0.00 H new ATOM 1071 N GLY A 79 -7.850 -4.632 -1.377 1.00 0.00 N ATOM 1072 CA GLY A 79 -8.799 -5.783 -1.378 1.00 0.00 C ATOM 1073 C GLY A 79 -9.542 -5.870 -0.044 1.00 0.00 C ATOM 1074 O GLY A 79 -9.406 -5.022 0.815 1.00 0.00 O ATOM 0 H GLY A 79 -7.728 -4.162 -0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.515 -5.670 -2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.255 -6.710 -1.558 1.00 0.00 H new ATOM 1078 N GLN A 80 -10.326 -6.901 0.131 1.00 0.00 N ATOM 1079 CA GLN A 80 -11.085 -7.065 1.407 1.00 0.00 C ATOM 1080 C GLN A 80 -10.594 -8.307 2.154 1.00 0.00 C ATOM 1081 O GLN A 80 -10.139 -9.262 1.556 1.00 0.00 O ATOM 1082 CB GLN A 80 -12.555 -7.230 1.003 1.00 0.00 C ATOM 1083 CG GLN A 80 -12.662 -8.067 -0.273 1.00 0.00 C ATOM 1084 CD GLN A 80 -14.136 -8.333 -0.581 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -14.605 -8.039 -1.662 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -14.891 -8.883 0.330 1.00 0.00 N ATOM 0 H GLN A 80 -10.474 -7.639 -0.557 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.948 -6.211 2.071 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -13.109 -7.710 1.809 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.008 -6.251 0.844 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -12.193 -7.543 -1.106 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -12.129 -9.010 -0.149 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.497 -9.130 1.238 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.875 -9.066 0.134 1.00 0.00 H new ATOM 1095 N ASN A 81 -10.680 -8.303 3.456 1.00 0.00 N ATOM 1096 CA ASN A 81 -10.216 -9.485 4.236 1.00 0.00 C ATOM 1097 C ASN A 81 -11.413 -10.271 4.776 1.00 0.00 C ATOM 1098 O ASN A 81 -11.921 -9.992 5.845 1.00 0.00 O ATOM 1099 CB ASN A 81 -9.394 -8.903 5.386 1.00 0.00 C ATOM 1100 CG ASN A 81 -8.394 -7.885 4.835 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -8.556 -6.695 5.021 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -7.359 -8.305 4.160 1.00 0.00 N ATOM 0 H ASN A 81 -11.051 -7.533 4.013 1.00 0.00 H new ATOM 0 HA ASN A 81 -9.634 -10.177 3.627 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.052 -8.426 6.112 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -8.866 -9.700 5.910 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -6.686 -7.634 3.789 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -7.223 -9.304 4.004 1.00 0.00 H new ATOM 1109 N GLY A 82 -11.866 -11.254 4.046 1.00 0.00 N ATOM 1110 CA GLY A 82 -13.028 -12.060 4.518 1.00 0.00 C ATOM 1111 C GLY A 82 -14.008 -12.275 3.363 1.00 0.00 C ATOM 1112 O GLY A 82 -14.390 -11.346 2.680 1.00 0.00 O ATOM 0 H GLY A 82 -11.482 -11.534 3.143 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -12.685 -13.021 4.901 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -13.527 -11.549 5.341 1.00 0.00 H new ATOM 1116 N ALA A 83 -14.415 -13.495 3.140 1.00 0.00 N ATOM 1117 CA ALA A 83 -15.370 -13.772 2.028 1.00 0.00 C ATOM 1118 C ALA A 83 -16.462 -12.697 1.984 1.00 0.00 C ATOM 1119 O ALA A 83 -16.749 -12.069 2.984 1.00 0.00 O ATOM 1120 CB ALA A 83 -15.974 -15.137 2.358 1.00 0.00 C ATOM 0 H ALA A 83 -14.128 -14.312 3.679 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.882 -13.766 1.053 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.690 -15.415 1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.182 -15.884 2.404 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -16.481 -15.087 3.321 1.00 0.00 H new ATOM 1126 N PRO A 84 -17.041 -12.518 0.820 1.00 0.00 N ATOM 1127 CA PRO A 84 -16.653 -13.313 -0.374 1.00 0.00 C ATOM 1128 C PRO A 84 -15.356 -12.775 -0.993 1.00 0.00 C ATOM 1129 O PRO A 84 -14.988 -13.141 -2.091 1.00 0.00 O ATOM 1130 CB PRO A 84 -17.824 -13.112 -1.330 1.00 0.00 C ATOM 1131 CG PRO A 84 -18.443 -11.807 -0.932 1.00 0.00 C ATOM 1132 CD PRO A 84 -18.112 -11.562 0.520 1.00 0.00 C ATOM 0 HA PRO A 84 -16.464 -14.361 -0.140 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -17.486 -13.087 -2.366 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -18.542 -13.928 -1.249 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.059 -10.997 -1.553 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -19.523 -11.836 -1.078 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.785 -10.535 0.685 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -18.980 -11.726 1.158 1.00 0.00 H new ATOM 1140 N TYR A 85 -14.665 -11.906 -0.304 1.00 0.00 N ATOM 1141 CA TYR A 85 -13.399 -11.346 -0.861 1.00 0.00 C ATOM 1142 C TYR A 85 -13.682 -10.598 -2.166 1.00 0.00 C ATOM 1143 O TYR A 85 -14.675 -10.833 -2.825 1.00 0.00 O ATOM 1144 CB TYR A 85 -12.500 -12.557 -1.124 1.00 0.00 C ATOM 1145 CG TYR A 85 -12.434 -13.423 0.111 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -11.857 -12.925 1.285 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -12.945 -14.725 0.079 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -11.794 -13.729 2.429 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -12.881 -15.530 1.223 1.00 0.00 C ATOM 1150 CZ TYR A 85 -12.306 -15.032 2.398 1.00 0.00 C ATOM 1151 OH TYR A 85 -12.243 -15.825 3.525 1.00 0.00 O ATOM 0 H TYR A 85 -14.922 -11.560 0.620 1.00 0.00 H new ATOM 0 HA TYR A 85 -12.932 -10.636 -0.179 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.888 -13.134 -1.963 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.499 -12.225 -1.401 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -11.461 -11.921 1.308 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.389 -15.109 -0.828 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -11.351 -13.344 3.336 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.275 -16.535 1.199 1.00 0.00 H new ATOM 0 HH TYR A 85 -12.643 -16.699 3.333 1.00 0.00 H new ATOM 1161 N GLY A 86 -12.816 -9.697 -2.543 1.00 0.00 N ATOM 1162 CA GLY A 86 -13.034 -8.932 -3.804 1.00 0.00 C ATOM 1163 C GLY A 86 -12.061 -7.752 -3.858 1.00 0.00 C ATOM 1164 O GLY A 86 -12.144 -6.831 -3.070 1.00 0.00 O ATOM 0 H GLY A 86 -11.966 -9.457 -2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.884 -9.581 -4.667 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.062 -8.572 -3.851 1.00 0.00 H new ATOM 1168 N THR A 87 -11.139 -7.772 -4.780 1.00 0.00 N ATOM 1169 CA THR A 87 -10.161 -6.650 -4.878 1.00 0.00 C ATOM 1170 C THR A 87 -10.697 -5.558 -5.807 1.00 0.00 C ATOM 1171 O THR A 87 -11.511 -5.809 -6.674 1.00 0.00 O ATOM 1172 CB THR A 87 -8.893 -7.275 -5.464 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.251 -8.289 -6.393 1.00 0.00 O ATOM 1174 CG2 THR A 87 -8.054 -7.884 -4.339 1.00 0.00 C ATOM 0 H THR A 87 -11.020 -8.515 -5.469 1.00 0.00 H new ATOM 0 HA THR A 87 -9.976 -6.182 -3.911 1.00 0.00 H new ATOM 0 HB THR A 87 -8.311 -6.506 -5.972 1.00 0.00 H new ATOM 0 HG1 THR A 87 -8.439 -8.689 -6.770 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.151 -8.329 -4.758 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.778 -7.105 -3.628 1.00 0.00 H new ATOM 0 HG23 THR A 87 -8.634 -8.653 -3.828 1.00 0.00 H new ATOM 1182 N VAL A 88 -10.243 -4.347 -5.634 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.721 -3.238 -6.507 1.00 0.00 C ATOM 1184 C VAL A 88 -9.540 -2.624 -7.263 1.00 0.00 C ATOM 1185 O VAL A 88 -9.700 -2.040 -8.316 1.00 0.00 O ATOM 1186 CB VAL A 88 -11.338 -2.216 -5.551 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.522 -2.851 -4.819 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -10.287 -1.774 -4.530 1.00 0.00 C ATOM 0 H VAL A 88 -9.561 -4.077 -4.925 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.439 -3.577 -7.254 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.682 -1.351 -6.118 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.962 -2.123 -4.138 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.271 -3.167 -5.545 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.178 -3.716 -4.252 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.726 -1.046 -3.848 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.943 -2.640 -3.964 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.442 -1.322 -5.050 1.00 0.00 H new ATOM 1198 N LEU A 89 -8.354 -2.758 -6.734 1.00 0.00 N ATOM 1199 CA LEU A 89 -7.161 -2.189 -7.424 1.00 0.00 C ATOM 1200 C LEU A 89 -6.347 -3.295 -8.094 1.00 0.00 C ATOM 1201 O LEU A 89 -6.237 -4.394 -7.588 1.00 0.00 O ATOM 1202 CB LEU A 89 -6.349 -1.516 -6.330 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.774 -0.056 -6.240 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -8.028 0.057 -5.377 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.643 0.756 -5.622 1.00 0.00 C ATOM 0 H LEU A 89 -8.160 -3.237 -5.854 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.443 -1.489 -8.210 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.511 -2.017 -5.376 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.284 -1.587 -6.551 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.992 0.328 -7.236 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.332 1.102 -5.312 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.832 -0.528 -5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.817 -0.322 -4.377 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.941 1.802 -5.555 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.425 0.376 -4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.752 0.672 -6.245 1.00 0.00 H new ATOM 1217 N ASP A 90 -5.775 -3.012 -9.229 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.963 -4.044 -9.933 1.00 0.00 C ATOM 1219 C ASP A 90 -3.866 -3.376 -10.765 1.00 0.00 C ATOM 1220 O ASP A 90 -3.968 -3.274 -11.972 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.953 -4.779 -10.837 1.00 0.00 C ATOM 1222 CG ASP A 90 -5.867 -6.283 -10.573 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -5.812 -6.658 -9.413 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -5.859 -7.034 -11.534 1.00 0.00 O ATOM 0 H ASP A 90 -5.834 -2.110 -9.701 1.00 0.00 H new ATOM 0 HA ASP A 90 -4.465 -4.722 -9.240 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.966 -4.424 -10.649 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.731 -4.570 -11.883 1.00 0.00 H new ATOM 1229 N THR A 91 -2.818 -2.915 -10.136 1.00 0.00 N ATOM 1230 CA THR A 91 -1.726 -2.253 -10.906 1.00 0.00 C ATOM 1231 C THR A 91 -0.365 -2.564 -10.281 1.00 0.00 C ATOM 1232 O THR A 91 -0.274 -3.209 -9.256 1.00 0.00 O ATOM 1233 CB THR A 91 -2.028 -0.756 -10.812 1.00 0.00 C ATOM 1234 OG1 THR A 91 -2.640 -0.476 -9.561 1.00 0.00 O ATOM 1235 CG2 THR A 91 -2.972 -0.352 -11.946 1.00 0.00 C ATOM 0 H THR A 91 -2.671 -2.968 -9.128 1.00 0.00 H new ATOM 0 HA THR A 91 -1.684 -2.600 -11.939 1.00 0.00 H new ATOM 0 HB THR A 91 -1.100 -0.191 -10.897 1.00 0.00 H new ATOM 0 HG1 THR A 91 -2.833 0.483 -9.498 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.187 0.715 -11.878 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.501 -0.567 -12.905 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.902 -0.915 -11.864 1.00 0.00 H new ATOM 1243 N SER A 92 0.695 -2.109 -10.893 1.00 0.00 N ATOM 1244 CA SER A 92 2.052 -2.374 -10.337 1.00 0.00 C ATOM 1245 C SER A 92 2.799 -1.054 -10.124 1.00 0.00 C ATOM 1246 O SER A 92 2.922 -0.258 -11.033 1.00 0.00 O ATOM 1247 CB SER A 92 2.755 -3.222 -11.397 1.00 0.00 C ATOM 1248 OG SER A 92 2.070 -4.459 -11.538 1.00 0.00 O ATOM 0 H SER A 92 0.679 -1.564 -11.755 1.00 0.00 H new ATOM 0 HA SER A 92 2.013 -2.879 -9.372 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.773 -2.693 -12.350 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.792 -3.398 -11.110 1.00 0.00 H new ATOM 0 HG SER A 92 2.517 -5.005 -12.218 1.00 0.00 H new ATOM 1254 N PRO A 93 3.271 -0.864 -8.921 1.00 0.00 N ATOM 1255 CA PRO A 93 4.012 0.377 -8.580 1.00 0.00 C ATOM 1256 C PRO A 93 5.394 0.382 -9.239 1.00 0.00 C ATOM 1257 O PRO A 93 6.162 -0.549 -9.103 1.00 0.00 O ATOM 1258 CB PRO A 93 4.139 0.311 -7.061 1.00 0.00 C ATOM 1259 CG PRO A 93 4.044 -1.143 -6.729 1.00 0.00 C ATOM 1260 CD PRO A 93 3.163 -1.774 -7.776 1.00 0.00 C ATOM 0 HA PRO A 93 3.510 1.280 -8.926 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.087 0.732 -6.725 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.347 0.880 -6.573 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.032 -1.604 -6.727 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.623 -1.285 -5.734 1.00 0.00 H new ATOM 0 HD2 PRO A 93 3.501 -2.779 -8.030 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.133 -1.862 -7.431 1.00 0.00 H new ATOM 1268 N ALA A 94 5.717 1.430 -9.946 1.00 0.00 N ATOM 1269 CA ALA A 94 7.052 1.503 -10.607 1.00 0.00 C ATOM 1270 C ALA A 94 7.958 2.470 -9.842 1.00 0.00 C ATOM 1271 O ALA A 94 7.587 3.593 -9.564 1.00 0.00 O ATOM 1272 CB ALA A 94 6.769 2.029 -12.015 1.00 0.00 C ATOM 0 H ALA A 94 5.114 2.239 -10.095 1.00 0.00 H new ATOM 0 HA ALA A 94 7.560 0.539 -10.630 1.00 0.00 H new ATOM 0 HB1 ALA A 94 7.705 2.111 -12.568 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.101 1.341 -12.533 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.299 3.010 -11.949 1.00 0.00 H new ATOM 1278 N LEU A 95 9.140 2.043 -9.492 1.00 0.00 N ATOM 1279 CA LEU A 95 10.062 2.941 -8.739 1.00 0.00 C ATOM 1280 C LEU A 95 11.355 3.164 -9.528 1.00 0.00 C ATOM 1281 O LEU A 95 11.536 2.632 -10.606 1.00 0.00 O ATOM 1282 CB LEU A 95 10.350 2.201 -7.432 1.00 0.00 C ATOM 1283 CG LEU A 95 9.030 1.807 -6.765 1.00 0.00 C ATOM 1284 CD1 LEU A 95 9.319 1.040 -5.473 1.00 0.00 C ATOM 1285 CD2 LEU A 95 8.228 3.068 -6.438 1.00 0.00 C ATOM 0 H LEU A 95 9.507 1.113 -9.694 1.00 0.00 H new ATOM 0 HA LEU A 95 9.628 