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= -1.77! C(o=-2.2!,f=-6.2!) USER MOD Set 1.2: A 124 GLN : amide:sc= -0.48 K(o=-2.2,f=-9!) USER MOD Set 2.1: A 42 GLN : amide:sc= -6.04! C(o=-9.3!,f=-9.1!) USER MOD Set 2.2: A 43 TYR OH : rot -48:sc= -3.22! USER MOD Single : A 8 THR OG1 : rot 180:sc= 0.00294 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.806 USER MOD Single : A 21 THR OG1 : rot 141:sc= 0.994 USER MOD Single : A 27 THR OG1 : rot 150:sc= -0.0625 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0627 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -170:sc= -5.91! USER MOD Single : A 50 ASN : amide:sc= -5.09! C(o=-5.1!,f=-10!) USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.74 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0101 USER MOD Single : A 60 TYR OH : rot 70:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.175 USER MOD Single : A 64 TYR OH : rot -15:sc= -2.48! USER MOD Single : A 65 THR OG1 : rot 122:sc= -2.16! USER MOD Single : A 67 THR OG1 : rot 159:sc= -2.25! USER MOD Single : A 69 SER OG : rot 180:sc= 0 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= -7.55! C(o=-7.6!,f=-13!) USER MOD Single : A 85 TYR OH : rot 180:sc= -0.234 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 63:sc= -0.196 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.152 X(o=-0.15,f=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 48:sc= 0.07 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0.0628 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 14:sc= -5.49! USER MOD Single : A 128 GLN : amide:sc= 0.569 K(o=0.57,f=-5.5!) USER MOD Single : A 133 SER OG : rot -112:sc= 0.268! USER MOD Single : A 138 THR OG1 : rot -76:sc= 0.18 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N PRO A 3 -9.041 7.074 8.007 1.00 0.00 N ATOM 25 CA PRO A 3 -8.313 6.433 6.889 1.00 0.00 C ATOM 26 C PRO A 3 -6.879 6.107 7.315 1.00 0.00 C ATOM 27 O PRO A 3 -6.588 5.959 8.485 1.00 0.00 O ATOM 28 CB PRO A 3 -8.336 7.497 5.793 1.00 0.00 C ATOM 29 CG PRO A 3 -8.484 8.799 6.513 1.00 0.00 C ATOM 30 CD PRO A 3 -9.189 8.519 7.815 1.00 0.00 C ATOM 0 HA PRO A 3 -8.755 5.491 6.564 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -7.419 7.475 5.204 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.163 7.333 5.102 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -7.508 9.250 6.695 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -9.055 9.507 5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -8.741 9.077 8.637 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.239 8.808 7.768 1.00 0.00 H new ATOM 38 N ILE A 4 -5.982 5.993 6.377 1.00 0.00 N ATOM 39 CA ILE A 4 -4.568 5.677 6.732 1.00 0.00 C ATOM 40 C ILE A 4 -3.779 6.969 6.963 1.00 0.00 C ATOM 41 O ILE A 4 -2.584 6.948 7.183 1.00 0.00 O ATOM 42 CB ILE A 4 -4.015 4.914 5.525 1.00 0.00 C ATOM 43 CG1 ILE A 4 -3.748 5.891 4.378 1.00 0.00 C ATOM 44 CG2 ILE A 4 -5.034 3.867 5.071 1.00 0.00 C ATOM 45 CD1 ILE A 4 -3.307 5.112 3.137 1.00 0.00 C ATOM 0 H ILE A 4 -6.165 6.105 5.380 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.493 5.093 7.649 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.085 4.420 5.807 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.648 6.466 4.159 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.976 6.605 4.666 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.640 3.324 4.212 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.225 3.168 5.885 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.964 4.362 4.792 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.117 5.807 2.320 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -2.396 4.557 3.361 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.094 4.416 2.846 1.00 0.00 H new ATOM 57 N GLY A 5 -4.438 8.094 6.913 1.00 0.00 N ATOM 58 CA GLY A 5 -3.727 9.386 7.129 1.00 0.00 C ATOM 59 C GLY A 5 -4.138 10.382 6.043 1.00 0.00 C ATOM 60 O GLY A 5 -5.097 10.174 5.327 1.00 0.00 O ATOM 0 H GLY A 5 -5.439 8.174 6.732 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -3.968 9.786 8.114 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -2.649 9.229 7.104 1.00 0.00 H new ATOM 64 N GLU A 6 -3.419 11.464 5.914 1.00 0.00 N ATOM 65 CA GLU A 6 -3.770 12.472 4.873 1.00 0.00 C ATOM 66 C GLU A 6 -2.505 12.966 4.168 1.00 0.00 C ATOM 67 O GLU A 6 -2.022 14.050 4.426 1.00 0.00 O ATOM 68 CB GLU A 6 -4.439 13.615 5.637 1.00 0.00 C ATOM 69 CG GLU A 6 -5.262 14.465 4.667 1.00 0.00 C ATOM 70 CD GLU A 6 -6.617 13.798 4.427 1.00 0.00 C ATOM 71 OE1 GLU A 6 -7.425 13.796 5.341 1.00 0.00 O ATOM 72 OE2 GLU A 6 -6.825 13.301 3.332 1.00 0.00 O ATOM 0 H GLU A 6 -2.605 11.693 6.484 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.422 12.060 4.103 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -5.081 13.215 6.422 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -3.684 14.231 6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.405 15.466 5.075 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -4.728 14.578 3.723 1.00 0.00 H new ATOM 79 N GLY A 7 -1.964 12.178 3.279 1.00 0.00 N ATOM 80 CA GLY A 7 -0.731 12.603 2.559 1.00 0.00 C ATOM 81 C GLY A 7 0.448 11.741 3.012 1.00 0.00 C ATOM 82 O GLY A 7 0.354 10.532 3.083 1.00 0.00 O ATOM 0 H GLY A 7 -2.323 11.259 3.021 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.874 12.506 1.483 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.524 13.654 2.759 1.00 0.00 H new ATOM 86 N THR A 8 1.560 12.353 3.317 1.00 0.00 N ATOM 87 CA THR A 8 2.744 11.566 3.764 1.00 0.00 C ATOM 88 C THR A 8 2.560 11.109 5.213 1.00 0.00 C ATOM 89 O THR A 8 1.966 11.796 6.018 1.00 0.00 O ATOM 90 CB THR A 8 3.926 12.530 3.652 1.00 0.00 C ATOM 91 OG1 THR A 8 3.701 13.651 4.495 1.00 0.00 O ATOM 92 CG2 THR A 8 4.070 13.000 2.204 1.00 0.00 C ATOM 0 H THR A 8 1.699 13.363 3.276 1.00 0.00 H new ATOM 0 HA THR A 8 2.892 10.668 3.165 1.00 0.00 H new ATOM 0 HB THR A 8 4.840 12.021 3.958 1.00 0.00 H new ATOM 0 HG1 THR A 8 4.458 14.269 4.426 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.913 13.687 2.127 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.243 12.139 1.558 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.157 13.509 1.894 1.00 0.00 H new ATOM 100 N PHE A 9 3.067 9.955 5.549 1.00 0.00 N ATOM 101 CA PHE A 9 2.924 9.455 6.946 1.00 0.00 C ATOM 102 C PHE A 9 3.184 10.594 7.939 1.00 0.00 C ATOM 103 O PHE A 9 2.551 10.686 8.972 1.00 0.00 O ATOM 104 CB PHE A 9 3.982 8.358 7.078 1.00 0.00 C ATOM 105 CG PHE A 9 3.702 7.270 6.065 1.00 0.00 C ATOM 106 CD1 PHE A 9 2.468 6.609 6.075 1.00 0.00 C ATOM 107 CD2 PHE A 9 4.672 6.925 5.114 1.00 0.00 C ATOM 108 CE1 PHE A 9 2.202 5.605 5.137 1.00 0.00 C ATOM 109 CE2 PHE A 9 4.404 5.920 4.177 1.00 0.00 C ATOM 110 CZ PHE A 9 3.170 5.260 4.188 1.00 0.00 C ATOM 0 H PHE A 9 3.574 9.336 4.917 1.00 0.00 H new ATOM 0 HA PHE A 9 1.924 9.078 7.158 1.00 0.00 H new ATOM 0 HB2 PHE A 9 4.976 8.774 6.916 1.00 0.00 H new ATOM 0 HB3 PHE A 9 3.970 7.944 8.086 1.00 0.00 H new ATOM 0 HD1 PHE A 9 1.720 6.874 6.808 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.625 7.434 5.104 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.249 5.097 5.146 1.00 0.00 H new ATOM 0 HE2 PHE A 9 5.151 5.653 3.444 1.00 0.00 H new ATOM 0 HZ PHE A 9 2.965 4.485 3.464 1.00 0.00 H new ATOM 120 N ASP A 10 4.104 11.466 7.618 1.00 0.00 N ATOM 121 CA ASP A 10 4.417 12.619 8.520 1.00 0.00 C ATOM 122 C ASP A 10 4.298 12.223 9.997 1.00 0.00 C ATOM 123 O ASP A 10 3.533 12.803 10.740 1.00 0.00 O ATOM 124 CB ASP A 10 3.382 13.690 8.163 1.00 0.00 C ATOM 125 CG ASP A 10 2.019 13.313 8.749 1.00 0.00 C ATOM 126 OD1 ASP A 10 1.340 12.498 8.146 1.00 0.00 O ATOM 127 OD2 ASP A 10 1.676 13.847 9.790 1.00 0.00 O ATOM 0 H ASP A 10 4.658 11.430 6.762 1.00 0.00 H new ATOM 0 HA ASP A 10 5.440 12.969 8.385 1.00 0.00 H new ATOM 0 HB2 ASP A 10 3.699 14.658 8.551 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.307 13.789 7.080 1.00 0.00 H new ATOM 132 N ASP A 11 5.064 11.250 10.426 1.00 0.00 N ATOM 133 CA ASP A 11 5.016 10.806 11.858 1.00 0.00 C ATOM 134 C ASP A 11 5.642 9.416 11.990 1.00 0.00 C ATOM 135 O ASP A 11 6.684 9.246 12.591 1.00 0.00 O ATOM 136 CB ASP A 11 3.526 10.755 12.235 1.00 0.00 C ATOM 137 CG ASP A 11 3.321 9.837 13.444 1.00 0.00 C ATOM 138 OD1 ASP A 11 4.257 9.684 14.212 1.00 0.00 O ATOM 139 OD2 ASP A 11 2.232 9.305 13.581 1.00 0.00 O ATOM 0 H ASP A 11 5.726 10.739 9.842 1.00 0.00 H new ATOM 0 HA ASP A 11 5.569 11.482 12.511 1.00 0.00 H new ATOM 0 HB2 ASP A 11 3.166 11.758 12.465 1.00 0.00 H new ATOM 0 HB3 ASP A 11 2.941 10.392 11.390 1.00 0.00 H new ATOM 144 N GLY A 12 5.012 8.424 11.433 1.00 0.00 N ATOM 145 CA GLY A 12 5.566 7.045 11.526 1.00 0.00 C ATOM 146 C GLY A 12 4.719 6.092 10.683 1.00 0.00 C ATOM 147 O GLY A 12 3.844 6.516 9.953 1.00 0.00 O ATOM 0 H GLY A 12 4.136 8.507 10.916 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.599 7.033 11.178 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.576 6.716 12.565 1.00 0.00 H new ATOM 151 N PRO A 13 5.012 4.829 10.816 1.00 0.00 N ATOM 152 CA PRO A 13 4.273 3.790 10.061 1.00 0.00 C ATOM 153 C PRO A 13 2.878 3.588 10.658 1.00 0.00 C ATOM 154 O PRO A 13 2.652 2.672 11.423 1.00 0.00 O ATOM 155 CB PRO A 13 5.127 2.540 10.241 1.00 0.00 C ATOM 156 CG PRO A 13 5.885 2.764 11.511 1.00 0.00 C ATOM 157 CD PRO A 13 6.051 4.254 11.676 1.00 0.00 C ATOM 0 HA PRO A 13 4.121 4.048 9.013 1.00 0.00 H new ATOM 0 HB2 PRO A 13 4.508 1.645 10.304 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.803 2.400 9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 13 5.347 2.341 12.359 1.00 0.00 H new ATOM 0 HG3 PRO A 13 6.856 2.271 11.471 1.00 0.00 H new ATOM 0 HD2 PRO A 13 5.920 4.557 12.715 1.00 0.00 H new ATOM 0 HD3 PRO A 13 7.046 4.580 11.372 1.00 0.00 H new ATOM 165 N GLU A 14 1.948 4.444 10.317 1.00 0.00 N ATOM 166 CA GLU A 14 0.561 4.318 10.859 1.00 0.00 C ATOM 167 C GLU A 14 0.173 2.845 11.006 1.00 0.00 C ATOM 168 O GLU A 14 -0.020 2.347 12.098 1.00 0.00 O ATOM 169 CB GLU A 14 -0.328 5.001 9.818 1.00 0.00 C ATOM 170 CG GLU A 14 -1.210 6.046 10.505 1.00 0.00 C ATOM 171 CD GLU A 14 -1.039 7.397 9.808 1.00 0.00 C ATOM 172 OE1 GLU A 14 -0.749 7.397 8.623 1.00 0.00 O ATOM 173 OE2 GLU A 14 -1.201 8.408 10.471 1.00 0.00 O ATOM 0 H GLU A 14 2.091 5.230 9.682 1.00 0.00 H new ATOM 0 HA GLU A 14 0.464 4.768 11.847 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.288 5.475 9.054 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.949 4.261 9.313 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -2.254 5.736 10.469 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -0.939 6.131 11.557 1.00 0.00 H new ATOM 180 N GLY A 15 0.067 2.148 9.915 1.00 0.00 N ATOM 181 CA GLY A 15 -0.300 0.705 9.980 1.00 0.00 C ATOM 182 C GLY A 15 0.440 -0.055 8.878 1.00 0.00 C ATOM 183 O GLY A 15 0.140 -1.195 8.586 1.00 0.00 O ATOM 0 H GLY A 15 0.219 2.514 8.975 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -0.041 0.296 10.957 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.377 0.586 9.860 1.00 0.00 H new ATOM 187 N TRP A 16 1.404 0.572 8.260 1.00 0.00 N ATOM 188 CA TRP A 16 2.161 -0.106 7.171 1.00 0.00 C ATOM 189 C TRP A 16 3.105 -1.165 7.742 1.00 0.00 C ATOM 190 O TRP A 16 4.115 -0.854 8.339 1.00 0.00 O ATOM 191 CB TRP A 16 2.958 1.009 6.498 1.00 0.00 C ATOM 192 CG TRP A 16 2.109 1.652 5.454 1.00 0.00 C ATOM 193 CD1 TRP A 16 1.397 2.789 5.624 1.00 0.00 C ATOM 194 CD2 TRP A 16 1.866 1.215 4.088 1.00 0.00 C ATOM 195 NE1 TRP A 16 0.728 3.075 4.449 1.00 0.00 N ATOM 196 CE2 TRP A 16 0.987 2.135 3.470 1.00 0.00 C ATOM 197 CE3 TRP A 16 2.319 0.120 3.332 1.00 0.00 C ATOM 198 CZ2 TRP A 16 0.572 1.972 2.148 1.00 0.00 C ATOM 199 CZ3 TRP A 16 1.904 -0.047 2.002 1.00 0.00 C ATOM 200 CH2 TRP A 16 1.032 0.877 1.411 1.00 0.00 C ATOM 0 H TRP A 16 1.700 1.527 8.463 1.00 0.00 H new ATOM 0 HA TRP A 16 1.500 -0.623 6.475 1.00 0.00 H new ATOM 0 HB2 TRP A 16 3.270 1.747 7.237 1.00 0.00 H new ATOM 0 HB3 TRP A 16 3.865 0.605 6.049 1.00 0.00 H new ATOM 0 HD1 TRP A 16 1.358 3.377 6.529 1.00 0.00 H new ATOM 0 HE1 TRP A 16 0.117 3.882 4.320 1.00 0.00 H new ATOM 0 HE3 TRP A 16 2.991 -0.598 3.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.100 2.687 1.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 2.259 -0.892 1.431 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.716 0.743 0.387 1.00 0.00 H new ATOM 211 N VAL A 17 2.790 -2.416 7.548 1.00 0.00 N ATOM 212 CA VAL A 17 3.678 -3.496 8.064 1.00 0.00 C ATOM 213 C VAL A 17 4.378 -4.176 6.885 1.00 0.00 C ATOM 214 O VAL A 17 3.856 -4.223 5.794 1.00 0.00 O ATOM 215 CB VAL A 17 2.754 -4.485 8.797 1.00 0.00 C ATOM 216 CG1 VAL A 17 1.647 -3.721 9.528 1.00 0.00 C ATOM 217 CG2 VAL A 17 2.121 -5.458 7.792 1.00 0.00 C ATOM 0 H VAL A 17 1.957 -2.737 7.055 1.00 0.00 H new ATOM 0 HA VAL A 17 4.450 -3.117 8.733 1.00 0.00 H new ATOM 0 HB VAL A 17 3.346 -5.047 9.520 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.997 -4.428 10.044 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.093 -3.041 10.254 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.062 -3.150 8.807 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.469 -6.154 8.320 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.538 -4.898 7.061 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.906 -6.014 7.280 1.00 0.00 H new ATOM 227 N ALA A 18 5.546 -4.706 7.088 1.00 0.00 N ATOM 228 CA ALA A 18 6.245 -5.382 5.961 1.00 0.00 C ATOM 229 C ALA A 18 6.734 -6.759 6.408 1.00 0.00 C ATOM 230 O ALA A 18 7.526 -6.886 7.321 1.00 0.00 O ATOM 231 CB ALA A 18 7.410 -4.464 5.605 1.00 0.00 C ATOM 0 H ALA A 18 6.046 -4.703 7.977 1.00 0.00 H new ATOM 0 HA ALA A 18 5.597 -5.545 5.100 1.00 0.00 H new ATOM 0 HB1 ALA A 18 7.975 -4.896 4.779 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.027 -3.487 5.310 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.062 -4.351 6.471 1.00 0.00 H new ATOM 237 N TYR A 19 6.247 -7.791 5.781 1.00 0.00 N ATOM 238 CA TYR A 19 6.654 -9.170 6.173 1.00 0.00 C ATOM 239 C TYR A 19 7.591 -9.780 5.127 1.00 0.00 C ATOM 240 O TYR A 19 7.823 -9.215 4.076 1.00 0.00 O ATOM 241 CB TYR A 19 5.343 -9.950 6.228 1.00 0.00 C ATOM 242 CG TYR A 19 4.618 -9.792 4.913 1.00 0.00 C ATOM 243 CD1 TYR A 19 5.138 -10.382 3.755 1.00 0.00 C ATOM 244 CD2 TYR A 19 3.429 -9.056 4.849 1.00 0.00 C ATOM 245 CE1 TYR A 19 4.471 -10.237 2.533 1.00 0.00 C ATOM 246 CE2 TYR A 19 2.762 -8.912 3.627 1.00 0.00 C ATOM 247 