USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 933 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 21 LYS NZ :NH3+ -160:sc= 1.3 (180deg=1.17) USER MOD Set 1.2: A 71 ASN : amide:sc= -1.08 X(o=0.21,f=0.3) USER MOD Single : A 5 MET CE :methyl 174:sc= 0 (180deg=-0.0471) USER MOD Single : A 8 GLN : amide:sc= -0.0276 K(o=-0.028,f=-1.3!) USER MOD Single : A 16 LYS NZ :NH3+ -148:sc= -0.504 (180deg=-1.92!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.287 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ -163:sc= 0.379 (180deg=0.241) USER MOD Single : A 41 SER OG : rot 168:sc= 1.12 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 145:sc= -2.25 (180deg=-5.53!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 73:sc= 1.3 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 42:sc= 0.0427 USER MOD Single : A 63 MET CE :methyl -110:sc= -2.6! (180deg=-5.28!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0386 USER MOD Single : A 84 GLN : amide:sc= -0.672 X(o=-0.67,f=-0.84) USER MOD Single : A 86 TYR OH : rot 150:sc= -0.138 USER MOD Single : A 90 TYR OH : rot 180:sc= -1.2 USER MOD Single : A 94 LYS NZ :NH3+ 155:sc= 0.394 (180deg=0.0164) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 17 N GLU A 2 -16.465 0.615 8.326 1.00 0.00 N ATOM 18 CA GLU A 2 -15.646 -0.151 7.401 1.00 0.00 C ATOM 19 C GLU A 2 -15.219 0.724 6.221 1.00 0.00 C ATOM 20 O GLU A 2 -15.868 1.724 5.917 1.00 0.00 O ATOM 21 CB GLU A 2 -16.386 -1.400 6.919 1.00 0.00 C ATOM 22 CG GLU A 2 -15.466 -2.622 6.934 1.00 0.00 C ATOM 23 CD GLU A 2 -15.814 -3.556 8.095 1.00 0.00 C ATOM 24 OE1 GLU A 2 -17.017 -3.868 8.231 1.00 0.00 O ATOM 25 OE2 GLU A 2 -14.870 -3.937 8.820 1.00 0.00 O ATOM 0 HA GLU A 2 -14.750 -0.481 7.926 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.251 -1.584 7.557 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -16.763 -1.237 5.909 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.555 -3.160 5.990 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.428 -2.299 7.020 1.00 0.00 H new ATOM 32 N TRP A 3 -14.129 0.316 5.588 1.00 0.00 N ATOM 33 CA TRP A 3 -13.607 1.050 4.447 1.00 0.00 C ATOM 34 C TRP A 3 -13.704 0.145 3.218 1.00 0.00 C ATOM 35 O TRP A 3 -13.511 -1.066 3.317 1.00 0.00 O ATOM 36 CB TRP A 3 -12.184 1.543 4.717 1.00 0.00 C ATOM 37 CG TRP A 3 -12.031 2.321 6.025 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.437 1.922 7.158 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.507 3.657 6.291 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.496 2.899 8.131 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.167 3.988 7.587 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.203 4.557 5.464 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.480 5.221 8.170 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.508 5.785 6.062 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.173 6.133 7.365 1.00 0.00 C ATOM 0 H TRP A 3 -13.593 -0.513 5.843 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.196 1.949 4.264 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.511 0.686 4.736 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.868 2.178 3.890 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -10.971 0.957 7.293 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.117 2.834 9.076 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.480 4.319 4.448 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.202 5.457 9.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.041 6.513 5.469 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.446 7.102 7.755 1.00 0.00 H new ATOM 56 N GLU A 4 -14.002 0.767 2.087 1.00 0.00 N ATOM 57 CA GLU A 4 -14.127 0.032 0.839 1.00 0.00 C ATOM 58 C GLU A 4 -13.210 0.636 -0.226 1.00 0.00 C ATOM 59 O GLU A 4 -12.952 1.839 -0.219 1.00 0.00 O ATOM 60 CB GLU A 4 -15.580 0.006 0.361 1.00 0.00 C ATOM 61 CG GLU A 4 -15.971 1.340 -0.280 1.00 0.00 C ATOM 62 CD GLU A 4 -17.436 1.676 0.003 1.00 0.00 C ATOM 63 OE1 GLU A 4 -17.748 1.897 1.193 1.00 0.00 O ATOM 64 OE2 GLU A 4 -18.212 1.703 -0.977 1.00 0.00 O ATOM 0 H GLU A 4 -14.161 1.772 2.008 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.819 -0.999 1.014 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.715 -0.801 -0.359 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.240 -0.204 1.203 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -15.331 2.134 0.105 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.807 1.292 -1.356 1.00 0.00 H new ATOM 71 N MET A 5 -12.743 -0.226 -1.117 1.00 0.00 N ATOM 72 CA MET A 5 -11.860 0.207 -2.187 1.00 0.00 C ATOM 73 C MET A 5 -12.009 -0.689 -3.418 1.00 0.00 C ATOM 74 O MET A 5 -12.896 -1.540 -3.467 1.00 0.00 O ATOM 75 CB MET A 5 -10.410 0.170 -1.700 1.00 0.00 C ATOM 76 CG MET A 5 -9.899 1.578 -1.390 1.00 0.00 C ATOM 77 SD MET A 5 -8.635 1.506 -0.133 1.00 0.00 S ATOM 78 CE MET A 5 -9.176 2.836 0.928 1.00 0.00 C ATOM 0 H MET A 5 -12.959 -1.223 -1.120 1.00 0.00 H new ATOM 0 HA MET A 5 -12.132 1.225 -2.467 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.338 -0.451 -0.807 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.779 -0.290 -2.460 1.00 0.00 H new ATOM 0 HG2 MET A 5 -9.498 2.036 -2.294 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.723 2.207 -1.053 1.00 0.00 H new ATOM 0 HE1 MET A 5 -8.556 2.861 1.824 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.086 3.784 0.398 1.00 0.00 H new ATOM 0 HE3 MET A 5 -10.216 2.676 1.211 1.00 0.00 H new ATOM 88 N GLY A 6 -11.127 -0.468 -4.381 1.00 0.00 N ATOM 89 CA GLY A 6 -11.149 -1.246 -5.609 1.00 0.00 C ATOM 90 C GLY A 6 -9.800 -1.175 -6.327 1.00 0.00 C ATOM 91 O GLY A 6 -9.110 -0.159 -6.261 1.00 0.00 O ATOM 0 H GLY A 6 -10.392 0.238 -4.337 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -11.390 -2.284 -5.382 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -11.935 -0.873 -6.266 1.00 0.00 H new ATOM 95 N LEU A 7 -9.463 -2.269 -6.995 1.00 0.00 N ATOM 96 CA LEU A 7 -8.209 -2.343 -7.725 1.00 0.00 C ATOM 97 C LEU A 7 -8.209 -3.596 -8.604 1.00 0.00 C ATOM 98 O LEU A 7 -9.011 -4.505 -8.395 1.00 0.00 O ATOM 99 CB LEU A 7 -7.023 -2.269 -6.761 1.00 0.00 C ATOM 100 CG LEU A 7 -6.923 -3.398 -5.732 1.00 0.00 C ATOM 101 CD1 LEU A 7 -5.599 -3.329 -4.970 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.128 -3.389 -4.789 1.00 0.00 C ATOM 0 H LEU A 7 -10.037 -3.111 -7.046 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.104 -1.486 -8.390 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.104 -2.256 -7.347 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.073 -1.320 -6.226 1.00 0.00 H new ATOM 0 HG LEU A 7 -6.939 -4.348 -6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.553 -4.142 -4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -4.770 -3.421 -5.672 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.528 -2.374 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.032 -4.201 -4.068 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.169 -2.437 -4.260 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.043 -3.523 -5.366 1.00 0.00 H new ATOM 114 N GLN A 8 -7.301 -3.603 -9.568 1.00 0.00 N ATOM 115 CA GLN A 8 -7.186 -4.729 -10.480 1.00 0.00 C ATOM 116 C GLN A 8 -7.052 -6.035 -9.695 1.00 0.00 C ATOM 117 O GLN A 8 -6.496 -6.051 -8.598 1.00 0.00 O ATOM 118 CB GLN A 8 -6.008 -4.541 -11.437 1.00 0.00 C ATOM 119 CG GLN A 8 -6.479 -4.534 -12.893 1.00 0.00 C ATOM 120 CD GLN A 8 -5.302 -4.723 -13.851 1.00 0.00 C ATOM 121 OE1 GLN A 8 -4.302 -5.345 -13.533 1.00 0.00 O ATOM 122 NE2 GLN A 8 -5.476 -4.153 -15.041 1.00 0.00 N ATOM 0 H GLN A 8 -6.638 -2.847 -9.738 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.094 -4.780 -11.080 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.498 -3.604 -11.212 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.284 -5.342 -11.289 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -7.209 -5.329 -13.047 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.983 -3.592 -13.111 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -6.338 -3.646 -15.243 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.747 -4.223 -15.751 1.00 0.00 H new ATOM 131 N GLU A 9 -7.572 -7.100 -10.288 1.00 0.00 N ATOM 132 CA GLU A 9 -7.517 -8.409 -9.659 1.00 0.00 C ATOM 133 C GLU A 9 -6.072 -8.770 -9.310 1.00 0.00 C ATOM 134 O GLU A 9 -5.811 -9.354 -8.259 1.00 0.00 O ATOM 135 CB GLU A 9 -8.148 -9.476 -10.556 1.00 0.00 C ATOM 136 CG GLU A 9 -9.312 -10.171 -9.847 1.00 0.00 C ATOM 137 CD GLU A 9 -9.716 -11.450 -10.582 1.00 0.00 C ATOM 138 OE1 GLU A 9 -8.794 -12.211 -10.946 1.00 0.00 O ATOM 139 OE2 GLU A 9 -10.939 -11.638 -10.763 1.00 0.00 O ATOM 0 H GLU A 9 -8.033 -7.083 -11.197 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.094 -8.371 -8.735 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.502 -9.017 -11.479 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.395 -10.213 -10.835 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -9.028 -10.410 -8.822 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -10.165 -9.494 -9.791 1.00 0.00 H new ATOM 146 N GLU A 10 -5.171 -8.408 -10.211 1.00 0.00 N ATOM 147 CA GLU A 10 -3.759 -8.687 -10.011 1.00 0.00 C ATOM 148 C GLU A 10 -3.229 -7.905 -8.808 1.00 0.00 C ATOM 149 O GLU A 10 -2.366 -8.392 -8.078 1.00 0.00 O ATOM 150 CB GLU A 10 -2.953 -8.366 -11.272 1.00 0.00 C ATOM 151 CG GLU A 10 -2.332 -9.633 -11.862 1.00 0.00 C ATOM 152 CD GLU A 10 -1.268 -9.287 -12.906 1.00 0.00 C ATOM 153 OE1 GLU A 10 -0.430 -8.413 -12.594 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.315 -9.904 -13.992 1.00 0.00 O ATOM 0 H GLU A 10 -5.391 -7.924 -11.081 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.644 -9.752 -9.807 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.600 -7.895 -12.012 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.168 -7.649 -11.033 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.885 -10.228 -11.066 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.110 -10.245 -12.319 1.00 0.00 H new ATOM 161 N PHE A 11 -3.767 -6.707 -8.637 1.00 0.00 N ATOM 162 CA PHE A 11 -3.359 -5.853 -7.535 1.00 0.00 C ATOM 163 C PHE A 11 -3.956 -6.341 -6.213 1.00 0.00 C ATOM 164 O PHE A 11 -3.384 -6.114 -5.148 1.00 0.00 O ATOM 165 CB PHE A 11 -3.891 -4.450 -7.834 1.00 0.00 C ATOM 166 CG PHE A 11 -2.808 -3.370 -7.880 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.362 -2.806 -6.726 1.00 0.00 C ATOM 168 CD2 PHE A 11 -2.292 -2.975 -9.074 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.357 -1.803 -6.769 1.00 0.00 C ATOM 170 CE2 PHE A 11 -1.287 -1.973 -9.117 1.00 0.00 C ATOM 171 CZ PHE A 11 -0.841 -1.408 -7.963 1.00 0.00 C ATOM 0 H PHE A 11 -4.483 -6.307 -9.244 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.273 -5.864 -7.439 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.413 -4.467 -8.790 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.625 -4.182 -7.074 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.772 -3.120 -5.777 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.647 -3.424 -9.990 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.003 -1.354 -5.853 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -0.877 -1.660 -10.066 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.077 -0.645 -7.995 1.00 0.00 H new ATOM 181 N LEU A 12 -5.099 -7.002 -6.325 1.00 0.00 N ATOM 182 CA LEU A 12 -5.779 -7.524 -5.153 1.00 0.00 C ATOM 183 C LEU A 12 -4.921 -8.617 -4.514 1.00 0.00 C ATOM 184 O LEU A 12 -4.911 -8.771 -3.294 1.00 0.00 O ATOM 185 CB LEU A 12 -7.193 -7.984 -5.514 1.00 0.00 C ATOM 186 CG LEU A 12 -8.324 -7.017 -5.161 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.030 -6.515 -6.423 1.00 0.00 C ATOM 188 CD2 LEU A 12 -9.303 -7.654 -4.173 1.00 0.00 C ATOM 0 H LEU A 12 -5.571 -7.188 -7.210 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.905 -6.740 -4.406 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.228 -8.177 -6.586 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.384 -8.933 -5.013 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.888 -6.148 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.830 -5.829 -6.144 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.313 -5.996 -7.059 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.451 -7.362 -6.966 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.097 -6.945 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.736 -8.550 -4.617 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.774 -7.921 -3.258 1.00 0.00 H new ATOM 200 N GLU A 13 -4.220 -9.349 -5.368 1.00 0.00 N ATOM 201 CA GLU A 13 -3.361 -10.424 -4.903 1.00 0.00 C ATOM 202 C GLU A 13 -2.088 -9.852 -4.275 1.00 0.00 C ATOM 203 O GLU A 13 -1.529 -10.440 -3.351 1.00 0.00 O ATOM 204 CB GLU A 13 -3.025 -11.390 -6.041 1.00 0.00 C ATOM 205 CG GLU A 13 -2.587 -12.750 -5.495 1.00 0.00 C ATOM 206 CD GLU A 13 -3.773 -13.712 -5.405 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.892 -13.213 -5.159 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.534 -14.926 -5.585 1.00 0.00 O ATOM 0 H GLU A 13 -4.230 -9.218 -6.380 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.898 -10.987 -4.140 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.896 -11.516 -6.685 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.231 -10.969 -6.658 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.818 -13.174 -6.140 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.141 -12.623 -4.508 1.00 0.00 H new ATOM 215 N LEU A 14 -1.667 -8.712 -4.803 1.00 0.00 N ATOM 216 CA LEU A 14 -0.471 -8.054 -4.307 1.00 0.00 C ATOM 217 C LEU A 14 -0.585 -7.871 -2.792 1.00 0.00 C ATOM 218 O LEU A 14 0.360 -8.150 -2.056 1.00 0.00 O ATOM 219 CB LEU A 14 -0.222 -6.749 -5.066 1.00 0.00 C ATOM 220 CG LEU A 14 0.291 -6.895 -6.501 1.00 0.00 C ATOM 221 CD1 LEU A 14 1.148 -5.693 -6.902 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.038 -8.218 -6.683 1.00 0.00 C ATOM 0 H LEU A 14 -2.133 -8.227 -5.570 1.00 0.00 H new ATOM 0 HA LEU A 14 0.407 -8.674 -4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.153 -6.182 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.498 -6.156 -4.502 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.568 -6.915 -7.171 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.500 -5.822 -7.926 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.552 -4.783 -6.835 