USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 813 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 115 CYS SG : rot 170:sc= 0.658 USER MOD Set 1.2: A 117 CYS SG : rot -80:sc= -0.456 USER MOD Set 1.3: A 136 CYS SG : rot -137:sc= -0.384 USER MOD Set 1.4: A 138 THR OG1 : rot 96:sc= -0.0674 USER MOD Set 1.5: A 139 CYS SG : rot -90:sc= 1.55 USER MOD Set 2.1: A 39 HIS : no HD1:sc= -1.79 X(o=-1.8,f=-1.9) USER MOD Set 2.2: A 58 LYS NZ :NH3+ 154:sc= -0.0166 (180deg=-0.392) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -80:sc= -1.28 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot -91:sc= 0.97 USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 159:sc= -0.0924 (180deg=-0.509) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 140:sc= -0.127 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 51 THR OG1 : rot -160:sc= -0.212 USER MOD Single : A 55 CYS SG : rot 180:sc= -0.17 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 64 GLN : amide:sc=-0.00501 K(o=-0.005,f=-1.5) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc=-0.00183 X(o=-0.0018,f=-0.17) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0382 X(o=-0.038,f=0) USER MOD Single : A 83 CYS SG : rot 77:sc= 0.87 USER MOD Single : A 96 GLN : amide:sc= -1.25 X(o=-1.3,f=-0.93) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl -135:sc= -4.87 (180deg=-7.6!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -1.11! C(o=-1.1!,f=-1.8!) USER MOD Single : A 109 HIS : no HD1:sc= -0.774 X(o=-0.77,f=-0.99) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 47:sc= 0.00973 USER MOD Single : A 120 LYS NZ :NH3+ 157:sc= -0.0759 (180deg=-0.425) USER MOD Single : A 121 TYR OH : rot 30:sc= -0.635 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0.0247 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 129 N LYS A 10 30.029 0.272 -79.142 1.00 31.04 N ATOM 130 CA LYS A 10 29.825 1.666 -79.521 1.00 44.30 C ATOM 131 C LYS A 10 29.979 2.586 -78.314 1.00 63.21 C ATOM 132 O LYS A 10 30.517 2.187 -77.282 1.00 1.13 O ATOM 133 CB LYS A 10 28.439 1.849 -80.143 1.00 11.01 C ATOM 134 CG LYS A 10 28.442 2.715 -81.390 1.00 14.23 C ATOM 135 CD LYS A 10 27.446 2.212 -82.421 1.00 14.14 C ATOM 136 CE LYS A 10 26.346 3.233 -82.678 1.00 44.30 C ATOM 137 NZ LYS A 10 25.031 2.581 -82.924 1.00 30.31 N ATOM 0 HA LYS A 10 30.584 1.932 -80.257 1.00 44.30 H new ATOM 0 HB2 LYS A 10 28.029 0.870 -80.392 1.00 11.01 H new ATOM 0 HB3 LYS A 10 27.774 2.294 -79.403 1.00 11.01 H new ATOM 0 HG2 LYS A 10 28.200 3.743 -81.121 1.00 14.23 H new ATOM 0 HG3 LYS A 10 29.442 2.726 -81.824 1.00 14.23 H new ATOM 0 HD2 LYS A 10 27.966 1.993 -83.354 1.00 14.14 H new ATOM 0 HD3 LYS A 10 27.003 1.278 -82.075 1.00 14.14 H new ATOM 0 HE2 LYS A 10 26.265 3.903 -81.822 1.00 44.30 H new ATOM 0 HE3 LYS A 10 26.614 3.847 -83.538 1.00 44.30 H new ATOM 0 HZ1 LYS A 10 24.309 3.310 -83.095 1.00 30.31 H new ATOM 0 HZ2 LYS A 10 25.101 1.961 -83.756 1.00 30.31 H new ATOM 0 HZ3 LYS A 10 24.763 2.016 -82.093 1.00 30.31 H new ATOM 147 N ASP A 11 29.503 3.818 -78.453 1.00 1.45 N ATOM 148 CA ASP A 11 29.585 4.795 -77.372 1.00 4.43 C ATOM 149 C ASP A 11 30.980 4.806 -76.755 1.00 0.44 C ATOM 150 O ASP A 11 31.899 5.430 -77.285 1.00 31.00 O ATOM 151 CB ASP A 11 28.541 4.488 -76.297 1.00 54.21 C ATOM 152 CG ASP A 11 27.156 4.972 -76.681 1.00 44.02 C ATOM 153 OD1 ASP A 11 26.613 4.476 -77.690 1.00 44.14 O ATOM 154 OD2 ASP A 11 26.615 5.847 -75.973 1.00 4.32 O ATOM 0 H ASP A 11 29.057 4.164 -79.302 1.00 1.45 H new ATOM 0 HA