USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 943 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 111 THR OG1 : rot -121:sc= 1.04 USER MOD Set 1.2: A 134 THR OG1 : rot -110:sc= 0.893 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.0591 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= -0.283 X(o=-0.28,f=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 66:sc= 1.19 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -72:sc= 1.15 USER MOD Single : A 60 SER OG : rot 180:sc= 0.0421 USER MOD Single : A 61 TYR OH : rot 180:sc= 0.214 USER MOD Single : A 63 THR OG1 : rot 8:sc= 0.907 USER MOD Single : A 65 THR OG1 : rot 13:sc= 0.981 USER MOD Single : A 69 ASN : amide:sc= -0.645 X(o=-0.64,f=-0.16) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -93:sc= 0.0061! USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.678 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.456 K(o=-0.46,f=-3!) USER MOD Single : A 109 THR OG1 : rot 178:sc= 0.0915 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot -86:sc= 1.65 USER MOD Single : A 133 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.5!) USER MOD Single : A 138 SER OG : rot 88:sc= 0.59 USER MOD Single : A 141 ASN : amide:sc= 0.703 K(o=0.7,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -19.067 9.296 3.434 1.00 0.00 N ATOM 32 CA GLY A 4 -17.685 9.749 3.604 1.00 0.00 C ATOM 33 C GLY A 4 -17.532 11.200 3.138 1.00 0.00 C ATOM 34 O GLY A 4 -18.510 11.820 2.702 1.00 0.00 O ATOM 0 HA2 GLY A 4 -17.395 9.665 4.652 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.013 9.106 3.035 1.00 0.00 H new ATOM 38 N GLU A 5 -16.322 11.753 3.167 1.00 0.00 N ATOM 39 CA GLU A 5 -16.062 13.131 2.759 1.00 0.00 C ATOM 40 C GLU A 5 -14.692 13.251 2.069 1.00 0.00 C ATOM 41 O GLU A 5 -13.753 12.583 2.503 1.00 0.00 O ATOM 42 CB GLU A 5 -16.122 14.007 4.026 1.00 0.00 C ATOM 43 CG GLU A 5 -16.083 15.510 3.723 1.00 0.00 C ATOM 44 CD GLU A 5 -16.096 16.384 4.975 1.00 0.00 C ATOM 45 OE1 GLU A 5 -15.277 16.146 5.896 1.00 0.00 O ATOM 46 OE2 GLU A 5 -16.868 17.370 4.999 1.00 0.00 O ATOM 0 H GLU A 5 -15.488 11.254 3.477 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.808 13.460 2.036 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -17.035 13.777 4.576 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -15.285 13.752 4.676 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -15.187 15.733 3.143 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -16.939 15.769 3.100 1.00 0.00 H new ATOM 53 N PRO A 6 -14.550 14.058 0.995 1.00 0.00 N ATOM 54 CA PRO A 6 -13.264 14.248 0.331 1.00 0.00 C ATOM 55 C PRO A 6 -12.351 15.014 1.302 1.00 0.00 C ATOM 56 O PRO A 6 -12.767 16.056 1.820 1.00 0.00 O ATOM 57 CB PRO A 6 -13.568 15.077 -0.924 1.00 0.00 C ATOM 58 CG PRO A 6 -14.849 15.834 -0.579 1.00 0.00 C ATOM 59 CD PRO A 6 -15.576 14.881 0.364 1.00 0.00 C ATOM 0 HA PRO A 6 -12.767 13.318 0.056 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -12.752 15.762 -1.155 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -13.706 14.440 -1.797 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -14.635 16.789 -0.099 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -15.441 16.049 -1.468 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.144 15.434 1.112 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -16.287 14.262 -0.183 1.00 0.00 H new ATOM 67 N LEU A 7 -11.115 14.556 1.534 1.00 0.00 N ATOM 68 CA LEU A 7 -10.180 15.196 2.442 1.00 0.00 C ATOM 69 C LEU A 7 -8.942 15.543 1.639 1.00 0.00 C ATOM 70 O LEU A 7 -8.168 14.660 1.272 1.00 0.00 O ATOM 71 CB LEU A 7 -9.916 14.278 3.652 1.00 0.00 C ATOM 72 CG LEU A 7 -9.363 14.973 4.914 1.00 0.00 C ATOM 73 CD1 LEU A 7 -7.996 15.629 4.708 1.00 0.00 C ATOM 74 CD2 LEU A 7 -10.354 15.983 5.502 1.00 0.00 C ATOM 0 H LEU A 7 -10.740 13.720 1.087 1.00 0.00 H new ATOM 0 HA LEU A 7 -10.574 16.120 2.866 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.848 13.778 3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.212 13.503 3.349 1.00 0.00 H new ATOM 0 HG LEU A 7 -9.222 14.166 5.633 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.673 16.097 5.638 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.270 14.872 4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.070 16.386 3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.919 16.446 6.388 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -10.572 16.752 4.761 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -11.276 15.471 5.776 1.00 0.00 H new ATOM 86 N VAL A 8 -8.801 16.808 1.261 1.00 0.00 N ATOM 87 CA VAL A 8 -7.672 17.309 0.505 1.00 0.00 C ATOM 88 C VAL A 8 -6.675 17.783 1.557 1.00 0.00 C ATOM 89 O VAL A 8 -7.029 18.512 2.488 1.00 0.00 O ATOM 90 CB VAL A 8 -8.108 18.420 -0.466 1.00 0.00 C ATOM 91 CG1 VAL A 8 -6.921 19.007 -1.243 1.00 0.00 C ATOM 92 CG2 VAL A 8 -9.118 17.871 -1.485 1.00 0.00 C ATOM 0 H VAL A 8 -9.490 17.528 1.480 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.221 16.551 -0.136 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.558 19.206 0.141 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.277 19.787 -1.916 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -6.202 19.432 -0.543 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -6.440 18.219 -1.823 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.418 18.668 -2.166 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.659 17.062 -2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -9.995 17.493 -0.960 1.00 0.00 H new ATOM 102 N GLY A 9 -5.446 17.319 1.402 1.00 0.00 N ATOM 103 CA GLY A 9 -4.285 17.577 2.231 1.00 0.00 C ATOM 104 C GLY A 9 -3.868 19.044 2.233 1.00 0.00 C ATOM 105 O GLY A 9 -4.603 19.937 1.794 1.00 0.00 O ATOM 0 H GLY A 9 -5.218 16.699 0.625 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.499 17.264 3.253 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -3.452 16.969 1.879 1.00 0.00 H new ATOM 109 N GLY A 10 -2.670 19.279 2.764 1.00 0.00 N ATOM 110 CA GLY A 10 -2.064 20.589 2.889 1.00 0.00 C ATOM 111 C GLY A 10 -0.868 20.819 1.971 1.00 0.00 C ATOM 112 O GLY A 10 -0.283 21.899 2.088 1.00 0.00 O ATOM 0 H GLY A 10 -2.080 18.532 3.130 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -2.819 21.347 2.679 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.747 20.732 3.922 1.00 0.00 H new ATOM 116 N ASP A 11 -0.496 19.874 1.091 1.00 0.00 N ATOM 117 CA ASP A 11 0.655 20.010 0.168 1.00 0.00 C ATOM 118 C ASP A 11 1.983 20.034 0.940 1.00 0.00 C ATOM 119 O ASP A 11 2.971 20.652 0.536 1.00 0.00 O ATOM 120 CB ASP A 11 0.455 21.222 -0.734 1.00 0.00 C ATOM 121 CG ASP A 11 0.937 21.062 -2.175 1.00 0.00 C ATOM 122 OD1 ASP A 11 0.360 20.221 -2.894 1.00 0.00 O ATOM 123 OD2 ASP A 11 1.763 21.899 -2.631 1.00 0.00 O ATOM 0 H ASP A 11 -0.987 18.985 0.996 1.00 0.00 H new ATOM 0 HA ASP A 11 0.708 19.136 -0.481 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.607 21.468 -0.751 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.972 22.072 -0.289 1.00 0.00 H new ATOM 128 N THR A 12 1.954 19.435 2.126 1.00 0.00 N ATOM 129 CA THR A 12 3.050 19.275 3.079 1.00 0.00 C ATOM 130 C THR A 12 2.963 17.930 3.773 1.00 0.00 C ATOM 131 O THR A 12 1.926 17.266 3.806 1.00 0.00 O ATOM 132 CB THR A 12 3.114 20.423 4.099 1.00 0.00 C ATOM 133 OG1 THR A 12 4.110 20.320 5.104 1.00 0.00 O ATOM 134 CG2 THR A 12 1.790 20.757 4.794 1.00 0.00 C ATOM 0 H THR A 12 1.093 19.014 2.475 1.00 0.00 H new ATOM 0 HA THR A 12 3.979 19.312 2.510 1.00 0.00 H new ATOM 0 HB THR A 12 3.389 21.235 3.426 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.061 21.101 5.694 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.943 21.579 5.493 1.00 0.00 H new ATOM 0 HG22 THR A 12 1.051 21.048 4.048 1.00 0.00 H new ATOM 0 HG23 THR A 12 1.433 19.882 5.337 1.00 0.00 H new ATOM 142 N ASP A 13 4.118 17.570 4.308 1.00 0.00 N ATOM 143 CA ASP A 13 4.386 16.345 5.033 1.00 0.00 C ATOM 144 C ASP A 13 3.614 16.311 6.338 1.00 0.00 C ATOM 145 O ASP A 13 3.682 17.241 7.145 1.00 0.00 O ATOM 146 CB ASP A 13 5.885 16.176 5.315 1.00 0.00 C ATOM 147 CG ASP A 13 6.568 17.384 5.953 1.00 0.00 C ATOM 148 OD1 ASP A 13 6.655 18.427 5.255 1.00 0.00 O ATOM 149 OD2 ASP A 13 7.094 17.271 7.080 1.00 0.00 O ATOM 0 H ASP A 13 4.944 18.165 4.242 1.00 0.00 H new ATOM 0 HA ASP A 13 4.058 15.518 4.403 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.020 15.315 5.969 1.00 0.00 H new ATOM 0 HB3 ASP A 13 6.391 15.946 4.377 1.00 0.00 H new ATOM 154 N ASP A 14 2.848 15.239 6.506 1.00 0.00 N ATOM 155 CA ASP A 14 2.023 14.898 7.655 1.00 0.00 C ATOM 156 C ASP A 14 1.507 13.488 7.381 1.00 0.00 C ATOM 157 O ASP A 14 1.851 12.858 6.376 1.00 0.00 O ATOM 158 CB ASP A 14 0.847 15.865 7.914 1.00 0.00 C ATOM 159 CG ASP A 14 0.513 16.018 9.410 1.00 0.00 C ATOM 160 OD1 ASP A 14 0.486 15.019 10.179 1.00 0.00 O ATOM 161 OD2 ASP A 14 0.244 17.155 9.856 1.00 0.00 O ATOM 0 H ASP A 14 2.784 14.527 5.779 1.00 0.00 H new ATOM 0 HA ASP A 14 2.625 14.970 8.561 1.00 0.00 H new ATOM 0 HB2 ASP A 14 1.090 16.843 7.500 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -0.036 15.505 7.385 1.00 0.00 H new ATOM 166 N GLN A 15 0.679 12.999 8.289 1.00 0.00 N ATOM 167 CA GLN A 15 0.063 11.695 8.261 1.00 0.00 C ATOM 168 C GLN A 15 -1.446 11.902 8.161 1.00 0.00 C ATOM 169 O GLN A 15 -2.049 12.553 9.024 1.00 0.00 O ATOM 170 CB GLN A 15 0.493 10.940 9.523 1.00 0.00 C ATOM 171 CG GLN A 15 1.985 10.570 9.604 1.00 0.00 C ATOM 172 CD GLN A 15 2.457 10.506 11.044 1.00 0.00 C ATOM 173 OE1 GLN A 15 2.876 11.493 11.640 1.00 0.00 O ATOM 174 NE2 GLN A 15 2.369 9.334 11.648 1.00 0.00 N ATOM 0 H GLN A 15 0.407 13.538 9.111 1.00 0.00 H new ATOM 0 HA GLN A 15 0.372 11.094 7.406 1.00 0.00 H new ATOM 0 HB2 GLN A 15 0.241 11.548 10.392 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -0.094 10.024 9.594 1.00 0.00 H new ATOM 0 HG2 GLN A 15 2.150 9.607 9.121 1.00 0.00 H new ATOM 0 HG3 GLN A 15 2.575 11.306 9.058 1.00 0.00 H new ATOM 0 HE21 GLN A 15 2.018 8.523 11.139 1.00 0.00 H new ATOM 0 HE22 GLN A 15 2.652 9.241 12.624 1.00 0.00 H new ATOM 183 N LEU A 16 -2.046 11.382 7.097 1.00 0.00 N ATOM 184 CA LEU A 16 -3.453 11.439 6.748 1.00 0.00 C ATOM 185 C LEU A 16 -4.025 10.056 7.051 1.00 0.00 C ATOM 186 O LEU A 16 -3.345 9.037 6.902 1.00 0.00 O ATOM 187 CB LEU A 16 -3.569 11.921 5.299 1.00 0.00 C ATOM 188 CG LEU A 16 -3.028 13.357 5.087 1.00 0.00 C ATOM 189 CD1 LEU A 16 -2.619 13.558 3.626 1.00 0.00 C ATOM 190 CD2 LEU A 16 -4.075 14.399 5.499 1.00 0.00 C ATOM 0 H LEU A 16 -1.511 10.866 6.399 1.00 0.00 H new ATOM 0 HA LEU A 16 -4.042 12.154 7.323 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -3.024 11.235 4.650 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.615 11.885 4.994 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.149 13.490 5.718 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.241 14.571 3.490 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.840 12.842 3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.485 13.405 2.981 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -3.674 15.400 5.342 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.974 14.270 4.896 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.323 14.269 6.552 1.00 0.00 H new ATOM 202 N GLN A 17 -5.255 10.027 7.553 1.00 0.00 N ATOM 203 CA GLN A 17 -5.976 8.821 7.962 1.00 0.00 C ATOM 204 C GLN A 17 -7.399 8.787 7.397 1.00 0.00 C ATOM 205 O GLN A 17 -7.911 9.818 6.975 1.00 0.00 O ATOM 206 CB GLN A 17 -6.047 8.793 9.505 1.00 0.00 C ATOM 207 CG GLN A 17 -4.744 8.420 10.238 1.00 0.00 C ATOM 208 CD GLN A 17 -3.687 9.508 10.458 1.00 0.00 C ATOM 209 OE1 GLN A 17 -2.588 9.210 10.925 1.00 0.00 O ATOM 210 NE2 GLN A 17 -3.978 10.772 10.227 1.00 0.00 N ATOM 0 H GLN A 17 -5.802 10.877 7.693 1.00 0.00 H new ATOM 0 HA GLN A 17 -5.442 7.953 7.574 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -6.366 9.776 9.851 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -6.821 8.085 9.800 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -5.017 8.021 11.215 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -4.273 7.609 9.683 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -4.888 11.023 9.840 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -3.294 11.499 10.435 1.00 0.00 H new ATOM 219 N GLY A 18 -8.076 7.638 7.479 1.00 0.00 N ATOM 220 CA GLY A 18 -9.444 7.458 6.991 1.00 0.00 C ATOM 221 C GLY A 18 -10.352 6.756 8.002 1.00 0.00 C ATOM 222 O GLY A 18 -11.570 6.896 7.931 1.00 0.00 O ATOM 0 H GLY A 18 -7.681 6.794 7.893 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.867 8.432 6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.421 6.879 6.068 1.00 0.00 H new ATOM 226 N GLY A 19 -9.795 6.038 8.985 1.00 0.00 N ATOM 227 CA GLY A 19 -10.563 5.332 10.003 1.00 0.00 C ATOM 228 C GLY A 19 -11.288 4.133 9.407 1.00 0.00 C ATOM 229 O GLY A 19 -10.731 3.036 9.406 1.00 0.00 O ATOM 0 H GLY A 19 -8.786 5.933 9.092 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -9.898 5.000 10.800 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.286 6.011 10.454 1.00 0.00 H new ATOM 233 N SER A 20 -12.523 4.307 8.942 1.00 0.00 N ATOM 234 CA SER A 20 -13.343 3.272 8.327 1.00 0.00 C ATOM 235 C SER A 20 -14.430 3.892 7.440 1.00 0.00 C ATOM 236 O SER A 20 -14.615 5.114 7.423 1.00 0.00 O ATOM 237 CB SER A 20 -13.921 2.327 9.393 1.00 0.00 C ATOM 238 OG SER A 20 -14.784 2.988 10.299 1.00 0.00 O ATOM 0 H SER A 20 -12.996 5.209 8.986 1.00 0.00 H new ATOM 0 HA SER A 20 -12.712 2.667 7.677 1.00 0.00 H new ATOM 0 HB2 SER A 20 -14.466 1.521 8.901 1.00 0.00 H new ATOM 0 HB3 SER A 20 -13.103 1.867 9.947 1.00 0.00 H new ATOM 0 HG SER A 20 -15.126 2.344 10.954 1.00 0.00 H new ATOM 244 N GLY A 21 -15.220 3.046 6.773 1.00 0.00 N ATOM 245 CA GLY A 21 -16.272 3.436 5.871 1.00 0.00 C ATOM 246 C GLY A 21 -15.623 3.585 4.504 1.00 0.00 C ATOM 247 O GLY A 21 -14.767 2.763 4.158 1.00 0.00 O ATOM 0 H GLY A 21 -15.129 2.034 6.860 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -17.063 2.686 5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -16.730 4.372 6.189 1.00 0.00 H new ATOM 251 N ALA A 22 -16.183 4.420 3.637 1.00 0.00 N ATOM 252 CA ALA A 22 -15.587 4.677 2.342 1.00 0.00 C ATOM 253 C ALA A 22 -15.368 6.179 2.372 1.00 0.00 C ATOM 254 O ALA A 22 -16.253 6.953 1.994 1.00 0.00 O ATOM 255 CB ALA A 22 -16.465 4.190 1.183 1.00 0.00 C ATOM 0 H ALA A 22 -17.050 4.929 3.812 1.00 0.00 H new ATOM 0 HA ALA A 22 -14.660 4.131 2.168 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.971 4.408 0.236 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -16.622 3.115 1.272 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -17.427 4.701 1.216 1.00 0.00 H new ATOM 261 N ASP A 23 -14.178 6.574 2.794 1.00 0.00 N ATOM 262 CA ASP A 23 -13.706 7.949 2.907 1.00 0.00 C ATOM 263 C ASP A 23 -12.738 8.143 1.733 1.00 0.00 C ATOM 264 O ASP A 23 -12.477 7.189 0.986 1.00 0.00 O ATOM 265 CB ASP A 23 -13.113 8.210 4.310 1.00 0.00 C ATOM 266 CG ASP A 23 -13.440 