3.926 -8.566 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.949 1.312 -7.630 1.00 0.00 H new ATOM 0 HB3 LEU A 95 10.932 2.835 -6.764 1.00 0.00 H new ATOM 0 HG LEU A 95 8.456 1.175 -7.443 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.379 0.760 -4.998 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.891 0.141 -5.704 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.893 1.672 -4.795 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.288 2.788 -5.963 1.00 0.00 H new ATOM 0 HD22 LEU A 95 8.803 3.699 -5.761 1.00 0.00 H new ATOM 0 HD23 LEU A 95 8.021 3.616 -7.357 1.00 0.00 H new ATOM 1297 N THR A 96 12.254 3.950 -9.001 1.00 0.00 N ATOM 1298 CA THR A 96 13.536 4.212 -9.721 1.00 0.00 C ATOM 1299 C THR A 96 14.605 4.704 -8.742 1.00 0.00 C ATOM 1300 O THR A 96 15.460 3.955 -8.313 1.00 0.00 O ATOM 1301 CB THR A 96 13.217 5.295 -10.764 1.00 0.00 C ATOM 1302 OG1 THR A 96 14.394 6.042 -11.037 1.00 0.00 O ATOM 1303 CG2 THR A 96 12.126 6.239 -10.243 1.00 0.00 C ATOM 0 H THR A 96 12.157 4.423 -8.102 1.00 0.00 H new ATOM 0 HA THR A 96 13.926 3.309 -10.191 1.00 0.00 H new ATOM 0 HB THR A 96 12.859 4.814 -11.674 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.196 6.733 -11.703 1.00 0.00 H new ATOM 0 HG21 THR A 96 11.913 6.999 -10.995 1.00 0.00 H new ATOM 0 HG22 THR A 96 11.220 5.669 -10.037 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.468 6.720 -9.327 1.00 0.00 H new ATOM 1311 N SER A 97 14.564 5.956 -8.388 1.00 0.00 N ATOM 1312 CA SER A 97 15.576 6.499 -7.436 1.00 0.00 C ATOM 1313 C SER A 97 15.045 7.774 -6.776 1.00 0.00 C ATOM 1314 O SER A 97 15.267 8.019 -5.607 1.00 0.00 O ATOM 1315 CB SER A 97 16.803 6.808 -8.293 1.00 0.00 C ATOM 1316 OG SER A 97 17.943 6.176 -7.724 1.00 0.00 O ATOM 0 H SER A 97 13.873 6.630 -8.716 1.00 0.00 H new ATOM 0 HA SER A 97 15.808 5.798 -6.634 1.00 0.00 H new ATOM 0 HB2 SER A 97 16.648 6.455 -9.312 1.00 0.00 H new ATOM 0 HB3 SER A 97 16.960 7.885 -8.349 1.00 0.00 H new ATOM 0 HG SER A 97 18.732 6.370 -8.272 1.00 0.00 H new ATOM 1322 N GLU A 98 14.341 8.584 -7.517 1.00 0.00 N ATOM 1323 CA GLU A 98 13.789 9.841 -6.935 1.00 0.00 C ATOM 1324 C GLU A 98 12.397 9.576 -6.355 1.00 0.00 C ATOM 1325 O GLU A 98 11.921 8.459 -6.376 1.00 0.00 O ATOM 1326 CB GLU A 98 13.709 10.814 -8.112 1.00 0.00 C ATOM 1327 CG GLU A 98 14.630 12.007 -7.851 1.00 0.00 C ATOM 1328 CD GLU A 98 15.711 12.065 -8.932 1.00 0.00 C ATOM 1329 OE1 GLU A 98 16.119 11.010 -9.390 1.00 0.00 O ATOM 1330 OE2 GLU A 98 16.112 13.162 -9.284 1.00 0.00 O ATOM 0 H GLU A 98 14.123 8.430 -8.502 1.00 0.00 H new ATOM 0 HA GLU A 98 14.402 10.235 -6.125 1.00 0.00 H new ATOM 0 HB2 GLU A 98 14.000 10.311 -9.034 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.683 11.156 -8.246 1.00 0.00 H new ATOM 0 HG2 GLU A 98 14.053 12.932 -7.849 1.00 0.00 H new ATOM 0 HG3 GLU A 98 15.090 11.916 -6.867 1.00 0.00 H new ATOM 1337 N PRO A 99 11.785 10.617 -5.854 1.00 0.00 N ATOM 1338 CA PRO A 99 10.431 10.486 -5.265 1.00 0.00 C ATOM 1339 C PRO A 99 9.394 10.256 -6.366 1.00 0.00 C ATOM 1340 O PRO A 99 9.332 10.987 -7.336 1.00 0.00 O ATOM 1341 CB PRO A 99 10.210 11.827 -4.571 1.00 0.00 C ATOM 1342 CG PRO A 99 11.104 12.786 -5.290 1.00 0.00 C ATOM 1343 CD PRO A 99 12.285 11.995 -5.791 1.00 0.00 C ATOM 0 HA PRO A 99 10.337 9.642 -4.581 1.00 0.00 H new ATOM 0 HB2 PRO A 99 9.167 12.137 -4.634 1.00 0.00 H new ATOM 0 HB3 PRO A 99 10.462 11.770 -3.512 1.00 0.00 H new ATOM 0 HG2 PRO A 99 10.576 13.258 -6.119 1.00 0.00 H new ATOM 0 HG3 PRO A 99 11.429 13.584 -4.623 1.00 0.00 H new ATOM 0 HD2 PRO A 99 12.615 12.346 -6.769 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.138 12.080 -5.118 1.00 0.00 H new ATOM 1351 N ARG A 100 8.581 9.245 -6.229 1.00 0.00 N ATOM 1352 CA ARG A 100 7.553 8.970 -7.273 1.00 0.00 C ATOM 1353 C ARG A 100 6.149 9.044 -6.670 1.00 0.00 C ATOM 1354 O ARG A 100 5.625 8.069 -6.165 1.00 0.00 O ATOM 1355 CB ARG A 100 7.853 7.552 -7.760 1.00 0.00 C ATOM 1356 CG ARG A 100 6.882 7.183 -8.883 1.00 0.00 C ATOM 1357 CD ARG A 100 7.537 6.155 -9.808 1.00 0.00 C ATOM 1358 NE ARG A 100 8.215 6.963 -10.859 1.00 0.00 N ATOM 1359 CZ ARG A 100 7.746 6.974 -12.077 1.00 0.00 C ATOM 1360 NH1 ARG A 100 6.473 6.781 -12.287 1.00 0.00 N ATOM 1361 NH2 ARG A 100 8.550 7.179 -13.084 1.00 0.00 N ATOM 0 H ARG A 100 8.584 8.598 -5.440 1.00 0.00 H new ATOM 0 HA ARG A 100 7.586 9.697 -8.085 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.881 7.489 -8.118 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.758 6.845 -6.936 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.962 6.776 -8.463 1.00 0.00 H new ATOM 0 HG3 ARG A 100 6.608 8.074 -9.448 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.250 5.533 -9.266 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.795 5.485 -10.242 1.00 0.00 H new ATOM 0 HE ARG A 100 9.046 7.508 -10.627 1.00 0.00 H new ATOM 0 HH11 ARG A 100 5.845 6.622 -11.500 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.106 6.790 -13.239 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.545 7.331 -12.919 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.183 7.188 -14.036 1.00 0.00 H new ATOM 1375 N GLN A 101 5.535 10.194 -6.721 1.00 0.00 N ATOM 1376 CA GLN A 101 4.163 10.334 -6.156 1.00 0.00 C ATOM 1377 C GLN A 101 3.157 9.579 -7.028 1.00 0.00 C ATOM 1378 O GLN A 101 3.408 9.302 -8.184 1.00 0.00 O ATOM 1379 CB GLN A 101 3.875 11.833 -6.180 1.00 0.00 C ATOM 1380 CG GLN A 101 4.166 12.379 -7.575 1.00 0.00 C ATOM 1381 CD GLN A 101 3.363 13.661 -7.803 1.00 0.00 C ATOM 1382 OE1 GLN A 101 3.072 14.017 -8.927 1.00 0.00 O ATOM 1383 NE2 GLN A 101 2.990 14.373 -6.776 1.00 0.00 N ATOM 0 H GLN A 101 5.924 11.043 -7.130 1.00 0.00 H new ATOM 0 HA GLN A 101 4.085 9.922 -5.150 1.00 0.00 H new ATOM 0 HB2 GLN A 101 2.835 12.020 -5.913 1.00 0.00 H new ATOM 0 HB3 GLN A 101 4.490 12.345 -5.440 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.232 12.582 -7.682 1.00 0.00 H new ATOM 0 HG3 GLN A 101 3.906 11.636 -8.329 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.235 14.074 -5.832 1.00 0.00 H new ATOM 0 HE22 GLN A 101 2.454 15.229 -6.917 1.00 0.00 H new ATOM 1392 N VAL A 102 2.020 9.243 -6.484 1.00 0.00 N ATOM 1393 CA VAL A 102 1.001 8.506 -7.283 1.00 0.00 C ATOM 1394 C VAL A 102 -0.386 9.114 -7.059 1.00 0.00 C ATOM 1395 O VAL A 102 -0.745 9.472 -5.955 1.00 0.00 O ATOM 1396 CB VAL A 102 1.052 7.071 -6.760 1.00 0.00 C ATOM 1397 CG1 VAL A 102 -0.025 6.234 -7.452 1.00 0.00 C ATOM 1398 CG2 VAL A 102 2.429 6.471 -7.054 1.00 0.00 C ATOM 0 H VAL A 102 1.753 9.447 -5.521 1.00 0.00 H new ATOM 0 HA VAL A 102 1.198 8.555 -8.354 1.00 0.00 H new ATOM 0 HB VAL A 102 0.875 7.071 -5.684 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.013 5.211 -7.078 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -1.006 