ASP A 11 29.384 5.781 -77.791 1.00 4.43 H new ATOM 0 HB2 ASP A 11 28.511 3.413 -76.120 1.00 54.21 H new ATOM 0 HB3 ASP A 11 28.840 4.957 -75.360 1.00 54.21 H new ATOM 158 N TRP A 12 31.130 4.114 -75.632 1.00 31.43 N ATOM 159 CA TRP A 12 32.413 4.045 -74.942 1.00 25.54 C ATOM 160 C TRP A 12 33.526 3.642 -75.901 1.00 53.45 C ATOM 161 O TRP A 12 34.605 4.236 -75.899 1.00 71.43 O ATOM 162 CB TRP A 12 32.339 3.051 -73.781 1.00 22.42 C ATOM 163 CG TRP A 12 31.666 1.761 -74.146 1.00 14.21 C ATOM 164 CD1 TRP A 12 32.256 0.649 -74.673 1.00 41.40 C ATOM 165 CD2 TRP A 12 30.274 1.454 -74.011 1.00 72.02 C ATOM 166 NE1 TRP A 12 31.316 -0.332 -74.875 1.00 35.33 N ATOM 167 CE2 TRP A 12 30.092 0.137 -74.476 1.00 31.03 C ATOM 168 CE3 TRP A 12 29.164 2.162 -73.543 1.00 22.10 C ATOM 169 CZ2 TRP A 12 28.845 -0.483 -74.486 1.00 25.01 C ATOM 170 CZ3 TRP A 12 27.928 1.545 -73.552 1.00 74.24 C ATOM 171 CH2 TRP A 12 27.775 0.233 -74.020 1.00 51.55 C ATOM 0 H TRP A 12 30.379 3.593 -75.179 1.00 31.43 H new ATOM 0 HA TRP A 12 32.639 5.036 -74.549 1.00 25.54 H new ATOM 0 HB2 TRP A 12 33.348 2.839 -73.428 1.00 22.42 H new ATOM 0 HB3 TRP A 12 31.802 3.511 -72.952 1.00 22.42 H new ATOM 0 HD1 TRP A 12 33.308 0.554 -74.898 1.00 41.40 H new ATOM 0 HE1 TRP A 12 31.499 -1.259 -75.259 1.00 35.33 H new ATOM 0 HE3 TRP A 12 29.270 3.174 -73.181 1.00 22.10 H new ATOM 0 HZ2 TRP A 12 28.726 -1.493 -74.849 1.00 25.01 H new ATOM 0 HZ3 TRP A 12 27.064 2.084 -73.192 1.00 74.24 H new ATOM 0 HH2 TRP A 12 26.795 -0.222 -74.013 1.00 51.55 H new ATOM 181 N TYR A 13 33.259 2.631 -76.720 1.00 71.23 N ATOM 182 CA TYR A 13 34.240 2.148 -77.685 1.00 5.33 C ATOM 183 C TYR A 13 34.387 3.124 -78.848 1.00 30.01 C ATOM 184 O TYR A 13 35.438 3.196 -79.484 1.00 2.21 O ATOM 185 CB TYR A 13 33.836 0.769 -78.208 1.00 32.31 C ATOM 186 CG TYR A 13 34.155 0.560 -79.672 1.00 22.25 C ATOM 187 CD1 TYR A 13 35.464 0.380 -80.099 1.00 50.14 C ATOM 188 CD2 TYR A 13 33.145 0.542 -80.626 1.00 51.34 C ATOM 189 CE1 TYR A 13 35.760 0.189 -81.435 1.00 15.03 C ATOM 190 CE2 TYR A 13 33.432 0.350 -81.964 1.00 75.34 C ATOM 191 CZ TYR A 13 34.740 0.175 -82.363 1.00 41.04 C ATOM 192 OH TYR A 13 35.029 -0.015 -83.696 1.00 4.22 O ATOM 0 H TYR A 13 32.371 2.130 -76.735 1.00 71.23 H new ATOM 0 HA TYR A 13 35.202 2.069 -77.178 1.00 5.33 H new ATOM 0 HB2 TYR A 13 34.344 0.004 -77.621 1.00 32.31 H new ATOM 0 HB3 TYR A 13 32.766 0.630 -78.054 1.00 32.31 H new ATOM 0 HD1 TYR A 13 36.265 0.389 -79.374 1.00 50.14 H new ATOM 0 HD2 TYR A 13 32.119 0.680 -80.317 1.00 51.34 H new ATOM 0 HE1 TYR A 13 36.784 0.052 -81.751 1.00 15.03 H new ATOM 0 HE2 TYR A 13 32.636 0.337 -82.693 1.00 75.34 H new ATOM 0 HH TYR A 13 34.199 0.001 -84.216 1.00 4.22 H new ATOM 201 N SER A 14 33.324 3.874 -79.119 1.00 71.12 N ATOM 202 CA SER A 14 33.331 4.844 -80.208 1.00 11.02 C ATOM 203 C SER A 14 34.086 6.108 -79.805 1.00 31.21 C ATOM 204 O SER A 14 34.623 6.820 -80.654 1.00 14.45 O ATOM 205 CB SER A 14 31.899 5.199 -80.612 1.00 71.15 C ATOM 206 OG SER A 14 31.149 4.033 -80.905 1.00 73.20 O ATOM 0 H SER A 14 32.447 3.829 -78.600 1.00 71.12 H new ATOM 0 HA SER A 14 33.840 4.393 -81.060 1.00 11.02 H new ATOM 0 HB2 SER A 14 31.417 5.753 -79.806 1.00 71.15 H new ATOM 0 HB3 SER A 14 31.915 5.854 -81.483 1.00 71.15 H new ATOM 0 HG SER A 14 31.361 3.727 -81.811 1.00 73.20 H new ATOM 211 N ILE A 15 34.120 6.379 -78.504 1.00 41.20 N ATOM 212 CA ILE A 15 34.809 7.555 -77.988 1.00 1.13 C ATOM 213 C ILE A 15 36.320 7.415 -78.133 1.00 52.32 C ATOM 214 O ILE A 15 