CZ TYR A 19 3.283 -9.502 2.469 1.00 0.00 C ATOM 248 OH TYR A 19 2.624 -9.359 1.265 1.00 0.00 O ATOM 0 H TYR A 19 5.581 -7.740 5.010 1.00 0.00 H new ATOM 0 HA TYR A 19 7.195 -9.187 7.119 1.00 0.00 H new ATOM 0 HB2 TYR A 19 5.541 -11.004 6.424 1.00 0.00 H new ATOM 0 HB3 TYR A 19 4.722 -9.584 7.046 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.055 -10.950 3.805 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.027 -8.600 5.742 1.00 0.00 H new ATOM 0 HE1 TYR A 19 4.874 -10.692 1.640 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.844 -8.345 3.577 1.00 0.00 H new ATOM 0 HH TYR A 19 1.816 -8.821 1.396 1.00 0.00 H new ATOM 258 N GLY A 20 8.124 -10.938 5.412 1.00 0.00 N ATOM 259 CA GLY A 20 9.042 -11.602 4.445 1.00 0.00 C ATOM 260 C GLY A 20 10.481 -11.177 4.732 1.00 0.00 C ATOM 261 O GLY A 20 11.423 -11.766 4.241 1.00 0.00 O ATOM 0 H GLY A 20 7.962 -11.454 6.277 1.00 0.00 H new ATOM 0 HA2 GLY A 20 8.949 -12.685 4.524 1.00 0.00 H new ATOM 0 HA3 GLY A 20 8.769 -11.333 3.425 1.00 0.00 H new ATOM 265 N THR A 21 10.659 -10.152 5.519 1.00 0.00 N ATOM 266 CA THR A 21 12.039 -9.683 5.832 1.00 0.00 C ATOM 267 C THR A 21 12.081 -9.055 7.227 1.00 0.00 C ATOM 268 O THR A 21 11.439 -9.520 8.148 1.00 0.00 O ATOM 269 CB THR A 21 12.339 -8.631 4.763 1.00 0.00 C ATOM 270 OG1 THR A 21 11.618 -7.442 5.060 1.00 0.00 O ATOM 271 CG2 THR A 21 11.908 -9.158 3.396 1.00 0.00 C ATOM 0 H THR A 21 9.909 -9.619 5.959 1.00 0.00 H new ATOM 0 HA THR A 21 12.766 -10.495 5.829 1.00 0.00 H new ATOM 0 HB THR A 21 13.408 -8.418 4.749 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.179 -6.662 4.865 1.00 0.00 H new ATOM 0 HG21 THR A 21 12.121 -8.409 2.633 1.00 0.00 H new ATOM 0 HG22 THR A 21 12.456 -10.073 3.169 1.00 0.00 H new ATOM 0 HG23 THR A 21 10.839 -9.369 3.408 1.00 0.00 H new ATOM 279 N ASP A 22 12.828 -7.997 7.386 1.00 0.00 N ATOM 280 CA ASP A 22 12.908 -7.333 8.716 1.00 0.00 C ATOM 281 C ASP A 22 11.808 -6.274 8.830 1.00 0.00 C ATOM 282 O ASP A 22 11.094 -6.009 7.884 1.00 0.00 O ATOM 283 CB ASP A 22 14.291 -6.680 8.744 1.00 0.00 C ATOM 284 CG ASP A 22 14.673 -6.351 10.188 1.00 0.00 C ATOM 285 OD1 ASP A 22 14.386 -7.161 11.055 1.00 0.00 O ATOM 286 OD2 ASP A 22 15.247 -5.296 10.404 1.00 0.00 O ATOM 0 H ASP A 22 13.387 -7.564 6.651 1.00 0.00 H new ATOM 0 HA ASP A 22 12.772 -8.029 9.544 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.030 -7.351 8.305 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.288 -5.771 8.142 1.00 0.00 H new ATOM 291 N GLY A 23 11.660 -5.667 9.977 1.00 0.00 N ATOM 292 CA GLY A 23 10.600 -4.633 10.128 1.00 0.00 C ATOM 293 C GLY A 23 11.207 -3.290 10.556 1.00 0.00 C ATOM 294 O GLY A 23 10.669 -2.626 11.420 1.00 0.00 O ATOM 0 H GLY A 23 12.223 -5.842 10.809 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.066 -4.512 9.185 1.00 0.00 H new ATOM 0 HA3 GLY A 23 9.870 -4.960 10.868 1.00 0.00 H new ATOM 298 N PRO A 24 12.303 -2.919 9.935 1.00 0.00 N ATOM 299 CA PRO A 24 12.958 -1.628 10.262 1.00 0.00 C ATOM 300 C PRO A 24 12.245 -0.465 9.559 1.00 0.00 C ATOM 301 O PRO A 24 12.879 0.436 9.047 1.00 0.00 O ATOM 302 CB PRO A 24 14.363 -1.787 9.694 1.00 0.00 C ATOM 303 CG PRO A 24 14.229 -2.788 8.589 1.00 0.00 C ATOM 304 CD PRO A 24 13.036 -3.658 8.900 1.00 0.00 C ATOM 0 HA PRO A 24 12.942 -1.408 11.329 1.00 0.00 H new ATOM 0 HB2 PRO A 24 14.747 -0.837 9.321 1.00 0.00 H new ATOM 0 HB3 PRO A 24 15.059 -2.134 10.457 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.096 -2.285 7.631 1.00 0.00 H new ATOM 0 HG3 PRO A 24 15.133 -3.392 8.509 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.420 -3.818 8.015 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.344 -4.641 9.257 1.00 0.00 H new ATOM 312 N LEU A 25 10.940 -0.475 9.520 1.00 0.00 N ATOM 313 CA LEU A 25 10.209 0.633 8.840 1.00 0.00 C ATOM 314 C LEU A 25 10.814 1.984 9.228 1.00 0.00 C ATOM 315 O LEU A 25 10.448 2.576 10.224 1.00 0.00 O ATOM 316 CB LEU A 25 8.768 0.531 9.342 1.00 0.00 C ATOM 317 CG LEU A 25 8.099 -0.712 8.752 1.00 0.00 C ATOM 318 CD1 LEU A 25 6.591 -0.640 8.997 1.00 0.00 C ATOM 319 CD2 LEU A 25 8.364 -0.772 7.246 1.00 0.00 C ATOM 0 H LEU A 25 10.350 -1.200 9.928 1.00 0.00 H new ATOM 0 HA LEU A 25 10.268 0.556 7.754 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.756 0.479 10.431 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.211 1.424 9.059 1.00 0.00 H new ATOM 0 HG LEU A 25 8.507 -1.603 9.228 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.112 -1.525 8.578 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.398 -0.597 10.069 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.187 0.253 8.519 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.887 -1.658 6.828 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.956 0.119 6.769 1.00 0.00 H new ATOM 0 HD23 LEU A 25 9.438 -0.820 7.067 1.00 0.00 H new ATOM 331 N ASP A 26 11.730 2.480 8.444 1.00 0.00 N ATOM 332 CA ASP A 26 12.348 3.797 8.764 1.00 0.00 C ATOM 333 C ASP A 26 11.356 4.913 8.441 1.00 0.00 C ATOM 334 O ASP A 26 10.977 5.104 7.304 1.00 0.00 O ATOM 335 CB ASP A 26 13.579 3.891 7.863 1.00 0.00 C ATOM 336 CG ASP A 26 14.347 5.175 8.179 1.00 0.00 C ATOM 337 OD1 ASP A 26 14.255 5.635 9.306 1.00 0.00 O ATOM 338 OD2 ASP A 26 15.014 5.678 7.290 1.00 0.00 O ATOM 0 H ASP A 26 12.077 2.031 7.596 1.00 0.00 H new ATOM 0 HA ASP A 26 12.616 3.892 9.816 1.00 0.00 H new ATOM 0 HB2 ASP A 26 14.221 3.024 8.016 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.277 3.884 6.816 1.00 0.00 H new ATOM 343 N THR A 27 10.919 5.641 9.428 1.00 0.00 N ATOM 344 CA THR A 27 9.939 6.726 9.162 1.00 0.00 C ATOM 345 C THR A 27 10.509 8.083 9.570 1.00 0.00 C ATOM 346 O THR A 27 10.186 9.090 8.984 1.00 0.00 O ATOM 347 CB THR A 27 8.733 6.375 10.023 1.00 0.00 C ATOM 348 OG1 THR A 27 9.178 5.849 11.265 1.00 0.00 O ATOM 349 CG2 THR A 27 7.873 5.336 9.301 1.00 0.00 C ATOM 0 H THR A 27 11.197 5.532 10.403 1.00 0.00 H new ATOM 0 HA THR A 27 9.687 6.801 8.104 1.00 0.00 H new ATOM 0 HB THR A 27 8.139 7.271 10.201 1.00 0.00 H new ATOM 0 HG1 THR A 27 8.525 6.064 11.964 1.00 0.00 H new ATOM 0 HG21 THR A 27 7.010 5.086 9.918 1.00 0.00 H new ATOM 0 HG22 THR A 27 7.532 5.744 8.349 1.00 0.00 H new ATOM 0 HG23 THR A 27 8.463 4.437 9.120 1.00 0.00 H new ATOM 357 N SER A 28 11.350 8.112 10.569 1.00 0.00 N ATOM 358 CA SER A 28 11.952 9.405 11.026 1.00 0.00 C ATOM 359 C SER A 28 12.609 10.139 9.851 1.00 0.00 C ATOM 360 O SER A 28 13.803 10.048 9.645 1.00 0.00 O ATOM 361 CB SER A 28 13.003 9.006 12.061 1.00 0.00 C ATOM 362 OG SER A 28 12.470 7.994 12.905 1.00 0.00 O ATOM 0 H SER A 28 11.650 7.291 11.094 1.00 0.00 H new ATOM 0 HA SER A 28 11.204 10.081 11.439 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.902 8.644 11.562 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.295 9.873 12.653 1.00 0.00 H new ATOM 0 HG SER A 28 13.142 7.734 13.569 1.00 0.00 H new ATOM 368 N THR A 29 11.840 10.861 9.076 1.00 0.00 N ATOM 369 CA THR A 29 12.413 11.595 7.906 1.00 0.00 C ATOM 370 C THR A 29 11.285 12.053 6.978 1.00 0.00 C ATOM 371 O THR A 29 11.366 13.089 6.349 1.00 0.00 O ATOM 372 CB THR A 29 13.317 10.587 7.182 1.00 0.00 C ATOM 373 OG1 THR A 29 13.497 11.004 5.836 1.00 0.00 O ATOM 374 CG2 THR A 29 12.675 9.197 7.204 1.00 0.00 C ATOM 0 H THR A 29 10.834 10.974 9.204 1.00 0.00 H new ATOM 0 HA THR A 29 12.968 12.481 8.214 1.00 0.00 H new ATOM 0 HB THR A 29 14.282 10.541 7.687 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.075 10.364 5.370 1.00 0.00 H new ATOM 0 HG21 THR A 29 13.323 8.489 6.688 1.00 0.00 H new ATOM 0 HG22 THR A 29 12.536 8.877 8.237 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.708 9.235 6.703 1.00 0.00 H new ATOM 382 N GLY A 30 10.232 11.285 6.889 1.00 0.00 N ATOM 383 CA GLY A 30 9.097 11.670 6.005 1.00 0.00 C ATOM 384 C GLY A 30 8.756 10.512 5.062 1.00 0.00 C ATOM 385 O GLY A 30 7.949 10.652 4.164 1.00 0.00 O ATOM 0 H GLY A 30 10.110 10.406 7.392 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.226 11.928 6.608 1.00 0.00 H new ATOM 0 HA3 GLY A 30 9.359 12.556 5.427 1.00 0.00 H new ATOM 389 N ALA A 31 9.360 9.369 5.253 1.00 0.00 N ATOM 390 CA ALA A 31 9.059 8.213 4.357 1.00 0.00 C ATOM 391 C ALA A 31 9.241 6.887 5.105 1.00 0.00 C ATOM 392 O ALA A 31 9.985 6.801 6.060 1.00 0.00 O ATOM 393 CB ALA A 31 10.069 8.326 3.214 1.00 0.00 C ATOM 0 H ALA A 31 10.045 9.186 5.986 1.00 0.00 H new ATOM 0 HA ALA A 31 8.029 8.231 3.999 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.914 7.509 2.509 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.933 9.278 2.701 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.081 8.271 3.616 1.00 0.00 H new ATOM 399 N LEU A 32 8.568 5.853 4.671 1.00 0.00 N ATOM 400 CA LEU A 32 8.701 4.529 5.352 1.00 0.00 C ATOM 401 C LEU A 32 9.549 3.580 4.503 1.00 0.00 C ATOM 402 O LEU A 32 9.090 3.054 3.512 1.00 0.00 O ATOM 403 CB LEU A 32 7.273 3.995 5.465 1.00 0.00 C ATOM 404 CG LEU A 32 7.308 2.546 5.956 1.00 0.00 C ATOM 405 CD1 LEU A 32 6.274 2.365 7.066 1.00 0.00 C ATOM 406 CD2 LEU A 32 6.982 1.596 4.796 1.00 0.00 C ATOM 0 H LEU A 32 7.932 5.868 3.874 1.00 0.00 H new ATOM 0 HA LEU A 32 9.187 4.616 6.324 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.697 4.611 6.156 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.775 4.050 4.497 1.00 0.00 H new ATOM 0 HG LEU A 32 8.303 2.318 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.296 1.334 7.419 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.506 3.036 7.893 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.281 2.596 6.680 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.008 0.566 5.151 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.988 1.821 4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.718 1.725 4.002 1.00 0.00 H new ATOM 418 N CYS A 33 10.778 3.351 4.884 1.00 0.00 N ATOM 419 CA CYS A 33 11.642 2.431 4.087 1.00 0.00 C ATOM 420 C CYS A 33 11.664 1.027 4.686 1.00 0.00 C ATOM 421 O CYS A 33 12.186 0.804 5.761 1.00 0.00 O ATOM 422 CB CYS A 33 13.043 3.039 4.120 1.00 0.00 C ATOM 423 SG CYS A 33 13.368 3.872 2.545 1.00 0.00 S ATOM 0 H CYS A 33 11.219 3.759 5.708 1.00 0.00 H new ATOM 0 HA CYS A 33 11.264 2.329 3.070 1.00 0.00 H new ATOM 0 HB2 CYS A 33 13.125 3.748 4.944 1.00 0.00 H new ATOM 0 HB3 CYS A 33 13.786 2.261 4.294 1.00 0.00 H new ATOM 428 N VAL A 34 11.126 0.072 3.980 1.00 0.00 N ATOM 429 CA VAL A 34 11.142 -1.326 4.487 1.00 0.00 C ATOM 430 C VAL A 34 12.419 -2.007 3.996 1.00 0.00 C ATOM 431 O VAL A 34 12.933 -1.682 2.942 1.00 0.00 O ATOM 432 CB VAL A 34 9.901 -1.990 3.892 1.00 0.00 C ATOM 433 CG1 VAL A 34 8.649 -1.367 4.513 1.00 0.00 C ATOM 434 CG2 VAL A 34 9.882 -1.775 2.377 1.00 0.00 C ATOM 0 H VAL A 34 10.676 0.200 3.074 1.00 0.00 H new ATOM 0 HA VAL A 34 11.129 -1.388 5.575 1.00 0.00 H new ATOM 0 HB VAL A 34 9.921 -3.059 4.104 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.761 -1.838 4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.663 -1.520 5.592 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.630 -0.298 4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.997 -2.249 1.953 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.860 -0.707 2.161 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.776 -2.216 1.936 1.00 0.00 H new ATOM 444 N ALA A 35 12.948 -2.928 4.755 1.00 0.00 N ATOM 445 CA ALA A 35 14.212 -3.601 4.335 1.00 0.00 C ATOM 446 C ALA A 35 13.926 -4.839 3.482 1.00 0.00 C ATOM 447 O ALA A 35 13.434 -5.840 3.961 1.00 0.00 O ATOM 448 CB ALA A 35 14.894 -4.006 5.643 1.00 0.00 C ATOM 0 H ALA A 35 12.562 -3.243 5.645 1.00 0.00 H new ATOM 0 HA ALA A 35 14.832 -2.944 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.835 -4.510 5.422 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.090 -3.116 6.242 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.243 -4.681 6.199 1.00 0.00 H new ATOM 454 N VAL A 36 14.252 -4.777 2.221 1.00 0.00 N ATOM 455 CA VAL A 36 14.026 -5.945 1.327 1.00 0.00 C ATOM 456 C VAL A 36 15.368 -6.627 1.035 1.00 0.00 C ATOM 457 O VAL A 36 16.342 -5.968 0.730 1.00 0.00 O ATOM 458 CB VAL A 36 13.424 -5.351 0.052 1.00 0.00 C ATOM 459 CG1 VAL A 36 13.384 -6.415 -1.043 1.00 0.00 C ATOM 460 CG2 VAL A 36 12.001 -4.868 0.340 1.00 0.00 C ATOM 0 H VAL A 36 14.668 -3.962 1.770 1.00 0.00 H new ATOM 0 HA VAL A 36 13.371 -6.698 1.764 1.00 0.00 H new ATOM 0 HB VAL A 36 14.037 -4.513 -0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 36 12.955 -5.988 -1.949 1.00 0.00 H new ATOM 0 HG12 VAL A 36 14.396 -6.763 -1.250 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.773 -7.255 -0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.570 -4.444 -0.567 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.392 -5.708 0.673 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.026 -4.107 1.120 1.00 0.00 H new ATOM 470 N PRO A 37 15.378 -7.927 1.151 1.00 0.00 N ATOM 471 CA PRO A 37 16.620 -8.707 0.911 1.00 0.00 C ATOM 472 C PRO A 37 17.033 -8.642 -0.563 1.00 0.00 C ATOM 473 O PRO A 37 16.317 -8.129 -1.399 1.00 0.00 O ATOM 474 CB PRO A 37 16.235 -10.127 1.323 1.00 0.00 C ATOM 475 CG PRO A 37 14.749 -10.173 1.186 1.00 0.00 C ATOM 476 CD PRO A 37 14.249 -8.790 1.508 1.00 0.00 C ATOM 0 HA PRO A 37 17.477 -8.328 1.467 1.00 0.00 H new ATOM 0 HB2 PRO A 37 16.715 -10.868 0.684 1.00 0.00 H new ATOM 0 HB3 PRO A 37 16.545 -10.340 2.346 1.00 0.00 H new ATOM 0 HG2 PRO A 37 14.461 -10.465 0.176 1.00 0.00 H new ATOM 0 HG3 PRO A 37 14.319 -10.909 1.865 1.00 0.00 H new ATOM 0 HD2 PRO A 37 13.357 -8.542 0.933 1.00 0.00 H new ATOM 0 HD3 PRO A 37 13.987 -8.693 2.562 1.00 0.00 H new ATOM 484 N ALA A 38 18.195 -9.148 -0.879 1.00 0.00 N ATOM 485 CA ALA A 38 18.674 -9.106 -2.291 1.00 0.00 C ATOM 486 C ALA A 38 17.688 -9.807 -3.227 1.00 0.00 C ATOM 487 O ALA A 38 17.284 -10.930 -3.000 1.00 0.00 O ATOM 488 CB ALA A 38 20.014 -9.841 -2.278 1.00 0.00 C ATOM 0 H ALA A 38 18.835 -9.590 -0.218 1.00 0.00 H new ATOM 0 HA ALA A 38 18.768 -8.083 -2.654 1.00 0.00 H new ATOM 0 HB1 ALA A 38 20.432 -9.853 -3.285 1.00 0.00 H new ATOM 0 HB2 ALA A 38 20.703 -9.330 -1.605 1.00 0.00 H new ATOM 0 HB3 ALA A 38 19.864 -10.865 -1.935 1.00 0.00 H new ATOM 494 N GLY A 39 17.309 -9.145 -4.286 1.00 0.00 N ATOM 495 CA GLY A 39 16.359 -9.750 -5.262 1.00 0.00 C ATOM 496 C GLY A 39 15.261 -10.522 -4.528 1.00 0.00 C ATOM 497 O GLY A 39 14.843 -11.568 -4.980 1.00 0.00 O ATOM 0 H GLY A 39 17.620 -8.202 -4.519 1.00 0.00 H new ATOM 0 HA2 GLY A 39 15.914 -8.969 -5.878 