9.608 4.863 1.00 0.00 C ATOM 267 OD1 ASP A 23 -14.596 10.067 4.691 1.00 0.00 O ATOM 268 OD2 ASP A 23 -12.573 10.215 5.540 1.00 0.00 O ATOM 0 H ASP A 23 -13.469 5.902 3.086 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.499 8.693 2.832 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.491 7.457 5.001 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -12.031 8.089 4.267 1.00 0.00 H new ATOM 273 N ARG A 24 -12.330 9.370 1.420 1.00 0.00 N ATOM 274 CA ARG A 24 -11.419 9.580 0.303 1.00 0.00 C ATOM 275 C ARG A 24 -10.459 10.701 0.630 1.00 0.00 C ATOM 276 O ARG A 24 -10.865 11.860 0.706 1.00 0.00 O ATOM 277 CB ARG A 24 -12.203 9.820 -0.980 1.00 0.00 C ATOM 278 CG ARG A 24 -11.281 10.369 -2.072 1.00 0.00 C ATOM 279 CD ARG A 24 -11.831 9.925 -3.409 1.00 0.00 C ATOM 280 NE ARG A 24 -11.146 10.610 -4.500 1.00 0.00 N ATOM 281 CZ ARG A 24 -11.630 11.608 -5.234 1.00 0.00 C ATOM 282 NH1 ARG A 24 -12.815 12.158 -4.968 1.00 0.00 N ATOM 283 NH2 ARG A 24 -10.895 12.038 -6.243 1.00 0.00 N ATOM 0 H ARG A 24 -12.610 10.217 1.914 1.00 0.00 H new ATOM 0 HA ARG A 24 -10.820 8.685 0.136 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -12.660 8.889 -1.315 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -13.014 10.523 -0.792 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -11.234 11.457 -2.021 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.265 9.999 -1.935 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -11.711 8.847 -3.517 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.900 10.133 -3.456 1.00 0.00 H new ATOM 0 HE ARG A 24 -10.203 10.292 -4.722 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -13.373 11.814 -4.186 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -13.164 12.922 -5.546 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.991 11.607 -6.436 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -11.231 12.802 -6.830 1.00 0.00 H new ATOM 297 N LEU A 25 -9.188 10.354 0.791 1.00 0.00 N ATOM 298 CA LEU A 25 -8.144 11.310 1.090 1.00 0.00 C ATOM 299 C LEU A 25 -7.286 11.493 -0.155 1.00 0.00 C ATOM 300 O LEU A 25 -7.141 10.590 -0.986 1.00 0.00 O ATOM 301 CB LEU A 25 -7.349 10.916 2.344 1.00 0.00 C ATOM 302 CG LEU A 25 -6.403 9.707 2.252 1.00 0.00 C ATOM 303 CD1 LEU A 25 -5.595 9.635 3.558 1.00 0.00 C ATOM 304 CD2 LEU A 25 -7.121 8.373 2.020 1.00 0.00 C ATOM 0 H LEU A 25 -8.856 9.392 0.716 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.580 12.277 1.342 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.758 11.779 2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -8.063 10.720 3.144 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.763 9.857 1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.915 8.784 3.519 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.021 10.553 3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.276 9.516 4.401 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.387 7.569 1.967 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.809 8.182 2.844 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.679 8.418 1.085 1.00 0.00 H new ATOM 316 N ASP A 26 -6.728 12.688 -0.276 1.00 0.00 N ATOM 317 CA ASP A 26 -5.854 13.102 -1.367 1.00 0.00 C ATOM 318 C ASP A 26 -4.850 14.069 -0.767 1.00 0.00 C ATOM 319 O ASP A 26 -5.256 15.098 -0.230 1.00 0.00 O ATOM 320 CB ASP A 26 -6.704 13.757 -2.464 1.00 0.00 C ATOM 321 CG ASP A 26 -6.093 13.652 -3.858 1.00 0.00 C ATOM 322 OD1 ASP A 26 -5.155 14.416 -4.174 1.00 0.00 O ATOM 323 OD2 ASP A 26 -6.622 12.859 -4.675 1.00 0.00 O ATOM 0 H ASP A 26 -6.877 13.427 0.411 1.00 0.00 H new ATOM 0 HA ASP A 26 -5.327 12.266 -1.827 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.690 13.293 -2.473 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.850 14.809 -2.219 1.00 0.00 H new ATOM 328 N GLY A 27 -3.568 13.723 -0.751 1.00 0.00 N ATOM 329 CA GLY A 27 -2.532 14.569 -0.169 1.00 0.00 C ATOM 330 C GLY A 27 -2.256 15.774 -1.046 1.00 0.00 C ATOM 331 O GLY A 27 -2.443 16.909 -0.600 1.00 0.00 O ATOM 0 H GLY A 27 -3.217 12.848 -1.141 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.842 14.900 0.822 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.616 13.992 -0.040 1.00 0.00 H new ATOM 335 N GLY A 28 -1.869 15.522 -2.297 1.00 0.00 N ATOM 336 CA GLY A 28 -1.563 16.565 -3.260 1.00 0.00 C ATOM 337 C GLY A 28 -0.169 16.385 -3.845 1.00 0.00 C ATOM 338 O GLY A 28 -0.065 15.967 -5.002 1.00 0.00 O ATOM 0 H GLY A 28 -1.760 14.578 -2.668 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -2.301 16.551 -4.062 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -1.635 17.540 -2.778 1.00 0.00 H new ATOM 342 N ALA A 29 0.876 16.724 -3.084 1.00 0.00 N ATOM 343 CA ALA A 29 2.270 16.629 -3.503 1.00 0.00 C ATOM 344 C ALA A 29 3.196 16.632 -2.286 1.00 0.00 C ATOM 345 O ALA A 29 3.166 17.603 -1.518 1.00 0.00 O ATOM 346 CB ALA A 29 2.603 17.871 -4.342 1.00 0.00 C ATOM 0 H ALA A 29 0.768 17.081 -2.135 1.00 0.00 H new ATOM 0 HA ALA A 29 2.410 15.707 -4.068 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.642 17.822 -4.667 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.951 17.906 -5.215 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.453 18.767 -3.740 1.00 0.00 H new ATOM 352 N GLY A 30 4.069 15.629 -2.148 1.00 0.00 N ATOM 353 CA GLY A 30 4.995 15.566 -1.027 1.00 0.00 C ATOM 354 C GLY A 30 5.451 14.149 -0.698 1.00 0.00 C ATOM 355 O GLY A 30 5.360 13.234 -1.512 1.00 0.00 O ATOM 0 H GLY A 30 4.149 14.851 -2.803 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.869 16.178 -1.252 1.00 0.00 H new ATOM 0 HA3 GLY A 30 4.520 16.000 -0.148 1.00 0.00 H new ATOM 359 N ASP A 31 6.090 13.987 0.458 1.00 0.00 N ATOM 360 CA ASP A 31 6.605 12.775 1.071 1.00 0.00 C ATOM 361 C ASP A 31 5.692 12.576 2.281 1.00 0.00 C ATOM 362 O ASP A 31 6.091 12.576 3.447 1.00 0.00 O ATOM 363 CB ASP A 31 8.081 12.920 1.451 1.00 0.00 C ATOM 364 CG ASP A 31 8.712 11.626 1.956 1.00 0.00 C ATOM 365 OD1 ASP A 31 7.988 10.648 2.245 1.00 0.00 O ATOM 366 OD2 ASP A 31 9.963 11.598 2.100 1.00 0.00 O ATOM 0 H ASP A 31 6.278 14.796 1.050 1.00 0.00 H new ATOM 0 HA ASP A 31 6.592 11.913 0.404 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.638 13.271 0.583 1.00 0.00 H new ATOM 0 HB3 ASP A 31 8.176 13.685 2.221 1.00 0.00 H new ATOM 371 N ASP A 32 4.408 12.509 1.963 1.00 0.00 N ATOM 372 CA ASP A 32 3.282 12.376 2.874 1.00 0.00 C ATOM 373 C ASP A 32 2.932 10.907 3.075 1.00 0.00 C ATOM 374 O ASP A 32 3.451 10.041 2.370 1.00 0.00 O ATOM 375 CB ASP A 32 2.054 13.136 2.333 1.00 0.00 C ATOM 376 CG ASP A 32 2.338 14.469 1.624 1.00 0.00 C ATOM 377 OD1 ASP A 32 3.256 15.215 2.049 1.00 0.00 O ATOM 378 OD2 ASP A 32 1.619 14.781 0.653 1.00 0.00 O ATOM 0 H ASP A 32 4.104 12.549 0.990 1.00 0.00 H new ATOM 0 HA ASP A 32 3.568 12.807 3.833 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.527 12.484 1.637 1.00 0.00 H new ATOM 0 HB3 ASP A 32 1.377 13.328 3.165 1.00 0.00 H new ATOM 383 N ILE A 33 2.136 10.590 4.094 1.00 0.00 N ATOM 384 CA ILE A 33 1.690 9.218 4.364 1.00 0.00 C ATOM 385 C ILE A 33 0.165 9.272 4.424 1.00 0.00 C ATOM 386 O ILE A 33 -0.404 10.080 5.163 1.00 0.00 O ATOM 387 CB ILE A 33 2.401 8.564 5.564 1.00 0.00 C ATOM 388 CG1 ILE A 33 1.901 7.129 5.853 1.00 0.00 C ATOM 389 CG2 ILE A 33 2.320 9.400 6.805 1.00 0.00 C ATOM 390 CD1 ILE A 33 2.873 6.282 6.683 1.00 0.00 C ATOM 0 H ILE A 33 1.779 11.276 4.759 1.00 0.00 H new ATOM 0 HA ILE A 33 1.983 8.533 3.568 1.00 0.00 H new ATOM 0 HB ILE A 33 3.448 8.496 5.269 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.947 7.187 6.378 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.713 6.624 4.906 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.837 8.893 7.620 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.789 10.367 6.624 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.275 9.549 7.076 1.00 0.00 H new ATOM 0 HD11 ILE A 33 2.448 5.291 6.841 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.820 6.190 6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.042 6.762 7.647 1.00 0.00 H new ATOM 402 N LEU A 34 -0.494 8.430 3.627 1.00 0.00 N ATOM 403 CA LEU A 34 -1.945 8.365 3.505 1.00 0.00 C ATOM 404 C LEU A 34 -2.466 6.963 3.802 1.00 0.00 C ATOM 405 O LEU A 34 -2.132 6.003 3.109 1.00 0.00 O ATOM 406 CB LEU A 34 -2.363 8.833 2.089 1.00 0.00 C ATOM 407 CG LEU A 34 -1.823 10.229 1.723 1.00 0.00 C ATOM 408 CD1 LEU A 34 -0.532 10.163 0.898 1.00 0.00 C ATOM 409 CD2 LEU A 34 -2.858 11.025 0.932 1.00 0.00 C ATOM 0 H LEU A 34 -0.015 7.755 3.031 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.391 9.031 4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.007 8.110 1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.451 8.844 2.024 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.607 10.724 2.670 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.195 11.174 0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.239 9.645 1.469 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.720 9.623 -0.030 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.452 12.006 0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.102 10.492 0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.760 11.145 1.532 1.00 0.00 H new ATOM 421 N ASP A 35 -3.303 6.835 4.829 1.00 0.00 N ATOM 422 CA ASP A 35 -3.917 5.588 5.239 1.00 0.00 C ATOM 423 C ASP A 35 -5.409 5.777 4.962 1.00 0.00 C ATOM 424 O ASP A 35 -6.031 6.654 5.564 1.00 0.00 O ATOM 425 CB ASP A 35 -3.743 5.296 6.739 1.00 0.00 C ATOM 426 CG ASP A 35 -2.373 5.295 7.410 1.00 0.00 C ATOM 427 OD1 ASP A 35 -1.408 5.933 6.939 1.00 0.00 O ATOM 428 OD2 ASP A 35 -2.308 4.709 8.519 1.00 0.00 O ATOM 0 H ASP A 35 -3.577 7.625 5.413 1.00 0.00 H new ATOM 0 HA ASP A 35 -3.458 4.757 4.704 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.354 6.023 7.273 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.183 4.315 6.921 1.00 0.00 H new ATOM 433 N GLY A 36 -6.007 4.982 4.079 1.00 0.00 N ATOM 434 CA GLY A 36 -7.422 5.073 3.727 1.00 0.00 C ATOM 435 C GLY A 36 -8.371 4.503 4.784 1.00 0.00 C ATOM 436 O GLY A 36 -9.582 4.746 4.736 1.00 0.00 O ATOM 0 H GLY A 36 -5.513 4.243 3.579 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.675 6.119 3.554 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.585 4.546 2.787 1.00 0.00 H new ATOM 440 N GLY A 37 -7.845 3.804 5.794 1.00 0.00 N ATOM 441 CA GLY A 37 -8.630 3.215 6.864 1.00 0.00 C ATOM 442 C GLY A 37 -9.115 1.811 6.512 1.00 0.00 C ATOM 443 O GLY A 37 -8.605 1.173 5.598 1.00 0.00 O ATOM 0 H GLY A 37 -6.844 3.633 5.886 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -8.030 3.174 7.773 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.488 3.852 7.077 1.00 0.00 H new ATOM 447 N ALA A 38 -10.056 1.295 7.302 1.00 0.00 N ATOM 448 CA ALA A 38 -10.669 -0.018 7.183 1.00 0.00 C ATOM 449 C ALA A 38 -11.970 0.069 6.381 1.00 0.00 C ATOM 450 O ALA A 38 -13.026 0.451 6.903 1.00 0.00 O ATOM 451 CB ALA A 38 -10.954 -0.474 8.621 1.00 0.00 C ATOM 0 H ALA A 38 -10.431 1.821 8.091 1.00 0.00 H new ATOM 0 HA ALA A 38 -10.019 -0.719 6.660 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.418 -1.460 8.605 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -10.019 -0.522 9.180 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.627 0.236 9.101 1.00 0.00 H new ATOM 457 N GLY A 39 -11.960 -0.431 5.152 1.00 0.00 N ATOM 458 CA GLY A 39 -13.093 -0.412 4.276 1.00 0.00 C ATOM 459 C GLY A 39 -12.625 -0.512 2.846 1.00 0.00 C ATOM 460 O GLY A 39 -11.555 -1.046 2.599 1.00 0.00 O ATOM 0 H GLY A 39 -11.136 -0.869 4.739 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.761 -1.241 4.510 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.662 0.506 4.420 1.00 0.00 H new ATOM 464 N ARG A 40 -13.472 -0.074 1.920 1.00 0.00 N ATOM 465 CA ARG A 40 -13.208 -0.026 0.503 1.00 0.00 C ATOM 466 C ARG A 40 -13.136 1.466 0.209 1.00 0.00 C ATOM 467 O ARG A 40 -14.147 2.111 -0.070 1.00 0.00 O ATOM 468 CB ARG A 40 -14.321 -0.810 -0.188 1.00 0.00 C ATOM 469 CG ARG A 40 -15.797 -0.398 0.021 1.00 0.00 C ATOM 470 CD ARG A 40 -16.576 -1.551 0.668 1.00 0.00 C ATOM 471 NE ARG A 40 -18.043 -1.419 0.574 1.00 0.00 N ATOM 472 CZ ARG A 40 -18.835 -0.571 1.240 1.00 0.00 C ATOM 473 NH1 ARG A 40 -18.325 0.343 2.047 1.00 0.00 N ATOM 474 NH2 ARG A 40 -20.155 -0.652 1.108 1.00 0.00 N ATOM 0 H ARG A 40 -14.402 0.271 2.158 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.288 -0.487 0.145 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.124 -0.779 -1.260 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -14.227 -1.850 0.123 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -15.850 0.488 0.654 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -16.249 -0.134 -0.935 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -16.276 -2.487 0.196 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.295 -1.619 1.719 1.00 0.00 H new ATOM 0 HE ARG A 40 -18.509 -2.050 -0.077 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -17.314 0.409 2.169 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -18.942 0.982 2.548 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -20.564 -1.361 0.499 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.759 -0.006 1.616 1.00 0.00 H new ATOM 488 N ASP A 41 -11.931 2.002 0.179 1.00 0.00 N ATOM 489 CA ASP A 41 -11.577 3.404 -0.017 1.00 0.00 C ATOM 490 C ASP A 41 -10.816 3.647 -1.314 1.00 0.00 C ATOM 491 O ASP A 41 -10.459 2.701 -2.026 1.00 0.00 O ATOM 492 CB ASP A 41 -10.809 3.923 1.209 1.00 0.00 C ATOM 493 CG ASP A 41 -9.294 3.831 1.048 1.00 0.00 C ATOM 494 OD1 ASP A 41 -8.729 4.801 0.486 1.00 0.00 O ATOM 495 OD2 ASP A 41 -8.723 2.822 1.507 1.00 0.00 O ATOM 0 H ASP A 41 -11.101 1.422 0.301 1.00 0.00 H new ATOM 0 HA ASP A 41 -12.503 3.971 -0.116 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -11.087 4.961 1.392 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.111 3.353 2.088 1.00 0.00 H new ATOM 500 N ARG A 42 -10.776 4.912 -1.734 1.00 0.00 N ATOM 501 CA ARG A 42 -10.090 5.359 -2.924 1.00 0.00 C ATOM 502 C ARG A 42 -9.035 6.376 -2.507 1.00 0.00 C ATOM 503 O ARG A 42 -9.359 7.552 -2.328 1.00 0.00 O ATOM 504 CB ARG A 42 -11.115 5.955 -3.877 1.00 0.00 C ATOM 505 CG ARG A 42 -10.446 6.294 -5.222 1.00 0.00 C ATOM 506 CD ARG A 42 -11.304 7.193 -6.119 1.00 0.00 C ATOM 507 NE ARG A 42 -12.687 6.717 -6.266 1.00 0.00 N ATOM 508 CZ ARG A 42 -13.096 5.622 -6.909 1.00 0.00 C ATOM 509 NH1 ARG A 42 -12.221 4.819 -7.503 1.00 0.00 N ATOM 510 NH2 ARG A 42 -14.383 5.327 -7.007 1.00 0.00 N ATOM 0 H ARG A 42 -11.238 5.670 -1.232 1.00 0.00 H new ATOM 0 HA ARG A 42 -9.591 4.539 -3.439 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.931 5.250 -4.034 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.550 6.854 -3.441 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -9.493 6.787 -5.031 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -10.225 5.368 -5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.316 8.202 -5.706 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -10.843 