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.004 -5.616 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.392 -8.297 -7.711 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.889 -8.252 -6.002 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.366 -9.048 -6.466 1.00 0.00 H new ATOM 234 N ILE A 15 -1.752 -7.404 -2.371 1.00 0.00 N ATOM 235 CA ILE A 15 -2.003 -7.180 -0.958 1.00 0.00 C ATOM 236 C ILE A 15 -1.837 -8.499 -0.200 1.00 0.00 C ATOM 237 O ILE A 15 -1.214 -8.537 0.860 1.00 0.00 O ATOM 238 CB ILE A 15 -3.368 -6.521 -0.753 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.349 -5.064 -1.220 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.828 -6.652 0.700 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.398 -4.977 -2.747 1.00 0.00 C ATOM 0 H ILE A 15 -2.534 -7.175 -2.984 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.274 -6.481 -0.548 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.097 -7.047 -1.369 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.199 -4.531 -0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.448 -4.572 -0.853 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.801 -6.175 0.818 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.907 -7.707 0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.105 -6.168 1.356 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.383 -3.931 -3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.534 -5.490 -3.169 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.312 -5.448 -3.109 1.00 0.00 H new ATOM 253 N LYS A 16 -2.405 -9.550 -0.774 1.00 0.00 N ATOM 254 CA LYS A 16 -2.328 -10.867 -0.166 1.00 0.00 C ATOM 255 C LYS A 16 -0.863 -11.215 0.103 1.00 0.00 C ATOM 256 O LYS A 16 -0.552 -11.898 1.078 1.00 0.00 O ATOM 257 CB LYS A 16 -3.056 -11.899 -1.030 1.00 0.00 C ATOM 258 CG LYS A 16 -4.426 -12.239 -0.440 1.00 0.00 C ATOM 259 CD LYS A 16 -5.476 -12.393 -1.543 1.00 0.00 C ATOM 260 CE LYS A 16 -6.002 -13.828 -1.603 1.00 0.00 C ATOM 261 NZ LYS A 16 -4.893 -14.794 -1.435 1.00 0.00 N ATOM 0 H LYS A 16 -2.920 -9.516 -1.654 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.839 -10.873 0.797 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.178 -11.511 -2.041 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.454 -12.804 -1.106 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -4.359 -13.163 0.135 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.733 -11.455 0.252 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.303 -11.706 -1.361 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.041 -12.121 -2.505 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.747 -13.981 -0.822 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.500 -13.999 -2.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.098 -15.656 -1.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.008 -14.369 -1.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.793 -15.036 -0.429 1.00 0.00 H new ATOM 275 N LEU A 17 -0.001 -10.729 -0.778 1.00 0.00 N ATOM 276 CA LEU A 17 1.424 -10.980 -0.647 1.00 0.00 C ATOM 277 C LEU A 17 2.038 -9.936 0.288 1.00 0.00 C ATOM 278 O LEU A 17 3.106 -10.158 0.856 1.00 0.00 O ATOM 279 CB LEU A 17 2.087 -11.037 -2.025 1.00 0.00 C ATOM 280 CG LEU A 17 2.212 -12.427 -2.652 1.00 0.00 C ATOM 281 CD1 LEU A 17 2.956 -12.361 -3.987 1.00 0.00 C ATOM 282 CD2 LEU A 17 2.866 -13.411 -1.680 1.00 0.00 C ATOM 0 H LEU A 17 -0.262 -10.163 -1.585 1.00 0.00 H new ATOM 0 HA LEU A 17 1.599 -11.956 -0.194 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.519 -10.403 -2.706 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.085 -10.605 -1.944 1.00 0.00 H new ATOM 0 HG LEU A 17 1.209 -12.799 -2.860 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.031 -13.362 -4.412 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.411 -11.715 -4.675 1.00 0.00 H new ATOM 0 HD13 LEU A 17 3.956 -11.959 -3.827 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.943 -14.391 -2.151 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.863 -13.055 -1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.259 -13.488 -0.778 1.00 0.00 H new ATOM 294 N ARG A 18 1.336 -8.820 0.418 1.00 0.00 N ATOM 295 CA ARG A 18 1.798 -7.741 1.274 1.00 0.00 C ATOM 296 C ARG A 18 1.661 -8.135 2.746 1.00 0.00 C ATOM 297 O ARG A 18 1.997 -7.354 3.636 1.00 0.00 O ATOM 298 CB ARG A 18 1.005 -6.457 1.020 1.00 0.00 C ATOM 299 CG ARG A 18 1.434 -5.798 -0.292 1.00 0.00 C ATOM 300 CD ARG A 18 0.451 -4.699 -0.700 1.00 0.00 C ATOM 301 NE ARG A 18 1.191 -3.500 -1.153 1.00 0.00 N ATOM 302 CZ ARG A 18 0.664 -2.538 -1.922 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.610 -2.628 -2.329 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.410 -1.486 -2.284 1.00 0.00 N ATOM 0 H ARG A 18 0.451 -8.640 -0.055 1.00 0.00 H new ATOM 0 HA ARG A 18 2.847 -7.558 1.040 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.060 -6.684 0.986 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.156 -5.762 1.846 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.433 -5.375 -0.181 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.492 -6.550 -1.079 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.198 -5.059 -1.498 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.191 -4.443 0.143 1.00 0.00 H new ATOM 0 HE ARG A 18 2.163 -3.400 -0.861 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.178 -3.429 -2.053 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.011 -1.896 -2.915 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.379 -1.417 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 18 1.009 -0.754 -2.870 1.00 0.00 H new ATOM 318 N LYS A 19 1.166 -9.345 2.958 1.00 0.00 N ATOM 319 CA LYS A 19 0.979 -9.852 4.307 1.00 0.00 C ATOM 320 C LYS A 19 2.343 -10.183 4.916 1.00 0.00 C ATOM 321 O LYS A 19 2.450 -10.413 6.119 1.00 0.00 O ATOM 322 CB LYS A 19 0.004 -11.031 4.306 1.00 0.00 C ATOM 323 CG LYS A 19 -0.434 -11.381 5.730 1.00 0.00 C ATOM 324 CD LYS A 19 -1.632 -12.333 5.716 1.00 0.00 C ATOM 325 CE LYS A 19 -1.238 -13.717 6.234 1.00 0.00 C ATOM 326 NZ LYS A 19 -2.272 -14.240 7.155 1.00 0.00 N ATOM 0 H LYS A 19 0.888 -9.990 2.218 1.00 0.00 H new ATOM 0 HA LYS A 19 0.522 -9.091 4.940 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.870 -10.784 3.703 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.476 -11.898 3.843 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.395 -11.842 6.267 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -0.695 -10.470 6.268 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.433 -11.925 6.332 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.022 -12.418 4.702 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -1.109 -14.402 5.396 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.279 -13.659 6.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -1.989 -15.180 7.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.376 -13.594 7.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.179 -14.314 6.652 1.00 0.00 H new ATOM 340 N LYS A 20 3.352 -10.196 4.057 1.00 0.00 N ATOM 341 CA LYS A 20 4.704 -10.495 4.495 1.00 0.00 C ATOM 342 C LYS A 20 5.644 -9.378 4.034 1.00 0.00 C ATOM 343 O LYS A 20 6.852 -9.449 4.253 1.00 0.00 O ATOM 344 CB LYS A 20 5.126 -11.887 4.022 1.00 0.00 C ATOM 345 CG LYS A 20 5.262 -12.850 5.203 1.00 0.00 C ATOM 346 CD LYS A 20 4.899 -14.278 4.792 1.00 0.00 C ATOM 347 CE LYS A 20 5.024 -15.238 5.977 1.00 0.00 C ATOM 348 NZ LYS A 20 4.468 -16.565 5.630 1.00 0.00 N ATOM 0 H LYS A 20 3.260 -10.004 3.059 1.00 0.00 H new ATOM 0 HA LYS A 20 4.753 -10.525 5.583 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.391 -12.273 3.316 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.075 -11.822 3.490 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.284 -12.825 5.581 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.613 -12.526 6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.880 -14.301 4.406 1.00 0.00 H new ATOM 0 HD3 LYS A 20 5.553 -14.605 3.984 1.00 0.00 H new ATOM 0 HE2 LYS A 20 6.071 -15.339 6.262 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.497 -14.831 6.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 4.561 -17.204 6.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.463 -16.466 5.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.989 -16.959 4.820 1.00 0.00 H new ATOM 362 N LYS A 21 5.052 -8.374 3.404 1.00 0.00 N ATOM 363 CA LYS A 21 5.821 -7.244 2.910 1.00 0.00 C ATOM 364 C LYS A 21 5.329 -5.963 3.587 1.00 0.00 C ATOM 365 O LYS A 21 5.462 -5.807 4.800 1.00 0.00 O ATOM 366 CB LYS A 21 5.772 -7.190 1.382 1.00 0.00 C ATOM 367 CG LYS A 21 6.298 -8.490 0.770 1.00 0.00 C ATOM 368 CD LYS A 21 7.818 -8.588 0.913 1.00 0.00 C ATOM 369 CE LYS A 21 8.245 -10.013 1.270 1.00 0.00 C ATOM 370 NZ LYS A 21 8.933 -10.035 2.580 1.00 0.00 N ATOM 0 H LYS A 21 4.049 -8.319 3.224 1.00 0.00 H new ATOM 0 HA LYS A 21 6.874 -7.357 3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.747 -7.018 1.053 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.367 -6.349 1.025 1.00 0.00 H new ATOM 0 HG2 LYS A 21 5.827 -9.343 1.259 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.025 -8.537 -0.284 1.00 0.00 H new ATOM 0 HD2 LYS A 21 8.295 -8.285 -0.019 1.00 0.00 H new ATOM 0 HD3 LYS A 21 8.159 -7.898 1.685 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.371 -10.664 1.301 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.907 -10.405 0.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 9.503 -10.901 2.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 9.553 -9.204 2.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 8.227 -10.015 3.343 1.00 0.00 H new ATOM 384 N ILE A 22 4.771 -5.079 2.773 1.00 0.00 N ATOM 385 CA ILE A 22 4.258 -3.816 3.278 1.00 0.00 C ATOM 386 C ILE A 22 3.411 -3.145 2.196 1.00 0.00 C ATOM 387 O ILE A 22 3.366 -3.613 1.059 1.00 0.00 O ATOM 388 CB ILE A 22 5.403 -2.941 3.793 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.371 -2.839 5.320 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.383 -1.564 3.126 1.00 0.00 C ATOM 391 CD1 ILE A 22 4.133 -2.074 5.792 1.00 0.00 C ATOM 0 H ILE A 22 4.663 -5.212 1.768 1.00 0.00 H new ATOM 0 HA ILE A 22 3.606 -3.985 4.135 1.00 0.00 H new ATOM 0 HB ILE A 22 6.345 -3.417 3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.373 -3.838 5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 22 6.271 -2.336 5.673 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.207 -0.962 3.510 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.490 -1.681 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.438 -1.067 3.345 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.134 -2.016 6.880 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.146 -1.067 5.375 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.235 -2.593 5.458 1.00 0.00 H new ATOM 403 N GLU A 23 2.759 -2.060 2.587 1.00 0.00 N ATOM 404 CA GLU A 23 1.915 -1.320 1.664 1.00 0.00 C ATOM 405 C GLU A 23 1.916 0.168 2.020 1.00 0.00 C ATOM 406 O GLU A 23 1.253 0.583 2.969 1.00 0.00 O ATOM 407 CB GLU A 23 0.491 -1.880 1.654 1.00 0.00 C ATOM 408 CG GLU A 23 -0.430 -1.020 0.787 1.00 0.00 C ATOM 409 CD GLU A 23 -1.854 -1.580 0.776 1.00 0.00 C ATOM 410 OE1 GLU A 23 -2.035 -2.682 1.339 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.729 -0.895 0.205 1.00 0.00 O ATOM 0 H GLU A 23 2.798 -1.675 3.531 1.00 0.00 H new ATOM 0 HA GLU A 23 2.322 -1.434 0.659 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.501 -2.903 1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.105 -1.920 2.673 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.440 0.002 1.165 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.043 -0.980 -0.231 1.00 0.00 H new ATOM 418 N GLY A 24 2.669 0.929 1.240 1.00 0.00 N ATOM 419 CA GLY A 24 2.765 2.362 1.461 1.00 0.00 C ATOM 420 C GLY A 24 2.356 3.139 0.208 1.00 0.00 C ATOM 421 O GLY A 24 2.522 2.653 -0.910 1.00 0.00 O ATOM 0 H GLY A 24 3.218 0.581 0.454 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.125 2.648 2.296 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.786 2.623 1.738 1.00 0.00 H new ATOM 425 N ARG A 25 1.830 4.333 0.436 1.00 0.00 N ATOM 426 CA ARG A 25 1.396 5.182 -0.661 1.00 0.00 C ATOM 427 C ARG A 25 1.276 6.634 -0.193 1.00 0.00 C ATOM 428 O ARG A 25 1.207 6.900 1.006 1.00 0.00 O ATOM 429 CB ARG A 25 0.047 4.719 -1.215 1.00 0.00 C ATOM 430 CG ARG A 25 0.158 3.324 -1.833 1.00 0.00 C ATOM 431 CD ARG A 25 -1.113 2.964 -2.606 1.00 0.00 C ATOM 432 NE ARG A 25 -1.510 1.570 -2.306 1.00 0.00 N ATOM 433 CZ ARG A 25 -2.504 0.922 -2.927 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.209 1.538 -3.886 1.00 0.00 N ATOM 435 NH2 ARG A 25 -2.795 -0.342 -2.590 1.00 0.00 N ATOM 0 H ARG A 25 1.694 4.733 1.364 1.00 0.00 H new ATOM 0 HA ARG A 25 2.144 5.112 -1.451 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.694 4.709 -0.416 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.304 5.427 -1.966 1.00 0.00 H new ATOM 0 HG2 ARG A 25 1.018 3.286 -2.502 1.00 0.00 H new ATOM 0 HG3 ARG A 25 0.332 2.588 -1.048 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -1.919 3.647 -2.336 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -0.943 3.080 -3.676 1.00 0.00 H new ATOM 0 HE ARG A 25 -0.994 1.072 -1.581 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.988 2.500 -4.143 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.966 1.045 -4.359 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -2.259 -0.811 -1.860 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.552 -0.835 -3.064 1.00 0.00 H new ATOM 449 N LEU A 26 1.255 7.535 -1.164 1.00 0.00 N ATOM 450 CA LEU A 26 1.144 8.953 -0.866 1.00 0.00 C ATOM 451 C LEU A 26 -0.104 9.196 -0.017 1.00 0.00 C ATOM 452 O LEU A 26 -1.226 9.077 -0.507 1.00 0.00 O ATOM 453 CB LEU A 26 1.180 9.775 -2.156 1.00 0.00 C ATOM 454 CG LEU A 26 0.349 11.060 -2.156 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.933 12.090 -1.187 1.00 0.00 C ATOM 456 CD2 LEU A 26 0.207 11.621 -3.572 1.00 0.00 C ATOM 0 H LEU A 26 1.313 7.311 -2.157 1.00 0.00 H new ATOM 0 HA LEU A 26 1.999 9.287 -0.278 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.217 10.036 -2.368 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.836 9.144 -2.975 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.654 10.819 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.324 