6.660 -7.244 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.150 6.233 -8.528 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.467 5.447 -6.681 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.604 6.472 -8.130 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.198 7.065 -6.560 1.00 0.00 H new ATOM 1408 N THR A 103 -1.168 9.234 -8.097 1.00 0.00 N ATOM 1409 CA THR A 103 -2.531 9.819 -7.939 1.00 0.00 C ATOM 1410 C THR A 103 -3.484 9.225 -8.980 1.00 0.00 C ATOM 1411 O THR A 103 -3.302 9.392 -10.169 1.00 0.00 O ATOM 1412 CB THR A 103 -2.352 11.322 -8.172 1.00 0.00 C ATOM 1413 OG1 THR A 103 -0.970 11.648 -8.121 1.00 0.00 O ATOM 1414 CG2 THR A 103 -3.102 12.100 -7.091 1.00 0.00 C ATOM 0 H THR A 103 -0.923 8.953 -9.046 1.00 0.00 H new ATOM 0 HA THR A 103 -2.958 9.609 -6.958 1.00 0.00 H new ATOM 0 HB THR A 103 -2.751 11.588 -9.151 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.855 12.609 -8.272 1.00 0.00 H new ATOM 0 HG21 THR A 103 -2.974 13.170 -7.258 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.162 11.851 -7.133 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.705 11.835 -6.111 1.00 0.00 H new ATOM 1422 N GLU A 104 -4.500 8.532 -8.542 1.00 0.00 N ATOM 1423 CA GLU A 104 -5.462 7.928 -9.508 1.00 0.00 C ATOM 1424 C GLU A 104 -6.824 7.718 -8.840 1.00 0.00 C ATOM 1425 O GLU A 104 -6.914 7.238 -7.728 1.00 0.00 O ATOM 1426 CB GLU A 104 -4.844 6.584 -9.896 1.00 0.00 C ATOM 1427 CG GLU A 104 -3.941 6.770 -11.117 1.00 0.00 C ATOM 1428 CD GLU A 104 -4.744 7.405 -12.254 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -5.944 7.193 -12.295 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -4.144 8.092 -13.064 1.00 0.00 O ATOM 0 H GLU A 104 -4.705 8.358 -7.558 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.629 8.566 -10.376 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -4.268 6.183 -9.062 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -5.629 5.861 -10.118 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.091 7.402 -10.861 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -3.539 5.808 -11.435 1.00 0.00 H new ATOM 1437 N THR A 105 -7.885 8.075 -9.512 1.00 0.00 N ATOM 1438 CA THR A 105 -9.241 7.895 -8.917 1.00 0.00 C ATOM 1439 C THR A 105 -9.921 6.663 -9.520 1.00 0.00 C ATOM 1440 O THR A 105 -10.147 6.588 -10.711 1.00 0.00 O ATOM 1441 CB THR A 105 -10.007 9.166 -9.286 1.00 0.00 C ATOM 1442 OG1 THR A 105 -9.102 10.259 -9.355 1.00 0.00 O ATOM 1443 CG2 THR A 105 -11.073 9.449 -8.226 1.00 0.00 C ATOM 0 H THR A 105 -7.872 8.483 -10.447 1.00 0.00 H new ATOM 0 HA THR A 105 -9.203 7.742 -7.839 1.00 0.00 H new ATOM 0 HB THR A 105 -10.489 9.031 -10.254 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.591 11.074 -9.593 1.00 0.00 H new ATOM 0 HG21 THR A 105 -11.618 10.355 -8.491 1.00 0.00 H new ATOM 0 HG22 THR A 105 -11.767 8.610 -8.175 1.00 0.00 H new ATOM 0 HG23 THR A 105 -10.595 9.584 -7.256 1.00 0.00 H new ATOM 1451 N PHE A 106 -10.248 5.696 -8.707 1.00 0.00 N ATOM 1452 CA PHE A 106 -10.912 4.470 -9.237 1.00 0.00 C ATOM 1453 C PHE A 106 -12.217 4.204 -8.481 1.00 0.00 C ATOM 1454 O PHE A 106 -12.404 4.656 -7.369 1.00 0.00 O ATOM 1455 CB PHE A 106 -9.910 3.341 -8.993 1.00 0.00 C ATOM 1456 CG PHE A 106 -9.859 3.021 -7.518 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -9.021 3.756 -6.671 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -10.650 1.991 -6.997 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -8.974 3.460 -5.304 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -10.603 1.694 -5.630 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.765 2.429 -4.783 1.00 0.00 C ATOM 0 H PHE A 106 -10.085 5.701 -7.700 1.00 0.00 H new ATOM 0 HA PHE A 106 -11.172 4.564 -10.291 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -10.200 2.455 -9.558 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.922 3.635 -9.346 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -8.411 4.551 -7.073 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -11.297 1.425 -7.650 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.327 4.027 -4.651 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -11.213 0.898 -5.229 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.729 2.201 -3.728 1.00 0.00 H new ATOM 1471 N THR A 107 -13.118 3.471 -9.075 1.00 0.00 N ATOM 1472 CA THR A 107 -14.407 3.173 -8.388 1.00 0.00 C ATOM 1473 C THR A 107 -14.278 1.887 -7.568 1.00 0.00 C ATOM 1474 O THR A 107 -14.378 0.794 -8.089 1.00 0.00 O ATOM 1475 CB THR A 107 -15.425 2.993 -9.515 1.00 0.00 C ATOM 1476 OG1 THR A 107 -15.325 4.085 -10.419 1.00 0.00 O ATOM 1477 CG2 THR A 107 -16.837 2.942 -8.929 1.00 0.00 C ATOM 0 H THR A 107 -13.018 3.066 -10.006 1.00 0.00 H new ATOM 0 HA THR A 107 -14.702 3.963 -7.698 1.00 0.00 H new ATOM 0 HB THR A 107 -15.221 2.062 -10.043 1.00 0.00 H new ATOM 0 HG1 THR A 107 -15.975 3.971 -11.143 1.00 0.00 H new ATOM 0 HG21 THR A 107 -17.561 2.814 -9.734 1.00 0.00 H new ATOM 0 HG22 THR A 107 -16.913 2.104 -8.236 1.00 0.00 H new ATOM 0 HG23 THR A 107 -17.045 3.872 -8.399 1.00 0.00 H new ATOM 1485 N ALA A 108 -14.050 2.009 -6.289 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.908 0.794 -5.436 1.00 0.00 C ATOM 1487 C ALA A 108 -15.179 -0.056 -5.502 1.00 0.00 C ATOM 1488 O ALA A 108 -16.202 0.298 -4.952 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.698 1.326 -4.020 1.00 0.00 C ATOM 0 H ALA A 108 -13.956 2.898 -5.797 1.00 0.00 H new ATOM 0 HA ALA A 108 -13.084 0.159 -5.762 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.585 0.490 -3.330 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.800 1.943 -3.993 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.559 1.925 -3.725 1.00 0.00 H new ATOM 1495 N SER A 109 -15.120 -1.178 -6.164 1.00 0.00 N ATOM 1496 CA SER A 109 -16.324 -2.052 -6.257 1.00 0.00 C ATOM 1497 C SER A 109 -16.281 -3.121 -5.162 1.00 0.00 C ATOM 1498 O SER A 109 -16.372 -4.302 -5.430 1.00 0.00 O ATOM 1499 CB SER A 109 -16.241 -2.697 -7.639 1.00 0.00 C ATOM 1500 OG SER A 109 -14.891 -3.049 -7.913 1.00 0.00 O ATOM 0 H SER A 109 -14.291 -1.528 -6.644 1.00 0.00 H new ATOM 0 HA SER A 109 -17.252 -1.495 -6.124 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.875 -3.583 -7.678 1.00 0.00 H new ATOM 0 HB3 SER A 109 -16.610 -2.007 -8.398 1.00 0.00 H new ATOM 0 HG SER A 109 -14.575 -3.685 -7.237 1.00 0.00 H new ATOM 1506 N ALA A 110 -16.139 -2.716 -3.929 1.00 0.00 N ATOM 1507 CA ALA A 110 -16.086 -3.712 -2.819 1.00 0.00 C ATOM 1508 C ALA A 110 -16.399 -3.038 -1.481 1.00 0.00 C ATOM 1509 O ALA A 110 -17.102 -2.049 -1.421 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.651 -4.239 -2.830 1.00 0.00 C ATOM 0 H ALA A 110 -16.057 -1.741 -3.642 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.817 -4.510 -2.948 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.529 -4.980 -2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -14.440 -4.700 -3.795 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.959 -3.414 -2.663 1.00 0.00 H new ATOM 1516 N THR A 111 -15.882 -3.569 -0.407 1.00 0.00 N ATOM 1517 CA THR A 111 -16.150 -2.961 0.929 1.00 0.00 C ATOM 1518 C THR A 111 -14.988 -3.245 1.885 1.00 0.00 C ATOM 1519 O THR A 111 -14.767 -4.368 2.292 1.00 0.00 O ATOM 1520 CB THR A 111 -17.428 -3.642 1.423 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.498 -3.336 0.538 1.00 0.00 O ATOM 1522 CG2 THR A 111 -17.762 -3.145 2.831 1.00 0.00 C ATOM 0 H THR A 111 -15.286 -4.397 -0.396 1.00 0.00 H new ATOM 0 HA THR A 111 -16.258 -1.878 0.875 1.00 0.00 H new ATOM 0 HB THR A 111 -17.279 -4.721 1.450 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.317 -3.773 0.852 1.00 0.00 H new ATOM 0 HG21 THR A 111 -18.673 -3.631 3.182 1.00 0.00 H new ATOM 0 HG22 THR A 111 -16.940 -3.384 3.506 1.00 0.00 H new ATOM 0 HG23 THR A 111 -17.912 -2.066 2.810 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.247 -2.233 2.251 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.102 -2.444 3.185 1.00 0.00 C ATOM 1532 C TYR A 112 -13.401 -1.798 4.541 1.00 0.00 C ATOM 1533 O TYR A 112 -12.793 -0.812 4.905 1.00 0.00 O ATOM 1534 CB TYR A 112 -11.908 -1.750 2.521 1.00 0.00 C ATOM 1535 CG TYR A 112 -11.612 -2.386 1.178 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.182 -3.619 0.832 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -10.765 -1.732 0.275 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -11.905 -4.194 -0.415 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.492 -2.305 -0.972 1.00 0.00 C ATOM 1540 CZ TYR A 112 -11.061 -3.535 -1.317 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.797 -4.094 -2.550 1.00 0.00 O ATOM 0 H TYR A 112 -14.385 -1.270 1.944 1.00 0.00 H new ATOM 0 HA TYR A 112 -12.911 -3.502 3.366 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -12.122 -0.689 2.390 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -11.032 -1.821 3.166 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -12.835 -4.126 1.527 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.322 -0.784 0.541 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.342 -5.145 -0.680 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.841 -1.797 -1.669 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.331 -4.908 -2.661 1.00 0.00 H new ATOM 1551 N PRO A 113 -14.333 -2.380 5.246 1.00 0.00 N ATOM 1552 CA PRO A 113 -14.719 -1.855 6.580 1.00 0.00 C ATOM 1553 C PRO A 113 -13.609 -2.124 7.600 1.00 0.00 C ATOM 1554 O PRO A 113 -13.279 -3.257 7.889 1.00 0.00 O ATOM 1555 CB PRO A 113 -15.978 -2.646 6.924 1.00 0.00 C ATOM 1556 CG PRO A 113 -15.866 -3.909 6.132 1.00 0.00 C ATOM 1557 CD PRO A 113 -15.108 -3.568 4.875 1.00 0.00 C ATOM 0 HA PRO A 113 -14.883 -0.778 6.587 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -16.035 -2.853 7.993 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -16.878 -2.091 6.659 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.344 -4.678 6.702 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -16.853 -4.304 5.893 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.460 -4.387 4.564 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.783 -3.362 4.044 1.00 0.00 H new ATOM 1565 N ALA A 114 -13.030 -1.090 8.146 1.00 0.00 N ATOM 1566 CA ALA A 114 -11.941 -1.286 9.146 1.00 0.00 C ATOM 1567 C ALA A 114 -12.464 -2.072 10.351 1.00 0.00 C ATOM 1568 O ALA A 114 -11.704 -2.552 11.169 1.00 0.00 O ATOM 1569 CB ALA A 114 -11.528 0.125 9.564 1.00 0.00 C ATOM 0 H ALA A 114 -13.263 -0.118 7.943 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.103 -1.852 8.738 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.727 0.066 10.301 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -11.177 0.675 8.691 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -12.384 0.641 9.998 1.00 0.00 H new ATOM 1661 N GLU A 122 -13.135 -6.881 6.068 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.607 -5.486 6.022 1.00 0.00 C ATOM 1663 C GLU A 122 -11.828 -5.263 4.721 1.00 0.00 C ATOM 1664 O GLU A 122 -12.194 -5.763 3.677 1.00 0.00 O ATOM 1665 CB GLU A 122 -11.686 -5.365 7.241 1.00 0.00 C ATOM 1666 CG GLU A 122 -10.347 -6.051 6.955 1.00 0.00 C ATOM 1667 CD GLU A 122 -10.030 -7.040 8.079 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -10.713 -8.046 8.166 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -9.109 -6.773 8.834 1.00 0.00 O ATOM 0 HA GLU A 122 -13.401 -4.739 6.046 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -11.522 -4.314 7.481 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -12.159 -5.820 8.111 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.390 -6.572 5.999 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.554 -5.307 6.877 1.00 0.00 H new ATOM 1676 N GLY A 123 -10.756 -4.520 4.776 1.00 0.00 N ATOM 1677 CA GLY A 123 -9.960 -4.275 3.541 1.00 0.00 C ATOM 1678 C GLY A 123 -8.603 -3.678 3.911 1.00 0.00 C ATOM 1679 O GLY A 123 -8.439 -3.083 4.958 1.00 0.00 O ATOM 0 H GLY A 123 -10.398 -4.073 5.620 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.821 -5.209 2.996 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.498 -3.596 2.879 1.00 0.00 H new ATOM 1683 N GLN A 124 -7.628 -3.836 3.060 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.278 -3.284 3.362 1.00 0.00 C ATOM 1685 C GLN A 124 -5.553 -2.913 2.065 1.00 0.00 C ATOM 1686 O GLN A 124 -6.161 -2.762 1.020 1.00 0.00 O ATOM 1687 CB GLN A 124 -5.544 -4.416 4.080 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.269 -5.553 3.094 1.00 0.00 C ATOM 1689 CD GLN A 124 -4.339 -6.578 3.744 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -3.305 -6.910 3.198 1.00 0.00 O ATOM 1691 NE2 GLN A 124 -4.664 -7.098 4.896 1.00 0.00 N ATOM 0 H GLN A 124 -7.708 -4.324 2.168 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.327 -2.378 3.966 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -4.607 -4.048 4.498 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.144 -4.781 4.914 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.205 -6.029 2.802 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -4.814 -5.159 2.185 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -5.532 -6.820 5.355 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -4.050 -7.783 5.338 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.256 -2.777 2.126 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.478 -2.422 0.905 1.00 0.00 C ATOM 1702 C ILE A 125 -2.488 -3.543 0.585 1.00 0.00 C ATOM 1703 O ILE A 125 -2.019 -4.239 1.467 1.00 0.00 O ATOM 1704 CB ILE A 125 -2.736 -1.132 1.267 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.694 