7.258 -7.104 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.412 7.285 -5.829 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.225 5.037 -7.470 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.545 3.984 -7.992 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -15.080 5.941 -6.587 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.677 4.485 -7.503 1.00 0.00 H new ATOM 524 N LEU A 43 -7.781 5.948 -2.445 1.00 0.00 N ATOM 525 CA LEU A 43 -6.648 6.763 -2.063 1.00 0.00 C ATOM 526 C LEU A 43 -5.840 7.184 -3.292 1.00 0.00 C ATOM 527 O LEU A 43 -5.771 6.438 -4.268 1.00 0.00 O ATOM 528 CB LEU A 43 -5.821 5.920 -1.083 1.00 0.00 C ATOM 529 CG LEU A 43 -5.071 4.679 -1.610 1.00 0.00 C ATOM 530 CD1 LEU A 43 -3.620 5.042 -1.957 1.00 0.00 C ATOM 531 CD2 LEU A 43 -5.021 3.596 -0.527 1.00 0.00 C ATOM 0 H LEU A 43 -7.521 4.987 -2.669 1.00 0.00 H new ATOM 0 HA LEU A 43 -6.963 7.692 -1.587 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.084 6.579 -0.623 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.490 5.587 -0.290 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.599 4.320 -2.493 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.102 4.157 -2.328 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.612 5.815 -2.725 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.114 5.411 -1.065 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.490 2.724 -0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.502 3.982 0.350 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.036 3.310 -0.251 1.00 0.00 H new ATOM 543 N SER A 44 -5.303 8.402 -3.299 1.00 0.00 N ATOM 544 CA SER A 44 -4.473 8.963 -4.360 1.00 0.00 C ATOM 545 C SER A 44 -3.563 9.925 -3.625 1.00 0.00 C ATOM 546 O SER A 44 -4.058 10.836 -2.966 1.00 0.00 O ATOM 547 CB SER A 44 -5.325 9.664 -5.417 1.00 0.00 C ATOM 548 OG SER A 44 -4.582 9.846 -6.612 1.00 0.00 O ATOM 0 H SER A 44 -5.442 9.055 -2.528 1.00 0.00 H new ATOM 0 HA SER A 44 -3.914 8.208 -4.914 1.00 0.00 H new ATOM 0 HB2 SER A 44 -6.218 9.074 -5.623 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.661 10.630 -5.040 1.00 0.00 H new ATOM 0 HG SER A 44 -4.385 8.973 -7.011 1.00 0.00 H new ATOM 554 N GLY A 45 -2.265 9.659 -3.593 1.00 0.00 N ATOM 555 CA GLY A 45 -1.345 10.553 -2.919 1.00 0.00 C ATOM 556 C GLY A 45 -1.181 11.762 -3.817 1.00 0.00 C ATOM 557 O GLY A 45 -1.663 12.865 -3.532 1.00 0.00 O ATOM 0 H GLY A 45 -1.832 8.841 -4.021 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.733 10.845 -1.943 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.386 10.065 -2.747 1.00 0.00 H new ATOM 561 N GLY A 46 -0.643 11.497 -4.999 1.00 0.00 N ATOM 562 CA GLY A 46 -0.355 12.482 -6.017 1.00 0.00 C ATOM 563 C GLY A 46 1.051 12.232 -6.533 1.00 0.00 C ATOM 564 O GLY A 46 1.566 11.113 -6.464 1.00 0.00 O ATOM 0 H GLY A 46 -0.387 10.551 -5.280 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.077 12.411 -6.830 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -0.436 13.488 -5.606 1.00 0.00 H new ATOM 568 N ALA A 47 1.623 13.269 -7.134 1.00 0.00 N ATOM 569 CA ALA A 47 2.969 13.223 -7.665 1.00 0.00 C ATOM 570 C ALA A 47 3.911 13.572 -6.509 1.00 0.00 C ATOM 571 O ALA A 47 4.054 14.742 -6.138 1.00 0.00 O ATOM 572 CB ALA A 47 3.087 14.207 -8.824 1.00 0.00 C ATOM 0 H ALA A 47 1.159 14.168 -7.264 1.00 0.00 H new ATOM 0 HA ALA A 47 3.227 12.240 -8.058 1.00 0.00 H new ATOM 0 HB1 ALA A 47 4.099 14.175 -9.227 1.00 0.00 H new ATOM 0 HB2 ALA A 47 2.377 13.936 -9.605 1.00 0.00 H new ATOM 0 HB3 ALA A 47 2.869 15.214 -8.470 1.00 0.00 H new ATOM 578 N GLY A 48 4.574 12.564 -5.962 1.00 0.00 N ATOM 579 CA GLY A 48 5.511 12.646 -4.856 1.00 0.00 C ATOM 580 C GLY A 48 5.878 11.232 -4.415 1.00 0.00 C ATOM 581 O GLY A 48 5.372 10.255 -4.977 1.00 0.00 O ATOM 0 H GLY A 48 4.464 11.608 -6.301 1.00 0.00 H new ATOM 0 HA2 GLY A 48 6.405 13.191 -5.159 1.00 0.00 H new ATOM 0 HA3 GLY A 48 5.068 13.197 -4.026 1.00 0.00 H new ATOM 585 N ALA A 49 6.804 11.109 -3.461 1.00 0.00 N ATOM 586 CA ALA A 49 7.255 9.830 -2.933 1.00 0.00 C ATOM 587 C ALA A 49 6.523 9.624 -1.607 1.00 0.00 C ATOM 588 O ALA A 49 7.118 9.721 -0.532 1.00 0.00 O ATOM 589 CB ALA A 49 8.784 9.837 -2.759 1.00 0.00 C ATOM 0 H ALA A 49 7.265 11.911 -3.031 1.00 0.00 H new ATOM 0 HA ALA A 49 7.030 9.007 -3.612 1.00 0.00 H new ATOM 0 HB1 ALA A 49 9.110 8.875 -2.363 1.00 0.00 H new ATOM 0 HB2 ALA A 49 9.259 10.012 -3.724 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.068 10.629 -2.066 1.00 0.00 H new ATOM 595 N ASP A 50 5.215 9.420 -1.676 1.00 0.00 N ATOM 596 CA ASP A 50 4.333 9.249 -0.535 1.00 0.00 C ATOM 597 C ASP A 50 4.168 7.786 -0.163 1.00 0.00 C ATOM 598 O ASP A 50 4.634 6.905 -0.884 1.00 0.00 O ATOM 599 CB ASP A 50 3.048 10.079 -0.673 1.00 0.00 C ATOM 600 CG ASP A 50 2.330 10.100 -2.016 1.00 0.00 C ATOM 601 OD1 ASP A 50 2.399 9.098 -2.754 1.00 0.00 O ATOM 602 OD2 ASP A 50 1.671 11.135 -2.266 1.00 0.00 O ATOM 0 H ASP A 50 4.721 9.367 -2.567 1.00 0.00 H new ATOM 0 HA ASP A 50 4.807 9.677 0.349 1.00 0.00 H new ATOM 0 HB2 ASP A 50 2.341 9.719 0.074 1.00 0.00 H new ATOM 0 HB3 ASP A 50 3.291 11.109 -0.412 1.00 0.00 H new ATOM 607 N THR A 51 3.636 7.517 1.032 1.00 0.00 N ATOM 608 CA THR A 51 3.462 6.164 1.536 1.00 0.00 C ATOM 609 C THR A 51 1.983 5.843 1.749 1.00 0.00 C ATOM 610 O THR A 51 1.280 6.597 2.417 1.00 0.00 O ATOM 611 CB THR A 51 4.294 5.983 2.818 1.00 0.00 C ATOM 612 OG1 THR A 51 5.614 6.488 2.704 1.00 0.00 O ATOM 613 CG2 THR A 51 4.468 4.492 3.111 1.00 0.00 C ATOM 0 H THR A 51 3.314 8.240 1.676 1.00 0.00 H new ATOM 0 HA THR A 51 3.826 5.451 0.796 1.00 0.00 H new ATOM 0 HB THR A 51 3.752 6.522 3.595 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.092 6.347 3.548 1.00 0.00 H new ATOM 0 HG21 THR A 51 5.057 4.366 4.019 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.490 4.031 3.247 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.981 4.015 2.276 1.00 0.00 H new ATOM 621 N PHE A 52 1.506 4.699 1.257 1.00 0.00 N ATOM 622 CA PHE A 52 0.128 4.253 1.388 1.00 0.00 C ATOM 623 C PHE A 52 0.079 3.094 2.379 1.00 0.00 C ATOM 624 O PHE A 52 0.840 2.135 2.235 1.00 0.00 O ATOM 625 CB PHE A 52 -0.412 3.843 0.013 1.00 0.00 C ATOM 626 CG PHE A 52 -0.255 4.881 -1.087 1.00 0.00 C ATOM 627 CD1 PHE A 52 -0.260 6.263 -0.799 1.00 0.00 C ATOM 628 CD2 PHE A 52 -0.046 4.452 -2.411 1.00 0.00 C ATOM 629 CE1 PHE A 52 0.018 7.191 -1.813 1.00 0.00 C ATOM 630 CE2 PHE A 52 0.168 5.389 -3.433 1.00 0.00 C ATOM 631 CZ PHE A 52 0.236 6.755 -3.127 1.00 0.00 C ATOM 0 H PHE A 52 2.090 4.041 0.741 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.502 5.059 1.765 1.00 0.00 H new ATOM 0 HB2 PHE A 52 0.093 2.929 -0.299 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -1.470 3.603 0.114 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.478 6.605 0.202 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.050 3.397 -2.641 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.064 8.245 -1.581 1.00 0.00 H new ATOM 0 HE2 PHE A 52 0.280 5.058 -4.455 1.00 0.00 H new ATOM 0 HZ PHE A 52 0.456 7.472 -3.904 1.00 0.00 H new ATOM 641 N VAL A 53 -0.760 3.173 3.413 1.00 0.00 N ATOM 642 CA VAL A 53 -0.873 2.104 4.406 1.00 0.00 C ATOM 643 C VAL A 53 -1.778 1.006 3.838 1.00 0.00 C ATOM 644 O VAL A 53 -2.963 1.229 3.609 1.00 0.00 O ATOM 645 CB VAL A 53 -1.291 2.686 5.775 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.861 1.628 6.727 1.00 0.00 C ATOM 647 CG2 VAL A 53 -0.016 3.284 6.402 1.00 0.00 C ATOM 0 H VAL A 53 -1.373 3.970 3.585 1.00 0.00 H new ATOM 0 HA VAL A 53 0.086 1.626 4.606 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.079 3.423 5.621 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.136 2.098 7.671 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.743 1.172 6.278 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.109 0.860 6.910 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.255 3.711 7.376 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.732 2.500 6.523 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.378 4.064 5.751 1.00 0.00 H new ATOM 657 N PHE A 54 -1.221 -0.190 3.625 1.00 0.00 N ATOM 658 CA PHE A 54 -1.955 -1.316 3.067 1.00 0.00 C ATOM 659 C PHE A 54 -2.608 -2.190 4.119 1.00 0.00 C ATOM 660 O PHE A 54 -1.922 -2.946 4.800 1.00 0.00 O ATOM 661 CB PHE A 54 -1.019 -2.140 2.176 1.00 0.00 C ATOM 662 CG PHE A 54 -1.726 -3.192 1.348 1.00 0.00 C ATOM 663 CD1 PHE A 54 -2.750 -2.797 0.472 1.00 0.00 C ATOM 664 CD2 PHE A 54 -1.378 -4.552 1.445 1.00 0.00 C ATOM 665 CE1 PHE A 54 -3.446 -3.748 -0.284 1.00 0.00 C ATOM 666 CE2 PHE A 54 -2.060 -5.504 0.666 1.00 0.00 C ATOM 667 CZ PHE A 54 -3.108 -5.105 -0.184 1.00 0.00 C ATOM 0 H PHE A 54 -0.245 -0.399 3.837 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.773 -0.909 2.473 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.483 -1.466 1.508 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.272 -2.627 2.803 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -3.003 -1.751 0.381 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -0.590 -4.864 2.115 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -4.242 -3.437 -0.944 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -1.778 -6.545 0.720 1.00 0.00 H new ATOM 0 HZ PHE A 54 -3.650 -5.842 -0.758 1.00 0.00 H new ATOM 677 N SER A 55 -3.920 -2.079 4.278 1.00 0.00 N ATOM 678 CA SER A 55 -4.699 -2.875 5.204 1.00 0.00 C ATOM 679 C SER A 55 -4.449 -2.663 6.675 1.00 0.00 C ATOM 680 O SER A 55 -4.066 -3.561 7.419 1.00 0.00 O ATOM 681 CB SER A 55 -4.651 -4.317 4.726 1.00 0.00 C ATOM 682 OG SER A 55 -4.823 -4.496 3.334 1.00 0.00 O ATOM 0 H SER A 55 -4.483 -1.413 3.749 1.00 0.00 H new ATOM 0 HA SER A 55 -5.727 -2.514 5.173 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.692 -4.747 5.016 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.424 -4.882 5.247 1.00 0.00 H new ATOM 0 HG SER A 55 -5.756 -4.318 3.094 1.00 0.00 H new ATOM 688 N ALA A 56 -4.855 -1.503 7.171 1.00 0.00 N ATOM 689 CA ALA A 56 -4.567 -1.164 8.549 1.00 0.00 C ATOM 690 C ALA A 56 -5.278 -1.869 9.673 1.00 0.00 C ATOM 691 O ALA A 56 -4.896 -1.691 10.832 1.00 0.00 O ATOM 692 CB ALA A 56 -4.788 0.341 8.727 1.00 0.00 C ATOM 0 H ALA A 56 -5.374 -0.797 6.649 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.542 -1.516 8.661 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.577 0.620 9.759 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.122 0.888 8.060 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.823 0.587 8.489 1.00 0.00 H new ATOM 698 N ARG A 57 -6.357 -2.548 9.343 1.00 0.00 N ATOM 699 CA ARG A 57 -7.173 -3.286 10.297 1.00 0.00 C ATOM 700 C ARG A 57 -8.163 -4.178 9.581 1.00 0.00 C ATOM 701 O ARG A 57 -8.101 -5.397 9.708 1.00 0.00 O ATOM 702 CB ARG A 57 -7.886 -2.327 11.274 1.00 0.00 C ATOM 703 CG ARG A 57 -8.653 -3.110 12.340 1.00 0.00 C ATOM 704 CD ARG A 57 -9.249 -2.150 13.363 1.00 0.00 C ATOM 705 NE ARG A 57 -9.942 -2.907 14.406 1.00 0.00 N ATOM 706 CZ ARG A 57 -10.690 -2.390 15.376 1.00 0.00 C ATOM 707 NH1 ARG A 57 -10.798 -1.082 15.543 1.00 0.00 N ATOM 708 NH2 ARG A 57 -11.312 -3.209 16.217 1.00 0.00 N ATOM 0 H ARG A 57 -6.702 -2.606 8.385 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.514 -3.925 10.885 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.154 -1.676 11.751 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -8.573 -1.684 10.724 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.445 -3.695 11.873 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.986 -3.815 12.836 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.461 -1.540 13.806 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.944 -1.467 12.874 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.842 -3.922 14.387 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.301 -0.446 14.920 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.378 -0.710 16.295 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.212 -4.219 16.113 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.890 -2.828 16.966 1.00 0.00 H new ATOM 722 N GLU A 58 -9.165 -3.564 8.954 1.00 0.00 N ATOM 723 CA GLU A 58 -10.192 -4.306 8.224 1.00 0.00 C ATOM 724 C GLU A 58 -10.008 -4.208 6.710 1.00 0.00 C ATOM 725 O GLU A 58 -10.671 -4.955 6.003 1.00 0.00 O ATOM 726 CB GLU A 58 -11.614 -3.915 8.673 1.00 0.00 C ATOM 727 CG GLU A 58 -12.573 -5.105 8.858 1.00 0.00 C ATOM 728 CD GLU A 58 -12.672 -5.584 10.312 1.00 0.00 C ATOM 729 OE1 GLU A 58 -13.428 -4.986 11.110 1.00 0.00 O ATOM 730 OE2 GLU A 58 -12.046 -6.611 10.677 1.00 0.00 O ATOM 0 H GLU A 58 -9.288 -2.552 8.937 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.065 -5.358 8.479 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -11.547 -3.368 9.614 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -12.039 -3.232 7.937 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -13.565 -4.821 8.508 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.239 -5.933 8.232 1.00 0.00 H new ATOM 737 N ASP A 59 -9.131 -3.333 6.185 1.00 0.00 N ATOM 738 CA ASP A 59 -8.925 -3.186 4.732 1.00 0.00 C ATOM 739 C ASP A 59 -8.071 -4.338 4.161 1.00 0.00 C ATOM 740 O ASP A 59 -7.436 -4.250 3.117 1.00 0.00 O ATOM 741 CB ASP A 59 -8.370 -1.766 4.517 1.00 0.00 C ATOM 742 CG ASP A 59 -7.669 -1.458 3.189 1.00 0.00 C ATOM 743 OD1 ASP A 59 -8.331 -1.499 2.132 1.00 0.00 O ATOM 744 OD2 ASP A 59 -6.458 -1.137 3.268 1.00 0.00 O ATOM 0 H ASP A 59 -8.550 -2.713 6.750 1.00 0.00 H new ATOM 0 HA ASP A 59 -9.850 -3.277 4.163 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -9.197 -1.065 4.628 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.665 -1.558 5.322 1.00 0.00 H new ATOM 749 N SER A 60 -8.000 -5.444 4.896 1.00 0.00 N ATOM 750 CA SER A 60 -7.237 -6.647 4.605 1.00 0.00 C ATOM 751 C SER A 60 -7.826 -7.614 3.589 1.00 0.00 C ATOM 752 O SER A 60 -7.072 -8.195 2.825 1.00 0.00 O ATOM 753 CB SER A 60 -7.022 -7.430 5.917 1.00 0.00 C ATOM 754 OG SER A 60 -7.169 -6.649 7.101 1.00 0.00 O ATOM 0 H SER A 60 -8.513 -5.526 5.774 1.00 0.00 H new ATOM 0 HA SER A 60 -6.320 -6.272 4.151 1.00 0.00 H new ATOM 0 HB2 SER A 60 -7.731 -8.257 5.952 1.00 0.00 H new ATOM 0 HB3 SER A 60 -6.023 -7.866 5.906 1.00 0.00 H new ATOM 0 HG SER A 60 -7.020 -7.215 7.887 1.00 0.00 H new ATOM 760 N TYR A 61 -9.129 -7.867 3.580 1.00 0.00 N ATOM 761 CA TYR A 61 -9.689 -8.848 2.659 1.00 0.00 C ATOM 762 C TYR A 61 -11.188 -8.648 2.538 1.00 0.00 C ATOM 763 O TYR A 61 -11.763 -7.724 3.115 1.00 0.00 O ATOM 764 CB TYR A 61 -9.304 -10.278 3.133 1.00 0.00 C ATOM 765 CG TYR A 61 -9.194 -10.534 4.631 1.00 0.00 C ATOM 766 CD1 TYR A 61 -10.322 -10.398 5.458 1.00 0.00 C ATOM 767 CD2 TYR A 61 -7.973 -10.962 5.193 1.00 0.00 C ATOM 768 CE1 TYR A 61 -10.243 -10.692 6.831 1.00 0.00 C ATOM 769 CE2 TYR A 61 -7.881 -11.260 6.565 1.00 0.00 C ATOM 770 CZ TYR A 61 -9.022 -11.129 7.390 1.00 0.00 C ATOM 771 OH TYR A 61 -8.978 -11.507 8.699 1.00 0.00 O ATOM 0 H TYR A 61 -9.809 -7.414 4.190 1.00 0.00 H new ATOM 0 HA