12.994 -1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.939 11.678 -0.178 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.953 12.333 -1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.388 12.534 -3.544 1.00 0.00 H new ATOM 0 HD22 LEU A 26 1.195 11.844 -3.976 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.287 10.886 -4.207 1.00 0.00 H new ATOM 468 N TYR A 27 0.132 9.532 1.243 1.00 0.00 N ATOM 469 CA TYR A 27 -0.960 9.793 2.165 1.00 0.00 C ATOM 470 C TYR A 27 -2.018 10.692 1.523 1.00 0.00 C ATOM 471 O TYR A 27 -1.823 11.193 0.417 1.00 0.00 O ATOM 472 CB TYR A 27 -0.340 10.526 3.357 1.00 0.00 C ATOM 473 CG TYR A 27 -0.850 10.046 4.717 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.959 9.228 4.789 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.201 10.432 5.872 1.00 0.00 C ATOM 476 CE1 TYR A 27 -2.439 8.777 6.069 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.681 9.980 7.153 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.777 9.175 7.188 1.00 0.00 C ATOM 479 OH TYR A 27 -2.230 8.749 8.397 1.00 0.00 O ATOM 0 H TYR A 27 1.064 9.629 1.647 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.448 8.862 2.454 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.743 10.403 3.323 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -0.543 11.593 3.260 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -2.467 8.926 3.885 1.00 0.00 H new ATOM 0 HD2 TYR A 27 0.667 11.073 5.816 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -3.306 8.137 6.139 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.182 10.274 8.065 1.00 0.00 H new ATOM 0 HH TYR A 27 -1.659 9.111 9.106 1.00 0.00 H new ATOM 489 N ASP A 28 -3.115 10.869 2.244 1.00 0.00 N ATOM 490 CA ASP A 28 -4.204 11.699 1.758 1.00 0.00 C ATOM 491 C ASP A 28 -5.203 11.937 2.892 1.00 0.00 C ATOM 492 O ASP A 28 -5.075 11.358 3.969 1.00 0.00 O ATOM 493 CB ASP A 28 -4.948 11.015 0.609 1.00 0.00 C ATOM 494 CG ASP A 28 -4.139 10.854 -0.680 1.00 0.00 C ATOM 495 OD1 ASP A 28 -3.944 11.885 -1.360 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.734 9.704 -0.956 1.00 0.00 O ATOM 0 H ASP A 28 -3.273 10.452 3.161 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.780 12.639 1.404 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.273 10.029 0.942 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.848 11.588 0.386 1.00 0.00 H new ATOM 501 N GLU A 29 -6.176 12.792 2.611 1.00 0.00 N ATOM 502 CA GLU A 29 -7.197 13.114 3.593 1.00 0.00 C ATOM 503 C GLU A 29 -7.991 11.860 3.965 1.00 0.00 C ATOM 504 O GLU A 29 -8.187 11.571 5.144 1.00 0.00 O ATOM 505 CB GLU A 29 -8.123 14.218 3.080 1.00 0.00 C ATOM 506 CG GLU A 29 -7.350 15.517 2.844 1.00 0.00 C ATOM 507 CD GLU A 29 -8.281 16.729 2.914 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.939 16.880 3.966 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.314 17.478 1.913 1.00 0.00 O ATOM 0 H GLU A 29 -6.278 13.272 1.717 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.704 13.487 4.491 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.596 13.898 2.151 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.922 14.392 3.801 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.562 15.616 3.590 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.864 15.483 1.869 1.00 0.00 H new ATOM 516 N LYS A 30 -8.427 11.148 2.936 1.00 0.00 N ATOM 517 CA LYS A 30 -9.195 9.932 3.139 1.00 0.00 C ATOM 518 C LYS A 30 -8.354 8.928 3.930 1.00 0.00 C ATOM 519 O LYS A 30 -8.858 8.270 4.838 1.00 0.00 O ATOM 520 CB LYS A 30 -9.703 9.389 1.802 1.00 0.00 C ATOM 521 CG LYS A 30 -11.229 9.282 1.798 1.00 0.00 C ATOM 522 CD LYS A 30 -11.683 7.890 2.243 1.00 0.00 C ATOM 523 CE LYS A 30 -12.617 7.979 3.451 1.00 0.00 C ATOM 524 NZ LYS A 30 -14.018 8.166 3.010 1.00 0.00 N ATOM 0 H LYS A 30 -8.263 11.390 1.959 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.086 10.140 3.732 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -9.379 10.043 0.993 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.266 8.408 1.614 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.652 10.036 2.462 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -11.609 9.490 0.798 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.193 7.390 1.420 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -10.813 7.283 2.495 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.536 7.071 4.049 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.317 8.809 4.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.639 8.224 3.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.094 9.045 2.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.306 7.360 2.419 1.00 0.00 H new ATOM 538 N ARG A 31 -7.085 8.843 3.556 1.00 0.00 N ATOM 539 CA ARG A 31 -6.169 7.931 4.219 1.00 0.00 C ATOM 540 C ARG A 31 -5.900 8.397 5.652 1.00 0.00 C ATOM 541 O ARG A 31 -5.873 7.587 6.577 1.00 0.00 O ATOM 542 CB ARG A 31 -4.842 7.837 3.464 1.00 0.00 C ATOM 543 CG ARG A 31 -4.935 6.830 2.316 1.00 0.00 C ATOM 544 CD ARG A 31 -3.891 5.722 2.472 1.00 0.00 C ATOM 545 NE ARG A 31 -4.562 4.418 2.670 1.00 0.00 N ATOM 546 CZ ARG A 31 -5.292 3.798 1.732 1.00 0.00 C ATOM 547 NH1 ARG A 31 -5.448 4.360 0.525 1.00 0.00 N ATOM 548 NH2 ARG A 31 -5.864 2.617 2.000 1.00 0.00 N ATOM 0 H ARG A 31 -6.670 9.391 2.802 1.00 0.00 H new ATOM 0 HA ARG A 31 -6.636 6.946 4.235 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.572 8.818 3.072 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -4.049 7.539 4.150 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.933 6.393 2.291 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -4.787 7.342 1.365 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.256 5.683 1.587 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.242 5.939 3.321 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.463 3.962 3.577 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -5.011 5.259 0.321 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.003 3.889 -0.189 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.744 2.189 2.918 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -6.419 2.146 1.286 1.00 0.00 H new ATOM 562 N ARG A 32 -5.709 9.701 5.790 1.00 0.00 N ATOM 563 CA ARG A 32 -5.443 10.284 7.094 1.00 0.00 C ATOM 564 C ARG A 32 -6.495 9.824 8.105 1.00 0.00 C ATOM 565 O ARG A 32 -6.164 9.497 9.244 1.00 0.00 O ATOM 566 CB ARG A 32 -5.447 11.812 7.024 1.00 0.00 C ATOM 567 CG ARG A 32 -4.602 12.414 8.149 1.00 0.00 C ATOM 568 CD ARG A 32 -4.010 13.761 7.729 1.00 0.00 C ATOM 569 NE ARG A 32 -3.033 14.223 8.740 1.00 0.00 N ATOM 570 CZ ARG A 32 -2.375 15.388 8.672 1.00 0.00 C ATOM 571 NH1 ARG A 32 -2.584 16.217 7.641 1.00 0.00 N ATOM 572 NH2 ARG A 32 -1.506 15.724 9.636 1.00 0.00 N ATOM 0 H ARG A 32 -5.733 10.370 5.020 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.456 9.948 7.413 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -5.058 12.137 6.059 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.470 12.180 7.096 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -5.216 12.545 9.040 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.799 11.726 8.413 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -3.524 13.667 6.758 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -4.805 14.498 7.617 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.849 13.616 9.539 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -3.245 15.962 6.907 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.083 17.104 7.590 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.346 15.093 10.421 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.005 16.611 9.584 1.00 0.00 H new ATOM 586 N GLN A 33 -7.740 9.812 7.653 1.00 0.00 N ATOM 587 CA GLN A 33 -8.842 9.397 8.504 1.00 0.00 C ATOM 588 C GLN A 33 -8.689 7.924 8.889 1.00 0.00 C ATOM 589 O GLN A 33 -9.169 7.500 9.940 1.00 0.00 O ATOM 590 CB GLN A 33 -10.187 9.649 7.822 1.00 0.00 C ATOM 591 CG GLN A 33 -11.051 10.604 8.648 1.00 0.00 C ATOM 592 CD GLN A 33 -12.446 10.751 8.035 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.821 11.795 7.527 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.190 9.652 8.112 1.00 0.00 N ATOM 0 H GLN A 33 -8.010 10.083 6.708 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.817 9.995 9.415 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.022 10.068 6.829 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.712 8.704 7.686 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.136 10.232 9.669 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.569 11.580 8.703 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.814 8.811 8.551 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.137 9.649 7.732 1.00 0.00 H new ATOM 603 N ILE A 34 -8.020 7.184 8.018 1.00 0.00 N ATOM 604 CA ILE A 34 -7.799 5.767 8.253 1.00 0.00 C ATOM 605 C ILE A 34 -6.742 5.595 9.346 1.00 0.00 C ATOM 606 O ILE A 34 -5.673 6.202 9.282 1.00 0.00 O ATOM 607 CB ILE A 34 -7.452 5.055 6.944 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.545 5.270 5.896 1.00 0.00 C ATOM 609 CG2 ILE A 34 -7.174 3.569 7.186 1.00 0.00 C ATOM 610 CD1 ILE A 34 -8.031 4.942 4.493 1.00 0.00 C ATOM 0 H ILE A 34 -7.623 7.539 7.148 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.712 5.293 8.614 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.536 5.494 6.548 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.405 4.642 6.128 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.887 6.304 5.929 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.930 3.086 6.240 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.336 3.463 7.875 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.058 3.099 7.616 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.828 5.103 3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.186 5.588 4.255 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.712 3.900 4.457 1.00 0.00 H new ATOM 622 N LYS A 35 -7.077 4.766 10.323 1.00 0.00 N ATOM 623 CA LYS A 35 -6.170 4.507 11.428 1.00 0.00 C ATOM 624 C LYS A 35 -6.020 2.996 11.616 1.00 0.00 C ATOM 625 O LYS A 35 -6.799 2.218 11.066 1.00 0.00 O ATOM 626 CB LYS A 35 -6.636 5.240 12.688 1.00 0.00 C ATOM 627 CG LYS A 35 -7.561 4.355 13.526 1.00 0.00 C ATOM 628 CD LYS A 35 -6.813 3.758 14.721 1.00 0.00 C ATOM 629 CE LYS A 35 -7.788 3.338 15.823 1.00 0.00 C ATOM 630 NZ LYS A 35 -7.117 2.447 16.796 1.00 0.00 N ATOM 0 H LYS A 35 -7.964 4.265 10.373 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.178 4.901 11.206 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.771 5.534 13.283 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.157 6.156 12.409 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.409 4.941 13.879 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.963 3.553 12.906 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -6.231 2.895 14.397 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.106 4.489 15.115 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.171 4.221 16.334 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.645 2.827 15.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.833 1.946 17.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.531 1.755 16.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -6.514 3.013 17.427 1.00 0.00 H new ATOM 644 N PRO A 36 -4.988 2.615 12.416 1.00 0.00 N ATOM 645 CA PRO A 36 -4.727 1.211 12.683 1.00 0.00 C ATOM 646 C PRO A 36 -5.747 0.641 13.670 1.00 0.00 C ATOM 647 O PRO A 36 -5.515 0.643 14.878 1.00 0.00 O ATOM 648 CB PRO A 36 -3.302 1.169 13.211 1.00 0.00 C ATOM 649 CG PRO A 36 -2.982 2.586 13.657 1.00 0.00 C ATOM 650 CD PRO A 36 -4.046 3.508 13.084 1.00 0.00 C ATOM 0 HA PRO A 36 -4.827 0.589 11.794 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.214 0.469 14.042 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.609 0.837 12.438 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.968 2.649 14.745 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.993 2.882 13.308 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.535 4.084 13.869 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.615 4.224 12.384 1.00 0.00 H new ATOM 658 N GLY A 37 -6.856 0.168 13.120 1.00 0.00 N ATOM 659 CA GLY A 37 -7.912 -0.403 13.937 1.00 0.00 C ATOM 660 C GLY A 37 -9.226 -0.483 13.157 1.00 0.00 C ATOM 661 O GLY A 37 -10.261 -0.011 13.627 1.00 0.00 O ATOM 0 H GLY A 37 -7.046 0.169 12.118 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.621 -1.399 14.269 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.052 0.203 14.832 1.00 0.00 H new ATOM 665 N ASP A 38 -9.143 -1.084 11.979 1.00 0.00 N ATOM 666 CA ASP A 38 -10.312 -1.232 11.130 1.00 0.00 C ATOM 667 C ASP A 38 -10.017 -2.262 10.038 1.00 0.00 C ATOM 668 O ASP A 38 -8.997 -2.948 10.086 1.00 0.00 O ATOM 669 CB ASP A 38 -10.668 0.091 10.448 1.00 0.00 C ATOM 670 CG ASP A 38 -12.016 0.687 10.859 1.00 0.00 C ATOM 671 OD1 ASP A 38 -12.917 -0.116 11.184 1.00 0.00 O ATOM 672 OD2 ASP A 38 -12.115 1.933 10.839 1.00 0.00 O ATOM 0 H ASP A 38 -8.283 -1.474 11.593 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.145 -1.551 11.756 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.885 0.817 10.666 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.669 -0.062 9.369 1.00 0.00 H new ATOM 677 N VAL A 39 -10.928 -2.338 9.079 1.00 0.00 N ATOM 678 CA VAL A 39 -10.778 -3.273 7.977 1.00 0.00 C ATOM 679 C VAL A 39 -11.147 -2.574 6.667 1.00 0.00 C ATOM 680 O VAL A 39 -11.968 -1.658 6.658 1.00 0.00 O ATOM 681 CB VAL A 39 -11.610 -4.530 8.239 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.261 -5.637 7.242 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.433 -5.013 9.680 1.00 0.00 C ATOM 0 H VAL A 39 -11.773 -1.767 9.042 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.741 -3.598 7.891 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.660 -4.273 8.098 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.867 -6.519 7.451 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.462 -5.290 6.228 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.205 -5.891 7.336 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.035 -5.908 9.840 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.383 -5.245 9.860 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.755 -4.231 10.368 1.00 0.00 H new ATOM 693 N ILE A 40 -10.524 -3.034 5.592 1.00 0.00 N ATOM 694 CA ILE A 40 -10.777 -2.464 4.279 1.00 0.00 C ATOM 695 C ILE A 40 -11.164 -3.582 3.309 1.00 0.00 C ATOM 696 O ILE A 40 -10.598 -4.673 3.355 1.00 0.00 O ATOM 697 CB ILE A 40 -9.579 -1.634 3.815 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.926 -0.908 4.992 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.980 -0.669 2.697 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.646 -0.192 4.554 1.00 0.00 C ATOM 0 H ILE A 40 -9.845 -3.795 5.603 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.618 -1.771 4.320 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.833 -2.313 3.402 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.626 -0.185 5.411 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -8.695 -1.623 5.782 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.110 -0.091 2.386 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.363 -1.235 1.848 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.754 0.007 3.060 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.202 0.316 5.410 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.939 -0.921 4.158 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.884 0.539 3.782 1.00 0.00 H new ATOM 712 N SER A 41 -12.127 -3.272 2.453 1.00 0.00 N ATOM 713 CA SER A 41 -12.596 -4.237 1.473 1.00 0.00 C ATOM 714 C SER A 41 -12.278 -3.745 0.060 1.00 0.00 C ATOM 715 O SER A 41 -12.480 -2.572 -0.254 1.00 0.00 O ATOM 716 CB SER A 41 -14.098 -4.487 1.622 1.00 0.00 C ATOM 717 OG SER A 41 -14.836 -3.982 0.512 1.00 0.00 O ATOM 0 H SER A 41 -12.595 -2.366 2.418 1.00 0.00 H new ATOM 0 HA SER A 41 -12.079 -5.180 1.647 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.279 -5.557 1.721 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.455 -4.017 2.539 1.00 0.00 H new ATOM 0 HG SER A 41 -15.754 -4.323 0.547 1.00 0.00 H new ATOM 723 N PHE A 42 -11.785 -4.665 -0.756 1.00 0.00 N ATOM 724 CA PHE A 42 -11.436 -4.339 -2.129 1.00 0.00 C ATOM 725 C PHE A 42 -12.363 -5.054 -3.114 1.00 0.00 C ATOM 726 O PHE A 42 -12.589 -6.257 -2.998 1.00 0.00 O ATOM 727 CB PHE A 42 -10.002 -4.823 -2.353 1.00 0.00 C ATOM 728 CG PHE A 42 -8.937 -3.935 -1.707 1.00 0.00 C ATOM 729 CD1 PHE A 42 -8.815 -2.634 -2.085 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.113 -4.446 -0.754 1.00 0.00 C ATOM 731 CE1 PHE A 42 -7.827 -1.810 -1.485 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.125 -3.622 -0.154 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.002 -2.321 -0.532 1.00 0.00 C ATOM 0 H PHE A 42 -11.619 -5.636 -0.493 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.533 -3.266 -2.293 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -9.905 -5.834 -1.958 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.812 -4.879 -3.425 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.470 -2.228 -2.842 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.210 -5.479 -0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.730 -0.777 -1.785 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.471 -4.028 0.603 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.250 -1.694 -0.076 1.00 0.00 H new ATOM 743 N GLU A 43 -12.876 -4.282 -4.061 1.00 0.00 N ATOM 744 CA GLU A 43 -13.773 -4.826 -5.066 1.00 0.00 C ATOM 745 C GLU A 43 -15.031 -5.392 -4.404 1.00 0.00 C ATOM 746 O GLU A 43 -15.518 -6.453 -4.792 1.00 0.00 O ATOM 747 CB GLU A 43 -13.071 -5.892 -5.909 1.00 0.00 C ATOM 748 CG GLU A 43 -12.028 -5.260 -6.834 1.00 0.00 C ATOM 749 CD GLU A 43 -12.700 -4.483 -7.968 1.00 0.00 C ATOM 750 OE1 GLU A 43 -13.017 -5.129 -8.990 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.883 -3.260 -7.786 1.00 0.00 O ATOM 0 H GLU A 43 -12.687 -3.284 -4.153 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.070 -4.018 -5.735 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.590 -6.619 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.807 -6.435 -6.502 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.386 -4.591 -6.261 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.388 -6.037 -7.251 1.00 0.00 H new ATOM 758 N GLY A 44 -15.521 -4.659 -3.415 1.00 0.00 N ATOM 759 CA GLY A 44 -16.713 -5.075 -2.695 1.00 0.00 C ATOM 760 C GLY A 44 -16.345 -5.831 -1.417 1.00 0.00 C ATOM 761 O GLY A 44 -16.673 -5.392 -0.315 1.00 0.00 O ATOM 0 H GLY A 44 -15.114 -3.780 -3.095 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.315 -4.201 -2.445 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.325 -5.711 -3.335 1.00 0.00 H new ATOM 765 N GLY A 45 -15.669 -6.955 -1.606 1.00 0.00 N ATOM 766 CA GLY A 45 -15.254 -7.776 -0.481 1.00 0.00 C ATOM 767 C GLY A 45 -14.454 -8.991 -0.956 1.00 0.00 C ATOM 768 O GLY A 45 -14.537 -10.064 -0.361 1.00 0.00 O ATOM 0 H GLY A 45 -15.398 -7.316 -2.521 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.648 -7.182 0.204 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.131 -8.108 0.075 1.00 0.00 H new ATOM 772 N LYS A 46 -13.698 -8.781 -2.024 1.00 0.00 N ATOM 773 CA LYS A 46 -12.884 -9.846 -2.585 1.00 0.00 C ATOM 774 C LYS A 46 -11.654 -10.062 -1.701 1.00 0.00 C ATOM 775 O LYS A 46 -11.246 -11.198 -1.465 1.00 0.00 O ATOM 776 CB LYS A 46 -12.546 -9.548 -4.047 1.00 0.00 C ATOM 777 CG LYS A 46 -12.303 -10.841 -4.828 1.00 0.00 C ATOM 778 CD LYS A 46 -10.817 -11.016 -5.149 1.00 0.00 C ATOM 779 CE LYS A 46 -10.624 -11.577 -6.559 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.264 -13.012 -6.502 1.00 0.00 N ATOM 0 H LYS A 46 -13.632 -7.890 -2.515 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.438 -10.784 -2.595 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.362 -8.990 -4.506 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.659 -8.916 -4.098 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.656 -11.693 -4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.879 -10.825 -5.753 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.307 -10.057 -5.062 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.360 -11.687 -4.421 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.540 -11.448 -7.136 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.842 -11.020 -7.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.137 -13.377 -7.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -9.378 -13.127 -5.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.024 -13.542 -6.029 1.00 0.00 H new ATOM 794 N LEU A 47 -11.097 -8.953 -1.236 1.00 0.00 N ATOM 795 CA LEU A 47 -9.921 -9.007 -0.384 1.00 0.00 C ATOM 796 C LEU A 47 -10.116 -8.064 0.805 1.00 0.00 C ATOM 797 O LEU A 47 -10.359 -6.872 0.624 1.00 0.00 O ATOM 798 CB LEU A 47 -8.657 -8.719 -1.196 1.00 0.00 C ATOM 799 CG LEU A 47 -7.344 -9.224 -0.594 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.599 -8.096 0.122 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.587 -10.424 0.324 1.00 0.00 C ATOM 0 H LEU A 47 -11.438 -8.012 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.789 -10.010 0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.775 -9.163 -2.184 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.578 -7.641 -1.338 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.705 -9.566 -1.408 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.670 -8.482 0.541 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.374 -7.300 -0.588 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.222 -7.701 0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.638 -10.763 0.739 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.254 -10.132 1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.043 -11.233 -0.247 1.00 0.00 H new ATOM 813 N LYS A 48 -10.001 -8.633 1.996 1.00 0.00 N ATOM 814 CA LYS A 48 -10.161 -7.858 3.215 1.00 0.00 C ATOM 815 C LYS A 48 -8.793 -7.660 3.871 1.00 0.00 C ATOM 816 O LYS A 48 -7.986 -8.586 3.925 1.00 0.00 O ATOM 817 CB LYS A 48 -11.195 -8.512 4.134 1.00 0.00 C ATOM 818 CG LYS A 48 -12.428 -8.955 3.344 1.00 0.00 C ATOM 819 CD LYS A 48 -13.174 -7.748 2.770 1.00 0.00 C ATOM 820 CE LYS A 48 -14.583 -7.644 3.357 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.583 -8.168 2.400 1.00 0.00 N ATOM 0 H LYS A 48 -9.799 -9.622 2.143 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.553 -6.867 2.988 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.750 -9.373 4.634 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.491 -7.809 4.913 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.126 -9.619 2.534 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.094 -9.524 3.992 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.618 -6.836 2.986 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.234 -7.835 1.685 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.637 -8.204 4.291 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.808 -6.604 3.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.349 -8.639 2.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.976 -7.382 1.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.128 -8.851 1.761 1.00 0.00 H new ATOM 835 N VAL A 49 -8.575 -6.445 4.353 1.00 0.00 N ATOM 836 CA VAL A 49 -7.319 -6.113 5.004 1.00 0.00 C ATOM 837 C VAL A 49 -7.603 -5.294 6.264 1.00 0.00 C ATOM 838 O VAL A 49 -8.668 -4.691 6.390 1.00 0.00 O ATOM 839 CB VAL A 49 -6.394 -5.394 4.019 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.096 -6.275 2.804 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.987 -4.050 3.591 1.00 0.00 C ATOM 0 H VAL A 49 -9.247 -5.679 4.306 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.799 -7.019 5.316 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.451 -5.196 4.528 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.437 -5.741 2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.611 -7.194 3.131 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.028 -6.519 2.294 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.310 -3.560 2.891 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.951 -4.215 3.109 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.123 -3.417 4.468 1.00 0.00 H new ATOM 851 N ARG A 50 -6.632 -5.298 7.166 1.00 0.00 N ATOM 852 CA ARG A 50 -6.765 -4.563 8.412 1.00 0.00 C ATOM 853 C ARG A 50 -5.494 -3.758 8.691 1.00 0.00 C ATOM 854 O ARG A 50 -4.390 -4.298 8.644 1.00 0.00 O ATOM 855 CB ARG A 50 -7.028 -5.509 9.585 1.00 0.00 C ATOM 856 CG ARG A 50 -6.799 -4.803 10.922 1.00 0.00 C ATOM 857 CD ARG A 50 -7.778 -5.307 11.984 1.00 0.00 C ATOM 858 NE ARG A 50 -7.043 -6.013 13.057 1.00 0.00 N ATOM 859 CZ ARG A 50 -7.623 -6.793 13.979 1.00 0.00 C ATOM 860 NH1 ARG A 50 -8.951 -6.971 13.965 1.00 0.00 N ATOM 861 NH2 ARG A 50 -6.877 -7.394 14.915 1.00 0.00 N ATOM 0 H ARG A 50 -5.750 -5.799 7.058 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.613 -3.887 8.309 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.052 -5.879 9.536 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.372 -6.377 9.511 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.776 -4.973 11.256 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.918 -3.727 10.794 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.335 -4.469 12.404 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.507 -5.978 11.529 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.030 -5.898 13.097 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.519 -6.513 13.253 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.393 -7.565 14.667 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.866 -7.258 14.926 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.320 -7.988 15.616 1.00 0.00 H new ATOM 875 N VAL A 51 -5.692 -2.479 8.976 1.00 0.00 N ATOM 876 CA VAL A 51 -4.576 -1.594 9.263 1.00 0.00 C ATOM 877 C VAL A 51 -3.880 -2.058 10.544 1.00 0.00 C ATOM 878 O VAL A 51 -4.535 -2.498 11.487 1.00 0.00 O ATOM 879 CB VAL A 51 -5.062 -0.146 9.337 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.902 0.808 9.632 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.789 0.256 8.052 1.00 0.00 C ATOM 0 H VAL A 51 -6.609 -2.035 9.014 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.840 -1.634 8.460 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.773 -0.074 10.160 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.275 1.831 9.679 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.447 0.543 10.586 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.157 0.730 8.841 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.124 1.290 8.132 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.111 0.159 7.204 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.651 -0.394 7.903 1.00 0.00 H new ATOM 891 N LYS A 52 -2.560 -1.944 10.536 1.00 0.00 N ATOM 892 CA LYS A 52 -1.767 -2.345 11.686 1.00 0.00 C ATOM 893 C LYS A 52 -1.140 -1.105 12.326 1.00 0.00 C ATOM 894 O LYS A 52 -1.106 -0.984 13.550 1.00 0.00 O ATOM 895 CB LYS A 52 -0.747 -3.413 11.286 1.00 0.00 C ATOM 896 CG LYS A 52 -0.936 -4.688 12.110 1.00 0.00 C ATOM 897 CD LYS A 52 0.388 -5.146 12.725 1.00 0.00 C ATOM 898 CE LYS A 52 0.347 -5.051 14.251 1.00 0.00 C ATOM 899 NZ LYS A 52 0.383 -6.401 14.856 1.00 0.00 N ATOM 0 H LYS A 52 -2.020 -1.580 9.751 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.400 -2.808 12.443 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.852 -3.642 10.226 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.263 -3.029 11.430 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.665 -4.510 12.900 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.339 -5.478 11.476 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.595 -6.174 12.427 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.203 -4.532 12.341 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.193 -4.464 14.607 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.557 -4.530 14.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.354 -6.318 15.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.438 -6.950 14.