0.056 1.149 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.553 -0.927 0.316 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -2.967 1.341 1.549 1.00 0.00 C ATOM 0 H ILE A 125 -3.700 -2.897 2.973 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.110 -2.288 0.027 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.366 -1.206 2.290 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -4.064 0.138 0.127 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.562 -0.098 1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.030 -0.008 0.579 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -0.868 -1.771 0.400 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.918 -0.856 -0.709 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.650 2.187 1.465 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.619 1.257 2.579 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.114 1.497 0.889 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.176 -3.730 -0.668 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.231 -4.817 -1.043 1.00 0.00 C ATOM 1721 C ALA A 126 0.060 -4.247 -1.638 1.00 0.00 C ATOM 1722 O ALA A 126 0.044 -3.384 -2.492 1.00 0.00 O ATOM 1723 CB ALA A 126 -1.980 -5.644 -2.089 1.00 0.00 C ATOM 0 H ALA A 126 -2.535 -3.177 -1.447 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.934 -5.409 -0.178 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.350 -6.470 -2.419 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -2.897 -6.040 -1.652 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.228 -5.013 -2.942 1.00 0.00 H new ATOM 1729 N PHE A 127 1.175 -4.750 -1.193 1.00 0.00 N ATOM 1730 CA PHE A 127 2.495 -4.288 -1.714 1.00 0.00 C ATOM 1731 C PHE A 127 3.455 -5.476 -1.702 1.00 0.00 C ATOM 1732 O PHE A 127 4.323 -5.577 -0.860 1.00 0.00 O ATOM 1733 CB PHE A 127 2.961 -3.206 -0.738 1.00 0.00 C ATOM 1734 CG PHE A 127 2.491 -1.852 -1.213 1.00 0.00 C ATOM 1735 CD1 PHE A 127 1.147 -1.486 -1.077 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.405 -0.962 -1.791 1.00 0.00 C ATOM 1737 CE1 PHE A 127 0.717 -0.228 -1.519 1.00 0.00 C ATOM 1738 CE2 PHE A 127 2.975 0.295 -2.232 1.00 0.00 C ATOM 1739 CZ PHE A 127 1.631 0.661 -2.096 1.00 0.00 C ATOM 0 H PHE A 127 1.231 -5.475 -0.478 1.00 0.00 H new ATOM 0 HA PHE A 127 2.445 -3.899 -2.731 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.568 -3.409 0.258 1.00 0.00 H new ATOM 0 HB3 PHE A 127 4.048 -3.217 -0.660 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.442 -2.173 -0.632 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.442 -1.246 -1.896 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.320 0.056 -1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 127 3.680 0.982 -2.677 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.299 1.631 -2.437 1.00 0.00 H new ATOM 1749 N GLN A 128 3.284 -6.393 -2.611 1.00 0.00 N ATOM 1750 CA GLN A 128 4.157 -7.600 -2.620 1.00 0.00 C ATOM 1751 C GLN A 128 5.437 -7.370 -3.423 1.00 0.00 C ATOM 1752 O GLN A 128 5.409 -7.007 -4.583 1.00 0.00 O ATOM 1753 CB GLN A 128 3.308 -8.688 -3.276 1.00 0.00 C ATOM 1754 CG GLN A 128 2.322 -9.253 -2.252 1.00 0.00 C ATOM 1755 CD GLN A 128 1.162 -9.933 -2.980 1.00 0.00 C ATOM 1756 OE1 GLN A 128 1.340 -10.488 -4.046 1.00 0.00 O ATOM 1757 NE2 GLN A 128 -0.029 -9.915 -2.445 1.00 0.00 N ATOM 0 H GLN A 128 2.579 -6.360 -3.347 1.00 0.00 H new ATOM 0 HA GLN A 128 4.480 -7.864 -1.613 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.768 -8.278 -4.129 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.948 -9.483 -3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 128 2.826 -9.968 -1.602 1.00 0.00 H new ATOM 0 HG3 GLN A 128 1.946 -8.453 -1.614 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -0.179 -9.449 -1.550 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -0.809 -10.367 -2.922 1.00 0.00 H new ATOM 1766 N LEU A 129 6.560 -7.605 -2.801 1.00 0.00 N ATOM 1767 CA LEU A 129 7.863 -7.438 -3.495 1.00 0.00 C ATOM 1768 C LEU A 129 8.526 -8.813 -3.625 1.00 0.00 C ATOM 1769 O LEU A 129 9.644 -9.028 -3.200 1.00 0.00 O ATOM 1770 CB LEU A 129 8.697 -6.509 -2.599 1.00 0.00 C ATOM 1771 CG LEU A 129 7.799 -5.445 -1.956 1.00 0.00 C ATOM 1772 CD1 LEU A 129 8.668 -4.321 -1.389 1.00 0.00 C ATOM 1773 CD2 LEU A 129 6.845 -4.870 -3.006 1.00 0.00 C ATOM 0 H LEU A 129 6.628 -7.909 -1.830 1.00 0.00 H new ATOM 0 HA LEU A 129 7.761 -7.018 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 129 9.196 -7.091 -1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.478 -6.028 -3.188 1.00 0.00 H new ATOM 0 HG LEU A 129 7.219 -5.900 -1.153 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.031 -3.564 -0.932 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.345 -4.728 -0.638 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.249 -3.869 -2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.209 -4.115 -2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.422 -4.416 -3.812 1.00 0.00 H new ATOM 0 HD23 LEU A 129 6.224 -5.670 -3.410 1.00 0.00 H new ATOM 1785 N GLY A 130 7.828 -9.757 -4.193 1.00 0.00 N ATOM 1786 CA GLY A 130 8.403 -11.124 -4.341 1.00 0.00 C ATOM 1787 C GLY A 130 8.780 -11.371 -5.803 1.00 0.00 C ATOM 1788 O GLY A 130 7.934 -11.610 -6.641 1.00 0.00 O ATOM 0 H GLY A 130 6.884 -9.641 -4.561 1.00 0.00 H new ATOM 0 HA2 GLY A 130 9.283 -11.229 -3.706 1.00 0.00 H new ATOM 0 HA3 GLY A 130 7.680 -11.870 -4.011 1.00 0.00 H new ATOM 1792 N GLY A 131 10.046 -11.320 -6.112 1.00 0.00 N ATOM 1793 CA GLY A 131 10.482 -11.556 -7.517 1.00 0.00 C ATOM 1794 C GLY A 131 10.208 -10.307 -8.358 1.00 0.00 C ATOM 1795 O GLY A 131 9.290 -10.273 -9.154 1.00 0.00 O ATOM 0 H GLY A 131 10.798 -11.125 -5.452 1.00 0.00 H new ATOM 0 HA2 GLY A 131 11.545 -11.798 -7.543 1.00 0.00 H new ATOM 0 HA3 GLY A 131 9.950 -12.411 -7.934 1.00 0.00 H new ATOM 1799 N PHE A 132 10.997 -9.281 -8.192 1.00 0.00 N ATOM 1800 CA PHE A 132 10.781 -8.037 -8.986 1.00 0.00 C ATOM 1801 C PHE A 132 12.125 -7.397 -9.344 1.00 0.00 C ATOM 1802 O PHE A 132 12.550 -7.426 -10.482 1.00 0.00 O ATOM 1803 CB PHE A 132 9.969 -7.119 -8.073 1.00 0.00 C ATOM 1804 CG PHE A 132 8.498 -7.408 -8.254 1.00 0.00 C ATOM 1805 CD1 PHE A 132 7.939 -7.422 -9.539 1.00 0.00 C ATOM 1806 CD2 PHE A 132 7.692 -7.661 -7.138 1.00 0.00 C ATOM 1807 CE1 PHE A 132 6.574 -7.689 -9.705 1.00 0.00 C ATOM 1808 CE2 PHE A 132 6.328 -7.928 -7.305 1.00 0.00 C ATOM 1809 CZ PHE A 132 5.769 -7.942 -8.588 1.00 0.00 C ATOM 0 H PHE A 132 11.782 -9.250 -7.541 1.00 0.00 H new ATOM 0 HA PHE A 132 10.265 -8.231 -9.926 1.00 0.00 H new ATOM 0 HB2 PHE A 132 10.257 -7.275 -7.033 1.00 0.00 H new ATOM 0 HB3 PHE A 132 10.178 -6.076 -8.309 1.00 0.00 H new ATOM 0 HD1 PHE A 132 8.560 -7.227 -10.401 1.00 0.00 H new ATOM 0 HD2 PHE A 132 