TYR A 61 -9.274 -8.714 1.660 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -10.041 -10.972 2.730 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -8.346 -10.532 2.680 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -11.258 -10.065 5.035 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -7.101 -11.062 4.564 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -11.116 -10.584 7.458 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -6.942 -11.588 6.987 1.00 0.00 H new ATOM 0 HH TYR A 61 -8.066 -11.782 8.930 1.00 0.00 H new ATOM 781 N ARG A 62 -11.823 -9.516 1.755 1.00 0.00 N ATOM 782 CA ARG A 62 -13.252 -9.488 1.525 1.00 0.00 C ATOM 783 C ARG A 62 -13.861 -10.738 2.120 1.00 0.00 C ATOM 784 O ARG A 62 -13.236 -11.798 2.158 1.00 0.00 O ATOM 785 CB ARG A 62 -13.544 -9.373 0.027 1.00 0.00 C ATOM 786 CG ARG A 62 -12.722 -10.313 -0.877 1.00 0.00 C ATOM 787 CD ARG A 62 -13.377 -10.506 -2.246 1.00 0.00 C ATOM 788 NE ARG A 62 -14.553 -11.372 -2.123 1.00 0.00 N ATOM 789 CZ ARG A 62 -15.580 -11.465 -2.964 1.00 0.00 C ATOM 790 NH1 ARG A 62 -15.576 -10.794 -4.116 1.00 0.00 N ATOM 791 NH2 ARG A 62 -16.596 -12.248 -2.621 1.00 0.00 N ATOM 0 H ARG A 62 -11.345 -10.268 1.258 1.00 0.00 H new ATOM 0 HA ARG A 62 -13.697 -8.617 2.007 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -14.603 -9.572 -0.137 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -13.361 -8.344 -0.284 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.720 -9.905 -1.009 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -12.611 -11.281 -0.388 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -13.668 -9.540 -2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.662 -10.946 -2.941 1.00 0.00 H new ATOM 0 HE ARG A 62 -14.588 -11.972 -1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -14.781 -10.203 -4.359 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.368 -10.872 -4.754 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -16.573 -12.755 -1.736 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -17.399 -12.342 -3.242 1.00 0.00 H new ATOM 805 N THR A 63 -15.091 -10.582 2.590 1.00 0.00 N ATOM 806 CA THR A 63 -15.876 -11.626 3.229 1.00 0.00 C ATOM 807 C THR A 63 -17.338 -11.538 2.793 1.00 0.00 C ATOM 808 O THR A 63 -17.712 -10.645 2.026 1.00 0.00 O ATOM 809 CB THR A 63 -15.710 -11.502 4.759 1.00 0.00 C ATOM 810 OG1 THR A 63 -15.802 -10.166 5.227 1.00 0.00 O ATOM 811 CG2 THR A 63 -14.369 -12.065 5.223 1.00 0.00 C ATOM 0 H THR A 63 -15.586 -9.692 2.534 1.00 0.00 H new ATOM 0 HA THR A 63 -15.520 -12.610 2.923 1.00 0.00 H new ATOM 0 HB THR A 63 -16.536 -12.078 5.177 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.075 -9.580 4.491 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.286 -11.961 6.305 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.304 -13.119 4.953 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.558 -11.517 4.743 1.00 0.00 H new ATOM 819 N ASP A 64 -18.162 -12.450 3.312 1.00 0.00 N ATOM 820 CA ASP A 64 -19.587 -12.669 3.141 1.00 0.00 C ATOM 821 C ASP A 64 -20.324 -11.356 3.301 1.00 0.00 C ATOM 822 O ASP A 64 -20.668 -10.906 4.395 1.00 0.00 O ATOM 823 CB ASP A 64 -20.097 -13.723 4.133 1.00 0.00 C ATOM 824 CG ASP A 64 -19.693 -15.127 3.700 1.00 0.00 C ATOM 825 OD1 ASP A 64 -20.331 -15.661 2.759 1.00 0.00 O ATOM 826 OD2 ASP A 64 -18.690 -15.657 4.227 1.00 0.00 O ATOM 0 H ASP A 64 -17.782 -13.147 3.952 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.774 -13.051 2.137 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -19.697 -13.516 5.125 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -21.183 -13.661 4.208 1.00 0.00 H new ATOM 831 N THR A 65 -20.596 -10.772 2.148 1.00 0.00 N ATOM 832 CA THR A 65 -21.277 -9.496 1.922 1.00 0.00 C ATOM 833 C THR A 65 -20.539 -8.301 2.564 1.00 0.00 C ATOM 834 O THR A 65 -21.093 -7.203 2.623 1.00 0.00 O ATOM 835 CB THR A 65 -22.777 -9.582 2.290 1.00 0.00 C ATOM 836 OG1 THR A 65 -23.027 -10.055 3.602 1.00 0.00 O ATOM 837 CG2 THR A 65 -23.566 -10.505 1.360 1.00 0.00 C ATOM 0 H THR A 65 -20.326 -11.210 1.267 1.00 0.00 H new ATOM 0 HA THR A 65 -21.242 -9.293 0.852 1.00 0.00 H new ATOM 0 HB THR A 65 -23.103 -8.546 2.196 1.00 0.00 H new ATOM 0 HG1 THR A 65 -22.192 -10.054 4.115 1.00 0.00 H new ATOM 0 HG21 THR A 65 -24.611 -10.525 1.668 1.00 0.00 H new ATOM 0 HG22 THR A 65 -23.496 -10.136 0.337 1.00 0.00 H new ATOM 0 HG23 THR A 65 -23.154 -11.513 1.412 1.00 0.00 H new ATOM 845 N ALA A 66 -19.292 -8.478 3.016 1.00 0.00 N ATOM 846 CA ALA A 66 -18.470 -7.480 3.658 1.00 0.00 C ATOM 847 C ALA A 66 -17.118 -7.465 2.954 1.00 0.00 C ATOM 848 O ALA A 66 -16.183 -8.152 3.359 1.00 0.00 O ATOM 849 CB ALA A 66 -18.375 -7.807 5.153 1.00 0.00 C ATOM 0 H ALA A 66 -18.815 -9.376 2.933 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.895 -6.479 3.581 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.756 -7.060 5.650 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -19.373 -7.801 5.591 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -17.928 -8.793 5.282 1.00 0.00 H new ATOM 855 N VAL A 67 -17.047 -6.758 1.831 1.00 0.00 N ATOM 856 CA VAL A 67 -15.841 -6.604 1.026 1.00 0.00 C ATOM 857 C VAL A 67 -15.180 -5.306 1.485 1.00 0.00 C ATOM 858 O VAL A 67 -15.891 -4.315 1.684 1.00 0.00 O ATOM 859 CB VAL A 67 -16.203 -6.525 -0.476 1.00 0.00 C ATOM 860 CG1 VAL A 67 -14.984 -6.557 -1.408 1.00 0.00 C ATOM 861 CG2 VAL A 67 -17.143 -7.663 -0.897 1.00 0.00 C ATOM 0 H VAL A 67 -17.850 -6.262 1.445 1.00 0.00 H new ATOM 0 HA VAL A 67 -15.170 -7.454 1.152 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.697 -5.559 -0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -15.317 -6.498 -2.444 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -14.334 -5.710 -1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -14.434 -7.486 -1.256 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -17.373 -7.571 -1.959 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -16.659 -8.622 -0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -18.066 -7.605 -0.320 1.00 0.00 H new ATOM 871 N PHE A 68 -13.855 -5.291 1.603 1.00 0.00 N ATOM 872 CA PHE A 68 -13.061 -4.130 2.007 1.00 0.00 C ATOM 873 C PHE A 68 -11.903 -4.033 1.008 1.00 0.00 C ATOM 874 O PHE A 68 -10.737 -4.177 1.351 1.00 0.00 O ATOM 875 CB PHE A 68 -12.621 -4.285 3.471 1.00 0.00 C ATOM 876 CG PHE A 68 -13.758 -4.590 4.431 1.00 0.00 C ATOM 877 CD1 PHE A 68 -14.866 -3.728 4.513 1.00 0.00 C ATOM 878 CD2 PHE A 68 -13.735 -5.764 5.207 1.00 0.00 C ATOM 879 CE1 PHE A 68 -15.933 -4.029 5.372 1.00 0.00 C ATOM 880 CE2 PHE A 68 -14.812 -6.071 6.055 1.00 0.00 C ATOM 881 CZ PHE A 68 -15.910 -5.201 6.141 1.00 0.00 C ATOM 0 H PHE A 68 -13.283 -6.114 1.414 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.622 -3.196 1.979 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.882 -5.084 3.534 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -12.127 -3.367 3.790 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.895 -2.831 3.912 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -12.887 -6.431 5.150 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.775 -3.356 5.441 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -14.795 -6.978 6.642 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.735 -5.434 6.798 1.00 0.00 H new ATOM 891 N ASN A 69 -12.286 -3.896 -0.262 1.00 0.00 N ATOM 892 CA ASN A 69 -11.513 -3.804 -1.480 1.00 0.00 C ATOM 893 C ASN A 69 -11.046 -2.387 -1.847 1.00 0.00 C ATOM 894 O ASN A 69 -11.869 -1.562 -2.256 1.00 0.00 O ATOM 895 CB ASN A 69 -12.378 -4.460 -2.570 1.00 0.00 C ATOM 896 CG ASN A 69 -12.168 -3.994 -3.991 1.00 0.00 C ATOM 897 OD1 ASN A 69 -12.989 -3.266 -4.546 1.00 0.00 O ATOM 898 ND2 ASN A 69 -11.158 -4.538 -4.633 1.00 0.00 N ATOM 0 H ASN A 69 -13.282 -3.841 -0.477 1.00 0.00 H new ATOM 0 HA ASN A 69 -10.562 -4.322 -1.354 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -12.204 -5.535 -2.538 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -13.425 -4.299 -2.313 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -11.033 -4.362 -5.630 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.499 -5.136 -4.134 1.00 0.00 H new ATOM 905 N ASP A 70 -9.739 -2.141 -1.727 1.00 0.00 N ATOM 906 CA ASP A 70 -9.047 -0.876 -2.019 1.00 0.00 C ATOM 907 C ASP A 70 -8.929 -0.622 -3.524 1.00 0.00 C ATOM 908 O ASP A 70 -9.082 -1.539 -4.355 1.00 0.00 O ATOM 909 CB ASP A 70 -7.624 -0.909 -1.404 1.00 0.00 C ATOM 910 CG ASP A 70 -6.564 -0.081 -2.156 1.00 0.00 C ATOM 911 OD1 ASP A 70 -6.637 1.162 -2.178 1.00 0.00 O ATOM 912 OD2 ASP A 70 -5.648 -0.687 -2.756 1.00 0.00 O ATOM 0 H ASP A 70 -9.093 -2.861 -1.404 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.638 -0.071 -1.582 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -7.681 -0.549 -0.377 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.289 -1.945 -1.360 1.00 0.00 H new ATOM 917 N LEU A 71 -8.802 0.660 -3.876 1.00 0.00 N ATOM 918 CA LEU A 71 -8.609 1.100 -5.237 1.00 0.00 C ATOM 919 C LEU A 71 -7.680 2.310 -5.200 1.00 0.00 C ATOM 920 O LEU A 71 -8.143 3.423 -4.938 1.00 0.00 O ATOM 921 CB LEU A 71 -9.976 1.386 -5.879 1.00 0.00 C ATOM 922 CG LEU A 71 -9.927 1.459 -7.413 1.00 0.00 C ATOM 923 CD1 LEU A 71 -11.357 1.391 -7.952 1.00 0.00 C ATOM 924 CD2 LEU A 71 -9.258 2.728 -7.954 1.00 0.00 C ATOM 0 H LEU A 71 -8.833 1.425 -3.202 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.140 0.337 -5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.678 0.607 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.362 2.328 -5.490 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.321 0.618 -7.748 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -11.338 1.442 -9.041 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.819 0.454 -7.640 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.934 2.228 -7.560 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -9.262 2.705 -9.044 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -9.806 3.604 -7.607 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.230 2.778 -7.596 1.00 0.00 H new ATOM 936 N ILE A 72 -6.406 2.137 -5.562 1.00 0.00 N ATOM 937 CA ILE A 72 -5.473 3.269 -5.552 1.00 0.00 C ATOM 938 C ILE A 72 -5.628 3.981 -6.891 1.00 0.00 C ATOM 939 O ILE A 72 -5.739 3.328 -7.939 1.00 0.00 O ATOM 940 CB ILE A 72 -4.006 2.815 -5.417 1.00 0.00 C ATOM 941 CG1 ILE A 72 -3.840 1.989 -4.133 1.00 0.00 C ATOM 942 CG2 ILE A 72 -3.046 4.029 -5.463 1.00 0.00 C ATOM 943 CD1 ILE A 72 -2.394 1.575 -3.884 1.00 0.00 C ATOM 0 H ILE A 72 -6.003 1.248 -5.859 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.702 3.909 -4.700 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.743 2.179 -6.262 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -4.199 2.569 -3.283 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -4.463 1.097 -4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.017 3.683 -5.366 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.165 4.551 -6.412 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.279 4.709 -4.643 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.335 0.994 -2.964 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.040 0.970 -4.719 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.772 2.465 -3.791 1.00 0.00 H new ATOM 955 N LEU A 73 -5.664 5.307 -6.853 1.00 0.00 N ATOM 956 CA LEU A 73 -5.764 6.172 -8.010 1.00 0.00 C ATOM 957 C LEU A 73 -4.394 6.825 -8.178 1.00 0.00 C ATOM 958 O LEU A 73 -3.817 7.324 -7.214 1.00 0.00 O ATOM 959 CB LEU A 73 -6.857 7.234 -7.795 1.00 0.00 C ATOM 960 CG LEU A 73 -7.821 7.465 -8.966 1.00 0.00 C ATOM 961 CD1 LEU A 73 -7.100 8.013 -10.201 1.00 0.00 C ATOM 962 CD2 LEU A 73 -8.631 6.203 -9.294 1.00 0.00 C ATOM 0 H LEU A 73 -5.622 5.826 -5.976 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.040 5.611 -8.903 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.443 6.950 -6.921 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.372 8.181 -7.559 1.00 0.00 H new ATOM 0 HG LEU A 73 -8.531 8.228 -8.647 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.819 8.162 -11.006 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.629 8.965 -9.955 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -6.338 7.303 -10.522 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -9.302 6.408 -10.128 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.952 5.395 -9.564 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -9.216 5.909 -8.422 1.00 0.00 H new ATOM 974 N ASP A 74 -3.926 6.873 -9.415 1.00 0.00 N ATOM 975 CA ASP A 74 -2.657 7.452 -9.866 1.00 0.00 C ATOM 976 C ASP A 74 -1.424 6.947 -9.089 1.00 0.00 C ATOM 977 O ASP A 74 -0.748 7.715 -8.399 1.00 0.00 O ATOM 978 CB ASP A 74 -2.799 8.985 -9.891 1.00 0.00 C ATOM 979 CG ASP A 74 -1.586 9.683 -10.501 1.00 0.00 C ATOM 980 OD1 ASP A 74 -1.146 9.297 -11.609 1.00 0.00 O ATOM 981 OD2 ASP A 74 -1.068 10.648 -9.896 1.00 0.00 O ATOM 0 H ASP A 74 -4.458 6.481 -10.192 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.455 7.104 -10.879 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.690 9.253 -10.459 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.948 9.348 -8.874 1.00 0.00 H new ATOM 986 N PHE A 75 -1.157 5.637 -9.153 1.00 0.00 N ATOM 987 CA PHE A 75 -0.010 4.995 -8.495 1.00 0.00 C ATOM 988 C PHE A 75 1.232 5.179 -9.378 1.00 0.00 C ATOM 989 O PHE A 75 1.138 5.001 -10.601 1.00 0.00 O ATOM 990 CB PHE A 75 -0.309 3.499 -8.297 1.00 0.00 C ATOM 991 CG PHE A 75 0.913 2.638 -8.020 1.00 0.00 C ATOM 992 CD1 PHE A 75 1.438 2.515 -6.722 1.00 0.00 C ATOM 993 CD2 PHE A 75 1.553 1.982 -9.086 1.00 0.00 C ATOM 994 CE1 PHE A 75 2.598 1.754 -6.497 1.00 0.00 C ATOM 995 CE2 PHE A 75 2.701 1.203 -8.862 1.00 0.00 C ATOM 996 CZ PHE A 75 3.229 1.099 -7.565 1.00 0.00 C ATOM 0 H PHE A 75 -1.741 4.981 -9.672 1.00 0.00 H new ATOM 0 HA PHE A 75 0.170 5.448 -7.520 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -1.009 3.389 -7.469 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -0.808 3.121 -9.189 1.00 0.00 H new ATOM 0 HD1 PHE A 75 0.948 3.007 -5.895 1.00 0.00 H new ATOM 0 HD2 PHE A 75 1.159 2.078 -10.087 1.00 0.00 H new ATOM 0 HE1 PHE A 75 3.004 1.673 -5.500 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.175 0.687 -9.684 1.00 0.00 H new ATOM 0 HZ PHE A 75 4.120 0.515 -7.390 1.00 0.00 H new ATOM 1006 N GLU A 76 2.388 5.479 -8.790 1.00 0.00 N ATOM 1007 CA GLU A 76 3.663 5.700 -9.446 1.00 0.00 C ATOM 1008 C GLU A 76 4.808 5.060 -8.651 1.00 0.00 C ATOM 1009 O GLU A 76 5.411 5.688 -7.775 1.00 0.00 O ATOM 1010 CB GLU A 76 3.845 7.213 -9.625 1.00 0.00 C ATOM 1011 CG GLU A 76 5.140 7.626 -10.343 1.00 0.00 C ATOM 1012 CD GLU A 76 5.426 6.736 -11.548 1.00 0.00 C ATOM 1013 OE1 GLU A 76 4.863 6.997 -12.642 1.00 0.00 O ATOM 1014 OE2 GLU A 76 6.153 5.735 -11.387 1.00 0.00 O ATOM 0 H GLU A 76 2.457 5.579 -7.777 1.00 0.00 H new ATOM 0 HA GLU A 76 3.679 5.222 -10.426 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.995 7.603 -10.185 