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.258 -6.886 14.572 1.00 0.00 H new ATOM 913 N ALA A 53 -0.660 -0.215 11.471 1.00 0.00 N ATOM 914 CA ALA A 53 -0.036 1.011 11.938 1.00 0.00 C ATOM 915 C ALA A 53 0.186 1.950 10.750 1.00 0.00 C ATOM 916 O ALA A 53 0.135 1.522 9.598 1.00 0.00 O ATOM 917 CB ALA A 53 1.266 0.676 12.668 1.00 0.00 C ATOM 0 H ALA A 53 -0.691 -0.318 10.457 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.684 1.525 12.648 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.734 1.596 13.018 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.050 0.032 13.520 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.943 0.161 11.986 1.00 0.00 H new ATOM 923 N ILE A 54 0.428 3.212 11.072 1.00 0.00 N ATOM 924 CA ILE A 54 0.658 4.215 10.046 1.00 0.00 C ATOM 925 C ILE A 54 2.044 4.832 10.244 1.00 0.00 C ATOM 926 O ILE A 54 2.530 4.928 11.370 1.00 0.00 O ATOM 927 CB ILE A 54 -0.476 5.241 10.035 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.576 5.935 8.675 1.00 0.00 C ATOM 929 CG2 ILE A 54 -0.318 6.244 11.180 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.993 5.828 8.108 1.00 0.00 C ATOM 0 H ILE A 54 0.470 3.563 12.029 1.00 0.00 H new ATOM 0 HA ILE A 54 0.651 3.757 9.057 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.416 4.713 10.196 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.300 6.984 8.777 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.133 5.485 7.980 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.137 6.963 11.150 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.335 5.714 12.133 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.631 6.770 11.074 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.037 6.329 7.141 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.257 4.778 7.985 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.696 6.301 8.794 1.00 0.00 H new ATOM 942 N ARG A 55 2.642 5.234 9.132 1.00 0.00 N ATOM 943 CA ARG A 55 3.963 5.839 9.169 1.00 0.00 C ATOM 944 C ARG A 55 4.138 6.803 7.994 1.00 0.00 C ATOM 945 O ARG A 55 3.485 6.655 6.962 1.00 0.00 O ATOM 946 CB ARG A 55 5.059 4.773 9.113 1.00 0.00 C ATOM 947 CG ARG A 55 5.479 4.344 10.520 1.00 0.00 C ATOM 948 CD ARG A 55 6.504 3.209 10.464 1.00 0.00 C ATOM 949 NE ARG A 55 7.662 3.530 11.328 1.00 0.00 N ATOM 950 CZ ARG A 55 7.636 3.486 12.667 1.00 0.00 C ATOM 951 NH1 ARG A 55 6.511 3.133 13.304 1.00 0.00 N ATOM 952 NH2 ARG A 55 8.735 3.794 13.369 1.00 0.00 N ATOM 0 H ARG A 55 2.236 5.153 8.200 1.00 0.00 H new ATOM 0 HA ARG A 55 4.051 6.385 10.108 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.701 3.907 8.557 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.923 5.163 8.575 1.00 0.00 H new ATOM 0 HG2 ARG A 55 5.903 5.196 11.052 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.603 4.020 11.082 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.044 2.276 10.790 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.837 3.059 9.437 1.00 0.00 H new ATOM 0 HE ARG A 55 8.535 3.802 10.876 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.675 2.898 12.770 1.00 0.00 H new ATOM 0 HH12 ARG A 55 6.491 3.099 14.323 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.591 4.062 12.884 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.715 3.761 14.388 1.00 0.00 H new ATOM 966 N VAL A 56 5.023 7.770 8.190 1.00 0.00 N ATOM 967 CA VAL A 56 5.292 8.758 7.159 1.00 0.00 C ATOM 968 C VAL A 56 6.795 8.798 6.877 1.00 0.00 C ATOM 969 O VAL A 56 7.606 8.631 7.788 1.00 0.00 O ATOM 970 CB VAL A 56 4.726 10.117 7.577 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.523 11.023 6.361 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.423 9.950 8.360 1.00 0.00 C ATOM 0 H VAL A 56 5.563 7.890 9.047 1.00 0.00 H new ATOM 0 HA VAL A 56 4.794 8.485 6.229 1.00 0.00 H new ATOM 0 HB VAL A 56 5.452 10.596 8.234 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.120 11.982 6.685 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.479 11.181 5.861 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.825 10.552 5.669 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.042 10.930 8.645 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.687 9.441 7.737 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.610 9.359 9.256 1.00 0.00 H new ATOM 982 N TYR A 57 7.122 9.019 5.613 1.00 0.00 N ATOM 983 CA TYR A 57 8.514 9.083 5.199 1.00 0.00 C ATOM 984 C TYR A 57 8.782 10.338 4.367 1.00 0.00 C ATOM 985 O TYR A 57 7.858 11.088 4.054 1.00 0.00 O ATOM 986 CB TYR A 57 8.752 7.847 4.328 1.00 0.00 C ATOM 987 CG TYR A 57 8.907 6.548 5.121 1.00 0.00 C ATOM 988 CD1 TYR A 57 7.800 5.949 5.687 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.154 5.975 5.270 1.00 0.00 C ATOM 990 CE1 TYR A 57 7.946 4.725 6.433 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.299 4.752 6.016 1.00 0.00 C ATOM 992 CZ TYR A 57 9.188 4.187 6.560 1.00 0.00 C ATOM 993 OH TYR A 57 9.326 3.032 7.265 1.00 0.00 O ATOM 0 H TYR A 57 6.447 9.156 4.861 1.00 0.00 H new ATOM 0 HA TYR A 57 9.172 9.115 6.068 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.919 7.739 3.633 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.649 8.004 3.729 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.824 6.398 5.571 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.020 6.444 4.827 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.088 4.246 6.881 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.269 4.293 6.141 1.00 0.00 H new ATOM 0 HH TYR A 57 8.960 2.286 6.746 1.00 0.00 H new ATOM 1003 N ASN A 58 10.049 10.528 4.032 1.00 0.00 N ATOM 1004 CA ASN A 58 10.450 11.680 3.242 1.00 0.00 C ATOM 1005 C ASN A 58 10.033 11.464 1.786 1.00 0.00 C ATOM 1006 O ASN A 58 9.511 12.374 1.145 1.00 0.00 O ATOM 1007 CB ASN A 58 11.968 11.869 3.276 1.00 0.00 C ATOM 1008 CG ASN A 58 12.392 12.683 4.500 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.577 13.888 4.443 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.535 11.960 5.607 1.00 0.00 N ATOM 0 H ASN A 58 10.812 9.904 4.293 1.00 0.00 H new ATOM 0 HA ASN A 58 9.967 12.562 3.662 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.459 10.896 3.294 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.296 12.374 2.367 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.815 12.411 6.478 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.364 10.955 5.585 1.00 0.00 H new ATOM 1017 N SER A 59 10.280 10.254 1.306 1.00 0.00 N ATOM 1018 CA SER A 59 9.936 9.907 -0.062 1.00 0.00 C ATOM 1019 C SER A 59 9.798 8.389 -0.199 1.00 0.00 C ATOM 1020 O SER A 59 10.198 7.643 0.694 1.00 0.00 O ATOM 1021 CB SER A 59 10.985 10.435 -1.044 1.00 0.00 C ATOM 1022 OG SER A 59 10.548 11.619 -1.705 1.00 0.00 O ATOM 0 H SER A 59 10.714 9.502 1.840 1.00 0.00 H new ATOM 0 HA SER A 59 8.982 10.375 -0.304 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.912 10.640 -0.509 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.207 9.667 -1.785 1.00 0.00 H new ATOM 0 HG SER A 59 10.103 12.208 -1.061 1.00 0.00 H new ATOM 1028 N PHE A 60 9.231 7.977 -1.323 1.00 0.00 N ATOM 1029 CA PHE A 60 9.035 6.562 -1.588 1.00 0.00 C ATOM 1030 C PHE A 60 10.360 5.802 -1.513 1.00 0.00 C ATOM 1031 O PHE A 60 10.403 4.666 -1.044 1.00 0.00 O ATOM 1032 CB PHE A 60 8.473 6.446 -3.006 1.00 0.00 C ATOM 1033 CG PHE A 60 6.953 6.280 -3.061 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.387 5.087 -2.733 1.00 0.00 C ATOM 1035 CD2 PHE A 60 6.167 7.324 -3.438 1.00 0.00 C ATOM 1036 CE1 PHE A 60 4.976 4.933 -2.784 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.757 7.170 -3.490 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.191 5.977 -3.161 1.00 0.00 C ATOM 0 H PHE A 60 8.901 8.599 -2.061 1.00 0.00 H new ATOM 0 HA PHE A 60 8.360 6.135 -0.847 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.752 7.336 -3.570 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.939 5.595 -3.502 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.010 4.257 -2.434 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.616 8.271 -3.698 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.527 3.986 -2.523 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.134 7.999 -3.791 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.118 5.860 -3.199 1.00 0.00 H new ATOM 1048 N ARG A 61 11.410 6.460 -1.983 1.00 0.00 N ATOM 1049 CA ARG A 61 12.734 5.860 -1.976 1.00 0.00 C ATOM 1050 C ARG A 61 13.120 5.443 -0.555 1.00 0.00 C ATOM 1051 O ARG A 61 13.566 4.318 -0.335 1.00 0.00 O ATOM 1052 CB ARG A 61 13.783 6.834 -2.517 1.00 0.00 C ATOM 1053 CG ARG A 61 14.907 6.085 -3.235 1.00 0.00 C ATOM 1054 CD ARG A 61 16.259 6.757 -2.985 1.00 0.00 C ATOM 1055 NE ARG A 61 16.917 7.066 -4.274 1.00 0.00 N ATOM 1056 CZ ARG A 61 18.047 7.777 -4.390 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.651 8.257 -3.295 1.00 0.00 N ATOM 1058 NH2 ARG A 61 18.572 8.008 -5.601 1.00 0.00 N ATOM 0 H ARG A 61 11.371 7.402 -2.371 1.00 0.00 H new ATOM 0 HA ARG A 61 12.704 4.982 -2.621 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.312 7.536 -3.205 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.198 7.420 -1.697 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.940 5.052 -2.888 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.704 6.055 -4.305 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.119 7.673 -2.410 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.896 6.102 -2.390 1.00 0.00 H new ATOM 0 HE ARG A 61 16.483 6.716 -5.128 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.251 8.081 -2.373 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.511 8.798 -3.383 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.112 7.643 -6.435 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.432 8.549 -5.689 1.00 0.00 H new ATOM 1072 N GLU A 62 12.933 6.371 0.371 1.00 0.00 N ATOM 1073 CA GLU A 62 13.256 6.114 1.764 1.00 0.00 C ATOM 1074 C GLU A 62 12.399 4.967 2.305 1.00 0.00 C ATOM 1075 O GLU A 62 12.827 4.234 3.194 1.00 0.00 O ATOM 1076 CB GLU A 62 13.079 7.376 2.610 1.00 0.00 C ATOM 1077 CG GLU A 62 14.401 8.136 2.743 1.00 0.00 C ATOM 1078 CD GLU A 62 14.797 8.783 1.413 1.00 0.00 C ATOM 1079 OE1 GLU A 62 13.911 9.424 0.808 1.00 0.00 O ATOM 1080 OE2 GLU A 62 15.977 8.622 1.033 1.00 0.00 O ATOM 0 H GLU A 62 12.562 7.302 0.184 1.00 0.00 H new ATOM 0 HA GLU A 62 14.304 5.819 1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.328 8.022 2.154 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.709 7.106 3.599 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.308 8.903 3.512 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.186 7.453 3.068 1.00 0.00 H new ATOM 1087 N MET A 63 11.204 4.849 1.745 1.00 0.00 N ATOM 1088 CA MET A 63 10.283 3.805 2.159 1.00 0.00 C ATOM 1089 C MET A 63 10.704 2.447 1.595 1.00 0.00 C ATOM 1090 O MET A 63 10.784 1.463 2.329 1.00 0.00 O ATOM 1091 CB MET A 63 8.872 4.145 1.673 1.00 0.00 C ATOM 1092 CG MET A 63 7.907 4.294 2.851 1.00 0.00 C ATOM 1093 SD MET A 63 6.227 4.053 2.298 1.00 0.00 S ATOM 1094 CE MET A 63 6.378 2.443 1.542 1.00 0.00 C ATOM 0 H MET A 63 10.852 5.460 1.008 1.00 0.00 H new ATOM 0 HA MET A 63 10.297 3.746 3.247 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.895 5.071 1.098 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.516 3.362 1.003 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.151 3.567 3.626 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.014 5.283 3.296 1.00 0.00 H new ATOM 0 HE1 MET A 63 6.286 2.539 0.460 1.00 0.00 H new ATOM 0 HE2 MET A 63 7.351 2.016 1.787 1.00 0.00 H new ATOM 0 HE3 MET A 63 5.590 1.790 1.917 1.00 0.00 H new ATOM 1104 N LEU A 64 10.962 2.436 0.295 1.00 0.00 N ATOM 1105 CA LEU A 64 11.373 1.215 -0.376 1.00 0.00 C ATOM 1106 C LEU A 64 12.816 0.886 0.012 1.00 0.00 C ATOM 1107 O LEU A 64 13.213 -0.279 0.009 1.00 0.00 O ATOM 1108 CB LEU A 64 11.154 1.333 -1.886 1.00 0.00 C ATOM 1109 CG LEU A 64 9.700 1.462 -2.344 1.00 0.00 C ATOM 1110 CD1 LEU A 64 8.743 0.880 -1.302 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.359 2.914 -2.686 1.00 0.00 C ATOM 0 H LEU A 64 10.894 3.254 -0.311 1.00 0.00 H new ATOM 0 HA LEU A 64 10.756 0.377 -0.052 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.706 2.201 -2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.589 0.456 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 64 9.577 0.878 -3.256 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.716 0.985 -1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.969 -0.175 -1.150 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.861 1.416 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.320 2.977 -3.009 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.504 3.539 -1.805 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.010 3.261 -3.488 1.00 0.00 H new ATOM 1123 N GLU A 65 13.562 1.932 0.335 1.00 0.00 N ATOM 1124 CA GLU A 65 14.952 1.769 0.724 1.00 0.00 C ATOM 1125 C GLU A 65 15.043 1.146 2.119 1.00 0.00 C ATOM 1126 O GLU A 65 15.842 0.238 2.346 1.00 0.00 O ATOM 1127 CB GLU A 65 15.697 3.104 0.670 1.00 0.00 C ATOM 1128 CG GLU A 65 15.980 3.516 -0.776 1.00 0.00 C ATOM 1129 CD GLU A 65 17.430 3.211 -1.159 1.00 0.00 C ATOM 1130 OE1 GLU A 65 17.783 2.012 -1.135 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.152 4.184 -1.467 1.00 0.00 O ATOM 0 H GLU A 65 13.230 2.896 0.335 1.00 0.00 H new ATOM 0 HA GLU A 65 15.431 1.095 0.014 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.105 3.875 1.162 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.635 3.023 1.219 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.304 2.987 -1.448 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.784 4.581 -0.900 1.00 0.00 H new ATOM 1138 N LYS A 66 14.214 1.659 3.016 1.00 0.00 N ATOM 1139 CA LYS A 66 14.192 1.164 4.382 1.00 0.00 C ATOM 1140 C LYS A 66 13.282 -0.064 4.461 1.00 0.00 C ATOM 1141 O LYS A 66 13.742 -1.163 4.765 1.00 0.00 O ATOM 1142 CB LYS A 66 13.800 2.282 5.351 1.00 0.00 C ATOM 1143 CG LYS A 66 14.709 2.285 6.581 1.00 0.00 C ATOM 1144 CD LYS A 66 13.990 2.881 7.793 1.00 0.00 C ATOM 1145 CE LYS A 66 14.076 4.409 7.785 1.00 0.00 C ATOM 1146 NZ LYS A 66 14.246 4.926 9.161 1.00 0.00 N ATOM 0 H LYS A 66 13.553 2.412 2.824 1.00 0.00 H new ATOM 0 HA LYS A 66 15.188 0.844 4.686 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.863 3.245 4.845 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.763 2.152 5.661 1.00 0.00 H new ATOM 0 HG2 LYS A 66 15.026 1.267 6.806 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.611 2.860 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.945 2.572 7.788 1.00 0.00 H new ATOM 0 HD3 LYS A 66 14.433 2.493 8.710 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.913 4.729 7.164 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.172 4.828 7.