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.896 -10.419 -5.935 1.00 0.00 H new ATOM 501 N SER A 40 14.788 -9.998 -3.415 1.00 0.00 N ATOM 502 CA SER A 40 13.705 -10.660 -2.629 1.00 0.00 C ATOM 503 C SER A 40 13.548 -12.132 -3.010 1.00 0.00 C ATOM 504 O SER A 40 12.507 -12.562 -3.464 1.00 0.00 O ATOM 505 CB SER A 40 12.460 -9.869 -2.988 1.00 0.00 C ATOM 506 OG SER A 40 12.261 -9.918 -4.393 1.00 0.00 O ATOM 0 H SER A 40 15.119 -9.120 -3.016 1.00 0.00 H new ATOM 0 HA SER A 40 13.914 -10.662 -1.559 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.593 -10.280 -2.472 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.565 -8.835 -2.660 1.00 0.00 H new ATOM 0 HG SER A 40 11.557 -9.285 -4.646 1.00 0.00 H new ATOM 512 N ALA A 41 14.585 -12.900 -2.839 1.00 0.00 N ATOM 513 CA ALA A 41 14.511 -14.343 -3.202 1.00 0.00 C ATOM 514 C ALA A 41 14.026 -15.168 -2.016 1.00 0.00 C ATOM 515 O ALA A 41 14.752 -15.420 -1.075 1.00 0.00 O ATOM 516 CB ALA A 41 15.933 -14.739 -3.577 1.00 0.00 C ATOM 0 H ALA A 41 15.482 -12.592 -2.463 1.00 0.00 H new ATOM 0 HA ALA A 41 13.811 -14.519 -4.019 1.00 0.00 H new ATOM 0 HB1 ALA A 41 15.956 -15.792 -3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.270 -14.133 -4.418 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.593 -14.576 -2.725 1.00 0.00 H new ATOM 522 N GLN A 42 12.800 -15.592 -2.068 1.00 0.00 N ATOM 523 CA GLN A 42 12.228 -16.411 -0.959 1.00 0.00 C ATOM 524 C GLN A 42 10.724 -16.589 -1.172 1.00 0.00 C ATOM 525 O GLN A 42 10.195 -16.259 -2.215 1.00 0.00 O ATOM 526 CB GLN A 42 12.492 -15.612 0.321 1.00 0.00 C ATOM 527 CG GLN A 42 12.127 -14.142 0.097 1.00 0.00 C ATOM 528 CD GLN A 42 12.459 -13.337 1.355 1.00 0.00 C ATOM 529 OE1 GLN A 42 12.729 -12.155 1.280 1.00 0.00 O ATOM 530 NE2 GLN A 42 12.450 -13.932 2.517 1.00 0.00 N ATOM 0 H GLN A 42 12.158 -15.406 -2.839 1.00 0.00 H new ATOM 0 HA GLN A 42 12.674 -17.405 -0.910 1.00 0.00 H new ATOM 0 HB2 GLN A 42 11.906 -16.021 1.144 1.00 0.00 H new ATOM 0 HB3 GLN A 42 13.541 -15.697 0.604 1.00 0.00 H new ATOM 0 HG2 GLN A 42 12.677 -13.746 -0.757 1.00 0.00 H new ATOM 0 HG3 GLN A 42 11.066 -14.051 -0.137 1.00 0.00 H new ATOM 0 HE21 GLN A 42 12.223 -14.924 2.580 1.00 0.00 H new ATOM 0 HE22 GLN A 42 12.670 -13.404 3.362 1.00 0.00 H new ATOM 539 N TYR A 43 10.028 -17.098 -0.194 1.00 0.00 N ATOM 540 CA TYR A 43 8.556 -17.281 -0.351 1.00 0.00 C ATOM 541 C TYR A 43 7.945 -16.031 -0.990 1.00 0.00 C ATOM 542 O TYR A 43 6.919 -16.090 -1.638 1.00 0.00 O ATOM 543 CB TYR A 43 8.015 -17.486 1.066 1.00 0.00 C ATOM 544 CG TYR A 43 8.708 -16.541 2.018 1.00 0.00 C ATOM 545 CD1 TYR A 43 8.452 -15.168 1.949 1.00 0.00 C ATOM 546 CD2 TYR A 43 9.608 -17.041 2.965 1.00 0.00 C ATOM 547 CE1 TYR A 43 9.098 -14.292 2.828 1.00 0.00 C ATOM 548 CE2 TYR A 43 10.254 -16.165 3.845 1.00 0.00 C ATOM 549 CZ TYR A 43 9.999 -14.790 3.777 1.00 0.00 C ATOM 550 OH TYR A 43 10.636 -13.927 4.644 1.00 0.00 O ATOM 0 H TYR A 43 10.411 -17.394 0.704 1.00 0.00 H new ATOM 0 HA TYR A 43 8.310 -18.126 -0.995 1.00 0.00 H new ATOM 0 HB2 TYR A 43 6.939 -17.311 1.084 1.00 0.00 H new ATOM 0 HB3 TYR A 43 8.175 -18.517 1.381 1.00 0.00 H new ATOM 0 HD1 TYR A 43 7.756 -14.784 1.218 1.00 0.00 H new ATOM 0 HD2 TYR A 43 9.804 -18.102 3.017 1.00 0.00 H new ATOM 0 HE1 TYR A 43 8.902 -13.231 2.775 1.00 0.00 H new ATOM 0 HE2 TYR A 43 10.949 -16.550 4.577 1.00 0.00 H new ATOM 0 HH TYR A 43 11.013 -13.176 4.140 1.00 0.00 H new ATOM 560 N GLY A 44 8.574 -14.898 -0.816 1.00 0.00 N ATOM 561 CA GLY A 44 8.036 -13.646 -1.418 1.00 0.00 C ATOM 562 C GLY A 44 7.819 -12.595 -0.327 1.00 0.00 C ATOM 563 O GLY A 44 7.166 -12.843 0.667 1.00 0.00 O ATOM 0 H GLY A 44 9.437 -14.787 -0.283 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.729 -13.266 -2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.095 -13.853 -1.928 1.00 0.00 H new ATOM 567 N VAL A 45 8.352 -11.416 -0.510 1.00 0.00 N ATOM 568 CA VAL A 45 8.167 -10.345 0.509 1.00 0.00 C ATOM 569 C VAL A 45 6.898 -9.556 0.183 1.00 0.00 C ATOM 570 O VAL A 45 6.248 -9.809 -0.812 1.00 0.00 O ATOM 571 CB VAL A 45 9.403 -9.451 0.374 1.00 0.00 C ATOM 572 CG1 VAL A 45 9.525 -8.560 1.610 1.00 0.00 C ATOM 573 CG2 VAL A 45 10.663 -10.317 0.240 1.00 0.00 C ATOM 0 H VAL A 45 8.908 -11.149 -1.323 1.00 0.00 H new ATOM 0 HA VAL A 45 8.063 -10.736 1.521 1.00 0.00 H new ATOM 0 HB VAL A 45 9.300 -8.830 -0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.405 -7.924 1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.635 -7.938 1.699 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.623 -9.183 2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.538 -9.674 0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.769 -10.945 1.125 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.578 -10.948 -0.645 1.00 0.00 H new ATOM 583 N GLY A 46 6.530 -8.604 0.999 1.00 0.00 N ATOM 584 CA GLY A 46 5.298 -7.824 0.692 1.00 0.00 C ATOM 585 C GLY A 46 4.841 -7.023 1.915 1.00 0.00 C ATOM 586 O GLY A 46 4.836 -7.512 3.027 1.00 0.00 O ATOM 0 H GLY A 46 7.021 -8.336 1.852 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.489 -7.147 -0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.503 -8.500 0.377 1.00 0.00 H new ATOM 590 N VAL A 47 4.442 -5.796 1.706 1.00 0.00 N ATOM 591 CA VAL A 47 3.962 -4.952 2.837 1.00 0.00 C ATOM 592 C VAL A 47 2.430 -4.847 2.784 1.00 0.00 C ATOM 593 O VAL A 47 1.846 -4.752 1.725 1.00 0.00 O ATOM 594 CB VAL A 47 4.604 -3.578 2.606 1.00 0.00 C ATOM 595 CG1 VAL A 47 4.348 -2.680 3.813 1.00 0.00 C ATOM 596 CG2 VAL A 47 6.114 -3.733 2.417 1.00 0.00 C ATOM 0 H VAL A 47 4.428 -5.340 0.794 1.00 0.00 H new ATOM 0 HA VAL A 47 4.227 -5.363 3.811 1.00 0.00 H new ATOM 0 HB VAL A 47 4.166 -3.132 1.713 1.00 0.00 H new ATOM 0 HG11 VAL A 47 4.806 -1.705 3.645 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.274 -2.557 3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.781 -3.135 4.704 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.563 -2.753 2.253 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.548 -4.186 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 47 6.309 -4.370 1.554 1.00 0.00 H new ATOM 606 N VAL A 48 1.772 -4.868 3.910 1.00 0.00 N ATOM 607 CA VAL A 48 0.281 -4.771 3.896 1.00 0.00 C ATOM 608 C VAL A 48 -0.198 -3.735 4.917 1.00 0.00 C ATOM 609 O VAL A 48 0.366 -3.592 5.984 1.00 0.00 O ATOM 610 CB VAL A 48 -0.216 -6.167 4.275 1.00 0.00 C ATOM 611 CG1 VAL A 48 -0.045 -7.111 3.084 1.00 0.00 C ATOM 612 CG2 VAL A 48 0.594 -6.693 5.462 1.00 0.00 C ATOM 0 H VAL A 48 2.196 -4.947 4.834 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.098 -4.454 2.924 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.270 -6.114 4.549 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.399 -8.106 3.354 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.622 -6.738 2.238 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.009 -7.163 2.809 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.240 -7.688 5.732 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.648 -6.745 5.189 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.472 -6.021 6.312 1.00 0.00 H new ATOM 622 N LEU A 49 -1.239 -3.013 4.597 1.00 0.00 N ATOM 623 CA LEU A 49 -1.760 -1.987 5.548 1.00 0.00 C ATOM 624 C LEU A 49 -3.289 -2.050 5.604 1.00 0.00 C ATOM 625 O LEU A 49 -3.968 -1.747 4.643 1.00 0.00 O ATOM 626 CB LEU A 49 -1.301 -0.646 4.976 1.00 0.00 C ATOM 627 CG LEU A 49 -2.063 0.488 5.664 1.00 0.00 C ATOM 628 CD1 LEU A 49 -1.705 0.515 7.151 1.00 0.00 C ATOM 629 CD2 LEU A 49 -1.676 1.823 5.023 1.00 0.00 C ATOM 0 H LEU A 49 -1.751 -3.089 3.718 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.396 -2.142 6.564 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.229 -0.522 5.127 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.477 -0.617 3.901 1.00 0.00 H new ATOM 0 HG LEU A 49 -3.135 0.326 5.551 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.248 1.323 7.641 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.978 -0.436 7.608 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.633 0.677 7.264 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.218 2.632 5.512 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.604 1.984 5.137 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.930 1.805 3.963 1.00 0.00 H new ATOM 641 N ASN A 50 -3.836 -2.443 6.721 1.00 0.00 N ATOM 642 CA ASN A 50 -5.321 -2.531 6.837 1.00 0.00 C ATOM 643 C ASN A 50 -5.904 -1.195 7.309 1.00 0.00 C ATOM 644 O ASN A 50 -5.433 -0.603 8.260 1.00 0.00 O ATOM 645 CB ASN A 50 -5.568 -3.623 7.879 1.00 0.00 C ATOM 646 CG ASN A 50 -7.012 -3.540 8.377 1.00 0.00 C ATOM 647 OD1 ASN A 50 -7.911 -4.074 7.759 1.00 0.00 O ATOM 648 ND2 ASN A 50 -7.274 -2.887 9.476 1.00 0.00 N ATOM 0 H ASN A 50 -3.319 -2.707 7.560 1.00 0.00 H new ATOM 0 HA ASN A 50 -5.796 -2.758 5.882 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -5.379 -4.604 7.444 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -4.877 -3.506 8.714 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.234 -2.825 9.816 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -6.519 -2.439 9.995 1.00 0.00 H new ATOM 655 N GLY A 51 -6.931 -0.719 6.655 1.00 0.00 N ATOM 656 CA GLY A 51 -7.544 0.572 7.076 1.00 0.00 C ATOM 657 C GLY A 51 -7.955 1.388 5.847 1.00 0.00 C ATOM 658 O GLY A 51 -7.344 2.387 5.524 1.00 0.00 O ATOM 0 H GLY A 51 -7.369 -1.168 5.851 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.415 0.382 7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.835 1.140 7.678 1.00 0.00 H new ATOM 662 N VAL A 52 -8.992 0.982 5.163 1.00 0.00 N ATOM 663 CA VAL A 52 -9.439 1.753 3.964 1.00 0.00 C ATOM 664 C VAL A 52 -10.876 2.245 4.163 1.00 0.00 C ATOM 665 O VAL A 52 -11.529 1.904 5.129 1.00 0.00 O ATOM 666 CB VAL A 52 -9.364 0.769 2.796 1.00 0.00 C ATOM 667 CG1 VAL A 52 -9.457 1.536 1.476 1.00 0.00 C ATOM 668 CG2 VAL A 52 -8.035 0.014 2.849 1.00 0.00 C ATOM 0 H VAL A 52 -9.547 0.154 5.381 1.00 0.00 H new ATOM 0 HA VAL A 52 -8.820 2.633 3.787 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.190 0.061 2.866 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.404 0.835 0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.403 2.077 1.435 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.631 2.244 1.408 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.982 -0.687 2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.210 0.723 2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -7.964 -0.533 3.789 1.00 0.00 H new ATOM 678 N ALA A 53 -11.374 3.051 3.263 1.00 0.00 N ATOM 679 CA ALA A 53 -12.766 3.566 3.415 1.00 0.00 C ATOM 680 C ALA A 53 -13.606 3.240 2.174 1.00 0.00 C ATOM 681 O ALA A 53 -13.818 4.078 1.320 1.00 0.00 O ATOM 682 CB ALA A 53 -12.612 5.078 3.572 1.00 0.00 C ATOM 0 H ALA A 53 -10.879 3.374 2.432 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.277 3.112 4.264 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.595 5.534 3.690 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.005 5.293 4.452 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.126 5.488 2.687 1.00 0.00 H new ATOM 688 N ILE A 54 -14.094 2.034 2.075 1.00 0.00 N ATOM 689 CA ILE A 54 -14.931 1.657 0.896 1.00 0.00 C ATOM 690 C ILE A 54 -16.062 0.728 1.345 1.00 0.00 C ATOM 691 O ILE A 54 -16.018 0.162 2.420 1.00 0.00 O ATOM 692 CB ILE A 54 -13.992 0.920 -0.069 1.00 0.00 C ATOM 693 CG1 ILE A 54 -12.599 1.558 -0.049 1.00 0.00 C ATOM 694 CG2 ILE A 54 -14.557 0.996 -1.488 1.00 0.00 C ATOM 695 CD1 ILE A 54 -12.659 2.949 -0.676 1.00 0.00 C ATOM 0 H ILE A 54 -13.950 1.291 2.759 1.00 0.00 H new ATOM 0 HA ILE A 54 -15.383 2.528 0.422 1.00 0.00 H new ATOM 0 HB ILE A 54 -13.913 -0.121 0.246 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -12.235 1.626 0.976 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -11.894 0.932 -0.597 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -13.890 0.473 -2.174 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -15.542 0.530 -1.513 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -14.642 2.040 -1.790 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -11.666 3.399 -0.659 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -13.004 2.869 -1.707 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -13.350 3.574 -0.110 1.00 0.00 H new ATOM 707 N GLU A 55 -17.071 0.557 0.536 1.00 0.00 N ATOM 708 CA GLU A 55 -18.192 -0.346 0.931 1.00 0.00 C ATOM 709 C GLU A 55 -19.156 -0.546 -0.236 1.00 0.00 C ATOM 710 O GLU A 55 -20.328 -0.806 -0.048 1.00 0.00 O ATOM 711 CB GLU A 55 -18.888 0.364 2.092 1.00 0.00 C ATOM 712 CG GLU A 55 -19.682 -0.654 2.913 1.00 0.00 C ATOM 713 CD GLU A 55 -20.136 -0.009 4.224 1.00 0.00 C ATOM 714 OE1 GLU A 55 -19.518 0.960 4.631 1.00 0.00 O ATOM 715 OE2 GLU A 55 -21.096 -0.497 4.799 1.00 0.00 O ATOM 0 H GLU A 55 -17.169 1.000 -0.377 1.00 0.00 H new ATOM 0 HA GLU A 55 -17.838 -1.337 1.215 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.150 0.860 2.723 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -19.554 1.138 1.711 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -20.547 -0.999 2.346 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -19.067 -1.530 3.120 1.00 0.00 H new ATOM 722 N GLU A 56 -18.665 -0.436 -1.436 1.00 0.00 N ATOM 723 CA GLU A 56 -19.539 -0.620 -2.629 1.00 0.00 C ATOM 724 C GLU A 56 -18.735 -0.381 -3.914 1.00 0.00 C ATOM 725 O GLU A 56 -17.522 -0.332 -3.898 1.00 0.00 O ATOM 726 CB GLU A 56 -20.656 0.425 -2.460 1.00 0.00 C ATOM 727 CG GLU A 56 -20.312 1.715 -3.214 1.00 0.00 C ATOM 728 CD GLU A 56 -21.184 2.860 -2.694 1.00 0.00 C ATOM 729 OE1 GLU A 56 -21.622 2.775 -1.558 1.00 0.00 O ATOM 730 OE2 GLU A 56 -21.398 3.801 -3.440 1.00 0.00 O ATOM 0 H GLU A 56 -17.689 -0.225 -1.645 1.00 0.00 H new ATOM 0 HA GLU A 56 -19.944 -1.629 -2.706 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -21.598 0.021 -2.832 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -20.799 0.644 -1.402 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -19.258 1.957 -3.079 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -20.474 1.578 -4.283 1.00 0.00 H new ATOM 737 N GLY A 57 -19.407 -0.218 -5.021 1.00 0.00 N ATOM 738 CA GLY A 57 -18.691 0.036 -6.303 1.00 0.00 C ATOM 739 C GLY A 57 -18.606 1.544 -6.530 1.00 0.00 C ATOM 740 O GLY A 57 -19.236 2.089 -7.415 1.00 0.00 O ATOM 0 H GLY A 57 -20.424 -0.250 -5.093 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -17.691 -0.397 -6.269 