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.824 7.686 -8.643 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.061 8.664 -10.668 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.976 7.573 -9.645 1.00 0.00 H new ATOM 1021 N ALA A 77 5.151 3.818 -9.017 1.00 0.00 N ATOM 1022 CA ALA A 77 6.212 3.020 -8.404 1.00 0.00 C ATOM 1023 C ALA A 77 7.569 3.731 -8.350 1.00 0.00 C ATOM 1024 O ALA A 77 8.418 3.357 -7.532 1.00 0.00 O ATOM 1025 CB ALA A 77 6.386 1.715 -9.194 1.00 0.00 C ATOM 0 H ALA A 77 4.678 3.327 -9.776 1.00 0.00 H new ATOM 0 HA ALA A 77 5.900 2.837 -7.376 1.00 0.00 H new ATOM 0 HB1 ALA A 77 7.176 1.117 -8.740 1.00 0.00 H new ATOM 0 HB2 ALA A 77 5.452 1.153 -9.179 1.00 0.00 H new ATOM 0 HB3 ALA A 77 6.653 1.947 -10.225 1.00 0.00 H new ATOM 1031 N SER A 78 7.811 4.705 -9.230 1.00 0.00 N ATOM 1032 CA SER A 78 9.054 5.455 -9.276 1.00 0.00 C ATOM 1033 C SER A 78 9.260 6.274 -7.994 1.00 0.00 C ATOM 1034 O SER A 78 10.413 6.529 -7.620 1.00 0.00 O ATOM 1035 CB SER A 78 9.008 6.374 -10.508 1.00 0.00 C ATOM 1036 OG SER A 78 10.282 6.898 -10.837 1.00 0.00 O ATOM 0 H SER A 78 7.136 4.994 -9.938 1.00 0.00 H new ATOM 0 HA SER A 78 9.896 4.766 -9.349 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.616 5.817 -11.359 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.317 7.196 -10.320 1.00 0.00 H new ATOM 0 HG SER A 78 10.205 7.474 -11.626 1.00 0.00 H new ATOM 1042 N GLU A 79 8.186 6.665 -7.295 1.00 0.00 N ATOM 1043 CA GLU A 79 8.262 7.471 -6.084 1.00 0.00 C ATOM 1044 C GLU A 79 7.431 6.936 -4.931 1.00 0.00 C ATOM 1045 O GLU A 79 7.979 6.811 -3.830 1.00 0.00 O ATOM 1046 CB GLU A 79 7.860 8.928 -6.389 1.00 0.00 C ATOM 1047 CG GLU A 79 8.594 9.467 -7.607 1.00 0.00 C ATOM 1048 CD GLU A 79 8.807 10.983 -7.693 1.00 0.00 C ATOM 1049 OE1 GLU A 79 7.894 11.801 -7.422 1.00 0.00 O ATOM 1050 OE2 GLU A 79 9.905 11.382 -8.137 1.00 0.00 O ATOM 0 H GLU A 79 7.232 6.424 -7.563 1.00 0.00 H new ATOM 0 HA GLU A 79 9.301 7.423 -5.758 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.785 8.982 -6.558 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.078 9.555 -5.525 1.00 0.00 H new ATOM 0 HG2 GLU A 79 9.572 8.987 -7.650 1.00 0.00 H new ATOM 0 HG3 GLU A 79 8.046 9.154 -8.496 1.00 0.00 H new ATOM 1057 N ASP A 80 6.138 6.680 -5.141 1.00 0.00 N ATOM 1058 CA ASP A 80 5.268 6.205 -4.069 1.00 0.00 C ATOM 1059 C ASP A 80 5.668 4.832 -3.545 1.00 0.00 C ATOM 1060 O ASP A 80 6.394 4.060 -4.188 1.00 0.00 O ATOM 1061 CB ASP A 80 3.766 6.346 -4.384 1.00 0.00 C ATOM 1062 CG ASP A 80 3.042 5.126 -4.970 1.00 0.00 C ATOM 1063 OD1 ASP A 80 3.000 4.057 -4.304 1.00 0.00 O ATOM 1064 OD2 ASP A 80 2.417 5.300 -6.032 1.00 0.00 O ATOM 0 H ASP A 80 5.673 6.794 -6.042 1.00 0.00 H new ATOM 0 HA ASP A 80 5.431 6.886 -3.234 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.255 6.629 -3.463 1.00 0.00 H new ATOM 0 HB3 ASP A 80 3.646 7.174 -5.082 1.00 0.00 H new ATOM 1069 N ARG A 81 5.245 4.571 -2.312 1.00 0.00 N ATOM 1070 CA ARG A 81 5.507 3.322 -1.607 1.00 0.00 C ATOM 1071 C ARG A 81 4.261 2.817 -0.905 1.00 0.00 C ATOM 1072 O ARG A 81 3.396 3.577 -0.483 1.00 0.00 O ATOM 1073 CB ARG A 81 6.700 3.442 -0.637 1.00 0.00 C ATOM 1074 CG ARG A 81 6.878 4.735 0.170 1.00 0.00 C ATOM 1075 CD ARG A 81 7.626 5.817 -0.610 1.00 0.00 C ATOM 1076 NE ARG A 81 7.939 6.995 0.210 1.00 0.00 N ATOM 1077 CZ ARG A 81 9.032 7.207 0.946 1.00 0.00 C ATOM 1078 NH1 ARG A 81 10.029 6.324 1.008 1.00 0.00 N ATOM 1079 NH2 ARG A 81 9.153 8.317 1.639 1.00 0.00 N ATOM 0 H ARG A 81 4.699 5.236 -1.764 1.00 0.00 H new ATOM 0 HA ARG A 81 5.787 2.581 -2.356 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.630 2.618 0.073 1.00 0.00 H new ATOM 0 HB3 ARG A 81 7.611 3.288 -1.216 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.899 5.114 0.462 1.00 0.00 H new ATOM 0 HG3 ARG A 81 7.421 4.514 1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.552 5.399 -1.006 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.024 6.124 -1.465 1.00 0.00 H new ATOM 0 HE ARG A 81 7.240 7.737 0.218 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.971 5.452 0.482 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.849 6.520 1.581 1.00 0.00 H new ATOM 0 HH21 ARG A 81 8.411 9.017 1.615 1.00 0.00 H new ATOM 0 HH22 ARG A 81 9.988 8.479 2.201 1.00 0.00 H new ATOM 1093 N ILE A 82 4.218 1.510 -0.660 1.00 0.00 N ATOM 1094 CA ILE A 82 3.110 0.833 -0.008 1.00 0.00 C ATOM 1095 C ILE A 82 3.675 0.172 1.249 1.00 0.00 C ATOM 1096 O ILE A 82 4.589 -0.660 1.197 1.00 0.00 O ATOM 1097 CB ILE A 82 2.425 -0.122 -1.008 1.00 0.00 C ATOM 1098 CG1 ILE A 82 1.969 0.651 -2.276 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.236 -0.820 -0.334 1.00 0.00 C ATOM 1100 CD1 ILE A 82 1.107 -0.142 -3.265 1.00 0.00 C ATOM 0 H ILE A 82 4.976 0.879 -0.918 1.00 0.00 H new ATOM 0 HA ILE A 82 2.315 1.509 0.309 1.00 0.00 H new ATOM 0 HB ILE A 82 3.142 -0.882 -1.319 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.410 1.532 -1.960 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.856 1.007 -2.800 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.758 -1.492 -1.046 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.589 -1.392 0.524 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.516 -0.072 -0.001 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.846 0.494 -4.111 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.665 -1.008 -3.620 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.196 -0.476 -2.768 1.00 0.00 H new ATOM 1112 N ASP A 83 3.153 0.570 2.409 1.00 0.00 N ATOM 1113 CA ASP A 83 3.571 0.080 3.713 1.00 0.00 C ATOM 1114 C ASP A 83 2.917 -1.265 4.031 1.00 0.00 C ATOM 1115 O ASP A 83 1.700 -1.404 4.108 1.00 0.00 O ATOM 1116 CB ASP A 83 3.274 1.131 4.789 1.00 0.00 C ATOM 1117 CG ASP A 83 3.833 0.750 6.156 1.00 0.00 C ATOM 1118 OD1 ASP A 83 4.515 -0.290 6.298 1.00 0.00 O ATOM 1119 OD2 ASP A 83 3.550 1.475 7.139 1.00 0.00 O ATOM 0 H ASP A 83 2.406 1.263 2.464 1.00 0.00 H new ATOM 0 HA ASP A 83 4.648 -0.089 3.697 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.696 2.088 4.482 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.196 1.269 4.868 1.00 0.00 H new ATOM 1124 N LEU A 84 3.770 -2.292 4.158 1.00 0.00 N ATOM 1125 CA LEU A 84 3.385 -3.671 4.444 1.00 0.00 C ATOM 1126 C LEU A 84 3.386 -4.000 5.939 1.00 0.00 C ATOM 1127 O LEU A 84 3.139 -5.146 6.318 1.00 0.00 O ATOM 1128 CB LEU A 84 4.248 -4.593 3.569 1.00 0.00 C ATOM 1129 CG LEU A 84 3.625 -5.958 3.221 1.00 0.00 C ATOM 1130 CD1 LEU A 84 2.226 -5.848 2.594 1.00 0.00 C ATOM 1131 CD2 LEU A 84 4.551 -6.636 2.203 1.00 0.00 C ATOM 0 H LEU A 84 4.779 -2.176 4.060 1.00 0.00 H new ATOM 0 HA LEU A 84 2.341 -3.835 4.177 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.477 -4.071 2.640 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.195 -4.766 4.080 1.00 0.00 H new ATOM 0 HG LEU A 84 3.518 -6.523 4.147 1.00 0.00 H new ATOM 0 HD11 LEU A 84 1.846 -6.846 2.374 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.553 -5.349 3.291 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.285 -5.271 1.671 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.142 -7.609 1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.630 -6.013 1.312 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.540 -6.768 2.642 1.00 0.00 H new ATOM 1143 N SER A 85 3.645 -3.008 6.797 1.00 0.00 N ATOM 1144 CA SER A 85 3.638 -3.218 8.235 1.00 0.00 C ATOM 1145 C SER A 85 2.223 -3.299 8.807 1.00 0.00 C ATOM 1146 O SER A 85 2.068 -3.717 9.957 1.00 0.00 O ATOM 1147 CB SER A 85 4.407 -2.117 8.958 1.00 0.00 C ATOM 1148 OG SER A 85 3.941 -0.814 8.732 1.00 0.00 O ATOM 0 H SER A 85 3.862 -2.053 6.513 1.00 0.00 H new ATOM 0 HA SER A 85 4.129 -4.177 8.401 1.00 0.00 H new ATOM 0 HB2 SER A 85 4.374 -2.317 10.029 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.453 -2.169 8.656 1.00 0.00 H new ATOM 0 HG SER A 85 4.441 -0.412 7.991 1.00 0.00 H new ATOM 1154 N ALA A 86 1.204 -2.873 8.054 1.00 0.00 N ATOM 1155 CA ALA A 86 -0.187 -2.909 8.488 1.00 0.00 C ATOM 1156 C ALA A 86 -0.648 -4.337 8.701 1.00 0.00 C ATOM 1157 O ALA A 86 -1.481 -4.573 9.579 1.00 0.00 O ATOM 1158 CB ALA A 86 -1.087 -2.048 7.573 1.00 0.00 C ATOM 0 H ALA A 86 1.328 -2.490 7.117 1.00 0.00 H new ATOM 0 HA ALA A 86 -0.276 -2.438 9.467 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -2.117 -2.097 7.925 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -0.745 -1.013 7.596 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -1.034 -2.425 6.552 1.00 0.00 H new ATOM 1164 N LEU A 87 -0.065 -5.281 7.956 1.00 0.00 N ATOM 1165 CA LEU A 87 -0.415 -6.681 8.138 1.00 0.00 C ATOM 1166 C LEU A 87 0.650 -7.306 9.014 1.00 0.00 C ATOM 1167 O LEU A 87 0.440 -7.541 10.205 1.00 0.00 O ATOM 1168 CB LEU A 87 -0.604 -7.381 6.787 1.00 0.00 C ATOM 1169 CG LEU A 87 -1.947 -7.117 6.069 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -2.889 -6.152 6.785 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -1.740 -6.583 4.644 1.00 0.00 C ATOM 0 H LEU A 87 0.636 -5.101 7.237 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.377 -6.790 8.639 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.206 -7.074 6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.501 -8.455 6.939 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.417 -8.100 6.062 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.802 -6.034 6.201 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.137 -6.549 7.769 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.402 -5.183 6.896 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.709 -6.411 4.176 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.185 -5.646 4.684 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.179 -7.313 4.060 1.00 0.00 H new ATOM 1183 N GLY A 88 1.802 -7.551 8.413 1.00 0.00 N ATOM 1184 CA GLY A 88 2.948 -8.153 9.069 1.00 0.00 C ATOM 1185 C GLY A 88 3.469 -9.286 8.207 1.00 0.00 C ATOM 1186 O GLY A 88 2.811 -10.318 8.066 1.00 0.00 O ATOM 0 H GLY A 88 1.969 -7.331 7.431 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.728 -7.408 9.224 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.665 -8.527 10.053 1.00 0.00 H new ATOM 1190 N PHE A 89 4.629 -9.064 7.602 1.00 0.00 N ATOM 1191 CA PHE A 89 5.329 -9.998 6.735 1.00 0.00 C ATOM 1192 C PHE A 89 6.728 -10.249 7.275 1.00 0.00 C ATOM 1193 O PHE A 89 7.158 -9.613 8.238 1.00 0.00 O ATOM 1194 CB PHE A 89 5.454 -9.376 5.338 1.00 0.00 C ATOM 1195 CG PHE A 89 6.453 -8.237 5.228 1.00 0.00 C ATOM 1196 CD1 PHE A 89 6.109 -6.946 5.676 1.00 0.00 C ATOM 1197 CD2 PHE A 89 7.733 -8.468 4.691 1.00 0.00 C ATOM 1198 CE1 PHE A 89 7.029 -5.891 5.565 1.00 0.00 C ATOM 1199 CE2 PHE A 89 8.652 -7.412 4.586 1.00 0.00 C ATOM 1200 CZ PHE A 89 8.291 -6.121 4.996 1.00 0.00 C ATOM 0 H PHE A 89 5.131 -8.182 7.709 1.00 0.00 H new ATOM 0 HA PHE A 89 4.776 -10.936 6.691 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.738 -10.157 4.633 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.474 -9.010 5.031 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.135 -6.767 6.106 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.009 -9.458 4.359 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.766 -4.904 5.917 1.00 0.00 H new ATOM 0 HE2 PHE A 89 9.639 -7.595 4.188 1.00 0.00 H new ATOM 0 HZ PHE A 89 8.985 -5.302 4.874 1.00 0.00 H new ATOM 1210 N SER A 90 7.449 -11.168 6.645 1.00 0.00 N ATOM 1211 CA SER A 90 8.821 -11.469 7.015 1.00 0.00 C ATOM 1212 C SER A 90 9.623 -11.739 5.738 1.00 0.00 C ATOM 1213 O SER A 90 10.776 -11.309 5.664 1.00 0.00 O ATOM 1214 CB SER A 90 8.882 -12.538 8.104 1.00 0.00 C ATOM 1215 OG SER A 90 10.162 -12.536 8.705 1.00 0.00 O ATOM 0 H SER A 90 7.097 -11.723 5.865 1.00 0.00 H new ATOM 0 HA SER A 90 9.306 -10.618 7.493 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.116 -12.348 8.856 1.00 0.00 H new ATOM 0 HB3 SER A 90 8.672 -13.518 7.676 1.00 0.00 H new ATOM 0 HG SER A 90 10.196 -13.222 9.404 1.00 0.00 H new ATOM 1221 N GLY A 91 9.010 -12.320 4.702 1.00 0.00 N ATOM 1222 CA GLY A 91 9.629 -12.614 3.420 1.00 0.00 C ATOM 1223 C GLY A 91 8.520 -12.780 2.391 1.00 0.00 C ATOM 1224 O GLY A 91 7.467 -13.318 2.714 1.00 0.00 O ATOM 0 H GLY A 91 8.032 -12.607 4.742 1.00 0.00 H new ATOM 0 HA2 GLY A 91 10.303 -11.808 3.128 1.00 0.00 H new ATOM 0 HA3 GLY A 91 10.228 -13.522 3.485 1.00 0.00 H new ATOM 1228 N LEU A 92 8.713 -12.282 1.169 1.00 0.00 N ATOM 1229 CA LEU A 92 7.730 -12.379 0.084 1.00 0.00 C ATOM 1230 C LEU A 92 7.607 -13.807 -0.437 1.00 0.00 C ATOM 1231 O LEU A 92 8.387 -14.691 -0.066 1.00 0.00 O ATOM 1232 CB LEU A 92 8.047 -11.389 -1.046 1.00 0.00 C ATOM 1233 CG LEU A 92 9.481 -11.468 -1.619 1.00 0.00 C ATOM 1234 CD1 LEU A 92 9.563 -12.396 -2.835 1.00 0.00 C ATOM 1235 CD2 LEU A 92 9.964 -10.064 -1.979 1.00 0.00 C ATOM 0 H LEU A 92 9.567 -11.793 0.899 1.00 0.00 H new ATOM 0 HA LEU A 92 6.759 -12.104 0.496 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.340 -11.555 -1.859 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.877 -10.377 -0.677 1.00 0.00 H new ATOM 0 HG LEU A 92 10.130 -11.892 -0.852 1.00 0.00 H new ATOM 0 HD11 LEU A 92 10.588 -12.421 -3.205 1.00 0.00 H new ATOM 0 HD12 LEU A 92 9.256 -13.401 -2.547 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.903 -12.026 -3.620 1.00 0.00 H new ATOM 0 HD21 LEU A 92 10.975 -10.119 -2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.298 -9.630 -2.725 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.964 -9.439 -1.086 1.00 0.00 H new ATOM 1247 N GLY A 93 6.610 -14.046 -1.289 1.00 0.00 N ATOM 1248 CA GLY A 93 6.383 -15.370 -1.845 1.00 0.00 C ATOM 1249 C GLY A 93 5.101 -15.491 -2.660 1.00 0.00 C ATOM 1250 O GLY A 93 5.117 -15.100 -3.827 1.00 0.00 O ATOM 0 H GLY A 93 5.949 -13.337 -1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 93 7.230 -15.637 -2.478 1.00 0.00 H new ATOM 0 HA3 GLY A 93 6.353 -16.094 -1.031 1.00 0.00 H new ATOM 1254 N ASP A 94 4.003 -15.986 -2.064 1.00 0.00 N ATOM 1255 CA ASP A 94 2.718 -16.206 -2.760 1.00 0.00 C ATOM 1256 C ASP A 94 1.468 -15.582 -2.132 1.00 0.00 C ATOM 1257 O ASP A 94 0.396 -15.670 -2.732 1.00 0.00 O ATOM 1258 CB ASP A 94 2.507 -17.711 -3.030 1.00 0.00 C ATOM 1259 CG ASP A 94 3.149 -18.142 -4.350 1.00 0.00 C ATOM 1260 OD1 ASP A 94 4.376 -18.410 -4.350 1.00 0.00 O ATOM 1261 OD2 ASP A 94 2.453 -18.200 -5.388 1.00 0.00 O ATOM 0 H ASP A 94 3.979 -16.248 -1.078 1.00 0.00 H new ATOM 0 HA ASP A 94 2.828 -15.653 -3.693 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.933 -18.291 -2.211 1.00 0.00 H new ATOM 0 HB3 ASP A 94 1.440 -17.931 -3.055 1.00 0.00 H new ATOM 1266 N GLY A 95 1.571 -14.913 -0.982 1.00 0.00 N ATOM 1267 CA GLY A 95 0.400 -14.307 -0.328 1.00 0.00 C ATOM 1268 C GLY A 95 -0.268 -15.269 0.640 1.00 0.00 C ATOM 1269 O GLY A 95 -1.484 -15.254 0.743 1.00 0.00 O ATOM 0 H GLY A 95 2.449 -14.775 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY A 95 0.707 -13.408 0.207 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -0.319 -13.997 -1.086 1.00 0.00 