8.123 -7.650 -6.148 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.142 -7.700 -10.695 1.00 0.00 H new ATOM 0 HE2 PHE A 132 5.707 -8.123 -6.443 1.00 0.00 H new ATOM 0 HZ PHE A 132 4.717 -8.148 -8.716 1.00 0.00 H new ATOM 1819 N SER A 133 12.802 -6.821 -8.386 1.00 0.00 N ATOM 1820 CA SER A 133 14.119 -6.188 -8.690 1.00 0.00 C ATOM 1821 C SER A 133 15.245 -7.216 -8.538 1.00 0.00 C ATOM 1822 O SER A 133 15.107 -8.203 -7.844 1.00 0.00 O ATOM 1823 CB SER A 133 14.265 -5.068 -7.663 1.00 0.00 C ATOM 1824 OG SER A 133 15.643 -4.872 -7.373 1.00 0.00 O ATOM 0 H SER A 133 12.503 -6.761 -7.413 1.00 0.00 H new ATOM 0 HA SER A 133 14.173 -5.810 -9.711 1.00 0.00 H new ATOM 0 HB2 SER A 133 13.828 -4.147 -8.048 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.722 -5.321 -6.752 1.00 0.00 H new ATOM 0 HG SER A 133 15.757 -4.720 -6.412 1.00 0.00 H new ATOM 1830 N ALA A 134 16.354 -6.998 -9.192 1.00 0.00 N ATOM 1831 CA ALA A 134 17.483 -7.970 -9.097 1.00 0.00 C ATOM 1832 C ALA A 134 18.279 -7.758 -7.804 1.00 0.00 C ATOM 1833 O ALA A 134 17.966 -8.321 -6.775 1.00 0.00 O ATOM 1834 CB ALA A 134 18.356 -7.680 -10.319 1.00 0.00 C ATOM 0 H ALA A 134 16.528 -6.189 -9.788 1.00 0.00 H new ATOM 0 HA ALA A 134 17.131 -9.002 -9.077 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.212 -8.355 -10.323 1.00 0.00 H new ATOM 0 HB2 ALA A 134 17.772 -7.829 -11.227 1.00 0.00 H new ATOM 0 HB3 ALA A 134 18.708 -6.649 -10.279 1.00 0.00 H new ATOM 1840 N ASP A 135 19.313 -6.961 -7.851 1.00 0.00 N ATOM 1841 CA ASP A 135 20.133 -6.725 -6.626 1.00 0.00 C ATOM 1842 C ASP A 135 19.245 -6.301 -5.455 1.00 0.00 C ATOM 1843 O ASP A 135 18.033 -6.327 -5.539 1.00 0.00 O ATOM 1844 CB ASP A 135 21.092 -5.596 -7.007 1.00 0.00 C ATOM 1845 CG ASP A 135 21.795 -5.944 -8.320 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.736 -6.720 -8.278 1.00 0.00 O ATOM 1847 OD2 ASP A 135 21.381 -5.428 -9.345 1.00 0.00 O ATOM 0 H ASP A 135 19.626 -6.463 -8.684 1.00 0.00 H new ATOM 0 HA ASP A 135 20.660 -7.624 -6.307 1.00 0.00 H new ATOM 0 HB2 ASP A 135 20.544 -4.660 -7.113 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.828 -5.447 -6.217 1.00 0.00 H new ATOM 1852 N ALA A 136 19.842 -5.913 -4.361 1.00 0.00 N ATOM 1853 CA ALA A 136 19.039 -5.490 -3.178 1.00 0.00 C ATOM 1854 C ALA A 136 18.475 -4.087 -3.392 1.00 0.00 C ATOM 1855 O ALA A 136 19.141 -3.208 -3.903 1.00 0.00 O ATOM 1856 CB ALA A 136 20.024 -5.499 -2.008 1.00 0.00 C ATOM 0 H ALA A 136 20.853 -5.871 -4.235 1.00 0.00 H new ATOM 0 HA ALA A 136 18.188 -6.148 -3.002 1.00 0.00 H new ATOM 0 HB1 ALA A 136 19.509 -5.198 -1.096 1.00 0.00 H new ATOM 0 HB2 ALA A 136 20.429 -6.503 -1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 136 20.837 -4.803 -2.212 1.00 0.00 H new ATOM 1862 N TRP A 137 17.253 -3.868 -2.999 1.00 0.00 N ATOM 1863 CA TRP A 137 16.647 -2.521 -3.172 1.00 0.00 C ATOM 1864 C TRP A 137 15.702 -2.221 -2.016 1.00 0.00 C ATOM 1865 O TRP A 137 15.731 -2.878 -0.994 1.00 0.00 O ATOM 1866 CB TRP A 137 15.910 -2.576 -4.512 1.00 0.00 C ATOM 1867 CG TRP A 137 14.588 -3.263 -4.370 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.428 -2.645 -4.049 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.259 -4.674 -4.559 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.412 -3.583 -4.033 1.00 0.00 N ATOM 1871 CE2 TRP A 137 12.872 -4.842 -4.339 1.00 0.00 C ATOM 1872 CE3 TRP A 137 15.016 -5.813 -4.896 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 12.256 -6.086 -4.450 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.393 -7.072 -5.008 1.00 0.00 C ATOM 1875 CH2 TRP A 137 13.017 -7.202 -4.786 1.00 0.00 C ATOM 0 H TRP A 137 16.647 -4.564 -2.565 1.00 0.00 H new ATOM 0 HA TRP A 137 17.390 -1.724 -3.172 1.00 0.00 H new ATOM 0 HB2 TRP A 137 15.759 -1.565 -4.890 1.00 0.00 H new ATOM 0 HB3 TRP A 137 16.521 -3.103 -5.245 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.314 -1.592 -3.840 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.438 -3.367 -3.820 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.078 -5.721 -5.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 11.195 -6.184 -4.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 14.980 -7.941 -5.266 1.00 0.00 H new ATOM 0 HH2 TRP A 137 12.545 -8.169 -4.876 1.00 0.00 H new ATOM 1886 N THR A 138 14.889 -1.215 -2.143 1.00 0.00 N ATOM 1887 CA THR A 138 13.985 -0.868 -1.019 1.00 0.00 C ATOM 1888 C THR A 138 12.810 -0.014 -1.511 1.00 0.00 C ATOM 1889 O THR A 138 12.790 0.454 -2.632 1.00 0.00 O ATOM 1890 CB THR A 138 14.910 -0.088 -0.069 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.281 -0.929 1.011 1.00 0.00 O ATOM 1892 CG2 THR A 138 14.216 1.165 0.482 1.00 0.00 C ATOM 0 H THR A 138 14.811 -0.622 -2.970 1.00 0.00 H new ATOM 0 HA THR A 138 13.523 -1.731 -0.540 1.00 0.00 H new ATOM 0 HB THR A 138 15.791 0.227 -0.628 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.605 -0.871 1.718 1.00 0.00 H new ATOM 0 HG21 THR A 138 14.896 1.694 1.150 1.00 0.00 H new ATOM 0 HG22 THR A 138 13.937 1.819 -0.344 1.00 0.00 H new ATOM 0 HG23 THR A 138 13.321 0.873 1.032 1.00 0.00 H new ATOM 1900 N LEU A 139 11.840 0.201 -0.666 1.00 0.00 N ATOM 1901 CA LEU A 139 10.669 1.037 -1.058 1.00 0.00 C ATOM 1902 C LEU A 139 10.429 2.107 0.006 1.00 0.00 C ATOM 1903 O LEU A 139 10.307 1.811 1.177 1.00 0.00 O ATOM 1904 CB LEU A 139 9.482 0.078 -1.126 1.00 0.00 C ATOM 1905 CG LEU A 139 9.357 -0.481 -2.543 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.165 -1.774 -2.658 1.00 0.00 C ATOM 1907 CD2 LEU A 139 7.884 -0.764 -2.845 1.00 0.00 C ATOM 0 H LEU A 139 11.807 -0.168 0.284 1.00 0.00 H new ATOM 0 HA LEU A 139 10.824 1.545 -2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 139 9.617 -0.736 -0.414 1.00 0.00 H new ATOM 0 HB3 LEU A 139 8.565 0.597 -0.847 1.00 0.00 H new ATOM 0 HG LEU A 139 9.742 0.246 -3.258 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.074 -2.171 -3.669 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.213 -1.568 -2.441 1.00 0.00 H new ATOM 0 HD13 LEU A 139 9.784 -2.506 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 139 7.790 -1.163 -3.855 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.499 -1.491 -2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.312 0.160 -2.765 1.00 0.00 H new ATOM 1919 N CYS A 140 10.370 3.349 -0.385 1.00 0.00 N ATOM 1920 CA CYS A 140 10.150 4.427 0.620 1.00 0.00 C ATOM 1921 C CYS A 140 8.893 5.233 0.289 1.00 0.00 C ATOM 1922 O CYS A 140 8.898 6.080 -0.582 1.00 0.00 O ATOM 1923 CB CYS A 140 11.392 5.313 0.526 1.00 0.00 C ATOM 1924 SG CYS A 140 12.757 4.535 1.425 1.00 0.00 S ATOM 0 H CYS A 140 10.464 3.664 -1.351 1.00 0.00 H new ATOM 0 HA CYS A 140 10.004 4.024 1.622 1.00 0.00 H new ATOM 0 HB2 CYS A 140 11.668 5.462 -0.518 1.00 0.00 H new ATOM 0 HB3 CYS A 140 