36.975 8.252 -78.757 1.00 71.44 O ATOM 215 CB ILE A 15 34.468 7.802 -76.506 1.00 73.10 C ATOM 216 CG1 ILE A 15 33.035 8.323 -76.370 1.00 44.33 C ATOM 217 CG2 ILE A 15 35.454 8.783 -75.892 1.00 4.34 C ATOM 218 CD1 ILE A 15 32.603 8.533 -74.936 1.00 13.42 C ATOM 0 H ILE A 15 33.679 5.800 -77.789 1.00 41.20 H new ATOM 0 HA ILE A 15 34.467 8.405 -78.578 1.00 1.13 H new ATOM 0 HB ILE A 15 34.544 6.857 -75.969 1.00 73.10 H new ATOM 0 HG12 ILE A 15 32.947 9.266 -76.909 1.00 44.33 H new ATOM 0 HG13 ILE A 15 32.354 7.618 -76.847 1.00 44.33 H new ATOM 0 HG21 ILE A 15 35.200 8.947 -74.845 1.00 4.34 H new ATOM 0 HG22 ILE A 15 36.463 8.376 -75.961 1.00 4.34 H new ATOM 0 HG23 ILE A 15 35.407 9.730 -76.429 1.00 4.34 H new ATOM 0 HD11 ILE A 15 31.578 8.903 -74.915 1.00 13.42 H new ATOM 0 HD12 ILE A 15 32.659 7.587 -74.397 1.00 13.42 H new ATOM 0 HD13 ILE A 15 33.261 9.261 -74.461 1.00 13.42 H new ATOM 229 N LEU A 16 36.869 6.353 -77.556 1.00 43.12 N ATOM 230 CA LEU A 16 38.304 6.101 -77.623 1.00 12.55 C ATOM 231 C LEU A 16 38.664 5.327 -78.887 1.00 31.33 C ATOM 232 O LEU A 16 39.836 5.191 -79.232 1.00 11.25 O ATOM 233 CB LEU A 16 38.764 5.325 -76.387 1.00 71.33 C ATOM 234 CG LEU A 16 39.788 6.028 -75.495 1.00 61.54 C ATOM 235 CD1 LEU A 16 39.089 6.929 -74.490 1.00 14.21 C ATOM 236 CD2 LEU A 16 40.663 5.007 -74.781 1.00 73.31 C ATOM 0 H LEU A 16 36.342 5.652 -77.036 1.00 43.12 H new ATOM 0 HA LEU A 16 38.815 7.063 -77.652 1.00 12.55 H new ATOM 0 HB2 LEU A 16 37.887 5.090 -75.784 1.00 71.33 H new ATOM 0 HB3 LEU A 16 39.189 4.376 -76.716 1.00 71.33 H new ATOM 0 HG LEU A 16 40.427 6.647 -76.125 1.00 61.54 H new ATOM 0 HD11 LEU A 16 39.833 7.421 -73.864 1.00 14.21 H new ATOM 0 HD12 LEU A 16 38.506 7.682 -75.020 1.00 14.21 H new ATOM 0 HD13 LEU A 16 38.426 6.331 -73.864 1.00 14.21 H new ATOM 0 HD21 LEU A 16 41.386 5.525 -74.151 1.00 73.31 H new ATOM 0 HD22 LEU A 16 40.039 4.362 -74.163 1.00 73.31 H new ATOM 0 HD23 LEU A 16 41.192 4.402 -75.518 1.00 73.31 H new ATOM 247 N GLY A 17 37.644 4.823 -79.575 1.00 62.22 N ATOM 248 CA GLY A 17 37.872 4.070 -80.795 1.00 13.31 C ATOM 249 C GLY A 17 38.919 2.987 -80.621 1.00 60.01 C ATOM 250 O GLY A 17 39.941 2.986 -81.306 1.00 10.22 O ATOM 0 H GLY A 17 36.664 4.923 -79.310 1.00 62.22 H new ATOM 0 HA2 GLY A 17 36.935 3.617 -81.119 1.00 13.31 H new ATOM 0 HA3 GLY A 17 38.186 4.751 -81.585 1.00 13.31 H new ATOM 254 N ALA A 18 38.664 2.064 -79.700 1.00 32.52 N ATOM 255 CA ALA A 18 39.591 0.970 -79.438 1.00 60.32 C ATOM 256 C ALA A 18 39.220 -0.269 -80.244 1.00 61.41 C ATOM 257 O ALA A 18 38.120 -0.804 -80.108 1.00 71.41 O ATOM 258 CB ALA A 18 39.619 0.646 -77.951 1.00 41.54 C ATOM 0 H ALA A 18 37.823 2.052 -79.123 1.00 32.52 H new ATOM 0 HA ALA A 18 40.586 1.288 -79.748 1.00 60.32 H new ATOM 0 HB1 ALA A 18 40.315 -0.173 -77.770 1.00 41.54 H new ATOM 0 HB2 ALA A 18 39.940 1.526 -77.393 1.00 41.54 H new ATOM 0 HB3 ALA A 18 38.621 0.353 -77.624 1.00 41.54 H new ATOM 264 N ASP A 19 40.144 -0.722 -81.085 1.00 41.20 N ATOM 265 CA ASP A 19 39.915 -1.900 -81.913 1.00 1.14 C ATOM 266 C ASP A 19 39.516 -3.097 -81.057 1.00 1.02 C ATOM 267 O ASP A 19 39.769 -3.141 -79.852 1.00 22.41 O ATOM 268 CB ASP A 19 41.168 -2.231 -82.725 1.00 3.04 C ATOM 269 CG ASP A 19 41.885 -0.990 -83.216 1.00 61.23 C ATOM 270 OD1 ASP A 19 42.734 -0.461 -82.469 1.00 11.11 O ATOM 271 OD2 ASP A 19 41.597 -0.547 -84.348 1.00 1.35 O ATOM 0 H ASP A 19 41.060 -0.290 -81.211 1.00 41.20 H new ATOM 0 HA ASP A 19 39.097 -1.678 -82.598 1.00 1.14 H new ATOM 0 