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -19.217 -0.441 -7.130 1.00 0.00 H new ATOM 744 N THR A 58 -17.837 2.222 -5.726 1.00 0.00 N ATOM 745 CA THR A 58 -17.712 3.701 -5.875 1.00 0.00 C ATOM 746 C THR A 58 -16.371 4.061 -6.525 1.00 0.00 C ATOM 747 O THR A 58 -15.518 3.219 -6.726 1.00 0.00 O ATOM 748 CB THR A 58 -17.792 4.240 -4.440 1.00 0.00 C ATOM 749 OG1 THR A 58 -19.155 4.404 -4.077 1.00 0.00 O ATOM 750 CG2 THR A 58 -17.073 5.589 -4.336 1.00 0.00 C ATOM 0 H THR A 58 -17.287 1.816 -4.969 1.00 0.00 H new ATOM 0 HA THR A 58 -18.486 4.126 -6.515 1.00 0.00 H new ATOM 0 HB THR A 58 -17.310 3.531 -3.767 1.00 0.00 H new ATOM 0 HG1 THR A 58 -19.211 4.746 -3.160 1.00 0.00 H new ATOM 0 HG21 THR A 58 -17.138 5.958 -3.313 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.025 5.465 -4.611 1.00 0.00 H new ATOM 0 HG23 THR A 58 -17.543 6.305 -5.011 1.00 0.00 H new ATOM 758 N THR A 59 -16.182 5.311 -6.846 1.00 0.00 N ATOM 759 CA THR A 59 -14.900 5.737 -7.474 1.00 0.00 C ATOM 760 C THR A 59 -13.897 6.131 -6.388 1.00 0.00 C ATOM 761 O THR A 59 -14.267 6.429 -5.271 1.00 0.00 O ATOM 762 CB THR A 59 -15.262 6.951 -8.330 1.00 0.00 C ATOM 763 OG1 THR A 59 -16.604 6.827 -8.781 1.00 0.00 O ATOM 764 CG2 THR A 59 -14.323 7.029 -9.534 1.00 0.00 C ATOM 0 H THR A 59 -16.862 6.057 -6.700 1.00 0.00 H new ATOM 0 HA THR A 59 -14.443 4.944 -8.066 1.00 0.00 H new ATOM 0 HB THR A 59 -15.160 7.858 -7.734 1.00 0.00 H new ATOM 0 HG1 THR A 59 -16.838 7.605 -9.329 1.00 0.00 H new ATOM 0 HG21 THR A 59 -14.583 7.895 -10.143 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.294 7.125 -9.187 1.00 0.00 H new ATOM 0 HG23 THR A 59 -14.422 6.123 -10.132 1.00 0.00 H new ATOM 772 N TYR A 60 -12.633 6.135 -6.706 1.00 0.00 N ATOM 773 CA TYR A 60 -11.612 6.509 -5.687 1.00 0.00 C ATOM 774 C TYR A 60 -10.312 6.934 -6.372 1.00 0.00 C ATOM 775 O TYR A 60 -10.232 7.012 -7.582 1.00 0.00 O ATOM 776 CB TYR A 60 -11.391 5.241 -4.862 1.00 0.00 C ATOM 777 CG TYR A 60 -12.573 5.023 -3.948 1.00 0.00 C ATOM 778 CD1 TYR A 60 -12.651 5.705 -2.729 1.00 0.00 C ATOM 779 CD2 TYR A 60 -13.592 4.139 -4.322 1.00 0.00 C ATOM 780 CE1 TYR A 60 -13.749 5.504 -1.884 1.00 0.00 C ATOM 781 CE2 TYR A 60 -14.690 3.938 -3.478 1.00 0.00 C ATOM 782 CZ TYR A 60 -14.768 4.621 -2.258 1.00 0.00 C ATOM 783 OH TYR A 60 -15.851 4.423 -1.425 1.00 0.00 O ATOM 0 H TYR A 60 -12.263 5.896 -7.626 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.935 7.347 -5.069 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -11.265 4.383 -5.522 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -10.476 5.330 -4.276 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -11.864 6.386 -2.440 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -13.531 3.612 -5.263 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -13.810 6.031 -0.943 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -15.477 3.257 -3.767 1.00 0.00 H new ATOM 0 HH TYR A 60 -16.405 5.231 -1.411 1.00 0.00 H new ATOM 793 N THR A 61 -9.293 7.205 -5.607 1.00 0.00 N ATOM 794 CA THR A 61 -7.996 7.621 -6.210 1.00 0.00 C ATOM 795 C THR A 61 -6.837 7.126 -5.344 1.00 0.00 C ATOM 796 O THR A 61 -6.741 7.448 -4.176 1.00 0.00 O ATOM 797 CB THR A 61 -8.039 9.150 -6.230 1.00 0.00 C ATOM 798 OG1 THR A 61 -9.152 9.580 -7.003 1.00 0.00 O ATOM 799 CG2 THR A 61 -6.748 9.691 -6.845 1.00 0.00 C ATOM 0 H THR A 61 -9.302 7.156 -4.588 1.00 0.00 H new ATOM 0 HA THR A 61 -7.849 7.208 -7.208 1.00 0.00 H new ATOM 0 HB THR A 61 -8.137 9.525 -5.211 1.00 0.00 H new ATOM 0 HG1 THR A 61 -9.183 10.559 -7.016 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.780 10.780 -6.859 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.896 9.360 -6.251 1.00 0.00 H new ATOM 0 HG23 THR A 61 -6.646 9.318 -7.864 1.00 0.00 H new ATOM 807 N LEU A 62 -5.956 6.344 -5.904 1.00 0.00 N ATOM 808 CA LEU A 62 -4.808 5.831 -5.105 1.00 0.00 C ATOM 809 C LEU A 62 -3.630 6.801 -5.193 1.00 0.00 C ATOM 810 O LEU A 62 -3.119 7.079 -6.260 1.00 0.00 O ATOM 811 CB LEU A 62 -4.442 4.489 -5.740 1.00 0.00 C ATOM 812 CG LEU A 62 -3.112 3.999 -5.164 1.00 0.00 C ATOM 813 CD1 LEU A 62 -3.331 3.480 -3.742 1.00 0.00 C ATOM 814 CD2 LEU A 62 -2.563 2.871 -6.037 1.00 0.00 C ATOM 0 H LEU A 62 -5.981 6.039 -6.877 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.058 5.725 -4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.226 3.757 -5.547 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.365 4.595 -6.822 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.400 4.824 -5.144 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.383 3.131 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.723 4.283 -3.118 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.044 2.655 -3.761 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.615 2.522 -5.627 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.276 2.047 -6.057 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.406 3.239 -7.051 1.00 0.00 H new ATOM 826 N ARG A 63 -3.194 7.316 -4.078 1.00 0.00 N ATOM 827 CA ARG A 63 -2.048 8.266 -4.096 1.00 0.00 C ATOM 828 C ARG A 63 -0.937 7.762 -3.173 1.00 0.00 C ATOM 829 O ARG A 63 -1.191 7.296 -2.082 1.00 0.00 O ATOM 830 CB ARG A 63 -2.619 9.587 -3.579 1.00 0.00 C ATOM 831 CG ARG A 63 -1.480 10.581 -3.346 1.00 0.00 C ATOM 832 CD ARG A 63 -1.982 12.003 -3.606 1.00 0.00 C ATOM 833 NE ARG A 63 -0.792 12.744 -4.110 1.00 0.00 N ATOM 834 CZ ARG A 63 -0.416 13.849 -3.526 1.00 0.00 C ATOM 835 NH1 ARG A 63 -0.557 13.985 -2.235 1.00 0.00 N ATOM 836 NH2 ARG A 63 0.102 14.817 -4.231 1.00 0.00 N ATOM 0 H ARG A 63 -3.582 7.120 -3.155 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.613 8.374 -5.090 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -3.329 9.994 -4.298 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.166 9.420 -2.651 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.112 10.495 -2.324 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.643 10.353 -4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -2.790 12.009 -4.338 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.373 12.457 -2.695 1.00 0.00 H new ATOM 0 HE ARG A 63 -0.271 12.388 -4.911 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -0.961 13.228 -1.684 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -0.263 14.848 -1.778 1.00 0.00 H new ATOM 0 HH21 ARG A 63 0.213 14.710 -5.239 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.396 15.680 -3.774 1.00 0.00 H new ATOM 850 N TYR A 64 0.291 7.852 -3.602 1.00 0.00 N ATOM 851 CA TYR A 64 1.419 7.380 -2.749 1.00 0.00 C ATOM 852 C TYR A 64 2.751 7.632 -3.466 1.00 0.00 C ATOM 853 O TYR A 64 2.853 7.501 -4.669 1.00 0.00 O ATOM 854 CB TYR A 64 1.159 5.878 -2.532 1.00 0.00 C ATOM 855 CG TYR A 64 1.804 5.060 -3.631 1.00 0.00 C ATOM 856 CD1 TYR A 64 3.185 4.825 -3.614 1.00 0.00 C ATOM 857 CD2 TYR A 64 1.018 4.538 -4.665 1.00 0.00 C ATOM 858 CE1 TYR A 64 3.778 4.069 -4.633 1.00 0.00 C ATOM 859 CE2 TYR A 64 1.611 3.782 -5.683 1.00 0.00 C ATOM 860 CZ TYR A 64 2.991 3.548 -5.667 1.00 0.00 C ATOM 861 OH TYR A 64 3.576 2.804 -6.671 1.00 0.00 O ATOM 0 H TYR A 64 0.563 8.233 -4.508 1.00 0.00 H new ATOM 0 HA TYR A 64 1.479 7.905 -1.796 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.554 5.571 -1.564 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.086 5.688 -2.513 1.00 0.00 H new ATOM 0 HD1 TYR A 64 3.792 5.226 -2.816 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -0.047 4.719 -4.677 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.843 3.888 -4.621 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.004 3.379 -6.480 1.00 0.00 H new ATOM 0 HH TYR A 64 4.547 2.934 -6.651 1.00 0.00 H new ATOM 871 N THR A 65 3.769 7.996 -2.738 1.00 0.00 N ATOM 872 CA THR A 65 5.087 8.259 -3.382 1.00 0.00 C ATOM 873 C THR A 65 6.139 7.302 -2.823 1.00 0.00 C ATOM 874 O THR A 65 6.698 7.523 -1.768 1.00 0.00 O ATOM 875 CB THR A 65 5.426 9.705 -3.017 1.00 0.00 C ATOM 876 OG1 THR A 65 4.419 10.568 -3.527 1.00 0.00 O ATOM 877 CG2 THR A 65 6.779 10.083 -3.623 1.00 0.00 C ATOM 0 H THR A 65 3.746 8.123 -1.726 1.00 0.00 H new ATOM 0 HA THR A 65 5.060 8.110 -4.461 1.00 0.00 H new ATOM 0 HB THR A 65 5.476 9.804 -1.933 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.026 11.083 -2.791 1.00 0.00 H new ATOM 0 HG21 THR A 65 7.019 11.114 -3.362 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.551 9.420 -3.232 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.732 9.985 -4.708 1.00 0.00 H new ATOM 885 N ALA A 66 6.407 6.236 -3.524 1.00 0.00 N ATOM 886 CA ALA A 66 7.416 5.256 -3.035 1.00 0.00 C ATOM 887 C ALA A 66 8.757 5.477 -3.740 1.00 0.00 C ATOM 888 O ALA A 66 8.810 5.903 -4.877 1.00 0.00 O ATOM 889 CB ALA A 66 6.837 3.887 -3.394 1.00 0.00 C ATOM 0 H ALA A 66 5.970 6.001 -4.415 1.00 0.00 H new ATOM 0 HA ALA A 66 7.604 5.353 -1.966 1.00 0.00 H new ATOM 0 HB1 ALA A 66 7.522 3.105 -3.067 1.00 0.00 H new ATOM 0 HB2 ALA A 66 5.875 3.757 -2.898 1.00 0.00 H new ATOM 0 HB3 ALA A 66 6.701 3.821 -4.473 1.00 0.00 H new ATOM 895 N THR A 67 9.840 5.191 -3.072 1.00 0.00 N ATOM 896 CA THR A 67 11.178 5.384 -3.702 1.00 0.00 C ATOM 897 C THR A 67 12.177 4.369 -3.142 1.00 0.00 C ATOM 898 O THR A 67 12.684 4.521 -2.048 1.00 0.00 O ATOM 899 CB THR A 67 11.594 6.807 -3.328 1.00 0.00 C ATOM 900 OG1 THR A 67 10.641 7.727 -3.841 1.00 0.00 O ATOM 901 CG2 THR A 67 12.972 7.109 -3.922 1.00 0.00 C ATOM 0 H THR A 67 9.857 4.832 -2.117 1.00 0.00 H new ATOM 0 HA THR A 67 11.149 5.240 -4.782 1.00 0.00 H new ATOM 0 HB THR A 67 11.641 6.901 -2.243 1.00 0.00 H new ATOM 0 HG1 THR A 67 10.699 8.570 -3.344 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.269 8.123 -3.656 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.701 6.402 -3.527 1.00 0.00 H new ATOM 0 HG23 THR A 67 12.929 7.017 -5.007 1.00 0.00 H new ATOM 909 N ALA A 68 12.465 3.337 -3.884 1.00 0.00 N ATOM 910 CA ALA A 68 13.434 2.314 -3.395 1.00 0.00 C ATOM 911 C ALA A 68 14.853 2.689 -3.826 1.00 0.00 C ATOM 912 O ALA A 68 15.094 3.023 -4.969 1.00 0.00 O ATOM 913 CB ALA A 68 13.004 1.006 -4.062 1.00 0.00 C ATOM 0 H ALA A 68 12.072 3.156 -4.808 1.00 0.00 H new ATOM 0 HA ALA A 68 13.437 2.235 -2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 68 13.671 0.202 -3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 68 11.983 0.765 -3.766 1.00 0.00 H new ATOM 0 HB3 ALA A 68 13.051 1.117 -5.145 1.00 0.00 H new ATOM 919 N SER A 69 15.796 2.628 -2.925 1.00 0.00 N ATOM 920 CA SER A 69 17.197 2.974 -3.297 1.00 0.00 C ATOM 921 C SER A 69 17.543 2.330 -4.641 1.00 0.00 C ATOM 922 O SER A 69 18.383 2.809 -5.376 1.00 0.00 O ATOM 923 CB SER A 69 18.061 2.389 -2.181 1.00 0.00 C ATOM 924 OG SER A 69 18.250 0.999 -2.413 1.00 0.00 O ATOM 0 H SER A 69 15.658 2.355 -1.952 1.00 0.00 H new ATOM 0 HA SER A 69 17.351 4.048 -3.402 1.00 0.00 H new ATOM 0 HB2 SER A 69 19.024 2.898 -2.146 1.00 0.00 H new ATOM 0 HB3 SER A 69 17.582 2.546 -1.214 1.00 0.00 H new ATOM 0 HG SER A 69 18.805 0.621 -1.700 1.00 0.00 H new ATOM 930 N THR A 70 16.893 1.245 -4.965 1.00 0.00 N ATOM 931 CA THR A 70 17.168 0.562 -6.259 1.00 0.00 C ATOM 932 C THR A 70 15.960 0.704 -7.194 1.00 0.00 C ATOM 933 O THR A 70 14.854 0.951 -6.756 1.00 0.00 O ATOM 934 CB THR A 70 17.394 -0.909 -5.881 1.00 0.00 C ATOM 935 OG1 THR A 70 18.142 -1.548 -6.906 1.00 0.00 O ATOM 936 CG2 THR A 70 16.046 -1.619 -5.713 1.00 0.00 C ATOM 0 H THR A 70 16.180 0.801 -4.386 1.00 0.00 H new ATOM 0 HA THR A 70 18.025 0.984 -6.784 1.00 0.00 H new ATOM 0 HB THR A 70 17.942 -0.958 -4.940 1.00 0.00 H new ATOM 0 HG1 THR A 70 18.289 -2.487 -6.667 1.00 0.00 H new ATOM 0 HG21 THR A 70 16.215 -2.662 -5.445 1.00 0.00 H new ATOM 0 HG22 THR A 70 15.473 -1.130 -4.925 1.00 0.00 H new ATOM 0 HG23 THR A 70 15.490 -1.571 -6.649 1.00 0.00 H new ATOM 944 N ASP A 71 16.157 0.535 -8.472 1.00 0.00 N ATOM 945 CA ASP A 71 15.010 0.646 -9.418 1.00 0.00 C ATOM 946 C ASP A 71 14.193 -0.647 -9.381 1.00 0.00 C ATOM 947 O ASP A 71 14.329 -1.503 -10.233 1.00 0.00 O ATOM 948 CB ASP A 71 15.645 0.845 -10.795 1.00 0.00 C ATOM 949 CG ASP A 71 16.373 2.190 -10.833 1.00 0.00 C ATOM 950 OD1 ASP A 71 16.848 2.614 -9.793 1.00 0.00 O ATOM 951 OD2 ASP A 71 16.443 2.773 -11.903 1.00 0.00 O ATOM 0 H ASP A 71 17.058 0.326 -8.902 1.00 0.00 H new ATOM 0 HA ASP A 71 14.335 1.465 -9.167 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.344 0.035 -11.005 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.878 0.813 -11.569 1.00 0.00 H new ATOM 956 N VAL A 72 13.357 -0.806 -8.390 1.00 0.00 N ATOM 957 CA VAL A 72 12.550 -2.056 -8.292 1.00 0.00 C ATOM 958 C VAL A 72 11.109 -1.823 -8.747 1.00 0.00 C ATOM 959 O VAL A 72 10.495 -0.823 -8.432 1.00 0.00 O ATOM 960 CB VAL A 72 12.571 -2.429 -6.809 1.00 0.00 C ATOM 961 CG1 VAL A 72 11.699 -1.450 -6.022 1.00 0.00 C ATOM 962 CG2 VAL A 72 12.017 -3.845 -6.634 1.00 0.00 C ATOM 0 H VAL A 72 13.198 -0.126 -7.646 1.00 0.00 H new ATOM 0 HA VAL A 72 12.957 -2.841 -8.929 1.00 0.00 H new ATOM 0 HB VAL A 72 13.596 -2.385 -6.440 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.715 -1.717 -4.965 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.085 -0.438 -6.146 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.675 -1.496 -6.392 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.031 -4.113 -5.578 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.993 -3.883 -7.005 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.632 -4.548 -7.195 1.00 0.00 H new ATOM 972 N THR A 73 10.561 -2.761 -9.465 1.00 0.00 N ATOM 973 CA THR A 73 9.152 -2.633 -9.925 1.00 0.00 C ATOM 974 C THR A 73 8.350 -3.803 -9.357 1.00 0.00 C ATOM 975 O THR A 73 8.216 -4.837 -9.982 1.00 0.00 O ATOM 976 CB THR A 73 9.215 -2.707 -11.452 1.00 0.00 C ATOM 977 OG1 THR A 73 9.797 -1.514 -11.958 1.00 0.00 O ATOM 978 CG2 THR A 73 7.802 -2.868 -12.015 1.00 0.00 C ATOM 0 H THR A 73 11.033 -3.618 -9.755 1.00 0.00 H new ATOM 0 HA THR A 73 8.676 -1.708 -9.599 1.00 0.00 H new ATOM 0 HB THR A 73 9.821 -3.562 -11.751 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.840 -1.560 -12.936 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.848 -2.921 -13.103 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.357 -3.784 -11.626 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.193 -2.014 -11.718 1.00 0.00 H new ATOM 986 N VAL A 74 7.839 -3.661 -8.166 1.00 0.00 N ATOM 987 CA VAL A 74 7.074 -4.781 -7.553 1.00 0.00 C ATOM 988 C VAL A 74 5.592 -4.686 -7.918 1.00 0.00 C ATOM 989 O VAL A 74 5.238 -4.328 -9.024 1.00 0.00 O ATOM 990 CB VAL A 74 7.283 -4.623 -6.047 1.00 0.00 C ATOM 991 CG1 VAL A 74 8.782 -4.520 -5.748 1.00 0.00 C ATOM 992 CG2 VAL A 74 6.584 -3.352 -5.564 1.00 0.00 C ATOM 0 H VAL A 74 7.918 -2.821 -7.593 1.00 0.00 H new ATOM 0 HA VAL A 74 7.412 -5.755 -7.908 1.00 0.00 H new ATOM 0 HB VAL A 74 6.865 -5.488 -5.532 1.00 0.00 H new ATOM 0 HG11 VAL A 74 8.932 -4.407 -4.674 1.00 0.00 H new ATOM 0 HG12 VAL A 74 9.285 -5.424 -6.092 1.00 0.00 H new ATOM 0 HG13 VAL A 74 9.198 -3.655 -6.265 1.00 0.00 H new ATOM 0 HG21 VAL A 74 6.734 -3.240 -4.490 1.00 0.00 H new ATOM 0 HG22 VAL A 74 7.002 -2.488 -6.081 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.517 -3.420 -5.777 1.00 0.00 H new ATOM 1002 N ARG A 75 4.724 -5.018 -7.004 1.00 0.00 N ATOM 1003 CA ARG A 75 3.267 -4.960 -7.307 1.00 0.00 C ATOM 1004 C ARG A 75 2.514 -4.244 -6.181 1.00 0.00 C ATOM 1005 O ARG A 75 2.895 -4.303 -5.029 1.00 0.00 O ATOM 1006 CB ARG A 75 2.835 -6.424 -7.403 1.00 0.00 C ATOM 1007 CG ARG A 75 2.977 -6.904 -8.848 1.00 0.00 C ATOM 1008 CD ARG A 75 1.957 -8.012 -9.119 1.00 0.00 C ATOM 1009 NE ARG A 75 2.414 -9.165 -8.295 1.00 0.00 N ATOM 1010 CZ ARG A 75 3.011 -10.177 -8.862 1.00 0.00 C ATOM 1011 NH1 ARG A 75 3.732 -9.992 -9.934 1.00 0.00 N ATOM 1012 NH2 ARG A 75 2.886 -11.375 -8.358 1.00 0.00 N ATOM 0 H ARG A 75 4.960 -5.327 -6.061 1.00 0.00 H new ATOM 0 HA ARG A 75 3.053 -4.407 -8.222 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.447 -7.039 -6.743 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.802 -6.532 -7.073 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.819 -6.073 -9.536 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.987 -7.274 -9.022 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.951 -7.700 -8.838 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.927 -8.271 -10.177 1.00 0.00 H new ATOM 0 HE ARG A 75 2.260 -9.164 -7.287 1.00 0.00 H new ATOM 0 HH11 ARG A 75 3.829 -9.056 -10.328 1.00 0.00 H new ATOM 0 HH12 ARG A 75 4.199 -10.783 -10.377 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.322 -11.520 -7.521 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.353 -12.166 -8.801 1.00 0.00 H new ATOM 1026 N ALA A 76 1.446 -3.568 -6.507 1.00 0.00 N ATOM 1027 CA ALA A 76 0.663 -2.850 -5.459 1.00 0.00 C ATOM 1028 C ALA A 76 -0.819 -2.828 -5.842 1.00 0.00 C ATOM 1029 O ALA A 76 -1.169 -2.915 -7.003 1.00 0.00 O ATOM 1030 CB ALA A 76 1.234 -1.432 -5.432 1.00 0.00 C ATOM 0 H ALA A 76 1.081 -3.481 -7.455 1.00 0.00 H new ATOM 0 HA ALA A 76 0.736 -3.331 -4.483 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.707 -0.842 -4.683 1.00 0.00 H new ATOM 0 HB2 ALA A 76 2.294 -1.471 -5.183 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.109 -0.971 -6.412 1.00 0.00 H new ATOM 1036 N LEU A 77 -1.693 -2.715 -4.877 1.00 0.00 N ATOM 1037 CA LEU A 77 -3.149 -2.693 -5.194 1.00 0.00 C ATOM 1038 C LEU A 77 -3.976 -2.579 -3.908 1.00 0.00 C ATOM 1039 O LEU A 77 -3.504 -2.108 -2.893 1.00 0.00 O ATOM 1040 CB LEU A 77 -3.419 -4.029 -5.889 1.00 0.00 C ATOM 1041 CG LEU A 77 -2.914 -5.174 -5.010 1.00 0.00 C ATOM 1042 CD1 LEU A 77 -4.008 -5.579 -4.020 1.00 0.00 C ATOM 1043 CD2 LEU A 77 -2.557 -6.373 -5.891 1.00 0.00 C ATOM 0 H LEU A 77 -1.462 -2.637 -3.887 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.422 -1.842 -5.818 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.487 -4.144 -6.076 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.921 -4.054 -6.858 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.030 -4.848 -4.462 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.648 -6.395 -3.394 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.265 -4.726 -3.392 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.892 -5.905 -4.568 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.197 -7.190 -5.265 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.441 -6.698 -6.439 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.778 -6.086 -6.597 1.00 0.00 H new ATOM 1055 N VAL A 78 -5.208 -3.010 -3.948 1.00 0.00 N ATOM 1056 CA VAL A 78 -6.075 -2.934 -2.737 1.00 0.00 C ATOM 1057 C VAL A 78 -7.081 -4.089 -2.754 1.00 0.00 C ATOM 1058 O VAL A 78 -7.271 -4.737 -3.763 1.00 0.00 O ATOM 1059 CB VAL A 78 -6.797 -1.589 -2.848 1.00 0.00 C ATOM 1060 CG1 VAL A 78 -7.402 -1.217 -1.494 1.00 0.00 C ATOM 1061 CG2 VAL A 78 -5.800 -0.507 -3.272 1.00 0.00 C ATOM 0 H VAL A 78 -5.653 -3.414 -4.772 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.508 -3.010 -1.809 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.590 -1.667 -3.591 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.915 -0.259 -1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.113 -1.985 -1.190 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.609 -1.141 -0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.314 0.451 -3.351 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.006 -0.432 -2.529 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.369 -0.768 -4.238 1.00 0.00 H new ATOM 1071 N GLY A 79 -7.725 -4.359 -1.651 1.00 0.00 N ATOM 1072 CA GLY A 79 -8.709 -5.480 -1.633 1.00 0.00 C ATOM 1073 C GLY A 79 -9.429 -5.530 -0.287 1.00 0.00 C ATOM 1074 O GLY A 79 -9.410 -4.586 0.478 1.00 0.00 O ATOM 0 H GLY A 79 -7.615 -3.858 -0.770 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.434 -5.350 -2.437 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.198 -6.425 -1.815 1.00 0.00 H new ATOM 1078 N GLN A 80 -10.069 -6.630 0.006 1.00 0.00 N ATOM 1079 CA GLN A 80 -10.798 -6.750 1.302 1.00 0.00 C ATOM 1080 C GLN A 80 -10.235 -7.909 2.127 1.00 0.00 C ATOM 1081 O GLN A 80 -9.865 -8.939 1.599 1.00 0.00 O ATOM 1082 CB GLN A 80 -12.260 -7.023 0.930 1.00 0.00 C ATOM 1083 CG GLN A 80 -12.331 -7.942 -0.290 1.00 0.00 C ATOM 1084 CD GLN A 80 -13.795 -8.254 -0.607 1.00 0.00 C ATOM 1085 OE1 GLN A 80 -14.200 -8.223 -1.752 1.00 0.00 O ATOM 1086 NE2 GLN A 80 -14.610 -8.554 0.366 1.00 0.00 N ATOM 0 H GLN A 80 -10.119 -7.451 -0.597 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.696 -5.848 1.905 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -12.777 -7.483 1.772 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.770 -6.084 0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -11.856 -7.464 -1.147 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.785 -8.865 -0.096 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.269 -8.580 1.327 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.588 -8.763 0.166 1.00 0.00 H new ATOM 1095 N ASN A 81 -10.174 -7.749 3.420 1.00 0.00 N ATOM 1096 CA ASN A 81 -9.642 -8.842 4.281 1.00 0.00 C ATOM 1097 C ASN A 81 -10.797 -9.678 4.839 1.00 0.00 C ATOM 1098 O ASN A 81 -11.386 -9.345 5.849 1.00 0.00 O ATOM 1099 CB ASN A 81 -8.896 -8.133 5.412 1.00 0.00 C ATOM 1100 CG ASN A 81 -7.436 -7.922 5.009 1.00 0.00 C ATOM 1101 OD1 ASN A 81 -7.138 -7.714 3.849 1.00 0.00 O ATOM 1102 ND2 ASN A 81 -6.506 -7.967 5.923 1.00 0.00 N ATOM 0 H ASN A 81 -10.469 -6.909 3.917 1.00 0.00 H new ATOM 0 HA ASN A 81 -8.991 -9.522 3.732 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -9.367 -7.174 5.627 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -8.950 -8.726 6.325 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.529 -7.828 5.664 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -6.756 -8.141 6.896 1.00 0.00 H new ATOM 1109 N GLY A 82 -11.127 -10.757 4.182 1.00 0.00 N ATOM 1110 CA GLY A 82 -12.244 -11.617 4.666 1.00 0.00 C ATOM 1111 C GLY A 82 -13.101 -12.051 3.475 1.00 0.00 C ATOM 1112 O GLY A 82 -13.217 -11.344 2.495 1.00 0.00 O ATOM 0 H GLY A 82 -10.670 -11.080 3.329 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.848 -12.492 5.181 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -12.853 -11.071 5.387 1.00 0.00 H new ATOM 1116 N ALA A 83 -13.698 -13.210 3.550 1.00 0.00 N ATOM 1117 CA ALA A 83 -14.545 -13.688 2.418 1.00 0.00 C ATOM 1118 C ALA A 83 -15.732 -12.741 2.205 1.00 0.00 C ATOM 1119 O ALA A 83 -16.147 -12.058 3.120 1.00 0.00 O ATOM 1120 CB ALA A 83 -15.034 -15.072 2.847 1.00 0.00 C ATOM 0 H ALA A 83 -13.636 -13.846 4.345 1.00 0.00 H new ATOM 0 HA ALA A 83 -13.995 -13.722 1.478 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -15.666 -15.493 2.065 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -14.177 -15.725 3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.608 -14.985 3.770 1.00 0.00 H new ATOM 1126 N PRO A 84 -16.246 -12.728 0.997 1.00 0.00 N ATOM 1127 CA PRO A 84 -15.702 -13.584 -0.092 1.00 0.00 C ATOM 1128 C PRO A 84 -14.407 -12.988 -0.658 1.00 0.00 C ATOM 1129 O PRO A 84 -13.886 -13.453 -1.652 1.00 0.00 O ATOM 1130 CB PRO A 84 -16.806 -13.565 -1.144 1.00 0.00 C ATOM 1131 CG PRO A 84 -17.556 -12.290 -0.908 1.00 0.00 C ATOM 1132 CD PRO A 84 -17.382 -11.919 0.544 1.00 0.00 C ATOM 0 HA PRO A 84 -15.450 -14.589 0.245 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -16.390 -13.596 -2.151 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.461 -14.431 -1.043 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -17.177 -11.498 -1.553 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -18.612 -12.417 -1.147 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.182 -10.854 0.660 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -18.281 -12.139 1.120 1.00 0.00 H new ATOM 1140 N TYR A 85 -13.891 -11.961 -0.039 1.00 0.00 N ATOM 1141 CA TYR A 85 -12.634 -11.328 -0.540 1.00 0.00 C ATOM 1142 C TYR A 85 -12.900 -10.599 -1.860 1.00 0.00 C ATOM 1143 O TYR A 85 -13.921 -10.788 -2.490 1.00 0.00 O ATOM 1144 CB TYR A 85 -11.643 -12.477 -0.760 1.00 0.00 C ATOM 1145 CG TYR A 85 -11.741 -13.474 0.371 1.00 0.00 C ATOM 1146 CD1 TYR A 85 -11.242 -13.148 1.638 1.00 0.00 C ATOM 1147 CD2 TYR A 85 -12.324 -14.728 0.150 1.00 0.00 C ATOM 1148 CE1 TYR A 85 -11.326 -14.076 2.684 1.00 0.00 C ATOM 1149 CE2 TYR A 85 -12.409 -15.655 1.196 1.00 0.00 C ATOM 1150 CZ TYR A 85 -11.910 -15.329 2.463 1.00 0.00 C ATOM 1151 OH TYR A 85 -11.993 -16.243 3.494 1.00 0.00 O ATOM 0 H TYR A 85 -14.287 -11.530 0.796 1.00 0.00 H new ATOM 0 HA TYR A 85 -12.246 -10.594 0.166 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -11.852 -12.971 -1.709 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -10.628 -12.085 -0.822 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.792 -12.181 1.809 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.708 -14.980 -0.827 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -10.940 -13.825 3.661 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.860 -16.622 1.025 1.00 0.00 H new ATOM 0 HH TYR A 85 -12.427 -17.061 3.172 1.00 0.00 H new ATOM 1161 N GLY A 86 -11.986 -9.768 -2.282 1.00 0.00 N ATOM 1162 CA GLY A 86 -12.183 -9.028 -3.560 1.00 0.00 C ATOM 1163 C GLY A 86 -11.065 -7.997 -3.730 1.00 0.00 C ATOM 1164 O GLY A 86 -10.343 -7.693 -2.802 1.00 0.00 O ATOM 0 H GLY A 86 -11.111 -9.570 -1.796 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.182 -9.723 -4.399 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.153 -8.531 -3.559 1.00 0.00 H new ATOM 1168 N THR A 87 -10.916 -7.458 -4.909 1.00 0.00 N ATOM 1169 CA THR A 87 -9.842 -6.447 -5.136 1.00 0.00 C ATOM 1170 C THR A 87 -10.331 -5.362 -6.099 1.00 0.00 C ATOM 1171 O THR A 87 -11.140 -5.612 -6.972 1.00 0.00 O ATOM 1172 CB THR A 87 -8.684 -7.231 -5.754 1.00 0.00 C ATOM 1173 OG1 THR A 87 -9.200 -8.324 -6.500 1.00 0.00 O ATOM 1174 CG2 THR A 87 -7.769 -7.753 -4.646 1.00 0.00 C ATOM 0 H THR A 87 -11.490 -7.673 -5.724 1.00 0.00 H new ATOM 0 HA THR A 87 -9.548 -5.944 -4.215 1.00 0.00 H new ATOM 0 HB THR A 87 -8.113 -6.577 -6.414 1.00 0.00 H new ATOM 0 HG1 THR A 87 -8.459 -8.827 -6.898 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.944 -8.312 -5.088 1.00 0.00 H new ATOM 0 HG22 THR A 87 -7.373 -6.913 -4.075 1.00 0.00 H new ATOM 0 HG23 THR A 87 -8.336 -8.407 -3.984 1.00 0.00 H new ATOM 1182 N VAL A 88 -9.847 -4.160 -5.949 1.00 0.00 N ATOM 1183 CA VAL A 88 -10.285 -3.061 -6.858 1.00 0.00 C ATOM 1184 C VAL A 88 -9.077 -2.452 -7.575 1.00 0.00 C ATOM 1185 O VAL A 88 -9.212 -1.789 -8.585 1.00 0.00 O ATOM 1186 CB VAL A 88 -10.945 -2.028 -5.945 1.00 0.00 C ATOM 1187 CG1 VAL A 88 -12.178 -2.644 -5.282 1.00 0.00 C ATOM 1188 CG2 VAL A 88 -9.951 -1.593 -4.865 1.00 0.00 C ATOM 0 H VAL A 88 -9.168 -3.890 -5.237 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.967 -3.414 -7.632 1.00 0.00 H new ATOM 0 HB VAL A 88 -11.245 -1.162 -6.535 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.648 -1.907 -4.631 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.887 -2.955 -6.050 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -11.879 -3.511 -4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -10.421 -0.856 -4.213 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.651 -2.460 -4.276 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.072 -1.153 -5.336 1.00 0.00 H new ATOM 1198 N LEU A 89 -7.896 -2.671 -7.063 1.00 0.00 N ATOM 1199 CA LEU A 89 -6.682 -2.102 -7.719 1.00 0.00 C ATOM 1200 C LEU A 89 -5.814 -3.209 -8.319 1.00 0.00 C ATOM 1201 O LEU A 89 -5.680 -4.280 -7.761 1.00 0.00 O ATOM 1202 CB LEU A 89 -5.931 -1.383 -6.612 1.00 0.00 C ATOM 1203 CG LEU A 89 -6.388 0.068 -6.574 1.00 0.00 C ATOM 1204 CD1 LEU A 89 -7.688 0.174 -5.781 1.00 0.00 C ATOM 1205 CD2 LEU A 89 -5.305 0.911 -5.911 1.00 0.00 C ATOM 0 H LEU A 89 -7.719 -3.218 -6.221 1.00 0.00 H new ATOM 0 HA LEU A 89 -6.945 -1.434 -8.539 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.121 -1.864 -5.653 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.857 -1.436 -6.788 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.562 0.429 -7.588 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.014 1.214 -5.754 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.456 -0.435 -6.258 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.523 -0.181 -4.764 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.623 1.953 -5.879 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.135 0.552 -4.896 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.381 0.831 -6.483 1.00 0.00 H new ATOM 1217 N ASP A 90 -5.219 -2.955 -9.451 1.00 0.00 N ATOM 1218 CA ASP A 90 -4.351 -3.986 -10.088 1.00 0.00 C ATOM 1219 C ASP A 90 -3.255 -3.313 -10.921 1.00 0.00 C ATOM 1220 O ASP A 90 -3.424 -3.072 -12.100 1.00 0.00 O ATOM 1221 CB ASP A 90 -5.289 -4.793 -10.987 1.00 0.00 C ATOM 1222 CG ASP A 90 -6.113 -5.756 -10.131 1.00 0.00 C ATOM 1223 OD1 ASP A 90 -5.555 -6.743 -9.680 1.00 0.00 O ATOM 1224 OD2 ASP