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 14.303 5.964 9.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.434 4.637 9.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.121 4.541 9.571 1.00 0.00 H new ATOM 1160 N GLU A 67 12.007 0.165 4.180 1.00 0.00 N ATOM 1161 CA GLU A 67 11.029 -0.909 4.214 1.00 0.00 C ATOM 1162 C GLU A 67 11.402 -2.000 3.209 1.00 0.00 C ATOM 1163 O GLU A 67 11.530 -3.168 3.573 1.00 0.00 O ATOM 1164 CB GLU A 67 9.620 -0.376 3.947 1.00 0.00 C ATOM 1165 CG GLU A 67 8.614 -0.966 4.937 1.00 0.00 C ATOM 1166 CD GLU A 67 9.015 -0.651 6.380 1.00 0.00 C ATOM 1167 OE1 GLU A 67 9.078 0.555 6.701 1.00 0.00 O ATOM 1168 OE2 GLU A 67 9.249 -1.624 7.129 1.00 0.00 O ATOM 0 H GLU A 67 11.629 1.078 3.928 1.00 0.00 H new ATOM 0 HA GLU A 67 11.034 -1.346 5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.618 0.711 4.025 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.321 -0.623 2.928 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.621 -0.563 4.736 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.554 -2.046 4.800 1.00 0.00 H new ATOM 1175 N GLY A 68 11.567 -1.580 1.963 1.00 0.00 N ATOM 1176 CA GLY A 68 11.923 -2.507 0.902 1.00 0.00 C ATOM 1177 C GLY A 68 11.034 -2.302 -0.327 1.00 0.00 C ATOM 1178 O GLY A 68 9.809 -2.283 -0.215 1.00 0.00 O ATOM 0 H GLY A 68 11.461 -0.610 1.665 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.968 -2.366 0.627 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.823 -3.531 1.261 1.00 0.00 H new ATOM 1182 N LEU A 69 11.686 -2.153 -1.471 1.00 0.00 N ATOM 1183 CA LEU A 69 10.970 -1.950 -2.719 1.00 0.00 C ATOM 1184 C LEU A 69 10.044 -3.142 -2.970 1.00 0.00 C ATOM 1185 O LEU A 69 8.830 -2.977 -3.080 1.00 0.00 O ATOM 1186 CB LEU A 69 11.951 -1.682 -3.862 1.00 0.00 C ATOM 1187 CG LEU A 69 11.411 -1.907 -5.276 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.392 -0.830 -5.651 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.553 -1.995 -6.290 1.00 0.00 C ATOM 0 H LEU A 69 12.702 -2.169 -1.560 1.00 0.00 H new ATOM 0 HA LEU A 69 10.339 -1.063 -2.657 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.294 -0.650 -3.785 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.824 -2.320 -3.722 1.00 0.00 H new ATOM 0 HG LEU A 69 10.889 -2.864 -5.295 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.024 -1.013 -6.660 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.558 -0.858 -4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.867 0.150 -5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.143 -2.155 -7.287 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.123 -1.066 -6.277 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.208 -2.827 -6.029 1.00 0.00 H new ATOM 1201 N GLU A 70 10.652 -4.316 -3.053 1.00 0.00 N ATOM 1202 CA GLU A 70 9.897 -5.535 -3.290 1.00 0.00 C ATOM 1203 C GLU A 70 8.999 -5.843 -2.090 1.00 0.00 C ATOM 1204 O GLU A 70 8.162 -6.743 -2.153 1.00 0.00 O ATOM 1205 CB GLU A 70 10.831 -6.708 -3.592 1.00 0.00 C ATOM 1206 CG GLU A 70 10.976 -6.920 -5.100 1.00 0.00 C ATOM 1207 CD GLU A 70 11.902 -8.100 -5.402 1.00 0.00 C ATOM 1208 OE1 GLU A 70 11.468 -9.243 -5.141 1.00 0.00 O ATOM 1209 OE2 GLU A 70 13.023 -7.833 -5.886 1.00 0.00 O ATOM 0 H GLU A 70 11.659 -4.449 -2.960 1.00 0.00 H new ATOM 0 HA GLU A 70 9.264 -5.384 -4.164 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.810 -6.520 -3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.442 -7.615 -3.129 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.996 -7.100 -5.541 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.372 -6.015 -5.562 1.00 0.00 H new ATOM 1216 N ASN A 71 9.203 -5.080 -1.027 1.00 0.00 N ATOM 1217 CA ASN A 71 8.421 -5.261 0.185 1.00 0.00 C ATOM 1218 C ASN A 71 7.238 -4.292 0.173 1.00 0.00 C ATOM 1219 O ASN A 71 6.511 -4.182 1.159 1.00 0.00 O ATOM 1220 CB ASN A 71 9.260 -4.967 1.430 1.00 0.00 C ATOM 1221 CG ASN A 71 10.337 -6.036 1.631 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.231 -6.909 2.476 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.376 -5.918 0.810 1.00 0.00 N ATOM 0 H ASN A 71 9.898 -4.335 -0.979 1.00 0.00 H new ATOM 0 HA ASN A 71 8.080 -6.296 0.215 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.728 -3.987 1.334 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.614 -4.927 2.307 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.148 -6.583 0.865 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.401 -5.163 0.125 1.00 0.00 H new ATOM 1230 N VAL A 72 7.081 -3.614 -0.955 1.00 0.00 N ATOM 1231 CA VAL A 72 5.997 -2.658 -1.108 1.00 0.00 C ATOM 1232 C VAL A 72 5.388 -2.804 -2.504 1.00 0.00 C ATOM 1233 O VAL A 72 4.180 -2.989 -2.642 1.00 0.00 O ATOM 1234 CB VAL A 72 6.504 -1.243 -0.823 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.387 -0.213 -1.004 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.112 -1.151 0.578 1.00 0.00 C ATOM 0 H VAL A 72 7.686 -3.708 -1.771 1.00 0.00 H new ATOM 0 HA VAL A 72 5.206 -2.858 -0.385 1.00 0.00 H new ATOM 0 HB VAL A 72 7.289 -1.017 -1.545 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.774 0.784 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.019 -0.252 -2.029 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.571 -0.437 -0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.465 -0.135 0.756 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.356 -1.408 1.320 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.949 -1.845 0.658 1.00 0.00 H new ATOM 1246 N LEU A 73 6.252 -2.716 -3.504 1.00 0.00 N ATOM 1247 CA LEU A 73 5.814 -2.836 -4.885 1.00 0.00 C ATOM 1248 C LEU A 73 6.442 -4.085 -5.508 1.00 0.00 C ATOM 1249 O LEU A 73 7.508 -4.010 -6.116 1.00 0.00 O ATOM 1250 CB LEU A 73 6.112 -1.549 -5.655 1.00 0.00 C ATOM 1251 CG LEU A 73 5.242 -1.288 -6.887 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.101 -0.323 -6.558 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.089 -0.795 -8.062 1.00 0.00 C ATOM 0 H LEU A 73 7.254 -2.563 -3.386 1.00 0.00 H new ATOM 0 HA LEU A 73 4.733 -2.965 -4.932 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.002 -0.707 -4.972 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.155 -1.570 -5.969 1.00 0.00 H new ATOM 0 HG LEU A 73 4.788 -2.231 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.498 -0.155 -7.450 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.477 -0.752 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.514 0.626 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.446 -0.617 -8.924 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.590 0.133 -7.785 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.835 -1.549 -8.314 1.00 0.00 H new ATOM 1265 N PRO A 74 5.735 -5.233 -5.330 1.00 0.00 N ATOM 1266 CA PRO A 74 6.212 -6.496 -5.868 1.00 0.00 C ATOM 1267 C PRO A 74 6.003 -6.561 -7.382 1.00 0.00 C ATOM 1268 O PRO A 74 4.869 -6.567 -7.856 1.00 0.00 O ATOM 1269 CB PRO A 74 5.434 -7.563 -5.115 1.00 0.00 C ATOM 1270 CG PRO A 74 4.226 -6.857 -4.521 1.00 0.00 C ATOM 1271 CD PRO A 74 4.468 -5.359 -4.616 1.00 0.00 C ATOM 0 HA PRO A 74 7.285 -6.633 -5.732 1.00 0.00 H new ATOM 0 HB2 PRO A 74 5.127 -8.367 -5.784 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.046 -8.014 -4.334 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.320 -7.132 -5.060 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.082 -7.155 -3.483 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.660 -4.861 -5.152 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.524 -4.903 -3.627 1.00 0.00 H new ATOM 1279 N GLY A 75 7.117 -6.608 -8.099 1.00 0.00 N ATOM 1280 CA GLY A 75 7.070 -6.673 -9.550 1.00 0.00 C ATOM 1281 C GLY A 75 7.912 -5.558 -10.175 1.00 0.00 C ATOM 1282 O GLY A 75 8.500 -5.743 -11.240 1.00 0.00 O ATOM 0 H GLY A 75 8.057 -6.602 -7.702 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.436 -7.643 -9.886 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.037 -6.587 -9.888 1.00 0.00 H new ATOM 1286 N VAL A 76 7.942 -4.426 -9.487 1.00 0.00 N ATOM 1287 CA VAL A 76 8.702 -3.282 -9.962 1.00 0.00 C ATOM 1288 C VAL A 76 10.012 -3.769 -10.584 1.00 0.00 C ATOM 1289 O VAL A 76 10.497 -4.849 -10.253 1.00 0.00 O ATOM 1290 CB VAL A 76 8.915 -2.286 -8.821 1.00 0.00 C ATOM 1291 CG1 VAL A 76 10.074 -2.722 -7.921 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.143 -0.873 -9.362 1.00 0.00 C ATOM 0 H VAL A 76 7.452 -4.277 -8.605 1.00 0.00 H new ATOM 0 HA VAL A 76 8.151 -2.752 -10.739 1.00 0.00 H new ATOM 0 HB VAL A 76 8.008 -2.271 -8.216 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.204 -1.996 -7.118 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.855 -3.701 -7.494 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.990 -2.780 -8.509 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.292 -0.185 -8.530 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.026 -0.866 -10.001 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.274 -0.560 -9.941 1.00 0.00 H new ATOM 1302 N LYS A 77 10.548 -2.947 -11.475 1.00 0.00 N ATOM 1303 CA LYS A 77 11.793 -3.279 -12.146 1.00 0.00 C ATOM 1304 C LYS A 77 12.971 -2.845 -11.272 1.00 0.00 C ATOM 1305 O LYS A 77 14.010 -3.502 -11.253 1.00 0.00 O ATOM 1306 CB LYS A 77 11.819 -2.681 -13.554 1.00 0.00 C ATOM 1307 CG LYS A 77 10.841 -3.411 -14.478 1.00 0.00 C ATOM 1308 CD LYS A 77 11.390 -3.492 -15.904 1.00 0.00 C ATOM 1309 CE LYS A 77 11.682 -4.941 -16.298 1.00 0.00 C ATOM 1310 NZ LYS A 77 12.872 -5.010 -17.175 1.00 0.00 N ATOM 0 H LYS A 77 10.142 -2.052 -11.748 1.00 0.00 H new ATOM 0 HA LYS A 77 11.876 -4.357 -12.281 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.561 -1.623 -13.508 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.828 -2.746 -13.962 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.657 -4.416 -14.098 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.883 -2.892 -14.482 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.670 -3.060 -16.600 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.302 -2.900 -15.981 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.847 -5.541 -15.403 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.819 -5.365 -16.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 13.056 -6.001 -17.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.701 -4.454 -18.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.697 -4.624 -16.672 1.00 0.00 H new ATOM 1324 N SER A 78 12.769 -1.739 -10.570 1.00 0.00 N ATOM 1325 CA SER A 78 13.802 -1.209 -9.696 1.00 0.00 C ATOM 1326 C SER A 78 13.246 -0.042 -8.877 1.00 0.00 C ATOM 1327 O SER A 78 12.142 0.433 -9.138 1.00 0.00 O ATOM 1328 CB SER A 78 15.025 -0.759 -10.498 1.00 0.00 C ATOM 1329 OG SER A 78 16.146 -0.497 -9.659 1.00 0.00 O ATOM 0 H SER A 78 11.906 -1.196 -10.589 1.00 0.00 H new ATOM 0 HA SER A 78 14.117 -2.003 -9.019 1.00 0.00 H new ATOM 0 HB2 SER A 78 15.287 -1.530 -11.223 1.00 0.00 H new ATOM 0 HB3 SER A 78 14.777 0.139 -11.063 1.00 0.00 H new ATOM 0 HG SER A 78 16.907 -0.214 -10.208 1.00 0.00 H new ATOM 1335 N ILE A 79 14.036 0.385 -7.903 1.00 0.00 N ATOM 1336 CA ILE A 79 13.636 1.486 -7.044 1.00 0.00 C ATOM 1337 C ILE A 79 13.339 2.716 -7.904 1.00 0.00 C ATOM 1338 O ILE A 79 12.435 3.490 -7.595 1.00 0.00 O ATOM 1339 CB ILE A 79 14.691 1.732 -5.963 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.903 0.481 -5.109 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.330 2.952 -5.112 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.578 0.831 -3.781 1.00 0.00 C ATOM 0 H ILE A 79 14.951 -0.012 -7.690 1.00 0.00 H new ATOM 0 HA ILE A 79 12.718 1.240 -6.511 1.00 0.00 H new ATOM 0 HB ILE A 79 15.639 1.951 -6.455 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.944 0.000 -4.918 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.516 -0.236 -5.655 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.096 3.105 -4.352 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.270 3.835 -5.749 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.367 2.787 -4.629 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.717 -0.076 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.548 1.289 -3.975 1.00 0.00 H new ATOM 0 HD13 ILE A 79 14.951 1.530 -3.227 1.00 0.00 H new ATOM 1354 N GLU A 80 14.117 2.857 -8.967 1.00 0.00 N ATOM 1355 CA GLU A 80 13.948 3.980 -9.874 1.00 0.00 C ATOM 1356 C GLU A 80 12.592 3.894 -10.578 1.00 0.00 C ATOM 1357 O GLU A 80 11.856 4.877 -10.637 1.00 0.00 O ATOM 1358 CB GLU A 80 15.091 4.040 -10.890 1.00 0.00 C ATOM 1359 CG GLU A 80 16.036 5.204 -10.583 1.00 0.00 C ATOM 1360 CD GLU A 80 15.970 6.268 -11.681 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.872 6.840 -11.851 1.00 0.00 O ATOM 1362 OE2 GLU A 80 17.019 6.485 -12.324 1.00 0.00 O ATOM 0 H GLU A 80 14.866 2.213 -9.221 1.00 0.00 H new ATOM 0 HA GLU A 80 13.975 4.901 -9.291 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.646 3.102 -10.874 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.684 4.153 -11.895 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.771 5.649 -9.624 1.00 0.00 H new ATOM 0 HG3 GLU A 80 17.057 4.834 -10.491 1.00 0.00 H new ATOM 1369 N GLU A 81 12.304 2.708 -11.095 1.00 0.00 N ATOM 1370 CA GLU A 81 11.050 2.481 -11.793 1.00 0.00 C ATOM 1371 C GLU A 81 9.869 2.677 -10.840 1.00 0.00 C ATOM 1372 O GLU A 81 8.830 3.204 -11.234 1.00 0.00 O ATOM 1373 CB GLU A 81 11.019 1.089 -12.425 1.00 0.00 C ATOM 1374 CG GLU A 81 11.684 1.097 -13.804 1.00 0.00 C ATOM 1375 CD GLU A 81 10.679 0.736 -14.899 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.558 1.287 -14.845 1.00 0.00 O ATOM 1377 OE2 GLU A 81 11.054 -0.082 -15.766 1.00 0.00 O ATOM 0 H GLU A 81 12.917 1.895 -11.044 1.00 0.00 H new ATOM 0 HA GLU A 81 10.967 3.211 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.531 0.379 -11.775 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.987 0.750 -12.517 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.106 2.082 -14.003 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.512 0.388 -13.817 1.00 0.00 H new ATOM 1384 N GLY A 82 10.069 2.243 -9.604 1.00 0.00 N ATOM 1385 CA GLY A 82 9.034 2.364 -8.592 1.00 0.00 C ATOM 1386 C GLY A 82 8.526 3.804 -8.496 1.00 0.00 C ATOM 1387 O GLY A 82 7.321 4.037 -8.411 1.00 0.00 O ATOM 0 H GLY A 82 10.933 1.807 -9.281 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.206 1.698 -8.833 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.427 2.048 -7.626 1.00 