HB2 ASP A 19 41.849 -2.822 -82.112 1.00 3.04 H new ATOM 0 HB3 ASP A 19 40.891 -2.849 -83.579 1.00 3.04 H new ATOM 275 N PRO A 20 38.876 -4.092 -81.690 1.00 51.53 N ATOM 276 CA PRO A 20 38.429 -5.307 -81.005 1.00 65.31 C ATOM 277 C PRO A 20 39.594 -6.195 -80.579 1.00 70.44 C ATOM 278 O PRO A 20 39.407 -7.180 -79.865 1.00 5.13 O ATOM 279 CB PRO A 20 37.575 -6.015 -82.059 1.00 70.43 C ATOM 280 CG PRO A 20 38.099 -5.523 -83.364 1.00 54.24 C ATOM 281 CD PRO A 20 38.542 -4.106 -83.124 1.00 1.42 C ATOM 0 HA PRO A 20 37.892 -5.081 -80.084 1.00 65.31 H new ATOM 0 HB2 PRO A 20 37.665 -7.098 -81.979 1.00 70.43 H new ATOM 0 HB3 PRO A 20 36.519 -5.774 -81.940 1.00 70.43 H new ATOM 0 HG2 PRO A 20 38.930 -6.139 -83.708 1.00 54.24 H new ATOM 0 HG3 PRO A 20 37.330 -5.566 -84.135 1.00 54.24 H new ATOM 0 HD2 PRO A 20 39.402 -3.844 -83.740 1.00 1.42 H new ATOM 0 HD3 PRO A 20 37.752 -3.393 -83.360 1.00 1.42 H new ATOM 286 N SER A 21 40.795 -5.841 -81.022 1.00 61.43 N ATOM 287 CA SER A 21 41.990 -6.608 -80.690 1.00 33.52 C ATOM 288 C SER A 21 42.956 -5.773 -79.854 1.00 23.32 C ATOM 289 O SER A 21 44.055 -6.219 -79.528 1.00 11.03 O ATOM 290 CB SER A 21 42.685 -7.088 -81.966 1.00 4.53 C ATOM 291 OG SER A 21 43.491 -6.064 -82.523 1.00 13.11 O ATOM 0 H SER A 21 40.967 -5.027 -81.612 1.00 61.43 H new ATOM 0 HA SER A 21 41.685 -7.475 -80.104 1.00 33.52 H new ATOM 0 HB2 SER A 21 43.301 -7.959 -81.743 1.00 4.53 H new ATOM 0 HB3 SER A 21 41.938 -7.404 -82.694 1.00 4.53 H new ATOM 0 HG SER A 21 43.926 -6.396 -83.336 1.00 13.11 H new ATOM 296 N ALA A 22 42.536 -4.561 -79.512 1.00 55.40 N ATOM 297 CA ALA A 22 43.362 -3.663 -78.713 1.00 32.35 C ATOM 298 C ALA A 22 43.617 -4.243 -77.325 1.00 43.25 C ATOM 299 O ALA A 22 43.168 -5.344 -77.010 1.00 30.13 O ATOM 300 CB ALA A 22 42.702 -2.297 -78.602 1.00 32.41 C ATOM 0 H ALA A 22 41.628 -4.177 -79.775 1.00 55.40 H new ATOM 0 HA ALA A 22 44.323 -3.550 -79.215 1.00 32.35 H new ATOM 0 HB1 ALA A 22 43.330 -1.637 -78.003 1.00 32.41 H new ATOM 0 HB2 ALA A 22 42.575 -1.872 -79.598 1.00 32.41 H new ATOM 0 HB3 ALA A 22 41.727 -2.402 -78.126 1.00 32.41 H new ATOM 306 N ASN A 23 44.344 -3.495 -76.501 1.00 63.31 N ATOM 307 CA ASN A 23 44.661 -3.936 -75.148 1.00 25.22 C ATOM 308 C ASN A 23 44.597 -2.769 -74.166 1.00 70.13 C ATOM 309 O ASN A 23 44.804 -1.616 -74.544 1.00 31.14 O ATOM 310 CB ASN A 23 46.051 -4.574 -75.110 1.00 22.14 C ATOM 311 CG ASN A 23 46.085 -5.834 -74.267 1.00 22.01 C ATOM 312 OD1 ASN A 23 46.481 -5.805 -73.101 1.00 51.22 O ATOM 313 ND2 ASN A 23 45.670 -6.951 -74.854 1.00 74.34 N ATOM 0 H ASN A 23 44.724 -2.581 -76.747 1.00 63.31 H new ATOM 0 HA ASN A 23 43.920 -4.678 -74.851 1.00 25.22 H new ATOM 0 HB2 ASN A 23 46.367 -4.811 -76.126 1.00 22.14 H new ATOM 0 HB3 ASN A 23 46.767 -3.855 -74.713 1.00 22.14 H new ATOM 0 HD21 ASN A 23 45.671 -7.830 -74.336 1.00 74.34 H new ATOM 0 HD22 ASN A 23 45.350 -6.930 -75.822 1.00 74.34 H new ATOM 319 N ILE A 24 44.311 -3.078 -72.907 1.00 30.23 N ATOM 320 CA ILE A 24 44.221 -2.056 -71.871 1.00 5.21 C ATOM 321 C ILE A 24 45.450 -1.154 -71.883 1.00 54.33 C ATOM 322 O ILE A 24 45.347 0.057 -71.683 1.00 34.33 O ATOM 323 CB ILE A 24 44.074 -2.684 -70.472 1.00 75.23 C ATOM 324 CG1 ILE A 24 44.024 -1.590 -69.403 1.00 4.14 C ATOM 325 CG2 ILE A 24 45.218 -3.648 -70.200 1.00 0.43 C ATOM 326 CD1 ILE A 24 42.907 -0.592 -69.610 1.00 32.42 C ATOM 0 H ILE A 24 44.137 -4.028 -72.579 1.00 30.23 H new ATOM 0 HA ILE A 24 43.333 -1.462 -72.089 1.00 5.21 H new ATOM 0 HB ILE A 24 43.140 -3.244 -70.437 1.00 75.23 H new ATOM 0 HG12 ILE A 24 43.908 -2.055 -68.424 1.00 4.14 H new ATOM 0 HG13 ILE A 24 44.976 -1.060 -69.393 1.00 4.14 H new ATOM 0 HG21 ILE A 24 45.099 -4.083 -69.208 1.00 0.43 H new ATOM 0 HG22 ILE A 24 45.211 -4.442 -70.947 1.00 0.43 H new ATOM 0 HG23 ILE A 24 46.166 -3.112 -70.250 1.00 0.43 H new ATOM 0 HD11 ILE A 24 42.933 0.153 -68.815 1.00 32.42 H new ATOM 0 HD12 ILE A 24 43.033 -0.099 -70.574 1.00 32.42 H new ATOM 0 HD13 ILE A 24 41.948 -1.110 -69.590 1.00 32.42 H new ATOM 337 N SER A 25 46.614 -1.749 -72.122 1.00 5.20 N ATOM 338 CA SER A 25 47.864 -1.000 -72.159 1.00 0.22 C ATOM 339 C SER A 25 47.772 0.161 -73.144 1.00 71.00 C ATOM 340 O SER A 25 47.678 1.322 -72.747 1.00 33.14 O ATOM 341 CB SER A 25 49.024 -1.920 -72.542 1.00 53.34 C ATOM 342 OG SER A 25 49.865 -2.172 -71.431 1.00 1.25 O ATOM 0 H SER A 25 46.717 -2.749 -72.293 1.00 5.20 H new ATOM 0 HA SER A 25 48.046 -0.595 -71.164 1.00 0.22 H new ATOM 0 HB2 SER A 25 48.633 -2.862 -72.927 1.00 53.34 H new ATOM 0 HB3 SER A 25 49.604 -1.464 -73.345 1.00 53.34 H new ATOM 0 HG SER A 25 50.597 -2.764 -71.703 1.00 1.25 H new ATOM 347 N ASP A 26 47.801 -0.161 -74.433 1.00 24.30 N ATOM 348 CA ASP A 26 47.720 0.852 -75.477 1.00 54.22 C ATOM 349 C ASP A 26 46.493 1.738 -75.282 1.00 64.01 C ATOM 350 O ASP A 26 46.476 2.896 -75.700 1.00 53.21 O ATOM 351 CB ASP A 26 47.674 0.193 -76.857 1.00 5.50 C ATOM 352 CG ASP A 26 48.018 1.160 -77.973 1.00 30.02 C ATOM 353 OD1 ASP A 26 48.645 2.200 -77.684 1.00 32.05 O ATOM 354 OD2 ASP A 26 47.658 0.876 -79.135 1.00 70.20 O ATOM 0 H ASP A 26 47.880 -1.117 -74.779 1.00 24.30 H new ATOM 0 HA ASP A 26 48.611 1.476 -75.411 1.00 54.22 H new ATOM 0 HB2 ASP A 26 48.370 -0.645 -76.879 1.00 5.50 H new ATOM 0 HB3 ASP A 26 46.678 -0.215 -77.028 1.00 5.50 H new ATOM 358 N LEU A 27 45.466 1.183 -74.645 1.00 53.52 N ATOM 359 CA LEU A 27 44.234 1.922 -74.395 1.00 32.22 C ATOM 360 C LEU A 27 44.455 3.015 -73.355 1.00 22.11 C ATOM 361 O LEU A 27 43.872 4.096 -73.440 1.00 61.22 O ATOM 362 CB LEU A 27 43.132 0.970 -73.926 1.00 3.13 C ATOM 363 CG LEU A 27 42.105 0.558 -74.981 1.00 5.33 C ATOM 364 CD1 LEU A 27 41.417 1.784 -75.563 1.00 24.04 C ATOM 365 CD2 LEU A 27 42.769 -0.257 -76.081 1.00 75.01 C ATOM 0 H LEU A 27 45.463 0.226 -74.293 1.00 53.52 H new ATOM 0 HA LEU A 27 43.926 2.393 -75.329 1.00 32.22 H new ATOM 0 HB2 LEU A 27 43.602 0.068 -73.534 1.00 3.13 H new ATOM 0 HB3 LEU A 27 42.603 1.440 -73.097 1.00 3.13 H new ATOM 0 HG LEU A 27 41.349 -0.064 -74.502 1.00 5.33 H new ATOM 0 HD11 LEU A 27 40.689 1.472 -76.312 1.00 24.04 H new ATOM 0 HD12 LEU A 27 40.908 2.328 -74.767 1.00 24.04 H new ATOM 0 HD13 LEU A 27 42.160 2.432 -76.027 1.00 24.04 H new ATOM 0 HD21 LEU A 27 42.023 -0.542 -76.823 1.00 75.01 H new ATOM 0 HD22 LEU A 27 43.546 0.340 -76.558 1.00 75.01 H new ATOM 0 HD23 LEU A 27 43.214 -1.154 -75.651 1.00 75.01 H new ATOM 376 N LYS A 28 45.303 2.727 -72.373 1.00 11.24 N ATOM 377 CA LYS A 28 45.604 3.686 -71.317 1.00 3.31 C ATOM 378 C LYS A 28 46.233 4.951 -71.893 1.00 23.23 C ATOM 379 O LYS A 28 45.850 6.063 -71.533 1.00 21.11 O ATOM 380 CB LYS A 28 46.547 3.059 -70.286 1.00 11.42 C ATOM 381 CG LYS A 28 46.717 3.897 -69.030 1.00 42.24 C ATOM 382 CD LYS A 28 48.180 4.206 -68.760 1.00 63.01 C ATOM 383 CE LYS A 28 48.924 2.982 -68.248 1.00 2.03 C ATOM 384 NZ LYS A 28 50.026 3.352 -67.318 1.00 23.33 N ATOM 0 H LYS A 28 45.794 1.837 -72.287 1.00 11.24 H new ATOM 0 HA LYS A 28 44.668 3.957 -70.829 1.00 3.31 H new ATOM 0 HB2 LYS A 28 46.167 