11.182 6.298 0.943 1.00 0.00 H new ATOM 1929 N LEU A 141 7.820 4.987 0.989 1.00 0.00 N ATOM 1930 CA LEU A 141 6.570 5.754 0.727 1.00 0.00 C ATOM 1931 C LEU A 141 6.486 6.934 1.698 1.00 0.00 C ATOM 1932 O LEU A 141 7.374 7.149 2.499 1.00 0.00 O ATOM 1933 CB LEU A 141 5.426 4.769 0.977 1.00 0.00 C ATOM 1934 CG LEU A 141 5.652 3.496 0.161 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.419 2.277 1.053 1.00 0.00 C ATOM 1936 CD2 LEU A 141 4.671 3.457 -1.016 1.00 0.00 C ATOM 0 H LEU A 141 7.755 4.289 1.730 1.00 0.00 H new ATOM 0 HA LEU A 141 6.532 6.157 -0.285 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.368 4.526 2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.475 5.225 0.702 1.00 0.00 H new ATOM 0 HG LEU A 141 6.674 3.486 -0.219 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.579 1.367 0.475 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.115 2.301 1.891 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.396 2.292 1.430 1.00 0.00 H new ATOM 0 HD21 LEU A 141 4.834 2.549 -1.596 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.649 3.467 -0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.831 4.327 -1.652 1.00 0.00 H new ATOM 1948 N ASP A 142 5.429 7.696 1.639 1.00 0.00 N ATOM 1949 CA ASP A 142 5.295 8.863 2.566 1.00 0.00 C ATOM 1950 C ASP A 142 4.136 9.759 2.127 1.00 0.00 C ATOM 1951 O ASP A 142 4.292 10.951 1.951 1.00 0.00 O ATOM 1952 CB ASP A 142 6.621 9.626 2.468 1.00 0.00 C ATOM 1953 CG ASP A 142 7.105 9.645 1.016 1.00 0.00 C ATOM 1954 OD1 ASP A 142 6.293 9.406 0.138 1.00 0.00 O ATOM 1955 OD2 ASP A 142 8.280 9.900 0.808 1.00 0.00 O ATOM 0 H ASP A 142 4.652 7.564 0.992 1.00 0.00 H new ATOM 0 HA ASP A 142 5.088 8.543 3.587 1.00 0.00 H new ATOM 0 HB2 ASP A 142 6.491 10.646 2.831 1.00 0.00 H new ATOM 0 HB3 ASP A 142 7.370 9.154 3.104 1.00 0.00 H new ATOM 1960 N ASP A 143 2.973 9.196 1.950 1.00 0.00 N ATOM 1961 CA ASP A 143 1.798 10.011 1.523 1.00 0.00 C ATOM 1962 C ASP A 143 0.661 9.087 1.086 1.00 0.00 C ATOM 1963 O ASP A 143 0.131 9.209 0.000 1.00 0.00 O ATOM 1964 CB ASP A 143 2.291 10.846 0.338 1.00 0.00 C ATOM 1965 CG ASP A 143 2.386 12.315 0.753 1.00 0.00 C ATOM 1966 OD1 ASP A 143 1.373 12.862 1.157 1.00 0.00 O ATOM 1967 OD2 ASP A 143 3.469 12.868 0.661 1.00 0.00 O ATOM 0 H ASP A 143 2.784 8.203 2.083 1.00 0.00 H new ATOM 0 HA ASP A 143 1.418 10.640 2.328 1.00 0.00 H new ATOM 0 HB2 ASP A 143 3.265 10.487 0.007 1.00 0.00 H new ATOM 0 HB3 ASP A 143 1.608 10.739 -0.505 1.00 0.00 H new ATOM 1972 N VAL A 144 0.287 8.157 1.922 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.811 7.219 1.549 1.00 0.00 C ATOM 1974 C VAL A 144 -2.145 7.717 2.111 1.00 0.00 C ATOM 1975 O VAL A 144 -2.346 7.766 3.308 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.431 5.873 2.177 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -1.143 4.747 1.426 1.00 0.00 C ATOM 1978 CG2 VAL A 144 1.083 5.659 2.081 1.00 0.00 C ATOM 0 H VAL A 144 0.693 8.006 2.845 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.929 7.139 0.468 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.730 5.871 3.225 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.875 3.788 1.869 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -2.221 4.890 1.494 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.840 4.760 0.379 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.344 4.700 2.530 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.386 5.664 1.034 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.598 6.460 2.611 1.00 0.00 H new ATOM 1988 N ALA A 145 -3.058 8.088 1.255 1.00 0.00 N ATOM 1989 CA ALA A 145 -4.378 8.583 1.740 1.00 0.00 C ATOM 1990 C ALA A 145 -5.488 8.174 0.767 1.00 0.00 C ATOM 1991 O ALA A 145 -5.231 7.784 -0.355 1.00 0.00 O ATOM 1992 CB ALA A 145 -4.238 10.105 1.782 1.00 0.00 C ATOM 0 H ALA A 145 -2.947 8.070 0.241 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.641 8.169 2.714 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.172 10.547 2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -3.431 10.378 2.463 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -4.011 10.477 0.783 1.00 0.00 H new ATOM 1998 N LEU A 146 -6.720 8.260 1.190 1.00 0.00 N ATOM 1999 CA LEU A 146 -7.846 7.876 0.291 1.00 0.00 C ATOM 2000 C LEU A 146 -9.058 8.775 0.547 1.00 0.00 C ATOM 2001 O LEU A 146 -9.285 9.227 1.652 1.00 0.00 O ATOM 2002 CB LEU A 146 -8.165 6.426 0.656 1.00 0.00 C ATOM 2003 CG LEU A 146 -9.362 5.943 -0.164 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -8.871 5.360 -1.490 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -10.113 4.863 0.618 1.00 0.00 C ATOM 0 H LEU A 146 -6.996 8.579 2.119 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.590 7.984 -0.763 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -7.299 5.793 0.463 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -8.385 6.348 1.721 1.00 0.00 H new ATOM 0 HG LEU A 146 -10.029 6.782 -0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -9.724 5.016 -2.074 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -8.335 6.127 -2.048 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -8.204 4.521 -1.294 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -10.966 4.518 0.034 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -9.445 4.024 0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -10.464 5.276 1.564 1.00 0.00 H new ATOM 2017 N ASP A 147 -9.839 9.039 -0.465 1.00 0.00 N ATOM 2018 CA ASP A 147 -11.036 9.910 -0.277 1.00 0.00 C ATOM 2019 C ASP A 147 -12.257 9.286 -0.958 1.00 0.00 C ATOM 2020 O ASP A 147 -12.204 8.179 -1.453 1.00 0.00 O ATOM 2021 CB ASP A 147 -10.669 11.237 -0.943 1.00 0.00 C ATOM 2022 CG ASP A 147 -10.308 12.265 0.130 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -11.185 12.623 0.899 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -9.160 12.677 0.166 1.00 0.00 O ATOM 0 H ASP A 147 -9.701 8.690 -1.413 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.292 10.039 0.775 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -9.829 11.095 -1.622 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -11.505 11.599 -1.542 1.00 0.00 H new ATOM 2029 N SER A 148 -13.357 9.988 -0.986 1.00 0.00 N ATOM 2030 CA SER A 148 -14.580 9.433 -1.635 1.00 0.00 C ATOM 2031 C SER A 148 -15.272 10.513 -2.471 1.00 0.00 C ATOM 2032 O SER A 148 -15.947 11.378 -1.949 1.00 0.00 O ATOM 2033 CB SER A 148 -15.477 8.995 -0.479 1.00 0.00 C ATOM 2034 OG SER A 148 -15.969 10.145 0.196 1.00 0.00 O ATOM 0 H SER A 148 -13.462 10.921 -0.588 1.00 0.00 H new ATOM 0 HA SER A 148 -14.351 8.608 -2.309 1.00 0.00 H new ATOM 0 HB2 SER A 148 -16.307 8.397 -0.854 1.00 0.00 H new ATOM 0 HB3 SER A 148 -14.917 8.365 0.212 1.00 0.00 H new ATOM 0 HG SER A 148 -16.536 10.663 -0.412 1.00 0.00 H new