H new ATOM 1273 N TYR A 96 0.490 -16.093 1.360 1.00 0.00 N ATOM 1274 CA TYR A 96 -0.061 -17.052 2.306 1.00 0.00 C ATOM 1275 C TYR A 96 0.537 -16.809 3.690 1.00 0.00 C ATOM 1276 O TYR A 96 0.287 -15.778 4.311 1.00 0.00 O ATOM 1277 CB TYR A 96 0.069 -18.469 1.713 1.00 0.00 C ATOM 1278 CG TYR A 96 -0.696 -19.548 2.460 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -2.104 -19.583 2.402 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -0.005 -20.545 3.174 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -2.821 -20.605 3.053 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -0.715 -21.565 3.828 1.00 0.00 C ATOM 1283 CZ TYR A 96 -2.127 -21.602 3.774 1.00 0.00 C ATOM 1284 OH TYR A 96 -2.788 -22.616 4.401 1.00 0.00 O ATOM 0 H TYR A 96 1.508 -16.112 1.301 1.00 0.00 H new ATOM 0 HA TYR A 96 -1.132 -16.925 2.467 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -0.277 -18.448 0.680 1.00 0.00 H new ATOM 0 HB3 TYR A 96 1.124 -18.742 1.690 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -2.637 -18.820 1.854 1.00 0.00 H new ATOM 0 HD2 TYR A 96 1.074 -20.526 3.219 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -3.900 -20.627 3.001 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -0.179 -22.326 4.376 1.00 0.00 H new ATOM 0 HH TYR A 96 -2.141 -23.204 4.843 1.00 0.00 H new ATOM 1294 N GLY A 97 1.369 -17.736 4.132 1.00 0.00 N ATOM 1295 CA GLY A 97 2.084 -17.820 5.390 1.00 0.00 C ATOM 1296 C GLY A 97 3.153 -16.757 5.551 1.00 0.00 C ATOM 1297 O GLY A 97 4.340 -17.065 5.614 1.00 0.00 O ATOM 0 H GLY A 97 1.583 -18.543 3.546 1.00 0.00 H new ATOM 0 HA2 GLY A 97 1.371 -17.734 6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 97 2.546 -18.804 5.471 1.00 0.00 H new ATOM 1301 N GLY A 98 2.719 -15.507 5.633 1.00 0.00 N ATOM 1302 CA GLY A 98 3.584 -14.343 5.813 1.00 0.00 C ATOM 1303 C GLY A 98 4.230 -13.851 4.520 1.00 0.00 C ATOM 1304 O GLY A 98 5.102 -12.982 4.579 1.00 0.00 O ATOM 0 H GLY A 98 1.730 -15.265 5.575 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.000 -13.532 6.248 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.368 -14.591 6.528 1.00 0.00 H new ATOM 1308 N THR A 99 3.780 -14.364 3.370 1.00 0.00 N ATOM 1309 CA THR A 99 4.282 -14.027 2.046 1.00 0.00 C ATOM 1310 C THR A 99 3.341 -13.064 1.304 1.00 0.00 C ATOM 1311 O THR A 99 2.214 -12.840 1.736 1.00 0.00 O ATOM 1312 CB THR A 99 4.555 -15.340 1.294 1.00 0.00 C ATOM 1313 OG1 THR A 99 3.424 -16.189 1.246 1.00 0.00 O ATOM 1314 CG2 THR A 99 5.691 -16.156 1.908 1.00 0.00 C ATOM 0 H THR A 99 3.027 -15.051 3.342 1.00 0.00 H new ATOM 0 HA THR A 99 5.219 -13.475 2.121 1.00 0.00 H new ATOM 0 HB THR A 99 4.828 -15.012 0.291 1.00 0.00 H new ATOM 0 HG1 THR A 99 3.650 -17.007 0.757 1.00 0.00 H new ATOM 0 HG21 THR A 99 5.835 -17.070 1.332 1.00 0.00 H new ATOM 0 HG22 THR A 99 6.610 -15.570 1.893 1.00 0.00 H new ATOM 0 HG23 THR A 99 5.440 -16.411 2.938 1.00 0.00 H new ATOM 1322 N LEU A 100 3.781 -12.511 0.168 1.00 0.00 N ATOM 1323 CA LEU A 100 3.071 -11.559 -0.698 1.00 0.00 C ATOM 1324 C LEU A 100 3.464 -11.841 -2.144 1.00 0.00 C ATOM 1325 O LEU A 100 4.617 -12.216 -2.372 1.00 0.00 O ATOM 1326 CB LEU A 100 3.523 -10.136 -0.274 1.00 0.00 C ATOM 1327 CG LEU A 100 3.377 -8.907 -1.214 1.00 0.00 C ATOM 1328 CD1 LEU A 100 4.371 -8.877 -2.387 1.00 0.00 C ATOM 1329 CD2 LEU A 100 1.967 -8.620 -1.739 1.00 0.00 C ATOM 0 H LEU A 100 4.707 -12.732 -0.197 1.00 0.00 H new ATOM 0 HA LEU A 100 1.988 -11.647 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.984 -9.896 0.642 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.579 -10.207 -0.013 1.00 0.00 H new ATOM 0 HG LEU A 100 3.626 -8.101 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.196 -7.986 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 100 5.390 -8.859 -2.000 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.232 -9.765 -3.004 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.990 -7.741 -2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.609 -9.478 -2.309 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.296 -8.437 -0.899 1.00 0.00 H new ATOM 1341 N LEU A 101 2.535 -11.666 -3.092 1.00 0.00 N ATOM 1342 CA LEU A 101 2.715 -11.835 -4.536 1.00 0.00 C ATOM 1343 C LEU A 101 1.876 -10.829 -5.332 1.00 0.00 C ATOM 1344 O LEU A 101 0.769 -10.503 -4.919 1.00 0.00 O ATOM 1345 CB LEU A 101 2.282 -13.247 -4.907 1.00 0.00 C ATOM 1346 CG LEU A 101 2.323 -13.605 -6.407 1.00 0.00 C ATOM 1347 CD1 LEU A 101 3.719 -13.493 -7.029 1.00 0.00 C ATOM 1348 CD2 LEU A 101 1.843 -15.042 -6.587 1.00 0.00 C ATOM 0 H LEU A 101 1.583 -11.386 -2.856 1.00 0.00 H new ATOM 0 HA LEU A 101 3.763 -11.664 -4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.917 -13.951 -4.370 1.00 0.00 H new ATOM 0 HB3 LEU A 101 1.264 -13.398 -4.547 1.00 0.00 H new ATOM 0 HG LEU A 101 1.679 -12.886 -6.914 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.669 -13.760 -8.085 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.080 -12.469 -6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.402 -14.170 -6.515 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.868 -15.304 -7.645 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.494 -15.716 -6.030 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.823 -15.134 -6.215 1.00 0.00 H new ATOM 1360 N LEU A 102 2.358 -10.375 -6.490 1.00 0.00 N ATOM 1361 CA LEU A 102 1.674 -9.444 -7.390 1.00 0.00 C ATOM 1362 C LEU A 102 1.305 -10.161 -8.674 1.00 0.00 C ATOM 1363 O LEU A 102 1.952 -11.133 -9.070 1.00 0.00 O ATOM 1364 CB LEU A 102 2.512 -8.176 -7.649 1.00 0.00 C ATOM 1365 CG LEU A 102 2.390 -7.464 -9.025 1.00 0.00 C ATOM 1366 CD1 LEU A 102 2.821 -6.010 -8.882 1.00 0.00 C ATOM 1367 CD2 LEU A 102 3.202 -8.079 -10.168 1.00 0.00 C ATOM 0 H LEU A 102 3.273 -10.657 -6.841 1.00 0.00 H new ATOM 0 HA LEU A 102 0.756 -9.102 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.257 -7.449 -6.878 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.560 -8.438 -7.505 1.00 0.00 H new ATOM 0 HG LEU A 102 1.341 -7.575 -9.299 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.736 -5.509 -9.846 1.00 0.00 H new ATOM 0 HD12 LEU A 102 2.180 -5.510 -8.156 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.856 -5.969 -8.542 1.00 0.00 H new ATOM 0 HD21 LEU A 102 3.042 -7.503 -11.079 1.00 0.00 H new ATOM 0 HD22 LEU A 102 4.261 -8.064 -9.911 1.00 0.00 H new ATOM 0 HD23 LEU A 102 2.882 -9.108 -10.329 1.00 0.00 H new ATOM 1379 N LYS A 103 0.244 -9.679 -9.312 1.00 0.00 N ATOM 1380 CA LYS A 103 -0.310 -10.157 -10.572 1.00 0.00 C ATOM 1381 C LYS A 103 -0.952 -8.972 -11.293 1.00 0.00 C ATOM 1382 O LYS A 103 -1.096 -7.866 -10.754 1.00 0.00 O ATOM 1383 CB LYS A 103 -1.341 -11.295 -10.364 1.00 0.00 C ATOM 1384 CG LYS A 103 -0.833 -12.559 -9.645 1.00 0.00 C ATOM 1385 CD LYS A 103 0.236 -13.322 -10.446 1.00 0.00 C ATOM 1386 CE LYS A 103 -0.359 -14.417 -11.339 1.00 0.00 C ATOM 1387 NZ LYS A 103 -0.391 -15.725 -10.656 1.00 0.00 N ATOM 0 H LYS A 103 -0.286 -8.892 -8.937 1.00 0.00 H new ATOM 0 HA LYS A 103 0.495 -10.578 -11.174 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -2.182 -10.895 -9.797 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.726 -11.589 -11.340 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.420 -12.277 -8.676 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.676 -13.223 -9.451 1.00 0.00 H new ATOM 0 HD2 LYS A 103 0.792 -12.617 -11.065 1.00 0.00 H new ATOM 0 HD3 LYS A 103 0.949 -13.771 -9.755 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -1.370 -14.136 -11.634 1.00 0.00 H new ATOM 0 HE3 LYS A 103 0.228 -14.499 -12.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -0.800 -16.439 -11.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 0.577 -16.005 -10.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -0.972 -15.654 -9.797 1.00 0.00 H new ATOM 1401 N THR A 104 -1.349 -9.198 -12.536 1.00 0.00 N ATOM 1402 CA THR A 104 -2.001 -8.228 -13.392 1.00 0.00 C ATOM 1403 C THR A 104 -3.329 -8.820 -13.845 1.00 0.00 C ATOM 1404 O THR A 104 -3.600 -10.008 -13.647 1.00 0.00 O ATOM 1405 CB THR A 104 -1.098 -7.845 -14.573 1.00 0.00 C ATOM 1406 OG1 THR A 104 -0.334 -8.953 -15.015 1.00 0.00 O ATOM 1407 CG2 THR A 104 -0.164 -6.700 -14.183 1.00 0.00 C ATOM 0 H THR A 104 -1.219 -10.101 -12.992 1.00 0.00 H new ATOM 0 HA THR A 104 -2.191 -7.303 -12.848 1.00 0.00 H new ATOM 0 HB THR A 104 -1.743 -7.521 -15.390 1.00 0.00 H new ATOM 0 HG1 THR A 104 0.231 -8.681 -15.769 1.00 0.00 H new ATOM 0 HG21 THR A 104 0.469 -6.441 -15.032 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.755 -5.831 -13.893 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.461 -7.010 -13.345 1.00 0.00 H new ATOM 1415 N ASN A 105 -4.198 -7.974 -14.390 1.00 0.00 N ATOM 1416 CA ASN A 105 -5.490 -8.403 -14.902 1.00 0.00 C ATOM 1417 C ASN A 105 -5.279 -9.260 -16.167 1.00 0.00 C ATOM 1418 O ASN A 105 -4.180 -9.253 -16.725 1.00 0.00 O ATOM 1419 CB ASN A 105 -6.395 -7.220 -15.115 1.00 0.00 C ATOM 1420 CG ASN A 105 -7.778 -7.616 -15.611 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -8.358 -8.579 -15.131 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -8.310 -6.951 -16.621 1.00 0.00 N ATOM 0 H ASN A 105 -4.024 -6.974 -14.488 1.00 0.00 H new ATOM 0 HA ASN A 105 -5.998 -9.033 -14.171 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.494 -6.671 -14.179 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.936 -6.543 -15.835 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -9.210 -7.240 -17.005 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.821 -6.148 -17.017 1.00 0.00 H new ATOM 1429 N ALA A 106 -6.340 -9.935 -16.640 1.00 0.00 N ATOM 1430 CA ALA A 106 -6.397 -10.795 -17.818 1.00 0.00 C ATOM 1431 C ALA A 106 -5.511 -10.238 -18.930 1.00 0.00 C ATOM 1432 O ALA A 106 -4.504 -10.860 -19.283 1.00 0.00 O ATOM 1433 CB ALA A 106 -7.857 -10.946 -18.262 1.00 0.00 C ATOM 0 H ALA A 106 -7.243 -9.885 -16.169 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.012 -11.785 -17.574 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.905 -11.588 -19.142 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -8.438 -11.392 -17.455 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -8.267 -9.966 -18.505 1.00 0.00 H new ATOM 1439 N GLU A 107 -5.837 -9.031 -19.390 1.00 0.00 N ATOM 1440 CA GLU A 107 -5.097 -8.335 -20.428 1.00 0.00 C ATOM 1441 C GLU A 107 -3.790 -7.786 -19.842 1.00 0.00 C ATOM 1442 O GLU A 107 -2.715 -8.046 -20.377 1.00 0.00 O ATOM 1443 CB GLU A 107 -5.976 -7.220 -21.002 1.00 0.00 C ATOM 1444 CG GLU A 107 -5.295 -6.539 -22.196 1.00 0.00 C ATOM 1445 CD GLU A 107 -6.183 -5.500 -22.880 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -7.353 -5.292 -22.484 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -5.700 -4.857 -23.836 1.00 0.00 O ATOM 0 H GLU A 107 -6.638 -8.504 -19.042 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.837 -9.016 -21.238 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -6.935 -7.633 -21.314 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -6.183 -6.481 -20.228 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -4.378 -6.058 -21.857 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -5.007 -7.298 -22.924 1.00 0.00 H new ATOM 1454 N GLY A 108 -3.857 -7.057 -18.721 1.00 0.00 N ATOM 1455 CA GLY A 108 -2.718 -6.451 -18.034 1.00 0.00 C ATOM 1456 C GLY A 108 -2.868 -4.948 -17.811 1.00 0.00 C ATOM 1457 O GLY A 108 -2.024 -4.349 -17.158 1.00 0.00 O ATOM 0 H GLY A 108 -4.743 -6.868 -18.252 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.583 -6.941 -17.070 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.814 -6.635 -18.615 1.00 0.00 H new ATOM 1461 N THR A 109 -3.966 -4.351 -18.272 1.00 0.00 N ATOM 1462 CA THR A 109 -4.287 -2.930 -18.187 1.00 0.00 C ATOM 1463 C THR A 109 -4.483 -2.474 -16.742 1.00 0.00 C ATOM 1464 O THR A 109 -4.416 -1.285 -16.446 1.00 0.00 O ATOM 1465 CB THR A 109 -5.559 -2.668 -19.023 1.00 0.00 C ATOM 1466 OG1 THR A 109 -5.757 -3.692 -19.992 1.00 0.00 O ATOM 1467 CG2 THR A 109 -5.509 -1.310 -19.719 1.00 0.00 C ATOM 0 H THR A 109 -4.699 -4.881 -18.744 1.00 0.00 H new ATOM 0 HA THR A 109 -3.451 -2.353 -18.582 1.00 0.00 H new ATOM 0 HB THR A 109 -6.398 -2.669 -18.327 1.00 0.00 H new ATOM 0 HG1 THR A 109 -6.587 -3.521 -20.484 1.00 0.00 H new ATOM 0 HG21 THR A 109 -6.422 -1.163 -20.297 1.00 0.00 H new ATOM 0 HG22 THR A 109 -5.422 -0.521 -18.972 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.648 -1.275 -20.386 1.00 0.00 H new ATOM 1475 N ARG A 110 -4.789 -3.416 -15.849 1.00 0.00 N ATOM 1476 CA ARG A 110 -4.983 -3.164 -14.415 1.00 0.00 C ATOM 1477 C ARG A 110 -4.077 -4.126 -13.652 1.00 0.00 C ATOM 1478 O ARG A 110 -3.737 -5.195 -14.174 1.00 0.00 O ATOM 1479 CB ARG A 110 -6.465 -3.293 -14.010 1.00 0.00 C ATOM 1480 CG ARG A 110 -6.908 -2.487 -12.775 1.00 0.00 C ATOM 1481 CD ARG A 110 -6.910 -0.962 -12.963 1.00 0.00 C ATOM 1482 NE ARG A 110 -8.099 -0.447 -13.671 1.00 0.00 N ATOM 1483 CZ ARG A 110 -8.131 0.119 -14.885 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -7.057 0.126 -15.667 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -9.262 0.644 -15.340 1.00 0.00 N ATOM 0 H ARG A 110 -4.912 -4.396 -16.104 1.00 0.00 H new ATOM 0 HA ARG A 110 -4.710 -2.138 -14.168 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -7.079 -2.986 -14.857 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -6.679 -4.346 -13.826 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -7.912 -2.805 -12.493 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -6.250 -2.735 -11.942 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -6.847 -0.485 -11.985 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.016 -0.673 -13.516 1.00 0.00 H new ATOM 0 HE ARG A 110 -8.991 -0.531 -13.184 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -6.190 -0.304 -15.346 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -7.100 0.562 -16.588 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -10.105 0.616 -14.766 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -9.289 1.075 -16.264 1.00 0.00 H new ATOM 1499 N THR A 111 -3.796 -3.816 -12.392 1.00 0.00 N ATOM 1500 CA THR A 111 -2.920 -4.606 -11.526 1.00 0.00 C ATOM 1501 C THR A 111 -3.684 -5.079 -10.271 1.00 0.00 C ATOM 1502 O THR A 111 -4.550 -4.354 -9.776 1.00 0.00 O ATOM 1503 CB THR A 111 -1.660 -3.745 -11.318 1.00 0.00 C ATOM 1504 OG1 THR A 111 -0.967 -3.644 -12.538 1.00 0.00 O ATOM 1505 CG2 THR A 111 -0.652 -4.297 -10.329 1.00 0.00 C ATOM 0 H THR A 111 -4.178 -2.990 -11.931 1.00 0.00 H new ATOM 0 HA THR A 111 -2.591 -5.554 -11.952 1.00 0.00 H new ATOM 0 HB THR A 111 -2.037 -2.799 -10.929 1.00 0.00 H new ATOM 0 HG1 THR A 111 -0.059 -3.995 -12.428 1.00 0.00 H new ATOM 0 HG21 THR A 111 0.196 -3.616 -10.256 1.00 0.00 H new ATOM 0 HG22 THR A 111 -1.121 -4.399 -9.350 1.00 0.00 H new ATOM 0 HG23 THR A 111 -0.306 -5.273 -10.669 1.00 0.00 H new ATOM 1513 N TYR A 112 -3.423 -6.321 -9.818 1.00 0.00 N ATOM 1514 CA TYR A 112 -4.041 -7.002 -8.662 