2.076 -70.008 1.00 11.42 H new ATOM 0 HB3 LYS A 28 47.524 2.905 -70.745 1.00 11.42 H new ATOM 0 HG2 LYS A 28 46.161 4.828 -69.135 1.00 42.24 H new ATOM 0 HG3 LYS A 28 46.293 3.367 -68.177 1.00 42.24 H new ATOM 0 HD2 LYS A 28 48.652 4.563 -69.675 1.00 63.01 H new ATOM 0 HD3 LYS A 28 48.254 5.010 -68.028 1.00 63.01 H new ATOM 0 HE2 LYS A 28 48.225 2.319 -67.738 1.00 2.03 H new ATOM 0 HE3 LYS A 28 49.332 2.426 -69.092 1.00 2.03 H new ATOM 0 HZ1 LYS A 28 50.508 2.491 -66.991 1.00 23.33 H new ATOM 0 HZ2 LYS A 28 50.707 3.964 -67.812 1.00 23.33 H new ATOM 0 HZ3 LYS A 28 49.634 3.861 -66.500 1.00 23.33 H new ATOM 394 N GLN A 29 47.197 4.771 -72.790 1.00 25.32 N ATOM 395 CA GLN A 29 47.877 5.899 -73.416 1.00 41.12 C ATOM 396 C GLN A 29 46.942 6.636 -74.370 1.00 42.00 C ATOM 397 O GLN A 29 46.797 7.856 -74.295 1.00 72.50 O ATOM 398 CB GLN A 29 49.119 5.419 -74.169 1.00 30.34 C ATOM 399 CG GLN A 29 49.952 4.414 -73.390 1.00 45.40 C ATOM 400 CD GLN A 29 51.428 4.491 -73.730 1.00 2.04 C ATOM 401 OE1 GLN A 29 51.848 4.089 -74.815 1.00 40.10 O ATOM 402 NE2 GLN A 29 52.223 5.011 -72.802 1.00 22.43 N ATOM 0 H GLN A 29 47.525 3.856 -73.099 1.00 25.32 H new ATOM 0 HA GLN A 29 48.182 6.589 -72.630 1.00 41.12 H new ATOM 0 HB2 GLN A 29 48.810 4.969 -75.112 1.00 30.34 H new ATOM 0 HB3 GLN A 29 49.740 6.280 -74.415 1.00 30.34 H new ATOM 0 HG2 GLN A 29 49.819 4.588 -72.322 1.00 45.40 H new ATOM 0 HG3 GLN A 29 49.587 3.408 -73.597 1.00 45.40 H new ATOM 0 HE21 GLN A 29 51.831 5.332 -71.916 1.00 22.43 H new ATOM 0 HE22 GLN A 29 53.225 5.090 -72.975 1.00 22.43 H new ATOM 409 N LYS A 30 46.311 5.887 -75.269 1.00 40.23 N ATOM 410 CA LYS A 30 45.390 6.468 -76.238 1.00 3.52 C ATOM 411 C LYS A 30 44.205 7.123 -75.536 1.00 74.44 C ATOM 412 O LYS A 30 43.546 7.999 -76.098 1.00 3.21 O ATOM 413 CB LYS A 30 44.893 5.393 -77.208 1.00 14.34 C ATOM 414 CG LYS A 30 45.131 5.733 -78.668 1.00 53.34 C ATOM 415 CD LYS A 30 46.612 5.718 -79.010 1.00 63.13 C ATOM 416 CE LYS A 30 46.846 5.984 -80.489 1.00 74.13 C ATOM 417 NZ LYS A 30 48.295 6.101 -80.809 1.00 54.42 N ATOM 0 H LYS A 30 46.421 4.876 -75.346 1.00 40.23 H new ATOM 0 HA LYS A 30 45.926 7.234 -76.799 1.00 3.52 H new ATOM 0 HB2 LYS A 30 45.390 4.450 -76.978 1.00 14.34 H new ATOM 0 HB3 LYS A 30 43.826 5.238 -77.049 1.00 14.34 H new ATOM 0 HG2 LYS A 30 44.604 5.018 -79.300 1.00 53.34 H new ATOM 0 HG3 LYS A 30 44.716 6.717 -78.886 1.00 53.34 H new ATOM 0 HD2 LYS A 30 47.131 6.471 -78.417 1.00 63.13 H new ATOM 0 HD3 LYS A 30 47.039 4.752 -78.741 1.00 63.13 H new ATOM 0 HE2 LYS A 30 46.408 5.177 -81.077 1.00 74.13 H new ATOM 0 HE3 LYS A 30 46.335 6.902 -80.778 1.00 74.13 H new ATOM 0 HZ1 LYS A 30 48.412 6.282 -81.826 1.00 54.42 H new ATOM 0 HZ2 LYS A 30 48.708 6.887 -80.268 1.00 54.42 H new ATOM 0 HZ3 LYS A 30 48.779 5.216 -80.557 1.00 54.42 H new ATOM 427 N TYR A 31 43.939 6.694 -74.308 1.00 63.32 N ATOM 428 CA TYR A 31 42.832 7.238 -73.531 1.00 31.14 C ATOM 429 C TYR A 31 43.080 8.702 -73.182 1.00 12.13 C ATOM 430 O TYR A 31 42.278 9.575 -73.515 1.00 63.03 O ATOM 431 CB TYR A 31 42.630 6.425 -72.252 1.00 24.20 C ATOM 432 CG TYR A 31 41.658 7.054 -71.281 1.00 13.24 C ATOM 433 CD1 TYR A 31 42.088 7.978 -70.336 1.00 23.15 C ATOM 434 CD2 TYR A 31 40.308 6.726 -71.308 1.00 30.41 C ATOM 435 CE1 TYR A 31 41.203 8.554 -69.446 1.00 50.25 C ATOM 436 CE2 TYR A 31 39.416 7.299 -70.423 1.00 34.13 C ATOM 437 CZ TYR A 31 39.868 8.212 -69.493 1.00 74.22 C ATOM 438 OH TYR A 31 38.982 8.786 -68.610 1.00 4.22 O ATOM 0 H TYR A 31 44.475 