A 90 -7.289 -5.491 -9.940 1.00 0.00 O ATOM 0 H ASP A 90 -5.296 -2.077 -9.964 1.00 0.00 H new ATOM 0 HA ASP A 90 -3.850 -4.616 -9.353 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -5.949 -4.122 -11.537 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -4.712 -5.349 -11.726 1.00 0.00 H new ATOM 1229 N THR A 91 -2.134 -3.005 -10.324 1.00 0.00 N ATOM 1230 CA THR A 91 -1.043 -2.345 -11.101 1.00 0.00 C ATOM 1231 C THR A 91 0.325 -2.658 -10.485 1.00 0.00 C ATOM 1232 O THR A 91 0.425 -3.311 -9.466 1.00 0.00 O ATOM 1233 CB THR A 91 -1.342 -0.848 -11.007 1.00 0.00 C ATOM 1234 OG1 THR A 91 -1.732 -0.528 -9.679 1.00 0.00 O ATOM 1235 CG2 THR A 91 -2.472 -0.491 -11.974 1.00 0.00 C ATOM 0 H THR A 91 -1.927 -3.180 -9.341 1.00 0.00 H new ATOM 0 HA THR A 91 -1.008 -2.694 -12.133 1.00 0.00 H new ATOM 0 HB THR A 91 -0.449 -0.280 -11.270 1.00 0.00 H new ATOM 0 HG1 THR A 91 -1.922 0.431 -9.616 1.00 0.00 H new ATOM 0 HG21 THR A 91 -2.685 0.576 -11.907 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.171 -0.738 -12.992 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.366 -1.057 -11.713 1.00 0.00 H new ATOM 1243 N SER A 92 1.380 -2.193 -11.101 1.00 0.00 N ATOM 1244 CA SER A 92 2.744 -2.458 -10.557 1.00 0.00 C ATOM 1245 C SER A 92 3.447 -1.135 -10.232 1.00 0.00 C ATOM 1246 O SER A 92 3.645 -0.309 -11.101 1.00 0.00 O ATOM 1247 CB SER A 92 3.480 -3.194 -11.676 1.00 0.00 C ATOM 1248 OG SER A 92 2.564 -4.032 -12.369 1.00 0.00 O ATOM 0 H SER A 92 1.356 -1.641 -11.958 1.00 0.00 H new ATOM 0 HA SER A 92 2.717 -3.040 -9.636 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.928 -2.478 -12.365 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.294 -3.789 -11.262 1.00 0.00 H new ATOM 0 HG SER A 92 3.033 -4.504 -13.089 1.00 0.00 H new ATOM 1254 N PRO A 93 3.797 -0.978 -8.984 1.00 0.00 N ATOM 1255 CA PRO A 93 4.481 0.259 -8.533 1.00 0.00 C ATOM 1256 C PRO A 93 5.939 0.284 -9.001 1.00 0.00 C ATOM 1257 O PRO A 93 6.692 -0.641 -8.771 1.00 0.00 O ATOM 1258 CB PRO A 93 4.412 0.171 -7.012 1.00 0.00 C ATOM 1259 CG PRO A 93 4.284 -1.287 -6.710 1.00 0.00 C ATOM 1260 CD PRO A 93 3.591 -1.927 -7.885 1.00 0.00 C ATOM 0 HA PRO A 93 4.021 1.162 -8.933 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.306 0.591 -6.552 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.561 0.730 -6.623 1.00 0.00 H new ATOM 0 HG2 PRO A 93 5.265 -1.735 -6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 93 3.712 -1.442 -5.795 1.00 0.00 H new ATOM 0 HD2 PRO A 93 4.018 -2.903 -8.116 1.00 0.00 H new ATOM 0 HD3 PRO A 93 2.531 -2.082 -7.686 1.00 0.00 H new ATOM 1268 N ALA A 94 6.346 1.348 -9.640 1.00 0.00 N ATOM 1269 CA ALA A 94 7.759 1.445 -10.104 1.00 0.00 C ATOM 1270 C ALA A 94 8.583 2.204 -9.061 1.00 0.00 C ATOM 1271 O ALA A 94 8.072 3.056 -8.361 1.00 0.00 O ATOM 1272 CB ALA A 94 7.696 2.228 -11.416 1.00 0.00 C ATOM 0 H ALA A 94 5.761 2.154 -9.860 1.00 0.00 H new ATOM 0 HA ALA A 94 8.225 0.470 -10.243 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.702 2.341 -11.821 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.075 1.689 -12.132 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.266 3.213 -11.232 1.00 0.00 H new ATOM 1278 N LEU A 95 9.847 1.904 -8.939 1.00 0.00 N ATOM 1279 CA LEU A 95 10.673 2.618 -7.923 1.00 0.00 C ATOM 1280 C LEU A 95 12.104 2.824 -8.426 1.00 0.00 C ATOM 1281 O LEU A 95 12.487 2.333 -9.469 1.00 0.00 O ATOM 1282 CB LEU A 95 10.661 1.704 -6.699 1.00 0.00 C ATOM 1283 CG LEU A 95 9.305 1.809 -6.003 1.00 0.00 C ATOM 1284 CD1 LEU A 95 9.132 0.635 -5.039 1.00 0.00 C ATOM 1285 CD2 LEU A 95 9.234 3.123 -5.222 1.00 0.00 C ATOM 0 H LEU A 95 10.340 1.203 -9.492 1.00 0.00 H new ATOM 0 HA LEU A 95 10.280 3.611 -7.703 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.850 0.673 -6.999 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.458 1.987 -6.012 1.00 0.00 H new ATOM 0 HG LEU A 95 8.512 1.785 -6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 95 8.164 0.711 -4.543 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.183 -0.302 -5.594 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.925 0.658 -4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.267 3.199 -4.725 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.028 3.146 -4.476 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.356 3.961 -5.908 1.00 0.00 H new ATOM 1297 N THR A 96 12.892 3.553 -7.682 1.00 0.00 N ATOM 1298 CA THR A 96 14.303 3.809 -8.096 1.00 0.00 C ATOM 1299 C THR A 96 14.914 4.894 -7.205 1.00 0.00 C ATOM 1300 O THR A 96 14.277 5.398 -6.302 1.00 0.00 O ATOM 1301 CB THR A 96 14.225 4.289 -9.549 1.00 0.00 C ATOM 1302 OG1 THR A 96 15.420 4.980 -9.882 1.00 0.00 O ATOM 1303 CG2 THR A 96 13.029 5.229 -9.724 1.00 0.00 C ATOM 0 H THR A 96 12.617 3.985 -6.800 1.00 0.00 H new ATOM 0 HA THR A 96 14.927 2.920 -8.003 1.00 0.00 H new ATOM 0 HB THR A 96 14.103 3.427 -10.205 1.00 0.00 H new ATOM 0 HG1 THR A 96 16.182 4.367 -9.816 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.980 5.566 -10.759 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.110 4.700 -9.471 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.144 6.091 -9.067 1.00 0.00 H new ATOM 1311 N SER A 97 16.141 5.261 -7.451 1.00 0.00 N ATOM 1312 CA SER A 97 16.781 6.318 -6.615 1.00 0.00 C ATOM 1313 C SER A 97 16.000 7.627 -6.747 1.00 0.00 C ATOM 1314 O SER A 97 16.178 8.551 -5.979 1.00 0.00 O ATOM 1315 CB SER A 97 18.192 6.472 -7.179 1.00 0.00 C ATOM 1316 OG SER A 97 19.138 6.312 -6.129 1.00 0.00 O ATOM 0 H SER A 97 16.728 4.877 -8.192 1.00 0.00 H new ATOM 0 HA SER A 97 16.797 6.060 -5.556 1.00 0.00 H new ATOM 0 HB2 SER A 97 18.367 5.730 -7.958 1.00 0.00 H new ATOM 0 HB3 SER A 97 18.306 7.453 -7.641 1.00 0.00 H new ATOM 0 HG SER A 97 20.045 6.409 -6.488 1.00 0.00 H new ATOM 1322 N GLU A 98 15.134 7.707 -7.718 1.00 0.00 N ATOM 1323 CA GLU A 98 14.332 8.947 -7.911 1.00 0.00 C ATOM 1324 C GLU A 98 12.969 8.797 -7.228 1.00 0.00 C ATOM 1325 O GLU A 98 12.443 7.705 -7.133 1.00 0.00 O ATOM 1326 CB GLU A 98 14.166 9.065 -9.428 1.00 0.00 C ATOM 1327 CG GLU A 98 13.144 10.155 -9.756 1.00 0.00 C ATOM 1328 CD GLU A 98 12.629 9.959 -11.183 1.00 0.00 C ATOM 1329 OE1 GLU A 98 13.223 9.175 -11.904 1.00 0.00 O ATOM 1330 OE2 GLU A 98 11.648 10.597 -11.530 1.00 0.00 O ATOM 0 H GLU A 98 14.946 6.963 -8.390 1.00 0.00 H new ATOM 0 HA GLU A 98 14.807 9.829 -7.481 1.00 0.00 H new ATOM 0 HB2 GLU A 98 15.124 9.302 -9.890 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.839 8.111 -9.842 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.315 10.115 -9.050 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.601 11.139 -9.655 1.00 0.00 H new ATOM 1337 N PRO A 99 12.438 9.901 -6.776 1.00 0.00 N ATOM 1338 CA PRO A 99 11.117 9.885 -6.098 1.00 0.00 C ATOM 1339 C PRO A 99 10.014 9.539 -7.100 1.00 0.00 C ATOM 1340 O PRO A 99 9.928 10.115 -8.167 1.00 0.00 O ATOM 1341 CB PRO A 99 10.965 11.312 -5.576 1.00 0.00 C ATOM 1342 CG PRO A 99 11.843 12.136 -6.461 1.00 0.00 C ATOM 1343 CD PRO A 99 13.000 11.254 -6.853 1.00 0.00 C ATOM 0 HA PRO A 99 11.046 9.143 -5.303 1.00 0.00 H new ATOM 0 HB2 PRO A 99 9.928 11.644 -5.627 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.272 11.387 -4.533 1.00 0.00 H new ATOM 0 HG2 PRO A 99 11.298 12.475 -7.342 1.00 0.00 H new ATOM 0 HG3 PRO A 99 12.193 13.027 -5.940 1.00 0.00 H new ATOM 0 HD2 PRO A 99 13.358 11.484 -7.856 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.846 11.377 -6.177 1.00 0.00 H new ATOM 1351 N ARG A 100 9.175 8.596 -6.770 1.00 0.00 N ATOM 1352 CA ARG A 100 8.086 8.209 -7.711 1.00 0.00 C ATOM 1353 C ARG A 100 6.715 8.428 -7.068 1.00 0.00 C ATOM 1354 O ARG A 100 6.181 7.558 -6.406 1.00 0.00 O ATOM 1355 CB ARG A 100 8.315 6.723 -7.987 1.00 0.00 C ATOM 1356 CG ARG A 100 8.475 6.503 -9.492 1.00 0.00 C ATOM 1357 CD ARG A 100 7.891 5.141 -9.874 1.00 0.00 C ATOM 1358 NE ARG A 100 7.328 5.335 -11.239 1.00 0.00 N ATOM 1359 CZ ARG A 100 8.106 5.698 -12.221 1.00 0.00 C ATOM 1360 NH1 ARG A 100 9.198 5.028 -12.471 1.00 0.00 N ATOM 1361 NH2 ARG A 100 7.794 6.733 -12.953 1.00 0.00 N ATOM 0 H ARG A 100 9.196 8.078 -5.892 1.00 0.00 H new ATOM 0 HA ARG A 100 8.102 8.805 -8.623 1.00 0.00 H new ATOM 0 HB2 ARG A 100 9.205 6.377 -7.461 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.476 6.139 -7.610 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.967 7.295 -10.042 1.00 0.00 H new ATOM 0 HG3 ARG A 100 9.529 6.549 -9.767 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.658 4.367 -9.869 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.120 4.830 -9.169 1.00 0.00 H new ATOM 0 HE ARG A 100 6.333 5.184 -11.406 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.443 4.220 -11.898 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.806 5.312 -13.239 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.942 7.258 -12.757 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.403 7.017 -13.721 1.00 0.00 H new ATOM 1375 N GLN A 101 6.136 9.581 -7.265 1.00 0.00 N ATOM 1376 CA GLN A 101 4.795 9.851 -6.676 1.00 0.00 C ATOM 1377 C GLN A 101 3.727 9.073 -7.450 1.00 0.00 C ATOM 1378 O GLN A 101 3.929 8.694 -8.586 1.00 0.00 O ATOM 1379 CB GLN A 101 4.587 11.357 -6.839 1.00 0.00 C ATOM 1380 CG GLN A 101 5.531 12.108 -5.898 1.00 0.00 C ATOM 1381 CD GLN A 101 5.523 13.598 -6.247 1.00 0.00 C ATOM 1382 OE1 GLN A 101 6.561 14.227 -6.298 1.00 0.00 O ATOM 1383 NE2 GLN A 101 4.388 14.192 -6.493 1.00 0.00 N ATOM 0 H GLN A 101 6.534 10.347 -7.808 1.00 0.00 H new ATOM 0 HA GLN A 101 4.726 9.545 -5.632 1.00 0.00 H new ATOM 0 HB2 GLN A 101 4.776 11.651 -7.871 1.00 0.00 H new ATOM 0 HB3 GLN A 101 3.552 11.618 -6.617 1.00 0.00 H new ATOM 0 HG2 GLN A 101 5.220 11.965 -4.863 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.542 11.709 -5.985 1.00 0.00 H new ATOM 0 HE21 GLN A 101 3.516 13.664 -6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 101 4.372 15.184 -6.728 1.00 0.00 H new ATOM 1392 N VAL A 102 2.597 8.827 -6.848 1.00 0.00 N ATOM 1393 CA VAL A 102 1.531 8.067 -7.563 1.00 0.00 C ATOM 1394 C VAL A 102 0.185 8.786 -7.440 1.00 0.00 C ATOM 1395 O VAL A 102 -0.214 9.203 -6.371 1.00 0.00 O ATOM 1396 CB VAL A 102 1.480 6.708 -6.868 1.00 0.00 C ATOM 1397 CG1 VAL A 102 0.429 5.829 -7.546 1.00 0.00 C ATOM 1398 CG2 VAL A 102 2.850 6.034 -6.972 1.00 0.00 C ATOM 0 H VAL A 102 2.365 9.117 -5.898 1.00 0.00 H new ATOM 0 HA VAL A 102 1.739 7.973 -8.629 1.00 0.00 H new ATOM 0 HB VAL A 102 1.218 6.844 -5.819 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.392 4.859 -7.051 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.547 6.310 -7.477 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.692 5.691 -8.595 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.817 5.064 -6.477 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.109 5.897 -8.022 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.601 6.661 -6.492 1.00 0.00 H new ATOM 1408 N THR A 103 -0.516 8.930 -8.530 1.00 0.00 N ATOM 1409 CA THR A 103 -1.839 9.617 -8.487 1.00 0.00 C ATOM 1410 C THR A 103 -2.754 9.061 -9.582 1.00 0.00 C ATOM 1411 O THR A 103 -2.804 9.575 -10.681 1.00 0.00 O ATOM 1412 CB THR A 103 -1.534 11.095 -8.743 1.00 0.00 C ATOM 1413 OG1 THR A 103 -0.176 11.241 -9.139 1.00 0.00 O ATOM 1414 CG2 THR A 103 -1.783 11.898 -7.465 1.00 0.00 C ATOM 0 H THR A 103 -0.230 8.601 -9.452 1.00 0.00 H new ATOM 0 HA THR A 103 -2.350 9.469 -7.535 1.00 0.00 H new ATOM 0 HB THR A 103 -2.183 11.465 -9.536 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.017 12.188 -9.304 1.00 0.00 H new ATOM 0 HG21 THR A 103 -1.566 12.950 -7.648 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.825 11.790 -7.165 1.00 0.00 H new ATOM 0 HG23 THR A 103 -1.136 11.527 -6.670 1.00 0.00 H new ATOM 1422 N GLU A 104 -3.474 8.012 -9.293 1.00 0.00 N ATOM 1423 CA GLU A 104 -4.380 7.425 -10.323 1.00 0.00 C ATOM 1424 C GLU A 104 -5.807 7.318 -9.779 1.00 0.00 C ATOM 1425 O GLU A 104 -6.097 7.745 -8.680 1.00 0.00 O ATOM 1426 CB GLU A 104 -3.808 6.035 -10.606 1.00 0.00 C ATOM 1427 CG GLU A 104 -2.464 6.172 -11.324 1.00 0.00 C ATOM 1428 CD GLU A 104 -1.754 4.817 -11.342 1.00 0.00 C ATOM 1429 OE1 GLU A 104 -2.442 3.811 -11.413 1.00 0.00 O ATOM 1430 OE2 GLU A 104 -0.536 4.808 -11.284 1.00 0.00 O ATOM 0 H GLU A 104 -3.475 7.536 -8.391 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.431 8.037 -11.223 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.679 5.486 -9.673 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -4.503 5.462 -11.220 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.619 6.527 -12.343 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.844 6.913 -10.819 1.00 0.00 H new ATOM 1437 N THR A 105 -6.700 6.749 -10.543 1.00 0.00 N ATOM 1438 CA THR A 105 -8.108 6.614 -10.071 1.00 0.00 C ATOM 1439 C THR A 105 -8.637 5.211 -10.380 1.00 0.00 C ATOM 1440 O THR A 105 -8.043 4.464 -11.132 1.00 0.00 O ATOM 1441 CB THR A 105 -8.892 7.668 -10.856 1.00 0.00 C ATOM 1442 OG1 THR A 105 -10.284 7.457 -10.667 1.00 0.00 O ATOM 1443 CG2 THR A 105 -8.553 7.557 -12.343 1.00 0.00 C ATOM 0 H THR A 105 -6.516 6.372 -11.473 1.00 0.00 H new ATOM 0 HA THR A 105 -8.198 6.757 -8.994 1.00 0.00 H new ATOM 0 HB THR A 105 -8.623 8.662 -10.499 1.00 0.00 H new ATOM 0 HG1 THR A 105 -10.470 7.340 -9.712 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.112 8.308 -12.901 1.00 0.00 H new ATOM 0 HG22 THR A 105 -7.485 7.720 -12.486 1.00 0.00 H new ATOM 0 HG23 THR A 105 -8.820 6.564 -12.704 1.00 0.00 H new ATOM 1451 N PHE A 106 -9.750 4.847 -9.805 1.00 0.00 N ATOM 1452 CA PHE A 106 -10.317 3.492 -10.065 1.00 0.00 C ATOM 1453 C PHE A 106 -11.682 3.351 -9.386 1.00 0.00 C ATOM 1454 O PHE A 106 -11.957 3.988 -8.389 1.00 0.00 O ATOM 1455 CB PHE A 106 -9.309 2.516 -9.455 1.00 0.00 C ATOM 1456 CG PHE A 106 -9.422 2.545 -7.948 1.00 0.00 C ATOM 1457 CD1 PHE A 106 -8.699 3.490 -7.209 1.00 0.00 C ATOM 1458 CD2 PHE A 106 -10.249 1.626 -7.290 1.00 0.00 C ATOM 1459 CE1 PHE A 106 -8.803 3.516 -5.814 1.00 0.00 C ATOM 1460 CE2 PHE A 106 -10.352 1.652 -5.894 1.00 0.00 C ATOM 1461 CZ PHE A 106 -9.630 2.597 -5.156 1.00 0.00 C ATOM 0 H PHE A 106 -10.292 5.429 -9.166 1.00 0.00 H new ATOM 0 HA PHE A 106 -10.471 3.306 -11.128 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -9.495 1.507 -9.824 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.297 2.785 -9.759 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -8.061 4.199 -7.716 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -10.807 