0.00 H new ATOM 1391 N ILE A 83 9.471 4.733 -8.514 1.00 0.00 N ATOM 1392 CA ILE A 83 9.134 6.144 -8.430 1.00 0.00 C ATOM 1393 C ILE A 83 8.320 6.544 -9.662 1.00 0.00 C ATOM 1394 O ILE A 83 7.389 7.343 -9.563 1.00 0.00 O ATOM 1395 CB ILE A 83 10.397 6.985 -8.228 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.824 6.989 -6.759 1.00 0.00 C ATOM 1397 CG2 ILE A 83 10.205 8.402 -8.773 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.348 6.932 -6.631 1.00 0.00 C ATOM 0 H ILE A 83 10.469 4.536 -8.585 1.00 0.00 H new ATOM 0 HA ILE A 83 8.508 6.335 -7.558 1.00 0.00 H new ATOM 0 HB ILE A 83 11.206 6.528 -8.797 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.448 7.887 -6.270 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.380 6.136 -6.245 1.00 0.00 H new ATOM 0 HG21 ILE A 83 11.117 8.979 -8.617 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.984 8.355 -9.839 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.378 8.883 -8.252 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.625 6.936 -5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.719 6.021 -7.100 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.787 7.799 -7.125 1.00 0.00 H new ATOM 1410 N GLN A 84 8.699 5.970 -10.794 1.00 0.00 N ATOM 1411 CA GLN A 84 8.015 6.256 -12.044 1.00 0.00 C ATOM 1412 C GLN A 84 6.551 5.820 -11.960 1.00 0.00 C ATOM 1413 O GLN A 84 5.668 6.490 -12.494 1.00 0.00 O ATOM 1414 CB GLN A 84 8.721 5.582 -13.222 1.00 0.00 C ATOM 1415 CG GLN A 84 9.808 6.490 -13.801 1.00 0.00 C ATOM 1416 CD GLN A 84 9.225 7.836 -14.236 1.00 0.00 C ATOM 1417 OE1 GLN A 84 8.145 7.921 -14.797 1.00 0.00 O ATOM 1418 NE2 GLN A 84 9.998 8.879 -13.948 1.00 0.00 N ATOM 0 H GLN A 84 9.471 5.308 -10.872 1.00 0.00 H new ATOM 0 HA GLN A 84 8.044 7.332 -12.213 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.164 4.641 -12.895 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.993 5.340 -13.997 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.587 6.651 -13.056 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.279 6.001 -14.654 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.891 8.737 -13.477 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.698 9.821 -14.198 1.00 0.00 H new ATOM 1427 N VAL A 85 6.338 4.700 -11.285 1.00 0.00 N ATOM 1428 CA VAL A 85 4.996 4.166 -11.124 1.00 0.00 C ATOM 1429 C VAL A 85 4.164 5.135 -10.281 1.00 0.00 C ATOM 1430 O VAL A 85 3.048 5.490 -10.657 1.00 0.00 O ATOM 1431 CB VAL A 85 5.061 2.759 -10.528 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.819 2.463 -9.684 1.00 0.00 C ATOM 1433 CG2 VAL A 85 5.242 1.707 -11.624 1.00 0.00 C ATOM 0 H VAL A 85 7.073 4.147 -10.843 1.00 0.00 H new ATOM 0 HA VAL A 85 4.504 4.072 -12.092 1.00 0.00 H new ATOM 0 HB VAL A 85 5.931 2.713 -9.872 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.891 1.456 -9.272 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.752 3.185 -8.870 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.929 2.537 -10.308 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.285 0.716 -11.173 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.401 1.755 -12.316 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.169 1.900 -12.165 1.00 0.00 H new ATOM 1443 N TYR A 86 4.740 5.536 -9.157 1.00 0.00 N ATOM 1444 CA TYR A 86 4.066 6.457 -8.258 1.00 0.00 C ATOM 1445 C TYR A 86 3.774 7.788 -8.954 1.00 0.00 C ATOM 1446 O TYR A 86 2.885 8.529 -8.537 1.00 0.00 O ATOM 1447 CB TYR A 86 5.036 6.702 -7.101 1.00 0.00 C ATOM 1448 CG TYR A 86 5.681 5.430 -6.549 1.00 0.00 C ATOM 1449 CD1 TYR A 86 5.017 4.223 -6.643 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.926 5.488 -5.956 1.00 0.00 C ATOM 1451 CE1 TYR A 86 5.624 3.025 -6.123 1.00 0.00 C ATOM 1452 CE2 TYR A 86 7.533 4.290 -5.436 1.00 0.00 C ATOM 1453 CZ TYR A 86 6.852 3.118 -5.546 1.00 0.00 C ATOM 1454 OH TYR A 86 7.425 1.986 -5.055 1.00 0.00 O ATOM 0 H TYR A 86 5.666 5.240 -8.849 1.00 0.00 H new ATOM 0 HA TYR A 86 3.115 6.042 -7.925 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.822 7.379 -7.436 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.503 7.206 -6.295 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.043 4.177 -7.106 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.445 6.432 -5.882 1.00 0.00 H new ATOM 0 HE1 TYR A 86 5.116 2.074 -6.190 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.507 4.322 -4.969 1.00 0.00 H new ATOM 0 HH TYR A 86 8.400 2.060 -5.117 1.00 0.00 H new ATOM 1464 N ARG A 87 4.539 8.051 -10.003 1.00 0.00 N ATOM 1465 CA ARG A 87 4.374 9.280 -10.761 1.00 0.00 C ATOM 1466 C ARG A 87 3.091 9.221 -11.593 1.00 0.00 C ATOM 1467 O ARG A 87 2.302 10.164 -11.591 1.00 0.00 O ATOM 1468 CB ARG A 87 5.566 9.519 -11.690 1.00 0.00 C ATOM 1469 CG ARG A 87 6.284 10.823 -11.336 1.00 0.00 C ATOM 1470 CD ARG A 87 6.404 11.732 -12.561 1.00 0.00 C ATOM 1471 NE ARG A 87 7.673 12.492 -12.505 1.00 0.00 N ATOM 1472 CZ ARG A 87 8.126 13.271 -13.496 1.00 0.00 C ATOM 1473 NH1 ARG A 87 7.416 13.399 -14.626 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.288 13.923 -13.357 1.00 0.00 N ATOM 0 H ARG A 87 5.275 7.434 -10.346 1.00 0.00 H new ATOM 0 HA ARG A 87 4.313 10.103 -10.049 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.263 8.684 -11.615 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.224 9.557 -12.724 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.738 11.340 -10.547 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.277 10.601 -10.944 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.368 11.135 -13.472 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.560 12.420 -12.598 1.00 0.00 H new ATOM 0 HE ARG A 87 8.238 12.418 -11.659 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.531 12.903 -14.731 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.761 13.992 -15.381 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.827 13.826 -12.497 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.633 14.516 -14.111 1.00 0.00 H new ATOM 1488 N ARG A 88 2.924 8.104 -12.286 1.00 0.00 N ATOM 1489 CA ARG A 88 1.750 7.910 -13.121 1.00 0.00 C ATOM 1490 C ARG A 88 0.527 7.604 -12.254 1.00 0.00 C ATOM 1491 O ARG A 88 -0.608 7.782 -12.693 1.00 0.00 O ATOM 1492 CB ARG A 88 1.964 6.765 -14.113 1.00 0.00 C ATOM 1493 CG ARG A 88 1.667 5.413 -13.462 1.00 0.00 C ATOM 1494 CD ARG A 88 0.294 4.889 -13.889 1.00 0.00 C ATOM 1495 NE ARG A 88 0.362 3.430 -14.130 1.00 0.00 N ATOM 1496 CZ ARG A 88 1.053 2.865 -15.130 1.00 0.00 C ATOM 1497 NH1 ARG A 88 1.739 3.633 -15.988 1.00 0.00 N ATOM 1498 NH2 ARG A 88 1.058 1.533 -15.272 1.00 0.00 N ATOM 0 H ARG A 88 3.582 7.324 -12.287 1.00 0.00 H new ATOM 0 HA ARG A 88 1.582 8.832 -13.678 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.318 6.905 -14.980 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.992 6.780 -14.475 1.00 0.00 H new ATOM 0 HG2 ARG A 88 2.437 4.694 -13.741 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.701 5.512 -12.377 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -0.443 5.104 -13.116 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.034 5.401 -14.794 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.149 2.816 -13.495 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.735 4.647 -15.880 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.265 3.203 -16.749 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.536 0.949 -14.619 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.584 1.103 -16.033 1.00 0.00 H new ATOM 1512 N PHE A 89 0.800 7.149 -11.041 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.264 6.816 -10.109 1.00 0.00 C ATOM 1514 C PHE A 89 -0.624 8.019 -9.235 1.00 0.00 C ATOM 1515 O PHE A 89 -1.781 8.433 -9.188 1.00 0.00 O ATOM 1516 CB PHE A 89 0.259 5.690 -9.216 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.312 4.311 -9.553 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -1.525 3.939 -9.063 1.00 0.00 C ATOM 1519 CD2 PHE A 89 0.392 3.458 -10.345 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.055 2.659 -9.376 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.138 2.179 -10.658 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.350 1.806 -10.167 1.00 0.00 C ATOM 0 H PHE A 89 1.743 7.003 -10.681 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.158 6.518 -10.657 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.345 5.651 -9.296 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.024 5.925 -8.178 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.085 4.617 -8.436 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.354 3.754 -10.736 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.018 2.363 -8.986 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.422 1.502 -11.286 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.753 0.833 -10.405 1.00 0.00 H new ATOM 1532 N TYR A 90 0.390 8.547 -8.564 1.00 0.00 N ATOM 1533 CA TYR A 90 0.196 9.694 -7.694 1.00 0.00 C ATOM 1534 C TYR A 90 0.957 10.914 -8.217 1.00 0.00 C ATOM 1535 O TYR A 90 2.018 10.775 -8.825 1.00 0.00 O ATOM 1536 CB TYR A 90 0.770 9.294 -6.334 1.00 0.00 C ATOM 1537 CG TYR A 90 0.684 7.795 -6.039 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.512 7.127 -6.201 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.804 7.111 -5.611 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.592 5.716 -5.924 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.724 5.700 -5.334 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.530 5.072 -5.503 1.00 0.00 C ATOM 1543 OH TYR A 90 0.454 3.740 -5.241 1.00 0.00 O ATOM 0 H TYR A 90 1.349 8.201 -8.606 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.860 9.960 -7.640 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.814 9.604 -6.286 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.240 9.839 -5.553 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.388 7.662 -6.536 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.740 7.634 -5.484 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.522 5.181 -6.048 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.593 5.153 -5.000 1.00 0.00 H new ATOM 0 HH TYR A 90 1.331 3.413 -4.950 1.00 0.00 H new ATOM 1553 N ASP A 91 0.386 12.082 -7.961 1.00 0.00 N ATOM 1554 CA ASP A 91 0.998 13.325 -8.399 1.00 0.00 C ATOM 1555 C ASP A 91 2.303 13.544 -7.630 1.00 0.00 C ATOM 1556 O ASP A 91 2.400 13.199 -6.454 1.00 0.00 O ATOM 1557 CB ASP A 91 0.080 14.518 -8.121 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.417 14.203 -8.154 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.852 13.621 -9.170 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -2.091 14.552 -7.161 1.00 0.00 O ATOM 0 H ASP A 91 -0.493 12.194 -7.456 1.00 0.00 H new ATOM 0 HA ASP A 91 1.181 13.252 -9.471 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.328 14.928 -7.142 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.289 15.297 -8.855 1.00 0.00 H new ATOM 1565 N GLU A 92 3.274 14.116 -8.328 1.00 0.00 N ATOM 1566 CA GLU A 92 4.569 14.385 -7.726 1.00 0.00 C ATOM 1567 C GLU A 92 4.477 15.587 -6.784 1.00 0.00 C ATOM 1568 O GLU A 92 5.177 15.644 -5.774 1.00 0.00 O ATOM 1569 CB GLU A 92 5.636 14.610 -8.799 1.00 0.00 C ATOM 1570 CG GLU A 92 7.024 14.227 -8.281 1.00 0.00 C ATOM 1571 CD GLU A 92 8.103 15.122 -8.893 1.00 0.00 C ATOM 1572 OE1 GLU A 92 7.944 15.470 -10.083 1.00 0.00 O ATOM 1573 OE2 GLU A 92 9.063 15.438 -8.157 1.00 0.00 O ATOM 0 H GLU A 92 3.190 14.400 -9.304 1.00 0.00 H new ATOM 0 HA GLU A 92 4.865 13.513 -7.143 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.398 14.019 -9.683 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.634 15.656 -9.105 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.047 14.314 -7.195 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.231 13.184 -8.522 1.00 0.00 H new ATOM 1580 N GLU A 93 3.607 16.518 -7.148 1.00 0.00 N ATOM 1581 CA GLU A 93 3.415 17.716 -6.348 1.00 0.00 C ATOM 1582 C GLU A 93 2.779 17.359 -5.003 1.00 0.00 C ATOM 1583 O GLU A 93 3.282 17.750 -3.951 1.00 0.00 O ATOM 1584 CB GLU A 93 2.570 18.747 -7.098 1.00 0.00 C ATOM 1585 CG GLU A 93 3.263 20.110 -7.125 1.00 0.00 C ATOM 1586 CD GLU A 93 2.743 21.012 -6.003 1.00 0.00 C ATOM 1587 OE1 GLU A 93 3.212 20.823 -4.860 1.00 0.00 O ATOM 1588 OE2 GLU A 93 1.889 21.870 -6.315 1.00 0.00 O ATOM 0 H GLU A 93 3.027 16.467 -7.986 1.00 0.00 H new ATOM 0 HA GLU A 93 4.391 18.164 -6.159 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.393 18.405 -8.118 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.595 18.840 -6.620 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.340 19.977 -7.020 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.094 20.589 -8.089 1.00 0.00 H new ATOM 1595 N LYS A 94 1.681 16.621 -5.081 1.00 0.00 N ATOM 1596 CA LYS A 94 0.970 16.207 -3.883 1.00 0.00 C ATOM 1597 C LYS A 94 1.881 15.314 -3.038 1.00 0.00 C ATOM 1598 O LYS A 94 1.845 15.370 -1.810 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.363 15.554 -4.250 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.536 16.485 -3.933 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.314 15.991 -2.712 1.00 0.00 C ATOM 1602 CE LYS A 94 -1.541 16.266 -1.421 1.00 0.00 C ATOM 1603 NZ LYS A 94 -1.882 17.603 -0.887 1.00 0.00 N ATOM 0 H LYS A 94 1.266 16.299 -5.956 1.00 0.00 H new ATOM 0 HA LYS A 94 0.716 17.073 -3.272 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.369 15.304 -5.311 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.477 14.619 -3.701 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.165 17.493 -3.749 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.202 16.543 -4.794 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.285 16.485 -2.671 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.504 14.922 -2.806 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.775 15.502 -0.680 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.470 16.207 -1.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.715 17.620 0.