5.971 -73.829 1.00 63.32 H new ATOM 0 HA TYR A 31 41.930 7.175 -74.139 1.00 31.14 H new ATOM 0 HB2 TYR A 31 42.273 5.430 -72.517 1.00 24.20 H new ATOM 0 HB3 TYR A 31 43.593 6.297 -71.757 1.00 24.20 H new ATOM 0 HD1 TYR A 31 43.132 8.250 -70.297 1.00 23.15 H new ATOM 0 HD2 TYR A 31 39.950 6.011 -72.034 1.00 30.41 H new ATOM 0 HE1 TYR A 31 41.555 9.269 -68.717 1.00 50.25 H new ATOM 0 HE2 TYR A 31 38.370 7.034 -70.459 1.00 34.13 H new ATOM 0 HH TYR A 31 38.915 8.230 -67.806 1.00 4.22 H new ATOM 447 N GLN A 32 44.196 8.963 -72.509 1.00 61.24 N ATOM 448 CA GLN A 32 44.550 10.321 -72.114 1.00 44.45 C ATOM 449 C GLN A 32 44.651 11.233 -73.332 1.00 74.01 C ATOM 450 O GLN A 32 44.439 12.442 -73.235 1.00 42.55 O ATOM 451 CB GLN A 32 45.876 10.324 -71.351 1.00 22.32 C ATOM 452 CG GLN A 32 45.709 10.429 -69.844 1.00 2.11 C ATOM 453 CD GLN A 32 47.035 10.533 -69.115 1.00 62.30 C ATOM 454 OE1 GLN A 32 47.833 9.595 -69.118 1.00 35.32 O ATOM 455 NE2 GLN A 32 47.276 11.677 -68.487 1.00 44.40 N ATOM 0 H GLN A 32 44.870 8.252 -72.226 1.00 61.24 H new ATOM 0 HA GLN A 32 43.762 10.699 -71.462 1.00 44.45 H new ATOM 0 HB2 GLN A 32 46.423 9.410 -71.585 1.00 22.32 H new ATOM 0 HB3 GLN A 32 46.485 11.158 -71.700 1.00 22.32 H new ATOM 0 HG2 GLN A 32 45.101 11.303 -69.610 1.00 2.11 H new ATOM 0 HG3 GLN A 32 45.167 9.556 -69.481 1.00 2.11 H new ATOM 0 HE21 GLN A 32 46.586 12.427 -68.511 1.00 44.40 H new ATOM 0 HE22 GLN A 32 48.152 11.806 -67.980 1.00 44.40 H new ATOM 462 N LYS A 33 44.974 10.647 -74.480 1.00 33.42 N ATOM 463 CA LYS A 33 45.101 11.406 -75.719 1.00 44.00 C ATOM 464 C LYS A 33 43.731 11.688 -76.326 1.00 54.33 C ATOM 465 O LYS A 33 43.341 12.845 -76.491 1.00 14.14 O ATOM 466 CB LYS A 33 45.968 10.641 -76.722 1.00 41.23 C ATOM 467 CG LYS A 33 47.149 11.443 -77.239 1.00 45.23 C ATOM 468 CD LYS A 33 47.912 10.683 -78.311 1.00 53.33 C ATOM 469 CE LYS A 33 49.323 10.344 -77.857 1.00 24.32 C ATOM 470 NZ LYS A 33 49.778 9.032 -78.395 1.00 3.41 N ATOM 0 H LYS A 33 45.153 9.648 -74.578 1.00 33.42 H new ATOM 0 HA LYS A 33 45.579 12.358 -75.487 1.00 44.00 H new ATOM 0 HB2 LYS A 33 46.336 9.730 -76.251 1.00 41.23 H new ATOM 0 HB3 LYS A 33 45.349 10.336 -77.566 1.00 41.23 H new ATOM 0 HG2 LYS A 33 46.796 12.391 -77.645 1.00 45.23 H new ATOM 0 HG3 LYS A 33 47.819 11.680 -76.413 1.00 45.23 H new ATOM 0 HD2 LYS A 33 47.378 9.765 -78.558 1.00 53.33 H new ATOM 0 HD3 LYS A 33 47.955 11.281 -79.221 1.00 53.33 H new ATOM 0 HE2 LYS A 33 50.007 11.127 -78.183 1.00 24.32 H new ATOM 0 HE3 LYS A 33 49.359 10.322 -76.768 1.00 24.32 H new ATOM 0 HZ1 LYS A 33 50.744 8.837 -78.063 1.00 3.41 H new ATOM 0 HZ2 LYS A 33 49.140 8.281 -78.064 1.00 3.41 H new ATOM 0 HZ3 LYS A 33 49.768 9.061 -79.435 1.00 3.41 H new ATOM 480 N LEU A 34 43.005 10.627 -76.657 1.00 71.30 N ATOM 481 CA LEU A 34 41.676 10.762 -77.246 1.00 41.33 C ATOM 482 C LEU A 34 40.776 11.624 -76.367 1.00 22.14 C ATOM 483 O LEU A 34 40.238 12.636 -76.817 1.00 24.42 O ATOM 484 CB LEU A 34 41.044 9.383 -77.446 1.00 74.03 C ATOM 485 CG LEU A 34 41.300 8.718 -78.799 1.00 61.21 C ATOM 486 CD1 LEU A 34 41.748 7.278 -78.609 1.00 31.50 C ATOM 487 CD2 LEU A 34 40.052 8.781 -79.668 1.00 45.45 C ATOM 0 H LEU A 34 43.313 9.663 -76.528 1.00 71.30 H new ATOM 0 HA LEU A 34 41.782 11.251 -78.215 1.00 41.33 H new ATOM 0 HB2 LEU A 34 41.411 8.720 -76.662 1.00 74.03 H new ATOM 0 HB3 LEU A 34 39.967 9.475 -77.307 1.00 74.03 H new ATOM 0 HG LEU A 34 42.098 9.261 -79.305 1.00 61.21 H new ATOM 0 HD11 LEU A 34 41.925 6.821 -79.582 1.00 