0.897 -7.859 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.245 4.245 -5.245 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -10.989 0.943 -5.386 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.711 2.618 -4.079 1.00 0.00 H new ATOM 1471 N THR A 107 -12.536 2.518 -9.912 1.00 0.00 N ATOM 1472 CA THR A 107 -13.877 2.338 -9.286 1.00 0.00 C ATOM 1473 C THR A 107 -13.820 1.224 -8.241 1.00 0.00 C ATOM 1474 O THR A 107 -13.956 0.059 -8.556 1.00 0.00 O ATOM 1475 CB THR A 107 -14.807 1.946 -10.436 1.00 0.00 C ATOM 1476 OG1 THR A 107 -15.101 3.095 -11.219 1.00 0.00 O ATOM 1477 CG2 THR A 107 -16.105 1.365 -9.870 1.00 0.00 C ATOM 0 H THR A 107 -12.365 1.955 -10.745 1.00 0.00 H new ATOM 0 HA THR A 107 -14.220 3.239 -8.777 1.00 0.00 H new ATOM 0 HB THR A 107 -14.318 1.197 -11.059 1.00 0.00 H new ATOM 0 HG1 THR A 107 -15.695 2.845 -11.957 1.00 0.00 H new ATOM 0 HG21 THR A 107 -16.767 1.086 -10.690 1.00 0.00 H new ATOM 0 HG22 THR A 107 -15.878 0.483 -9.271 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.596 2.111 -9.245 1.00 0.00 H new ATOM 1485 N ALA A 108 -13.620 1.572 -6.998 1.00 0.00 N ATOM 1486 CA ALA A 108 -13.555 0.528 -5.936 1.00 0.00 C ATOM 1487 C ALA A 108 -14.768 -0.396 -6.036 1.00 0.00 C ATOM 1488 O ALA A 108 -15.789 -0.157 -5.428 1.00 0.00 O ATOM 1489 CB ALA A 108 -13.583 1.300 -4.617 1.00 0.00 C ATOM 0 H ALA A 108 -13.499 2.531 -6.673 1.00 0.00 H new ATOM 0 HA ALA A 108 -12.666 -0.096 -6.024 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -13.538 0.599 -3.784 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -12.727 1.973 -4.571 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.504 1.880 -4.554 1.00 0.00 H new ATOM 1495 N SER A 109 -14.665 -1.449 -6.799 1.00 0.00 N ATOM 1496 CA SER A 109 -15.817 -2.384 -6.933 1.00 0.00 C ATOM 1497 C SER A 109 -15.793 -3.409 -5.799 1.00 0.00 C ATOM 1498 O SER A 109 -15.828 -4.602 -6.026 1.00 0.00 O ATOM 1499 CB SER A 109 -15.613 -3.072 -8.282 1.00 0.00 C ATOM 1500 OG SER A 109 -14.260 -3.490 -8.396 1.00 0.00 O ATOM 0 H SER A 109 -13.835 -1.702 -7.335 1.00 0.00 H new ATOM 0 HA SER A 109 -16.777 -1.871 -6.880 1.00 0.00 H new ATOM 0 HB2 SER A 109 -16.279 -3.930 -8.370 1.00 0.00 H new ATOM 0 HB3 SER A 109 -15.864 -2.389 -9.093 1.00 0.00 H new ATOM 0 HG SER A 109 -14.126 -3.933 -9.260 1.00 0.00 H new ATOM 1506 N ALA A 110 -15.729 -2.955 -4.576 1.00 0.00 N ATOM 1507 CA ALA A 110 -15.699 -3.911 -3.433 1.00 0.00 C ATOM 1508 C ALA A 110 -16.170 -3.223 -2.150 1.00 0.00 C ATOM 1509 O ALA A 110 -16.780 -2.173 -2.183 1.00 0.00 O ATOM 1510 CB ALA A 110 -14.235 -4.332 -3.309 1.00 0.00 C ATOM 0 H ALA A 110 -15.696 -1.968 -4.320 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.358 -4.764 -3.593 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -14.128 -5.039 -2.486 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -13.912 -4.804 -4.237 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -13.619 -3.454 -3.115 1.00 0.00 H new ATOM 1516 N THR A 111 -15.891 -3.809 -1.018 1.00 0.00 N ATOM 1517 CA THR A 111 -16.323 -3.191 0.268 1.00 0.00 C ATOM 1518 C THR A 111 -15.188 -3.252 1.294 1.00 0.00 C ATOM 1519 O THR A 111 -14.831 -4.308 1.779 1.00 0.00 O ATOM 1520 CB THR A 111 -17.513 -4.032 0.733 1.00 0.00 C ATOM 1521 OG1 THR A 111 -18.546 -3.966 -0.240 1.00 0.00 O ATOM 1522 CG2 THR A 111 -18.030 -3.493 2.067 1.00 0.00 C ATOM 0 H THR A 111 -15.383 -4.689 -0.928 1.00 0.00 H new ATOM 0 HA THR A 111 -16.588 -2.140 0.151 1.00 0.00 H new ATOM 0 HB THR A 111 -17.199 -5.068 0.860 1.00 0.00 H new ATOM 0 HG1 THR A 111 -19.309 -4.506 0.056 1.00 0.00 H new ATOM 0 HG21 THR A 111 -18.878 -4.093 2.398 1.00 0.00 H new ATOM 0 HG22 THR A 111 -17.236 -3.545 2.812 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.345 -2.457 1.943 1.00 0.00 H new ATOM 1530 N TYR A 112 -14.621 -2.126 1.628 1.00 0.00 N ATOM 1531 CA TYR A 112 -13.510 -2.108 2.624 1.00 0.00 C ATOM 1532 C TYR A 112 -13.991 -1.477 3.937 1.00 0.00 C ATOM 1533 O TYR A 112 -13.594 -0.379 4.274 1.00 0.00 O ATOM 1534 CB TYR A 112 -12.420 -1.235 1.996 1.00 0.00 C ATOM 1535 CG TYR A 112 -11.872 -1.880 0.739 1.00 0.00 C ATOM 1536 CD1 TYR A 112 -12.251 -3.181 0.376 1.00 0.00 C ATOM 1537 CD2 TYR A 112 -10.984 -1.162 -0.073 1.00 0.00 C ATOM 1538 CE1 TYR A 112 -11.746 -3.756 -0.800 1.00 0.00 C ATOM 1539 CE2 TYR A 112 -10.478 -1.739 -1.243 1.00 0.00 C ATOM 1540 CZ TYR A 112 -10.860 -3.032 -1.607 1.00 0.00 C ATOM 1541 OH TYR A 112 -10.371 -3.587 -2.770 1.00 0.00 O ATOM 0 H TYR A 112 -14.880 -1.213 1.253 1.00 0.00 H new ATOM 0 HA TYR A 112 -13.152 -3.111 2.854 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -12.827 -0.252 1.758 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -11.613 -1.081 2.713 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -12.931 -3.740 1.002 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -10.689 -0.161 0.205 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -12.040 -4.756 -1.082 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.791 -1.184 -1.865 1.00 0.00 H new ATOM 0 HH TYR A 112 -10.898 -4.380 -3.001 1.00 0.00 H new ATOM 1551 N PRO A 113 -14.832 -2.190 4.634 1.00 0.00 N ATOM 1552 CA PRO A 113 -15.372 -1.687 5.922 1.00 0.00 C ATOM 1553 C PRO A 113 -14.283 -1.700 6.999 1.00 0.00 C ATOM 1554 O PRO A 113 -13.728 -2.732 7.320 1.00 0.00 O ATOM 1555 CB PRO A 113 -16.481 -2.679 6.258 1.00 0.00 C ATOM 1556 CG PRO A 113 -16.102 -3.934 5.540 1.00 0.00 C ATOM 1557 CD PRO A 113 -15.356 -3.518 4.298 1.00 0.00 C ATOM 0 HA PRO A 113 -15.730 -0.659 5.865 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -16.551 -2.844 7.333 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -17.453 -2.312 5.928 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.479 -4.567 6.171 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -16.988 -4.514 5.282 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.554 -4.216 4.060 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -16.014 -3.481 3.430 1.00 0.00 H new ATOM 1565 N ALA A 114 -13.975 -0.563 7.559 1.00 0.00 N ATOM 1566 CA ALA A 114 -12.922 -0.512 8.614 1.00 0.00 C ATOM 1567 C ALA A 114 -13.386 -1.269 9.862 1.00 0.00 C ATOM 1568 O ALA A 114 -12.629 -1.478 10.790 1.00 0.00 O ATOM 1569 CB ALA A 114 -12.744 0.974 8.924 1.00 0.00 C ATOM 0 H ALA A 114 -14.406 0.333 7.332 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.990 -0.975 8.290 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -11.983 1.096 9.694 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -12.434 1.500 8.021 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -13.688 1.387 9.278 1.00 0.00 H new ATOM 1661 N GLU A 122 -12.862 -6.348 5.786 1.00 0.00 N ATOM 1662 CA GLU A 122 -12.580 -4.887 5.654 1.00 0.00 C ATOM 1663 C GLU A 122 -11.814 -4.615 4.356 1.00 0.00 C ATOM 1664 O GLU A 122 -12.055 -5.241 3.344 1.00 0.00 O ATOM 1665 CB GLU A 122 -11.734 -4.529 6.883 1.00 0.00 C ATOM 1666 CG GLU A 122 -10.277 -4.950 6.664 1.00 0.00 C ATOM 1667 CD GLU A 122 -9.810 -5.805 7.843 1.00 0.00 C ATOM 1668 OE1 GLU A 122 -10.334 -5.620 8.928 1.00 0.00 O ATOM 1669 OE2 GLU A 122 -8.935 -6.631 7.640 1.00 0.00 O ATOM 0 HA GLU A 122 -13.490 -4.289 5.610 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -11.786 -3.456 7.069 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -12.135 -5.026 7.767 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.186 -5.512 5.735 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.643 -4.068 6.567 1.00 0.00 H new ATOM 1676 N GLY A 123 -10.894 -3.688 4.375 1.00 0.00 N ATOM 1677 CA GLY A 123 -10.116 -3.385 3.140 1.00 0.00 C ATOM 1678 C GLY A 123 -8.718 -2.900 3.521 1.00 0.00 C ATOM 1679 O GLY A 123 -8.527 -2.263 4.538 1.00 0.00 O ATOM 0 H GLY A 123 -10.648 -3.128 5.192 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.045 -4.275 2.515 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.629 -2.623 2.553 1.00 0.00 H new ATOM 1683 N GLN A 124 -7.738 -3.199 2.714 1.00 0.00 N ATOM 1684 CA GLN A 124 -6.351 -2.758 3.033 1.00 0.00 C ATOM 1685 C GLN A 124 -5.551 -2.538 1.746 1.00 0.00 C ATOM 1686 O GLN A 124 -6.103 -2.420 0.669 1.00 0.00 O ATOM 1687 CB GLN A 124 -5.751 -3.909 3.840 1.00 0.00 C ATOM 1688 CG GLN A 124 -5.664 -5.159 2.962 1.00 0.00 C ATOM 1689 CD GLN A 124 -4.352 -5.892 3.245 1.00 0.00 C ATOM 1690 OE1 GLN A 124 -3.518 -5.406 3.983 1.00 0.00 O ATOM 1691 NE2 GLN A 124 -4.133 -7.051 2.687 1.00 0.00 N ATOM 0 H GLN A 124 -7.837 -3.729 1.848 1.00 0.00 H new ATOM 0 HA GLN A 124 -6.334 -1.816 3.581 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -4.759 -3.636 4.201 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -6.365 -4.110 4.718 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.510 -5.816 3.162 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -5.718 -4.881 1.909 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -4.833 -7.459 2.067 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.262 -7.549 2.870 1.00 0.00 H new ATOM 1700 N ILE A 125 -4.252 -2.494 1.854 1.00 0.00 N ATOM 1701 CA ILE A 125 -3.403 -2.293 0.646 1.00 0.00 C ATOM 1702 C ILE A 125 -2.483 -3.501 0.469 1.00 0.00 C ATOM 1703 O ILE A 125 -2.019 -4.084 1.430 1.00 0.00 O ATOM 1704 CB ILE A 125 -2.589 -1.030 0.935 1.00 0.00 C ATOM 1705 CG1 ILE A 125 -3.462 0.203 0.687 1.00 0.00 C ATOM 1706 CG2 ILE A 125 -1.365 -0.980 0.016 1.00 0.00 C ATOM 1707 CD1 ILE A 125 -2.638 1.470 0.924 1.00 0.00 C ATOM 0 H ILE A 125 -3.740 -2.589 2.731 1.00 0.00 H new ATOM 0 HA ILE A 125 -3.987 -2.190 -0.269 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.258 -1.044 1.973 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.844 0.191 -0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.326 0.189 1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -0.789 -0.079 0.226 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -0.743 -1.858 0.191 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -1.691 -0.968 -1.024 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -3.260 2.347 0.747 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.277 1.482 1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.788 1.484 0.241 1.00 0.00 H new ATOM 1719 N ALA A 126 -2.226 -3.893 -0.746 1.00 0.00 N ATOM 1720 CA ALA A 126 -1.350 -5.075 -0.966 1.00 0.00 C ATOM 1721 C ALA A 126 -0.077 -4.683 -1.719 1.00 0.00 C ATOM 1722 O ALA A 126 -0.120 -4.258 -2.856 1.00 0.00 O ATOM 1723 CB ALA A 126 -2.191 -6.036 -1.806 1.00 0.00 C ATOM 0 H ALA A 126 -2.582 -3.449 -1.592 1.00 0.00 H new ATOM 0 HA ALA A 126 -1.027 -5.519 -0.025 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -1.615 -6.938 -2.013 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -3.096 -6.301 -1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -2.463 -5.555 -2.746 1.00 0.00 H new ATOM 1729 N PHE A 127 1.057 -4.856 -1.096 1.00 0.00 N ATOM 1730 CA PHE A 127 2.351 -4.529 -1.764 1.00 0.00 C ATOM 1731 C PHE A 127 3.157 -5.822 -1.895 1.00 0.00 C ATOM 1732 O PHE A 127 3.718 -6.315 -0.938 1.00 0.00 O ATOM 1733 CB PHE A 127 3.074 -3.551 -0.825 1.00 0.00 C ATOM 1734 CG PHE A 127 2.731 -2.118 -1.173 1.00 0.00 C ATOM 1735 CD1 PHE A 127 1.553 -1.819 -1.864 1.00 0.00 C ATOM 1736 CD2 PHE A 127 3.603 -1.085 -0.801 1.00 0.00 C ATOM 1737 CE1 PHE A 127 1.244 -0.492 -2.185 1.00 0.00 C ATOM 1738 CE2 PHE A 127 3.294 0.242 -1.122 1.00 0.00 C ATOM 1739 CZ PHE A 127 2.115 0.538 -1.815 1.00 0.00 C ATOM 0 H PHE A 127 1.144 -5.213 -0.144 1.00 0.00 H new ATOM 0 HA PHE A 127 2.218 -4.093 -2.754 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.793 -3.756 0.208 1.00 0.00 H new ATOM 0 HB3 PHE A 127 4.151 -3.700 -0.897 1.00 0.00 H new ATOM 0 HD1 PHE A 127 0.880 -2.614 -2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.513 -1.313 -0.267 1.00 0.00 H new ATOM 0 HE1 PHE A 127 0.333 -0.263 -2.718 1.00 0.00 H new ATOM 0 HE2 PHE A 127 3.966 1.037 -0.835 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.878 1.562 -2.064 1.00 0.00 H new ATOM 1749 N GLN A 128 3.193 -6.394 -3.064 1.00 0.00 N ATOM 1750 CA GLN A 128 3.933 -7.674 -3.237 1.00 0.00 C ATOM 1751 C GLN A 128 5.397 -7.420 -3.596 1.00 0.00 C ATOM 1752 O GLN A 128 5.721 -7.025 -4.698 1.00 0.00 O ATOM 1753 CB GLN A 128 3.217 -8.389 -4.383 1.00 0.00 C ATOM 1754 CG GLN A 128 2.020 -9.165 -3.831 1.00 0.00 C ATOM 1755 CD GLN A 128 1.880 -10.491 -4.579 1.00 0.00 C ATOM 1756 OE1 GLN A 128 1.703 -10.508 -5.781 1.00 0.00 O ATOM 1757 NE2 GLN A 128 1.952 -11.612 -3.915 1.00 0.00 N ATOM 0 H GLN A 128 2.744 -6.033 -3.905 1.00 0.00 H new ATOM 0 HA GLN A 128 3.941 -8.264 -2.320 1.00 0.00 H new ATOM 0 HB2 GLN A 128 2.883 -7.664 -5.126 1.00 0.00 H new ATOM 0 HB3 GLN A 128 3.904 -9.069 -4.887 1.00 0.00 H new ATOM 0 HG2 GLN A 128 2.153 -9.349 -2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 128 1.110 -8.576 -3.941 1.00 0.00 H new ATOM 0 HE21 GLN A 128 2.101 -11.598 -2.906 1.00 0.00 H new ATOM 0 HE22 GLN A 128 1.860 -12.502 -4.405 1.00 0.00 H new ATOM 1766 N LEU A 129 6.284 -7.665 -2.672 1.00 0.00 N ATOM 1767 CA LEU A 129 7.733 -7.467 -2.949 1.00 0.00 C ATOM 1768 C LEU A 129 8.404 -8.836 -3.103 1.00 0.00 C ATOM 1769 O LEU A 129 9.473 -9.084 -2.580 1.00 0.00 O ATOM 1770 CB LEU A 129 8.280 -6.723 -1.728 1.00 0.00 C ATOM 1771 CG LEU A 129 7.444 -5.467 -1.472 1.00 0.00 C ATOM 1772 CD1 LEU A 129 8.175 -4.565 -0.475 1.00 0.00 C ATOM 1773 CD2 LEU A 129 7.240 -4.710 -2.786 1.00 0.00 C ATOM 0 H LEU A 129 6.066 -7.996 -1.732 1.00 0.00 H new ATOM 0 HA LEU A 129 7.918 -6.906 -3.865 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.255 -7.373 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.322 -6.450 -1.893 1.00 0.00 H new ATOM 0 HG LEU A 129 6.475 -5.754 -1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.581 -3.670 -0.291 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.321 -5.102 0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.144 -4.280 -0.885 1.00 0.00 H new ATOM 0 HD21 LEU A 129 6.644 -3.816 -2.602 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.209 -4.423 -3.195 1.00 0.00 H new ATOM 0 HD23 LEU A 129 6.721 -5.351 -3.499 1.00 0.00 H new ATOM 1785 N GLY A 130 7.771 -9.731 -3.812 1.00 0.00 N ATOM 1786 CA GLY A 130 8.353 -11.091 -4.000 1.00 0.00 C ATOM 1787 C GLY A 130 9.203 -11.122 -5.270 1.00 0.00 C ATOM 1788 O GLY A 130 8.710 -10.941 -6.366 1.00 0.00 O ATOM 0 H GLY A 130 6.873 -9.578 -4.271 1.00 0.00 H new ATOM 0 HA2 GLY A 130 8.963 -11.357 -3.137 1.00 0.00 H new ATOM 0 HA3 GLY A 130 7.556 -11.831 -4.067 1.00 0.00 H new