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.288 18.322 -1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.884 17.808 -1.078 1.00 0.00 H new ATOM 1617 N GLU A 95 2.676 14.511 -3.730 1.00 0.00 N ATOM 1618 CA GLU A 95 3.594 13.607 -3.059 1.00 0.00 C ATOM 1619 C GLU A 95 4.652 14.400 -2.289 1.00 0.00 C ATOM 1620 O GLU A 95 4.852 14.180 -1.096 1.00 0.00 O ATOM 1621 CB GLU A 95 4.246 12.647 -4.056 1.00 0.00 C ATOM 1622 CG GLU A 95 5.027 11.549 -3.331 1.00 0.00 C ATOM 1623 CD GLU A 95 6.512 11.904 -3.236 1.00 0.00 C ATOM 1624 OE1 GLU A 95 7.159 11.930 -4.306 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.968 12.142 -2.097 1.00 0.00 O ATOM 0 H GLU A 95 2.703 14.468 -4.749 1.00 0.00 H new ATOM 0 HA GLU A 95 3.027 13.008 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.480 12.197 -4.687 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.916 13.200 -4.714 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.619 11.407 -2.330 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.909 10.604 -3.860 1.00 0.00 H new ATOM 1632 N LYS A 96 5.303 15.306 -3.005 1.00 0.00 N ATOM 1633 CA LYS A 96 6.336 16.133 -2.404 1.00 0.00 C ATOM 1634 C LYS A 96 5.705 17.043 -1.348 1.00 0.00 C ATOM 1635 O LYS A 96 6.401 17.573 -0.484 1.00 0.00 O ATOM 1636 CB LYS A 96 7.111 16.890 -3.484 1.00 0.00 C ATOM 1637 CG LYS A 96 8.150 15.985 -4.149 1.00 0.00 C ATOM 1638 CD LYS A 96 9.485 16.044 -3.405 1.00 0.00 C ATOM 1639 CE LYS A 96 10.581 16.639 -4.291 1.00 0.00 C ATOM 1640 NZ LYS A 96 11.810 16.884 -3.502 1.00 0.00 N ATOM 0 H LYS A 96 5.135 15.485 -3.995 1.00 0.00 H new ATOM 0 HA LYS A 96 7.071 15.512 -1.892 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.418 17.268 -4.236 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.606 17.755 -3.043 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.785 14.958 -4.167 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.293 16.290 -5.185 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.376 16.645 -2.502 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.773 15.042 -3.088 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.800 15.959 -5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.233 17.573 -4.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.544 17.288 -4.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.601 17.550 -2.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.150 15.987 -3.101 1.00 0.00 H new ATOM 1654 N LYS A 97 4.393 17.196 -1.453 1.00 0.00 N ATOM 1655 CA LYS A 97 3.660 18.033 -0.517 1.00 0.00 C ATOM 1656 C LYS A 97 3.677 17.379 0.866 1.00 0.00 C ATOM 1657 O LYS A 97 4.163 17.969 1.829 1.00 0.00 O ATOM 1658 CB LYS A 97 2.253 18.320 -1.045 1.00 0.00 C ATOM 1659 CG LYS A 97 2.127 19.774 -1.505 1.00 0.00 C ATOM 1660 CD LYS A 97 0.723 20.316 -1.229 1.00 0.00 C ATOM 1661 CE LYS A 97 -0.040 20.552 -2.534 1.00 0.00 C ATOM 1662 NZ LYS A 97 -1.008 21.661 -2.375 1.00 0.00 N ATOM 0 H LYS A 97 3.819 16.755 -2.171 1.00 0.00 H new ATOM 0 HA LYS A 97 4.142 19.005 -0.416 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.029 17.651 -1.876 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.519 18.116 -0.265 1.00 0.00 H new ATOM 0 HG2 LYS A 97 2.866 20.388 -0.989 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.344 19.842 -2.571 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.174 19.611 -0.605 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.793 21.249 -0.671 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.661 20.786 -3.335 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.565 19.642 -2.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.517 21.808 -3.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.688 21.424 -1.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -0.500 22.531 -2.119 1.00 0.00 H new ATOM 1676 N TYR A 98 3.140 16.169 0.920 1.00 0.00 N ATOM 1677 CA TYR A 98 3.087 15.429 2.169 1.00 0.00 C ATOM 1678 C TYR A 98 4.204 14.386 2.236 1.00 0.00 C ATOM 1679 O TYR A 98 4.991 14.374 3.182 1.00 0.00 O ATOM 1680 CB TYR A 98 1.735 14.712 2.178 1.00 0.00 C ATOM 1681 CG TYR A 98 0.559 15.606 2.574 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.662 16.437 3.671 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.606 15.583 1.834 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.445 17.279 4.044 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.713 16.425 2.207 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.578 17.231 3.293 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.623 18.026 3.646 1.00 0.00 O ATOM 0 H TYR A 98 2.738 15.683 0.119 1.00 0.00 H new ATOM 0 HA TYR A 98 3.209 16.101 3.018 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.547 14.300 1.186 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.786 13.870 2.868 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.573 16.456 4.250 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.687 14.933 0.975 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.377 17.934 4.900 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.630 16.416 1.637 1.00 0.00 H new ATOM 0 HH TYR A 98 -3.365 17.888 3.020 1.00 0.00 H new ATOM 1697 N GLY A 99 4.238 13.535 1.221 1.00 0.00 N ATOM 1698 CA GLY A 99 5.246 12.491 1.153 1.00 0.00 C ATOM 1699 C GLY A 99 4.598 11.105 1.112 1.00 0.00 C ATOM 1700 O GLY A 99 3.400 10.984 0.863 1.00 0.00 O ATOM 0 H GLY A 99 3.583 13.547 0.439 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.864 12.634 0.266 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.907 12.562 2.017 1.00 0.00 H new ATOM 1704 N VAL A 100 5.419 10.096 1.361 1.00 0.00 N ATOM 1705 CA VAL A 100 4.941 8.724 1.356 1.00 0.00 C ATOM 1706 C VAL A 100 4.688 8.271 2.796 1.00 0.00 C ATOM 1707 O VAL A 100 5.286 8.801 3.731 1.00 0.00 O ATOM 1708 CB VAL A 100 5.932 7.827 0.613 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.251 6.551 0.114 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.596 8.581 -0.541 1.00 0.00 C ATOM 0 H VAL A 100 6.412 10.201 1.568 1.00 0.00 H new ATOM 0 HA VAL A 100 3.994 8.652 0.821 1.00 0.00 H new ATOM 0 HB VAL A 100 6.712 7.537 1.317 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.978 5.932 -0.411 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.848 5.998 0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.440 6.813 -0.566 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.296 7.920 -1.052 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.833 8.915 -1.244 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.133 9.445 -0.150 1.00 0.00 H new ATOM 1720 N VAL A 101 3.802 7.294 2.928 1.00 0.00 N ATOM 1721 CA VAL A 101 3.463 6.764 4.238 1.00 0.00 C ATOM 1722 C VAL A 101 3.375 5.239 4.158 1.00 0.00 C ATOM 1723 O VAL A 101 2.429 4.697 3.588 1.00 0.00 O ATOM 1724 CB VAL A 101 2.173 7.412 4.747 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.439 8.825 5.268 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.098 7.421 3.659 1.00 0.00 C ATOM 0 H VAL A 101 3.309 6.856 2.150 1.00 0.00 H new ATOM 0 HA VAL A 101 4.240 7.008 4.962 1.00 0.00 H new ATOM 0 HB VAL A 101 1.802 6.813 5.579 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.506 9.263 5.624 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.156 8.781 6.088 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.845 9.439 4.464 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.192 7.887 4.047 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.456 7.985 2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.879 6.397 3.356 1.00 0.00 H new ATOM 1736 N ALA A 102 4.373 4.589 4.739 1.00 0.00 N ATOM 1737 CA ALA A 102 4.421 3.137 4.741 1.00 0.00 C ATOM 1738 C ALA A 102 3.523 2.604 5.859 1.00 0.00 C ATOM 1739 O ALA A 102 3.931 2.553 7.018 1.00 0.00 O ATOM 1740 CB ALA A 102 5.871 2.674 4.887 1.00 0.00 C ATOM 0 H ALA A 102 5.155 5.042 5.212 1.00 0.00 H new ATOM 0 HA ALA A 102 4.046 2.739 3.798 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.907 1.585 4.888 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.460 3.055 4.053 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.281 3.052 5.824 1.00 0.00 H new ATOM 1746 N ILE A 103 2.315 2.219 5.471 1.00 0.00 N ATOM 1747 CA ILE A 103 1.356 1.691 6.426 1.00 0.00 C ATOM 1748 C ILE A 103 1.402 0.162 6.396 1.00 0.00 C ATOM 1749 O ILE A 103 1.418 -0.442 5.325 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.036 2.269 6.163 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.577 1.804 4.810 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.027 3.795 6.283 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -1.987 2.344 4.568 1.00 0.00 C ATOM 0 H ILE A 103 1.979 2.262 4.509 1.00 0.00 H new ATOM 0 HA ILE A 103 1.618 1.999 7.438 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.714 1.889 6.928 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.087 2.141 4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -0.590 0.715 4.775 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.028 4.181 6.091 1.00 0.00 H new ATOM 0 HG22 ILE A 103 0.285 4.079 7.288 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.668 4.213 5.555 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.348 1.998 3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -2.654 1.985 5.352 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.966 3.434 4.580 1.00 0.00 H new ATOM 1765 N GLU A 104 1.421 -0.421 7.586 1.00 0.00 N ATOM 1766 CA GLU A 104 1.465 -1.869 7.710 1.00 0.00 C ATOM 1767 C GLU A 104 0.046 -2.439 7.770 1.00 0.00 C ATOM 1768 O GLU A 104 -0.726 -2.100 8.666 1.00 0.00 O ATOM 1769 CB GLU A 104 2.278 -2.290 8.935 1.00 0.00 C ATOM 1770 CG GLU A 104 2.550 -3.795 8.921 1.00 0.00 C ATOM 1771 CD GLU A 104 3.899 -4.115 9.569 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.036 -3.811 10.774 1.00 0.00 O ATOM 1773 OE2 GLU A 104 4.763 -4.655 8.845 1.00 0.00 O ATOM 0 H GLU A 104 1.407 0.083 8.473 1.00 0.00 H new ATOM 0 HA GLU A 104 1.962 -2.275 6.829 1.00 0.00 H new ATOM 0 HB2 GLU A 104 3.222 -1.746 8.954 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.738 -2.023 9.844 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.754 -4.317 9.453 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.540 -4.160 7.894 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.254 -3.296 6.805 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.566 -3.917 6.738 1.00 0.00 C ATOM 1782 C ILE A 105 -1.405 -5.438 6.706 1.00 0.00 C ATOM 1783 O ILE A 105 -0.317 -5.945 6.438 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.363 -3.358 5.557 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -1.994 -4.077 4.257 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.186 -1.843 5.443 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.515 -3.875 3.920 1.00 0.00 C ATOM 0 H ILE A 105 0.389 -3.575 6.064 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.147 -3.677 7.628 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.421 -3.546 5.740 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.207 -5.142 4.353 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.611 -3.701 3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.763 -1.472 4.596 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.537 -1.366 6.358 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.132 -1.610 5.294 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.279 -4.396 2.992 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.311 -2.811 3.801 1.00 0.00 H new ATOM 0 HD13 ILE A 105 0.100 -4.274 4.727 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.504 -6.123 6.984 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.498 -7.576 6.991 1.00 0.00 C ATOM 1801 C GLU A 106 -3.840 -8.115 6.490 1.00 0.00 C ATOM 1802 O GLU A 106 -4.847 -8.032 7.191 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.178 -8.116 8.387 1.00 0.00 C ATOM 1804 CG GLU A 106 -2.669 -7.157 9.472 1.00 0.00 C ATOM 1805 CD GLU A 106 -3.059 -7.918 10.741 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -4.065 -8.657 10.672 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -2.344 -7.743 11.751 1.00 0.00 O ATOM 0 H GLU A 106 -3.405 -5.699 7.206 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.715 -7.920 6.315 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.646 -9.091 8.520 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.103 -8.263 8.486 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -1.888 -6.433 9.703 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -3.526 -6.594 9.104 1.00 0.00 H new ATOM 1814 N PRO A 107 -3.809 -8.670 5.249 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.010 -9.222 4.645 1.00 0.00 C ATOM 1816 C PRO A 107 -5.371 -10.568 5.276 1.00 0.00 C ATOM 1817 O PRO A 107 -4.707 -11.573 5.025 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.693 -9.326 3.163 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.178 -9.268 3.055 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.634 -8.785 4.390 1.00 0.00 C ATOM 0 HA PRO A 107 -5.888 -8.597 4.807 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.079 -10.256 2.746 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.156 -8.511 2.607 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.775 -10.251 2.811 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -2.878 -8.593 2.254 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -1.910 -9.489 4.801 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.124 -7.827 4.287 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.422 -10.545 6.082 1.00 0.00 N ATOM 1829 CA LEU A 108 -6.879 -11.752 6.750 1.00 0.00 C ATOM 1830 C LEU A 108 -7.645 -12.623 5.752 1.00 0.00 C ATOM 1831 O LEU A 108 -8.872 -12.576 5.695 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.685 -11.399 8.002 1.00 0.00 C ATOM 1833 CG LEU A 108 -7.321 -10.078 8.682 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -8.388 -9.013 8.418 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.073 -10.282 10.178 1.00 0.00 C ATOM 0 H LEU A 108 -6.970 -9.710 6.288 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.029 -12.338 7.100 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.741 -11.368 7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.564 -12.204 8.727 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.390 -9.715 8.247 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.105 -8.084 8.913 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -8.473 -8.842 7.345 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.347 -9.354 8.808 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -6.816 -9.328 10.638 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.974 -10.679 10.645 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.252 -10.985 10.318 1.00 0.00 H new