1.00 0.00 C ATOM 1515 C TYR A 112 -2.999 -7.827 -7.883 1.00 0.00 C ATOM 1516 O TYR A 112 -2.441 -8.766 -8.448 1.00 0.00 O ATOM 1517 CB TYR A 112 -5.097 -8.008 -9.185 1.00 0.00 C ATOM 1518 CG TYR A 112 -6.510 -7.487 -9.361 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -6.786 -6.470 -10.291 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -7.558 -8.024 -8.585 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -8.069 -5.916 -10.371 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -8.859 -7.507 -8.690 1.00 0.00 C ATOM 1523 CZ TYR A 112 -9.109 -6.431 -9.564 1.00 0.00 C ATOM 1524 OH TYR A 112 -10.360 -5.908 -9.654 1.00 0.00 O ATOM 0 H TYR A 112 -2.732 -6.913 -10.278 1.00 0.00 H new ATOM 0 HA TYR A 112 -4.476 -6.240 -8.015 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -4.754 -8.391 -10.146 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -5.130 -8.854 -8.498 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -6.005 -6.114 -10.947 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -7.358 -8.839 -7.905 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -8.264 -5.097 -11.048 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -9.662 -7.931 -8.105 1.00 0.00 H new ATOM 0 HH TYR A 112 -10.956 -6.376 -9.033 1.00 0.00 H new ATOM 1534 N LEU A 113 -2.729 -7.537 -6.604 1.00 0.00 N ATOM 1535 CA LEU A 113 -1.769 -8.290 -5.775 1.00 0.00 C ATOM 1536 C LEU A 113 -2.549 -9.113 -4.761 1.00 0.00 C ATOM 1537 O LEU A 113 -3.750 -8.917 -4.557 1.00 0.00 O ATOM 1538 CB LEU A 113 -0.642 -7.456 -5.118 1.00 0.00 C ATOM 1539 CG LEU A 113 -1.017 -6.271 -4.219 1.00 0.00 C ATOM 1540 CD1 LEU A 113 -1.542 -6.704 -2.848 1.00 0.00 C ATOM 1541 CD2 LEU A 113 0.221 -5.388 -4.012 1.00 0.00 C ATOM 0 H LEU A 113 -3.174 -6.765 -6.107 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.212 -8.939 -6.451 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.032 -8.138 -4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.008 -7.074 -5.918 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.818 -5.728 -4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.790 -5.822 -2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -2.434 -7.317 -2.977 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.776 -7.282 -2.331 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.037 -4.543 -3.374 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.010 -5.973 -3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.571 -5.020 -4.977 1.00 0.00 H new ATOM 1553 N LYS A 114 -1.875 -10.081 -4.153 1.00 0.00 N ATOM 1554 CA LYS A 114 -2.424 -10.979 -3.160 1.00 0.00 C ATOM 1555 C LYS A 114 -1.403 -11.037 -2.043 1.00 0.00 C ATOM 1556 O LYS A 114 -0.234 -11.357 -2.269 1.00 0.00 O ATOM 1557 CB LYS A 114 -2.661 -12.363 -3.781 1.00 0.00 C ATOM 1558 CG LYS A 114 -3.696 -12.305 -4.920 1.00 0.00 C ATOM 1559 CD LYS A 114 -3.992 -13.698 -5.484 1.00 0.00 C ATOM 1560 CE LYS A 114 -2.899 -14.102 -6.481 1.00 0.00 C ATOM 1561 NZ LYS A 114 -2.783 -15.565 -6.606 1.00 0.00 N ATOM 0 H LYS A 114 -0.891 -10.265 -4.350 1.00 0.00 H new ATOM 0 HA LYS A 114 -3.387 -10.637 -2.782 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -1.719 -12.756 -4.164 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.005 -13.054 -3.011 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.619 -11.857 -4.551 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.325 -11.660 -5.717 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.043 -14.425 -4.673 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.964 -13.701 -5.976 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.121 -13.671 -7.457 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.943 -13.688 -6.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -2.034 -15.797 -7.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.546 -15.975 -5.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.687 -15.958 -6.938 1.00 0.00 H new ATOM 1575 N SER A 115 -1.828 -10.684 -0.844 1.00 0.00 N ATOM 1576 CA SER A 115 -1.002 -10.694 0.342 1.00 0.00 C ATOM 1577 C SER A 115 -1.721 -11.582 1.338 1.00 0.00 C ATOM 1578 O SER A 115 -2.911 -11.819 1.167 1.00 0.00 O ATOM 1579 CB SER A 115 -0.802 -9.266 0.859 1.00 0.00 C ATOM 1580 OG SER A 115 0.506 -9.132 1.367 1.00 0.00 O ATOM 0 H SER A 115 -2.784 -10.375 -0.667 1.00 0.00 H new ATOM 0 HA SER A 115 -0.001 -11.080 0.152 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.967 -8.549 0.054 1.00 0.00 H new ATOM 0 HB3 SER A 115 -1.531 -9.044 1.638 1.00 0.00 H new ATOM 0 HG SER A 115 0.526 -9.428 2.301 1.00 0.00 H new ATOM 1586 N PHE A 116 -0.975 -12.043 2.339 1.00 0.00 N ATOM 1587 CA PHE A 116 -1.309 -12.910 3.465 1.00 0.00 C ATOM 1588 C PHE A 116 -2.814 -13.282 3.513 1.00 0.00 C ATOM 1589 O PHE A 116 -3.543 -12.829 4.401 1.00 0.00 O ATOM 1590 CB PHE A 116 -0.802 -12.212 4.775 1.00 0.00 C ATOM 1591 CG PHE A 116 0.323 -11.223 4.577 1.00 0.00 C ATOM 1592 CD1 PHE A 116 1.615 -11.686 4.312 1.00 0.00 C ATOM 1593 CD2 PHE A 116 0.047 -9.845 4.533 1.00 0.00 C ATOM 1594 CE1 PHE A 116 2.618 -10.785 3.928 1.00 0.00 C ATOM 1595 CE2 PHE A 116 1.063 -8.938 4.194 1.00 0.00 C ATOM 1596 CZ PHE A 116 2.329 -9.418 3.843 1.00 0.00 C ATOM 0 H PHE A 116 0.010 -11.781 2.384 1.00 0.00 H new ATOM 0 HA PHE A 116 -0.806 -13.870 3.351 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -1.641 -11.696 5.242 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -0.471 -12.981 5.474 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.841 -12.738 4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -0.946 -9.485 4.760 1.00 0.00 H new ATOM 0 HE1 PHE A 116 3.610 -11.144 3.699 1.00 0.00 H new ATOM 0 HE2 PHE A 116 0.868 -7.876 4.204 1.00 0.00 H new ATOM 0 HZ PHE A 116 3.089 -8.729 3.504 1.00 0.00 H new ATOM 1606 N GLU A 117 -3.292 -14.148 2.613 1.00 0.00 N ATOM 1607 CA GLU A 117 -4.695 -14.539 2.490 1.00 0.00 C ATOM 1608 C GLU A 117 -5.020 -15.972 2.921 1.00 0.00 C ATOM 1609 O GLU A 117 -4.199 -16.634 3.563 1.00 0.00 O ATOM 1610 CB GLU A 117 -5.192 -14.174 1.080 1.00 0.00 C ATOM 1611 CG GLU A 117 -4.475 -14.798 -0.129 1.00 0.00 C ATOM 1612 CD GLU A 117 -5.206 -14.510 -1.443 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -5.936 -13.497 -1.526 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -5.146 -15.330 -2.384 1.00 0.00 O ATOM 0 H GLU A 117 -2.691 -14.609 1.930 1.00 0.00 H new ATOM 0 HA GLU A 117 -5.261 -13.965 3.224 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -6.246 -14.445 1.018 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -5.135 -13.090 0.977 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -3.458 -14.409 -0.187 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -4.397 -15.876 0.013 1.00 0.00 H new ATOM 1621 N ALA A 118 -6.262 -16.409 2.660 1.00 0.00 N ATOM 1622 CA ALA A 118 -6.791 -17.721 2.993 1.00 0.00 C ATOM 1623 C ALA A 118 -7.484 -18.379 1.794 1.00 0.00 C ATOM 1624 O ALA A 118 -6.819 -18.808 0.855 1.00 0.00 O ATOM 1625 CB ALA A 118 -7.656 -17.611 4.261 1.00 0.00 C ATOM 0 H ALA A 118 -6.950 -15.821 2.188 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.975 -18.405 3.228 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -8.055 -18.593 4.515 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.047 -17.242 5.086 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -8.479 -16.920 4.081 1.00 0.00 H new ATOM 1631 N ASP A 119 -8.811 -18.469 1.820 1.00 0.00 N ATOM 1632 CA ASP A 119 -9.660 -19.090 0.791 1.00 0.00 C ATOM 1633 C ASP A 119 -10.667 -18.102 0.215 1.00 0.00 C ATOM 1634 O ASP A 119 -11.010 -17.131 0.882 1.00 0.00 O ATOM 1635 CB ASP A 119 -10.388 -20.299 1.389 1.00 0.00 C ATOM 1636 CG ASP A 119 -9.424 -21.435 1.706 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -8.639 -21.810 0.808 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -9.408 -21.909 2.869 1.00 0.00 O ATOM 0 H ASP A 119 -9.357 -18.094 2.596 1.00 0.00 H new ATOM 0 HA ASP A 119 -9.017 -19.414 -0.027 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -10.908 -19.998 2.299 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -11.147 -20.650 0.690 1.00 0.00 H new ATOM 1643 N ALA A 120 -11.148 -18.327 -1.014 1.00 0.00 N ATOM 1644 CA ALA A 120 -12.103 -17.433 -1.676 1.00 0.00 C ATOM 1645 C ALA A 120 -13.416 -17.283 -0.910 1.00 0.00 C ATOM 1646 O ALA A 120 -14.024 -16.212 -0.937 1.00 0.00 O ATOM 1647 CB ALA A 120 -12.381 -17.922 -3.098 1.00 0.00 C ATOM 0 H ALA A 120 -10.885 -19.136 -1.577 1.00 0.00 H new ATOM 0 HA ALA A 120 -11.640 -16.446 -1.703 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -13.091 -17.251 -3.581 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -11.451 -17.936 -3.666 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -12.799 -18.928 -3.062 1.00 0.00 H new ATOM 1653 N GLU A 121 -13.864 -18.334 -0.230 1.00 0.00 N ATOM 1654 CA GLU A 121 -15.094 -18.304 0.541 1.00 0.00 C ATOM 1655 C GLU A 121 -14.791 -17.935 1.994 1.00 0.00 C ATOM 1656 O GLU A 121 -15.636 -17.334 2.656 1.00 0.00 O ATOM 1657 CB GLU A 121 -15.826 -19.647 0.410 1.00 0.00 C ATOM 1658 CG GLU A 121 -17.242 -19.551 0.996 1.00 0.00 C ATOM 1659 CD GLU A 121 -18.126 -20.731 0.605 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -18.327 -20.962 -0.612 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -18.731 -21.362 1.502 1.00 0.00 O ATOM 0 H GLU A 121 -13.380 -19.231 -0.201 1.00 0.00 H new ATOM 0 HA GLU A 121 -15.761 -17.536 0.149 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -15.880 -19.937 -0.639 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -15.265 -20.425 0.927 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -17.177 -19.496 2.083 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -17.708 -18.626 0.657 1.00 0.00 H new ATOM 1668 N GLY A 122 -13.586 -18.232 2.485 1.00 0.00 N ATOM 1669 CA GLY A 122 -13.187 -17.940 3.851 1.00 0.00 C ATOM 1670 C GLY A 122 -12.839 -16.471 4.050 1.00 0.00 C ATOM 1671 O GLY A 122 -13.308 -15.868 5.015 1.00 0.00 O ATOM 0 H GLY A 122 -12.857 -18.686 1.935 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -13.994 -18.215 4.530 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -12.326 -18.554 4.115 1.00 0.00 H new ATOM 1675 N ARG A 123 -11.989 -15.916 3.176 1.00 0.00 N ATOM 1676 CA ARG A 123 -11.473 -14.538 3.136 1.00 0.00 C ATOM 1677 C ARG A 123 -10.216 -14.477 2.275 1.00 0.00 C ATOM 1678 O ARG A 123 -9.217 -15.125 2.598 1.00 0.00 O ATOM 1679 CB ARG A 123 -11.170 -13.925 4.525 1.00 0.00 C ATOM 1680 CG ARG A 123 -10.336 -14.803 5.480 1.00 0.00 C ATOM 1681 CD ARG A 123 -10.477 -14.325 6.929 1.00 0.00 C ATOM 1682 NE ARG A 123 -10.305 -15.432 7.881 1.00 0.00 N ATOM 1683 CZ ARG A 123 -10.123 -15.315 9.199 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -10.018 -14.119 9.772 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -10.025 -16.410 9.939 1.00 0.00 N ATOM 0 H ARG A 123 -11.609 -16.470 2.408 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.275 -13.939 2.705 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -10.645 -12.981 4.378 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -12.117 -13.690 5.012 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -10.660 -15.841 5.402 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -9.287 -14.774 5.184 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -9.737 -13.551 7.132 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.458 -13.872 7.070 1.00 0.00 H new ATOM 0 HE ARG A 123 -10.327 -16.378 7.499 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -10.076 -13.274 9.203 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -9.879 -14.047 10.780 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -10.089 -17.329 9.501 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -9.886 -16.334 10.947 1.00 0.00 H new ATOM 1699 N ARG A 124 -10.234 -13.715 1.184 1.00 0.00 N ATOM 1700 CA ARG A 124 -9.097 -13.546 0.296 1.00 0.00 C ATOM 1701 C ARG A 124 -8.928 -12.050 0.016 1.00 0.00 C ATOM 1702 O ARG A 124 -9.864 -11.278 0.229 1.00 0.00 O ATOM 1703 CB ARG A 124 -9.256 -14.414 -0.936 1.00 0.00 C ATOM 1704 CG ARG A 124 -8.380 -15.660 -0.759 1.00 0.00 C ATOM 1705 CD ARG A 124 -8.371 -16.538 -1.989 1.00 0.00 C ATOM 1706 NE ARG A 124 -7.882 -15.824 -3.177 1.00 0.00 N ATOM 1707 CZ ARG A 124 -8.403 -15.854 -4.408 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -9.225 -16.834 -4.777 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -8.101 -14.897 -5.272 1.00 0.00 N ATOM 0 H ARG A 124 -11.058 -13.189 0.891 1.00 0.00 H new ATOM 0 HA ARG A 124 -8.170 -13.889 0.755 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -10.300 -14.699 -1.069 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -8.960 -13.864 -1.829 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -7.360 -15.354 -0.527 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -8.741 -16.236 0.093 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -7.742 -17.410 -1.807 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -9.379 -16.906 -2.178 1.00 0.00 H new ATOM 0 HE ARG A 124 -7.054 -15.242 -3.048 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -9.464 -17.574 -4.117 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.615 -16.845 -5.719 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -7.473 -14.141 -4.997 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -8.496 -14.916 -6.212 1.00 0.00 H new ATOM 1723 N PHE A 125 -7.730 -11.621 -0.373 1.00 0.00 N ATOM 1724 CA PHE A 125 -7.371 -10.259 -0.663 1.00 0.00 C ATOM 1725 C PHE A 125 -7.762 -9.937 -2.101 1.00 0.00 C ATOM 1726 O PHE A 125 -7.138 -10.431 -3.044 1.00 0.00 O ATOM 1727 CB PHE A 125 -5.850 -10.176 -0.514 1.00 0.00 C ATOM 1728 CG PHE A 125 -5.291 -9.699 0.814 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -5.397 -10.500 1.968 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -4.618 -8.465 0.890 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -4.783 -10.103 3.168 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -4.051 -8.043 2.106 1.00 0.00 C ATOM 1733 CZ PHE A 125 -4.113 -8.873 3.238 1.00 0.00 C ATOM 0 H PHE A 125 -6.947 -12.262 -0.498 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.874 -9.556 0.001 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.440 -11.166 -0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.473 -9.513 -1.293 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.954 -11.425 1.930 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.537 -7.841 0.012 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.827 -10.745 4.036 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.567 -7.080 2.170 1.00 0.00 H new ATOM 0 HZ PHE A 125 -3.645 -8.564 4.161 1.00 0.00 H new ATOM 1743 N GLU A 126 -8.796 -9.130 -2.288 1.00 0.00 N ATOM 1744 CA GLU A 126 -9.248 -8.709 -3.619 1.00 0.00 C ATOM 1745 C GLU A 126 -9.143 -7.198 -3.599 1.00 0.00 C ATOM 1746 O GLU A 126 -9.903 -6.512 -2.918 1.00 0.00 O ATOM 1747 CB GLU A 126 -10.648 -9.224 -3.937 1.00 0.00 C ATOM 1748 CG GLU A 126 -11.102 -8.922 -5.374 1.00 0.00 C ATOM 1749 CD GLU A 126 -12.028 -10.007 -5.942 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -13.185 -10.174 -5.489 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -11.598 -10.714 -6.893 1.00 0.00 O ATOM 0 H GLU A 126 -9.351 -8.744 -1.524 1.00 0.00 H new ATOM 0 HA GLU A 126 -8.640 -9.129 -4.420 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -10.675 -10.302 -3.775 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.357 -8.779 -3.239 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -11.618 -7.962 -5.394 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -10.226 -8.826 -6.015 1.00 0.00 H new ATOM 1758 N VAL A 127 -8.198 -6.677 -4.362 1.00 0.00 N ATOM 1759 CA VAL A 127 -7.893 -5.253 -4.447 1.00 0.00 C ATOM 1760 C VAL A 127 -7.474 -4.907 -5.876 1.00 0.00 C ATOM 1761 O VAL A 127 -7.043 -5.803 -6.601 1.00 0.00 O ATOM 1762 CB VAL A 127 -6.736 -4.989 -3.451 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -6.228 -3.558 -3.542 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -7.161 -5.225 -1.998 1.00 0.00 C ATOM 0 H VAL A 127 -7.601 -7.249 -4.960 1.00 0.00 H new ATOM 0 HA VAL A 127 -8.757 -4.636 -4.198 1.00 0.00 H new ATOM 0 HB VAL A 127 -5.950 -5.691 -3.731 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -5.417 -3.414 -2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -5.862 -3.365 -4.550 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -7.040 -2.868 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -6.318 -5.028 -1.336 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -7.984 -4.556 -1.747 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -7.484 -6.259 -1.877 1.00 0.00 H new ATOM 1774 N ALA A 128 -7.614 -3.639 -6.287 1.00 0.00 N ATOM 1775 CA ALA A 128 -7.208 -3.201 -7.624 1.00 0.00 C ATOM 1776 C ALA A 128 -6.303 -1.980 -7.522 1.00 0.00 C ATOM 1777 O ALA A 128 -6.476 -1.126 -6.653 1.00 0.00 O ATOM 1778 CB ALA A 128 -8.410 -2.880 -8.512 1.00 0.00 C ATOM 0 H ALA A 128 -8.008 -2.898 -5.707 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.665 -4.025 -8.086 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -8.062 -2.559 -9.494 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -9.031 -3.770 -8.620 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.996 -2.082 -8.056 1.00 0.00 H new ATOM 1784 N LEU A 129 -5.386 -1.845 -8.469 1.00 0.00 N ATOM 1785 CA LEU A 129 -4.417 -0.762 -8.564 1.00 0.00 C ATOM 1786 C LEU A 129 -4.551 -0.122 -9.942 1.00 0.00 C ATOM 1787 O LEU A 129 -4.662 -0.865 -10.929 1.00 0.00 O ATOM 1788 CB LEU A 129 -3.023 -1.395 -8.438 1.00 0.00 C ATOM 1789 CG LEU A 129 -1.883 -0.361 -8.485 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -1.500 -0.032 -7.048 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -0.677 -0.875 -9.267 1.00 0.00 C ATOM 0 H LEU A 129 -5.293 -2.520 -9.228 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.575 -0.010 -7.791 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.965 -1.948 -7.501 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.884 -2.117 -9.243 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.223 0.534 -9.006 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.692 0.700 -7.045 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.364 0.379 -6.526 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.169 -0.939 -6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.103 -0.114 -9.275 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.296 -1.780 -8.794 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -0.976 -1.099 -10.291 1.00 0.00 H new ATOM 1803 N ASP A 130 -4.583 1.210 -10.021 1.00 0.00 N ATOM 1804 CA ASP A 130 -4.690 1.942 -11.286 1.00 0.00 C ATOM 1805 C ASP A 130 -3.319 2.569 -11.579 1.00 0.00 C ATOM 1806 O ASP A 130 -2.924 3.520 -10.893 1.00 0.00 O ATOM 1807 CB ASP A 130 -5.845 2.969 -11.242 1.00 0.00 C ATOM 1808 CG ASP A 130 -6.354 3.415 -12.623 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -5.624 3.271 -13.633 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -7.519 3.876 -12.709 1.00 0.00 O ATOM 0 H ASP A 130 -4.535 1.816 -9.202 1.00 0.00 H new ATOM 0 HA ASP A 130 -4.946 1.271 -12.106 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.676 2.538 -10.684 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -5.512 3.848 -10.690 1.00 0.00 H new ATOM 1815 N GLY A 131 -2.582 2.029 -12.556 1.00 0.00 N ATOM 1816 CA GLY A 131 -1.247 2.482 -12.963 1.00 0.00 C ATOM 1817 C GLY A 131 -0.703 1.668 -14.149 1.00 0.00 C ATOM 1818 O GLY A 131 -1.458 0.892 -14.749 1.00 0.00 O ATOM 0 H GLY A 131 -2.911 1.235 -13.105 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -1.289 3.537 -13.235 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -0.562 2.397 -12.120 1.00 0.00 H new ATOM 1822 N ASP A 132 0.575 1.852 -14.508 1.00 0.00 N ATOM 1823 CA ASP A 132 1.273 1.163 -15.614 1.00 0.00 C ATOM 1824 C ASP A 132 2.671 0.640 -15.219 1.00 0.00 C ATOM 1825 O ASP A 132 3.167 -0.325 -15.799 1.00 0.00 O ATOM 1826 CB ASP A 132 1.373 2.111 -16.825 1.00 0.00 C ATOM 1827 CG ASP A 132 1.822 1.444 -18.140 1.00 0.00 C ATOM 1828 OD1 ASP A 132 1.948 0.207 -18.239 1.00 0.00 O ATOM 1829 OD2 ASP A 132 2.092 2.191 -19.117 1.00 0.00 O ATOM 0 H ASP A 132 1.180 2.511 -14.018 1.00 0.00 H new ATOM 0 HA ASP A 132 0.683 0.284 -15.872 1.00 0.00 H new ATOM 0 HB2 ASP A 132 0.400 2.576 -16.985 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.073 2.911 -16.584 1.00 0.00 H new ATOM 1834 N HIS A 133 3.347 1.228 -14.223 1.00 0.00 N ATOM 1835 CA HIS A 133 4.673 0.791 -13.760 1.00 0.00 C ATOM 1836 C HIS A 133 4.487 -0.384 -12.785 1.00 0.00 C ATOM 1837 O HIS A 133 4.880 -0.346 -11.617 1.00 0.00 O ATOM 1838 CB HIS A 133 5.448 1.977 -13.159 1.00 0.00 C ATOM 1839 CG HIS A 133 5.732 3.097 -14.138 1.00 0.00 C ATOM 1840 ND1 HIS A 133 6.119 4.373 -13.799 1.00 0.00 N ATOM 1841 CD2 HIS A 133 5.633 3.052 -15.506 1.00 0.00 C ATOM 1842 CE1 HIS A 133 6.213 5.096 -14.922 1.00 0.00 C ATOM 1843 NE2 HIS A 133 5.943 4.327 -15.999 1.00 0.00 N ATOM 0 H HIS A 133 2.985 2.031 -13.709 1.00 0.00 H new ATOM 0 HA HIS A 133 5.281 0.435 -14.592 1.00 0.00 H new ATOM 0 HB2 HIS A 133 4.880 2.379 -12.320 1.00 0.00 H new ATOM 0 HB3 HIS A 133 6.394 1.612 -12.758 1.00 0.00 H new ATOM 0 HD1 HIS A 133 6.303 4.710 -12.854 1.00 0.00 H new ATOM 0 HD2 HIS A 133 5.364 2.189 -16.097 1.00 0.00 H new ATOM 0 HE1 HIS A 133 6.468 6.145 -14.961 1.00 0.00 H new ATOM 1851 N THR A 134 3.832 -1.428 -13.282 1.00 0.00 N ATOM 1852 CA THR A 134 3.483 -2.656 -12.600 1.00 0.00 C ATOM 1853 C THR A 134 4.644 -3.651 -12.582 1.00 0.00 C ATOM 1854 O THR A 134 5.419 -3.752 -13.542 1.00 0.00 O ATOM 1855 CB THR A 134 2.221 -3.227 -13.294 1.00 0.00 C ATOM 1856 OG1 THR A 134 1.722 -4.380 -12.644 1.00 0.00 O ATOM 1857 CG2 THR A 134 2.398 -3.602 -14.772 1.00 0.00 C ATOM 0 H THR A 134 3.509 -1.431 -14.249 1.00 0.00 H new ATOM 0 HA THR A 134 3.268 -2.458 -11.550 1.00 0.00 H new ATOM 0 HB THR A 134 1.524 -2.392 -13.227 1.00 0.00 H new ATOM 0 HG1 THR A 134 1.875 -5.166 -13.209 1.00 0.00 H new ATOM 0 HG21 THR A 134 1.458 -3.991 -15.164 1.00 0.00 H new ATOM 0 HG22 THR A 134 2.689 -2.718 -15.339 1.00 0.00 H new ATOM 0 HG23 THR A 134 3.172 -4.364 -14.864 1.00 0.00 H new ATOM 1865 N GLY A 135 4.740 -4.419 -11.495 1.00 0.00 N ATOM 1866 CA GLY A 135 5.731 -5.464 -11.294 1.00 0.00 C ATOM 1867 C GLY A 135 6.981 -5.107 -10.506 1.00 0.00 C ATOM 1868 O GLY A 135 7.586 -6.040 -9.967 1.00 0.00 O ATOM 0 H GLY A 135 4.103 -4.322 -10.704 1.00 0.00 H new ATOM 0 HA2 GLY A 135 5.242 -6.298 -10.789 1.00 0.00 H new ATOM 0 HA3 GLY A 135 6.043 -5.824 -12.274 1.00 0.00 H new ATOM 1872 N ASP A 136 7.387 -3.837 -10.406 1.00 0.00 N ATOM 1873 CA ASP A 136 8.599 -3.495 -9.648 1.00 0.00 C ATOM 1874 C ASP A 136 8.288 -3.103 -8.216 1.00 0.00 C ATOM 1875 O ASP A 136 7.698 -2.050 -7.970 1.00 0.00 O ATOM 1876 CB ASP A 136 9.458 -2.399 -10.278 1.00 0.00 C ATOM 1877 CG ASP A 136 10.840 -2.285 -9.596 1.00 0.00 C ATOM 1878 OD1 ASP A 136 11.203 -3.099 -8.708 1.00 0.00 O ATOM 1879 OD2 ASP A 136 11.620 -1.395 -10.013 1.00 0.00 O ATOM 0 H ASP A 136 6.907 -3.043 -10.830 1.00 0.00 H new ATOM 0 HA ASP A 136 9.180 -4.417 -9.668 1.00 0.00 H new ATOM 0 HB2 ASP A 136 9.593 -2.609 -11.339 1.00 0.00 H new ATOM 0 HB3 ASP A 136 8.938 -1.444 -10.206 1.00 0.00 H new ATOM 1884 N LEU A 137 8.596 -3.996 -7.284 1.00 0.00 N ATOM 1885 CA LEU A 137 8.438 -3.823 -5.856 1.00 0.00 C ATOM 1886 C LEU A 137 9.838 -4.126 -5.369 1.00 0.00 C ATOM 1887 O LEU A 137 10.385 -5.189 -5.683 1.00 0.00 O ATOM 1888 CB LEU A 137 7.479 -4.809 -5.193 1.00 0.00 C ATOM 1889 CG LEU A 137 5.978 -4.494 -5.294 1.00 0.00 C ATOM 1890 CD1 LEU A 137 5.431 -4.661 -6.715 1.00 0.00 C ATOM 1891 CD2 LEU A 137 5.213 -5.444 -4.363 1.00 0.00 C ATOM 0 H LEU A 137 8.984 -4.909 -7.523 1.00 0.00 H new ATOM 0 HA LEU A 137 8.025 -2.842 -5.622 1.00 0.00 H new ATOM 0 HB2 LEU A 137 7.649 -5.793 -5.629 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.741 -4.879 -4.137 1.00 0.00 H new ATOM 0 HG LEU A 137 5.843 -3.451 -5.009 1.00 0.00 H new ATOM 0 HD11 LEU A 137 4.367 -4.425 -6.725 1.00 0.00 H new ATOM 0 HD12 LEU A 137 5.959 -3.987 -7.390 1.00 0.00 H new ATOM 0 HD13 LEU A 137 5.578 -5.690 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.146 -5.232 -4.424 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.396 -6.475 -4.665 1.00 0.00 H new ATOM 0 HD23 LEU A 137 5.553 -5.301 -3.337 1.00 0.00 H new ATOM 1903 N SER A 138 10.443 -3.194 -4.655 1.00 0.00 N ATOM 1904 CA SER A 138 11.761 -3.295 -4.123 1.00 0.00 C ATOM 1905 C SER A 138 11.714 -2.632 -2.747 1.00 0.00 C ATOM 1906 O SER A 138 10.663 -2.221 -2.249 1.00 0.00 O ATOM 1907 CB SER A 138 12.744 -2.655 -5.119 1.00 0.00 C ATOM 1908 OG SER A 138 12.807 -3.373 -6.345 1.00 0.00 O ATOM 0 H SER A 138 9.993 -2.307 -4.427 1.00 0.00 H new ATOM 0 HA SER A 138 12.113 -4.318 -3.989 1.00 0.00 H new ATOM 0 HB2 SER A 138 12.441 -1.627 -5.317 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.737 -2.614 -4.672 1.00 0.00 H new ATOM 0 HG SER A 138 12.117 -3.039 -6.955 1.00 0.00 H new ATOM 1914 N ALA A 139 12.885 -2.549 -2.144 1.00 0.00 N ATOM 1915 CA ALA A 139 13.157 -1.992 -0.822 1.00 0.00 C ATOM 1916 C ALA A 139 12.621 -0.573 -0.608 1.00 0.00 C ATOM 1917 O ALA A 139 12.476 -0.162 0.541 1.00 0.00 O ATOM 1918 CB ALA A 139 14.663 -2.037 -0.568 1.00 0.00 C ATOM 0 H ALA A 139 13.734 -2.892 -2.593 1.00 0.00 H new ATOM 0 HA ALA A 139 12.618 -2.610 -0.103 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.878 -1.623 0.417 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.009 -3.070 -0.611 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.178 -1.450 -1.329 1.00 0.00 H new ATOM 1924 N ALA A 140 12.346 0.176 -1.675 1.00 0.00 N ATOM 1925 CA ALA A 140 11.819 1.525 -1.615 1.00 0.00 C ATOM 1926 C ALA A 140 10.288 1.472 -1.650 1.00 0.00 C ATOM 1927 O ALA A 140 9.646 1.900 -0.693 1.00 0.00 O ATOM 1928 CB ALA A 140 12.419 2.341 -2.759 1.00 0.00 C ATOM 0 H ALA A 140 12.490 -0.155 -2.629 1.00 0.00 H new ATOM 0 HA ALA A 140 12.097 2.019 -0.684 1.00 0.00 H new ATOM 0 HB1 ALA A 140 12.029 3.358 -2.724 1.00 0.00 H new ATOM 0 HB2 ALA A 140 13.504 2.364 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 140 12.152 1.883 -3.711 1.00 0.00 H new ATOM 1934 N ASN A 141 9.710 0.881 -2.708 1.00 0.00 N ATOM 1935 CA ASN A 141 8.259 0.740 -2.928 1.00 0.00 C ATOM 1936 C ASN A 141 7.561 -0.091 -1.829 1.00 0.00 C ATOM 1937 O ASN A 141 6.336 -0.112 -1.724 1.00 0.00 O ATOM 1938 CB ASN A 141 8.044 0.178 -4.349 1.00 0.00 C ATOM 1939 CG ASN A 141 6.611 0.130 -4.880 1.00 0.00 C ATOM 1940 OD1 ASN A 141 5.645 0.571 -4.272 1.00 0.00 O ATOM 1941 ND2 ASN A 141 6.415 -0.476 -6.037 1.00 0.00 N ATOM 0 H ASN A 141 10.260 0.472 -3.463 1.00 0.00 H new ATOM 0 HA ASN A 141 7.783 1.718 -2.855 1.00 0.00 H new ATOM 0 HB2 ASN A 141 8.639 0.775 -5.040 1.00 0.00 H new ATOM 0 HB3 ASN A 141 8.446 -0.835 -4.375 1.00 0.00 H new ATOM 0 HD21 ASN A 141 5.470 -0.570 -6.410 1.00 0.00 H new ATOM 0 HD22 ASN A 141 7.208 -0.850 -6.558 1.00 0.00 H new ATOM 1948 N VAL A 142 8.305 -0.792 -0.978 1.00 0.00 N ATOM 1949 CA VAL A 142 7.770 -1.597 0.117 1.00 0.00 C ATOM 1950 C VAL A 142 8.414 -1.063 1.396 1.00 0.00 C ATOM 1951 O VAL A 142 9.596 -0.709 1.401 1.00 0.00 O ATOM 1952 CB VAL A 142 8.062 -3.095 -0.124 1.00 0.00 C ATOM 1953 CG1 VAL A 142 7.471 -3.993 0.976 1.00 0.00 C ATOM 1954 CG2 VAL A 142 7.505 -3.569 -1.477 1.00 0.00 C ATOM 0 H VAL A 142 9.323 -0.817 -1.032 1.00 0.00 H new ATOM 0 HA VAL A 142 6.685 -1.520 0.193 1.00 0.00 H new ATOM 0 HB VAL A 142 9.148 -3.185 -0.114 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.704 -5.035 0.759 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.900 -3.718 1.940 1.00 0.00 H new ATOM 0 HG13 VAL A 142 6.389 -3.863 1.010 1.00 0.00 H new ATOM 0 HG21 VAL A 142 7.729 -4.627 -1.612 1.00 0.00 H new ATOM 0 HG22 VAL A 142 6.425 -3.421 -1.498 1.00 0.00 H new ATOM 0 HG23 VAL A 142 7.965 -2.995 -2.281 1.00 0.00 H new ATOM 1964 N VAL A 143 7.666 -1.031 2.496 1.00 0.00 N ATOM 1965 CA VAL A 143 8.135 -0.554 3.799 1.00 0.00 C ATOM 1966 C VAL A 143 8.114 -1.739 4.768 1.00 0.00 C ATOM 1967 O VAL A 143 7.240 -2.607 4.673 1.00 0.00 O ATOM 1968 CB VAL A 143 7.282 0.638 4.286 1.00 0.00 C ATOM 1969 CG1 VAL A 143 7.913 1.373 5.473 1.00 0.00 C ATOM 1970 CG2 VAL A 143 6.992 1.648 3.162 1.00 0.00 C ATOM 0 H VAL A 143 6.695 -1.342 2.509 1.00 0.00 H new ATOM 0 HA VAL A 143 9.155 -0.176 3.731 1.00 0.00 H new ATOM 0 HB VAL A 143 6.341 0.196 4.615 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.270 2.201 5.772 1.00 0.00 H new ATOM 0 HG12 VAL A 143 8.028 0.683 6.309 1.00 0.00 H new ATOM 0 HG13 VAL A 143 8.890 1.759 5.184 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.389 2.467 3.555 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.932 2.042 2.776 1.00 0.00 H new ATOM 0 HG23 VAL A 143 6.449 1.151 2.358 1.00 0.00 H new ATOM 1980 N PHE A 144 9.120 -1.819 5.642 1.00 0.00 N ATOM 1981 CA PHE A 144 9.266 -2.861 6.654 1.00 0.00 C ATOM 1982 C PHE A 144 8.468 -2.451 7.887 1.00 0.00 C ATOM 1983 O PHE A 144 7.714 -3.255 8.439 1.00 0.00 O ATOM 1984 CB PHE A 144 10.755 -3.072 7.011 1.00 0.00 C ATOM 1985 CG PHE A 144 11.322 -4.422 6.609 1.00 0.00 C ATOM 1986 CD1 PHE A 144 11.599 -4.695 5.257 1.00 0.00 C ATOM 1987 CD2 PHE A 144 11.583 -5.407 7.581 1.00 0.00 C ATOM 1988 CE1 PHE A 144 12.108 -5.948 4.874 1.00 0.00 C ATOM 1989 CE2 PHE A 144 12.094 -6.660 7.200 1.00 0.00 C ATOM 1990 CZ PHE A 144 12.348 -6.935 5.845 1.00 0.00 C ATOM 0 H PHE A 144 9.878 -1.137 5.663 1.00 0.00 H new ATOM 0 HA PHE A 144 8.886 -3.806 6.267 1.00 0.00 H new ATOM 0 HB2 PHE A 144 11.343 -2.290 6.532 1.00 0.00 H new ATOM 0 HB3 PHE A 144 10.877 -2.948 8.087 1.00 0.00 H new ATOM 0 HD1 PHE A 144 11.419 -3.937 4.509 1.00 0.00 H new ATOM 0 HD2 PHE A 144 11.390 -5.199 8.623 1.00 0.00 H new ATOM 0 HE1 PHE A 144 12.315 -6.152 3.834 1.00 0.00 H new ATOM 0 HE2 PHE A 144 12.292 -7.412 7.949 1.00 0.00 H new ATOM 0 HZ PHE A 144 12.727 -7.903 5.551 1.00 0.00 H new