ATOM 1792 N GLY A 131 10.480 -11.355 -5.128 1.00 0.00 N ATOM 1793 CA GLY A 131 11.373 -11.405 -6.321 1.00 0.00 C ATOM 1794 C GLY A 131 11.010 -10.277 -7.291 1.00 0.00 C ATOM 1795 O GLY A 131 10.186 -10.444 -8.168 1.00 0.00 O ATOM 0 H GLY A 131 10.945 -11.513 -4.234 1.00 0.00 H new ATOM 0 HA2 GLY A 131 12.414 -11.309 -6.011 1.00 0.00 H new ATOM 0 HA3 GLY A 131 11.276 -12.370 -6.819 1.00 0.00 H new ATOM 1799 N PHE A 132 11.618 -9.130 -7.144 1.00 0.00 N ATOM 1800 CA PHE A 132 11.304 -7.998 -8.065 1.00 0.00 C ATOM 1801 C PHE A 132 12.583 -7.237 -8.436 1.00 0.00 C ATOM 1802 O PHE A 132 12.903 -7.084 -9.598 1.00 0.00 O ATOM 1803 CB PHE A 132 10.338 -7.104 -7.285 1.00 0.00 C ATOM 1804 CG PHE A 132 8.918 -7.543 -7.565 1.00 0.00 C ATOM 1805 CD1 PHE A 132 8.442 -7.568 -8.883 1.00 0.00 C ATOM 1806 CD2 PHE A 132 8.079 -7.926 -6.511 1.00 0.00 C ATOM 1807 CE1 PHE A 132 7.127 -7.975 -9.145 1.00 0.00 C ATOM 1808 CE2 PHE A 132 6.764 -8.333 -6.775 1.00 0.00 C ATOM 1809 CZ PHE A 132 6.290 -8.358 -8.091 1.00 0.00 C ATOM 0 H PHE A 132 12.316 -8.928 -6.429 1.00 0.00 H new ATOM 0 HA PHE A 132 10.866 -8.339 -9.003 1.00 0.00 H new ATOM 0 HB2 PHE A 132 10.547 -7.167 -6.217 1.00 0.00 H new ATOM 0 HB3 PHE A 132 10.473 -6.062 -7.575 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.089 -7.274 -9.696 1.00 0.00 H new ATOM 0 HD2 PHE A 132 8.445 -7.908 -5.495 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.759 -7.993 -10.160 1.00 0.00 H new ATOM 0 HE2 PHE A 132 6.117 -8.627 -5.962 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.277 -8.673 -8.294 1.00 0.00 H new ATOM 1819 N SER A 133 13.321 -6.761 -7.467 1.00 0.00 N ATOM 1820 CA SER A 133 14.577 -6.020 -7.792 1.00 0.00 C ATOM 1821 C SER A 133 15.757 -6.992 -7.890 1.00 0.00 C ATOM 1822 O SER A 133 15.596 -8.190 -7.771 1.00 0.00 O ATOM 1823 CB SER A 133 14.780 -5.047 -6.631 1.00 0.00 C ATOM 1824 OG SER A 133 16.171 -4.831 -6.436 1.00 0.00 O ATOM 0 H SER A 133 13.111 -6.852 -6.473 1.00 0.00 H new ATOM 0 HA SER A 133 14.512 -5.502 -8.749 1.00 0.00 H new ATOM 0 HB2 SER A 133 14.280 -4.102 -6.842 1.00 0.00 H new ATOM 0 HB3 SER A 133 14.332 -5.449 -5.722 1.00 0.00 H new ATOM 0 HG SER A 133 16.445 -5.219 -5.579 1.00 0.00 H new ATOM 1830 N ALA A 134 16.940 -6.487 -8.115 1.00 0.00 N ATOM 1831 CA ALA A 134 18.126 -7.385 -8.228 1.00 0.00 C ATOM 1832 C ALA A 134 18.915 -7.395 -6.915 1.00 0.00 C ATOM 1833 O ALA A 134 18.863 -8.342 -6.157 1.00 0.00 O ATOM 1834 CB ALA A 134 18.969 -6.787 -9.354 1.00 0.00 C ATOM 0 H ALA A 134 17.137 -5.492 -8.225 1.00 0.00 H new ATOM 0 HA ALA A 134 17.842 -8.417 -8.433 1.00 0.00 H new ATOM 0 HB1 ALA A 134 19.863 -7.393 -9.500 1.00 0.00 H new ATOM 0 HB2 ALA A 134 18.387 -6.772 -10.275 1.00 0.00 H new ATOM 0 HB3 ALA A 134 19.259 -5.770 -9.091 1.00 0.00 H new ATOM 1840 N ASP A 135 19.649 -6.350 -6.643 1.00 0.00 N ATOM 1841 CA ASP A 135 20.442 -6.303 -5.380 1.00 0.00 C ATOM 1842 C ASP A 135 19.559 -5.838 -4.220 1.00 0.00 C ATOM 1843 O ASP A 135 18.584 -5.141 -4.412 1.00 0.00 O ATOM 1844 CB ASP A 135 21.555 -5.290 -5.649 1.00 0.00 C ATOM 1845 CG ASP A 135 22.632 -5.935 -6.522 1.00 0.00 C ATOM 1846 OD1 ASP A 135 22.533 -7.125 -6.769 1.00 0.00 O ATOM 1847 OD2 ASP A 135 23.539 -5.227 -6.930 1.00 0.00 O ATOM 0 H ASP A 135 19.734 -5.527 -7.240 1.00 0.00 H new ATOM 0 HA ASP A 135 20.839 -7.280 -5.104 1.00 0.00 H new ATOM 0 HB2 ASP A 135 21.148 -4.410 -6.146 1.00 0.00 H new ATOM 0 HB3 ASP A 135 21.989 -4.952 -4.708 1.00 0.00 H new ATOM 1852 N ALA A 136 19.893 -6.223 -3.018 1.00 0.00 N ATOM 1853 CA ALA A 136 19.074 -5.811 -1.840 1.00 0.00 C ATOM 1854 C ALA A 136 18.642 -4.348 -1.974 1.00 0.00 C ATOM 1855 O ALA A 136 19.387 -3.511 -2.444 1.00 0.00 O ATOM 1856 CB ALA A 136 19.997 -5.988 -0.635 1.00 0.00 C ATOM 0 H ALA A 136 20.700 -6.807 -2.800 1.00 0.00 H new ATOM 0 HA ALA A 136 18.162 -6.401 -1.748 1.00 0.00 H new ATOM 0 HB1 ALA A 136 19.467 -5.705 0.274 1.00 0.00 H new ATOM 0 HB2 ALA A 136 20.307 -7.031 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 136 20.876 -5.355 -0.754 1.00 0.00 H new ATOM 1862 N TRP A 137 17.443 -4.034 -1.562 1.00 0.00 N ATOM 1863 CA TRP A 137 16.968 -2.625 -1.665 1.00 0.00 C ATOM 1864 C TRP A 137 15.910 -2.335 -0.605 1.00 0.00 C ATOM 1865 O TRP A 137 15.823 -3.009 0.401 1.00 0.00 O ATOM 1866 CB TRP A 137 16.395 -2.496 -3.077 1.00 0.00 C ATOM 1867 CG TRP A 137 15.065 -3.178 -3.172 1.00 0.00 C ATOM 1868 CD1 TRP A 137 13.869 -2.572 -2.992 1.00 0.00 C ATOM 1869 CD2 TRP A 137 14.771 -4.573 -3.485 1.00 0.00 C ATOM 1870 NE1 TRP A 137 12.864 -3.506 -3.177 1.00 0.00 N ATOM 1871 CE2 TRP A 137 13.368 -4.747 -3.480 1.00 0.00 C ATOM 1872 CE3 TRP A 137 15.573 -5.693 -3.769 1.00 0.00 C ATOM 1873 CZ2 TRP A 137 12.780 -5.981 -3.749 1.00 0.00 C ATOM 1874 CZ3 TRP A 137 14.982 -6.939 -4.040 1.00 0.00 C ATOM 1875 CH2 TRP A 137 13.588 -7.079 -4.029 1.00 0.00 C ATOM 0 H TRP A 137 16.774 -4.691 -1.160 1.00 0.00 H new ATOM 0 HA TRP A 137 17.770 -1.907 -1.494 1.00 0.00 H new ATOM 0 HB2 TRP A 137 16.289 -1.443 -3.337 1.00 0.00 H new ATOM 0 HB3 TRP A 137 17.086 -2.934 -3.797 1.00 0.00 H new ATOM 0 HD1 TRP A 137 13.722 -1.531 -2.745 1.00 0.00 H new ATOM 0 HE1 TRP A 137 11.869 -3.297 -3.098 1.00 0.00 H new ATOM 0 HE3 TRP A 137 16.649 -5.595 -3.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 11.705 -6.085 -3.740 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 15.606 -7.793 -4.258 1.00 0.00 H new ATOM 0 HH2 TRP A 137 13.140 -8.039 -4.238 1.00 0.00 H new ATOM 1886 N THR A 138 15.126 -1.317 -0.808 1.00 0.00 N ATOM 1887 CA THR A 138 14.098 -0.960 0.204 1.00 0.00 C ATOM 1888 C THR A 138 13.012 -0.090 -0.448 1.00 0.00 C ATOM 1889 O THR A 138 13.106 0.263 -1.606 1.00 0.00 O ATOM 1890 CB THR A 138 14.910 -0.195 1.263 1.00 0.00 C ATOM 1891 OG1 THR A 138 15.095 -1.028 2.399 1.00 0.00 O ATOM 1892 CG2 THR A 138 14.196 1.093 1.690 1.00 0.00 C ATOM 0 H THR A 138 15.153 -0.716 -1.632 1.00 0.00 H new ATOM 0 HA THR A 138 13.568 -1.810 0.634 1.00 0.00 H new ATOM 0 HB THR A 138 15.872 0.077 0.829 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.261 -1.072 2.911 1.00 0.00 H new ATOM 0 HG21 THR A 138 14.796 1.610 2.439 1.00 0.00 H new ATOM 0 HG22 THR A 138 14.062 1.739 0.823 1.00 0.00 H new ATOM 0 HG23 THR A 138 13.222 0.846 2.112 1.00 0.00 H new ATOM 1900 N LEU A 139 11.981 0.256 0.278 1.00 0.00 N ATOM 1901 CA LEU A 139 10.904 1.100 -0.331 1.00 0.00 C ATOM 1902 C LEU A 139 10.448 2.211 0.614 1.00 0.00 C ATOM 1903 O LEU A 139 9.903 1.955 1.665 1.00 0.00 O ATOM 1904 CB LEU A 139 9.742 0.151 -0.601 1.00 0.00 C ATOM 1905 CG LEU A 139 9.861 -0.407 -2.014 1.00 0.00 C ATOM 1906 CD1 LEU A 139 10.648 -1.717 -1.986 1.00 0.00 C ATOM 1907 CD2 LEU A 139 8.460 -0.650 -2.571 1.00 0.00 C ATOM 0 H LEU A 139 11.836 -0.004 1.254 1.00 0.00 H new ATOM 0 HA LEU A 139 11.268 1.589 -1.235 1.00 0.00 H new ATOM 0 HB2 LEU A 139 9.747 -0.662 0.124 1.00 0.00 H new ATOM 0 HB3 LEU A 139 8.794 0.677 -0.485 1.00 0.00 H new ATOM 0 HG LEU A 139 10.387 0.305 -2.650 1.00 0.00 H new ATOM 0 HD11 LEU A 139 10.731 -2.113 -2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 139 11.645 -1.534 -1.585 1.00 0.00 H new ATOM 0 HD13 LEU A 139 10.130 -2.439 -1.355 1.00 0.00 H new ATOM 0 HD21 LEU A 139 8.535 -1.050 -3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 139 7.935 -1.364 -1.937 1.00 0.00 H new ATOM 0 HD23 LEU A 139 7.909 0.290 -2.592 1.00 0.00 H new ATOM 1919 N CYS A 140 10.637 3.442 0.222 1.00 0.00 N ATOM 1920 CA CYS A 140 10.193 4.589 1.074 1.00 0.00 C ATOM 1921 C CYS A 140 8.933 5.245 0.505 1.00 0.00 C ATOM 1922 O CYS A 140 8.970 5.896 -0.520 1.00 0.00 O ATOM 1923 CB CYS A 140 11.349 5.594 1.061 1.00 0.00 C ATOM 1924 SG CYS A 140 12.239 5.538 2.638 1.00 0.00 S ATOM 0 H CYS A 140 11.082 3.707 -0.657 1.00 0.00 H new ATOM 0 HA CYS A 140 9.951 4.251 2.082 1.00 0.00 H new ATOM 0 HB2 CYS A 140 12.030 5.366 0.241 1.00 0.00 H new ATOM 0 HB3 CYS A 140 10.966 6.599 0.886 1.00 0.00 H new ATOM 1929 N LEU A 141 7.824 5.105 1.178 1.00 0.00 N ATOM 1930 CA LEU A 141 6.574 5.751 0.688 1.00 0.00 C ATOM 1931 C LEU A 141 6.328 7.032 1.485 1.00 0.00 C ATOM 1932 O LEU A 141 7.095 7.378 2.359 1.00 0.00 O ATOM 1933 CB LEU A 141 5.457 4.738 0.939 1.00 0.00 C ATOM 1934 CG LEU A 141 5.760 3.443 0.187 1.00 0.00 C ATOM 1935 CD1 LEU A 141 5.588 2.260 1.136 1.00 0.00 C ATOM 1936 CD2 LEU A 141 4.794 3.293 -0.992 1.00 0.00 C ATOM 0 H LEU A 141 7.729 4.573 2.043 1.00 0.00 H new ATOM 0 HA LEU A 141 6.629 6.020 -0.367 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.367 4.538 2.007 1.00 0.00 H new ATOM 0 HB3 LEU A 141 4.501 5.146 0.610 1.00 0.00 H new ATOM 0 HG LEU A 141 6.783 3.471 -0.187 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.803 1.333 0.605 1.00 0.00 H new ATOM 0 HD12 LEU A 141 6.275 2.364 1.976 1.00 0.00 H new ATOM 0 HD13 LEU A 141 4.563 2.237 1.506 1.00 0.00 H new ATOM 0 HD21 LEU A 141 5.013 2.368 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.769 3.264 -0.621 1.00 0.00 H new ATOM 0 HD23 LEU A 141 4.911 4.139 -1.669 1.00 0.00 H new ATOM 1948 N ASP A 142 5.269 7.733 1.197 1.00 0.00 N ATOM 1949 CA ASP A 142 4.975 8.998 1.947 1.00 0.00 C ATOM 1950 C ASP A 142 3.899 9.804 1.216 1.00 0.00 C ATOM 1951 O ASP A 142 4.143 10.893 0.734 1.00 0.00 O ATOM 1952 CB ASP A 142 6.292 9.784 1.979 1.00 0.00 C ATOM 1953 CG ASP A 142 7.018 9.640 0.639 1.00 0.00 C ATOM 1954 OD1 ASP A 142 6.655 10.346 -0.288 1.00 0.00 O ATOM 1955 OD2 ASP A 142 7.924 8.827 0.563 1.00 0.00 O ATOM 0 H ASP A 142 4.590 7.490 0.476 1.00 0.00 H new ATOM 0 HA ASP A 142 4.606 8.793 2.952 1.00 0.00 H new ATOM 0 HB2 ASP A 142 6.093 10.836 2.183 1.00 0.00 H new ATOM 0 HB3 ASP A 142 6.925 9.417 2.787 1.00 0.00 H new ATOM 1960 N ASP A 143 2.712 9.275 1.130 1.00 0.00 N ATOM 1961 CA ASP A 143 1.605 9.993 0.432 1.00 0.00 C ATOM 1962 C ASP A 143 0.462 9.014 0.177 1.00 0.00 C ATOM 1963 O ASP A 143 -0.118 8.982 -0.890 1.00 0.00 O ATOM 1964 CB ASP A 143 2.198 10.476 -0.895 1.00 0.00 C ATOM 1965 CG ASP A 143 2.206 12.006 -0.932 1.00 0.00 C ATOM 1966 OD1 ASP A 143 1.820 12.606 0.058 1.00 0.00 O ATOM 1967 OD2 ASP A 143 2.597 12.552 -1.950 1.00 0.00 O ATOM 0 H ASP A 143 2.456 8.366 1.517 1.00 0.00 H new ATOM 0 HA ASP A 143 1.213 10.826 1.016 1.00 0.00 H new ATOM 0 HB2 ASP A 143 3.213 10.095 -1.011 1.00 0.00 H new ATOM 0 HB3 ASP A 143 1.614 10.086 -1.728 1.00 0.00 H new ATOM 1972 N VAL A 144 0.150 8.202 1.147 1.00 0.00 N ATOM 1973 CA VAL A 144 -0.938 7.201 0.960 1.00 0.00 C ATOM 1974 C VAL A 144 -2.290 7.795 1.359 1.00 0.00 C ATOM 1975 O VAL A 144 -2.499 8.197 2.486 1.00 0.00 O ATOM 1976 CB VAL A 144 -0.579 6.022 1.876 1.00 0.00 C ATOM 1977 CG1 VAL A 144 -1.114 4.731 1.260 1.00 0.00 C ATOM 1978 CG2 VAL A 144 0.944 5.903 2.027 1.00 0.00 C ATOM 0 H VAL A 144 0.601 8.187 2.062 1.00 0.00 H new ATOM 0 HA VAL A 144 -1.023 6.891 -0.082 1.00 0.00 H new ATOM 0 HB VAL A 144 -1.023 6.191 2.857 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -0.863 3.889 1.905 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -2.197 4.799 1.157 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -0.664 4.583 0.278 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.180 5.062 2.679 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.395 5.741 1.048 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.339 6.821 2.461 1.00 0.00 H new ATOM 1988 N ALA A 145 -3.211 7.847 0.435 1.00 0.00 N ATOM 1989 CA ALA A 145 -4.557 8.407 0.744 1.00 0.00 C ATOM 1990 C ALA A 145 -5.584 7.869 -0.256 1.00 0.00 C ATOM 1991 O ALA A 145 -5.272 7.617 -1.403 1.00 0.00 O ATOM 1992 CB ALA A 145 -4.402 9.921 0.597 1.00 0.00 C ATOM 0 H ALA A 145 -3.088 7.524 -0.525 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.905 8.133 1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -5.354 10.407 0.809 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -3.648 10.279 1.298 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -4.093 10.158 -0.421 1.00 0.00 H new ATOM 1998 N LEU A 146 -6.804 7.685 0.170 1.00 0.00 N ATOM 1999 CA LEU A 146 -7.844 7.157 -0.760 1.00 0.00 C ATOM 2000 C LEU A 146 -9.200 7.803 -0.464 1.00 0.00 C ATOM 2001 O LEU A 146 -9.516 8.118 0.666 1.00 0.00 O ATOM 2002 CB LEU A 146 -7.891 5.654 -0.481 1.00 0.00 C ATOM 2003 CG LEU A 146 -9.042 5.023 -1.265 1.00 0.00 C ATOM 2004 CD1 LEU A 146 -8.723 5.060 -2.760 1.00 0.00 C ATOM 2005 CD2 LEU A 146 -9.225 3.570 -0.820 1.00 0.00 C ATOM 0 H LEU A 146 -7.125 7.877 1.119 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.615 7.373 -1.804 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -6.946 5.191 -0.766 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -8.024 5.476 0.586 1.00 0.00 H new ATOM 0 HG LEU A 146 -9.959 5.581 -1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -9.544 4.610 -3.318 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -8.591 6.094 -3.078 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -7.806 4.502 -2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -10.045 3.119 -1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -8.308 3.013 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -9.453 3.542 0.246 1.00 0.00 H new ATOM 2017 N ASP A 147 -10.005 8.004 -1.473 1.00 0.00 N ATOM 2018 CA ASP A 147 -11.341 8.630 -1.249 1.00 0.00 C ATOM 2019 C ASP A 147 -12.117 8.712 -2.567 1.00 0.00 C ATOM 2020 O ASP A 147 -11.541 8.794 -3.634 1.00 0.00 O ATOM 2021 CB ASP A 147 -11.037 10.031 -0.718 1.00 0.00 C ATOM 2022 CG ASP A 147 -12.268 10.580 0.006 1.00 0.00 C ATOM 2023 OD1 ASP A 147 -13.309 10.671 -0.622 1.00 0.00 O ATOM 2024 OD2 ASP A 147 -12.147 10.900 1.177 1.00 0.00 O ATOM 0 H ASP A 147 -9.796 7.762 -2.442 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.955 8.055 -0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -10.187 9.997 -0.037 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -10.761 10.691 -1.540 1.00 0.00 H new ATOM 2029 N SER A 148 -13.421 8.693 -2.500 1.00 0.00 N ATOM 2030 CA SER A 148 -14.235 8.771 -3.747 1.00 0.00 C ATOM 2031 C SER A 148 -14.580 10.229 -4.062 1.00 0.00 C ATOM 2032 O SER A 148 -14.145 11.140 -3.386 1.00 0.00 O ATOM 2033 CB SER A 148 -15.503 7.975 -3.442 1.00 0.00 C ATOM 2034 OG SER A 148 -16.393 8.783 -2.683 1.00 0.00 O ATOM 0 H SER A 148 -13.958 8.627 -1.635 1.00 0.00 H new ATOM 0 HA SER A 148 -13.704 8.376 -4.613 1.00 0.00 H new ATOM 0 HB2 SER A 148 -15.981 7.660 -4.370 1.00 0.00 H new ATOM 0 HB3 SER A 148 -15.254 7.070 -2.889 1.00 0.00 H new ATOM 0 HG SER A 148 -17.208 8.276 -2.487 1.00 0.00 H new