31.50 H new ATOM 0 HD12 LEU A 34 42.668 7.257 -78.025 1.00 31.50 H new ATOM 0 HD13 LEU A 34 40.972 6.722 -78.083 1.00 31.50 H new ATOM 0 HD21 LEU A 34 40.252 8.303 -80.627 1.00 45.45 H new ATOM 0 HD22 LEU A 34 39.234 8.263 -79.168 1.00 45.45 H new ATOM 0 HD23 LEU A 34 39.775 9.822 -79.832 1.00 45.45 H new ATOM 498 N ILE A 35 40.619 11.218 -75.111 1.00 62.15 N ATOM 499 CA ILE A 35 39.787 11.955 -74.169 1.00 25.44 C ATOM 500 C ILE A 35 40.148 13.437 -74.159 1.00 4.15 C ATOM 501 O ILE A 35 39.297 14.296 -74.391 1.00 41.24 O ATOM 502 CB ILE A 35 39.924 11.395 -72.740 1.00 33.45 C ATOM 503 CG1 ILE A 35 39.448 9.942 -72.691 1.00 45.42 C ATOM 504 CG2 ILE A 35 39.135 12.249 -71.759 1.00 54.34 C ATOM 505 CD1 ILE A 35 37.972 9.779 -72.973 1.00 24.40 C ATOM 0 H ILE A 35 41.057 10.383 -74.723 1.00 62.15 H new ATOM 0 HA ILE A 35 38.755 11.837 -74.500 1.00 25.44 H new ATOM 0 HB ILE A 35 40.975 11.424 -72.453 1.00 33.45 H new ATOM 0 HG12 ILE A 35 40.015 9.358 -73.416 1.00 45.42 H new ATOM 0 HG13 ILE A 35 39.669 9.529 -71.707 1.00 45.42 H new ATOM 0 HG21 ILE A 35 39.241 11.841 -70.754 1.00 54.34 H new ATOM 0 HG22 ILE A 35 39.515 13.270 -71.778 1.00 54.34 H new ATOM 0 HG23 ILE A 35 38.082 12.248 -72.041 1.00 54.34 H new ATOM 0 HD11 ILE A 35 37.706 8.723 -72.921 1.00 24.40 H new ATOM 0 HD12 ILE A 35 37.397 10.335 -72.233 1.00 24.40 H new ATOM 0 HD13 ILE A 35 37.747 10.161 -73.969 1.00 24.40 H new ATOM 516 N LEU A 36 41.416 13.729 -73.890 1.00 4.41 N ATOM 517 CA LEU A 36 41.892 15.108 -73.852 1.00 31.52 C ATOM 518 C LEU A 36 41.594 15.823 -75.165 1.00 61.15 C ATOM 519 O LEU A 36 41.233 17.000 -75.175 1.00 64.12 O ATOM 520 CB LEU A 36 43.394 15.141 -73.568 1.00 40.41 C ATOM 521 CG LEU A 36 44.016 16.529 -73.410 1.00 43.12 C ATOM 522 CD1 LEU A 36 45.016 16.538 -72.265 1.00 13.54 C ATOM 523 CD2 LEU A 36 44.683 16.966 -74.705 1.00 51.35 C ATOM 0 H LEU A 36 42.133 13.030 -73.695 1.00 4.41 H new ATOM 0 HA LEU A 36 41.366 15.627 -73.051 1.00 31.52 H new ATOM 0 HB2 LEU A 36 43.584 14.574 -72.657 1.00 40.41 H new ATOM 0 HB3 LEU A 36 43.908 14.624 -74.378 1.00 40.41 H new ATOM 0 HG LEU A 36 43.221 17.237 -73.177 1.00 43.12 H new ATOM 0 HD11 LEU A 36 45.448 17.534 -72.167 1.00 13.54 H new ATOM 0 HD12 LEU A 36 44.510 16.270 -71.338 1.00 13.54 H new ATOM 0 HD13 LEU A 36 45.808 15.817 -72.468 1.00 13.54 H new ATOM 0 HD21 LEU A 36 45.120 17.956 -74.573 1.00 51.35 H new ATOM 0 HD22 LEU A 36 45.467 16.256 -74.968 1.00 51.35 H new ATOM 0 HD23 LEU A 36 43.941 17.000 -75.503 1.00 51.35 H new ATOM 534 N MET A 37 41.745 15.103 -76.273 1.00 10.12 N ATOM 535 CA MET A 37 41.488 15.669 -77.592 1.00 3.31 C ATOM 536 C MET A 37 40.001 15.945 -77.786 1.00 11.05 C ATOM 537 O MET A 37 39.618 16.815 -78.568 1.00 31.51 O ATOM 538 CB MET A 37 41.990 14.721 -78.683 1.00 2.23 C ATOM 539 CG MET A 37 43.363 15.087 -79.223 1.00 53.51 C ATOM 540 SD MET A 37 43.509 14.807 -80.998 1.00 25.14 S ATOM 541 CE MET A 37 43.592 13.019 -81.052 1.00 64.53 C ATOM 0 H MET A 37 42.044 14.128 -76.283 1.00 10.12 H new ATOM 0 HA MET A 37 42.026 16.614 -77.665 1.00 3.31 H new ATOM 0 HB2 MET A 37 42.024 13.707 -78.284 1.00 2.23 H new ATOM 0 HB3 MET A 37 41.275 14.716 -79.506 1.00 2.23 H new ATOM 0 HG2 MET A 37 43.566 16.136 -79.007 1.00 53.51 H new ATOM 0 HG3 MET A 37 44.121 14.502 -78.703 1.00 53.51 H new ATOM 0 HE1 MET A 37 43.684 12.690 -82.087 1.00 64.53 H new ATOM 0 HE2 MET A 37 44.457 12.678 -80.484 1.00 64.53 H new ATOM 0 HE3 MET A 37 42.685 12.599 -80.618 1.00 64.53 H new ATOM 549 N TYR A 38 39.168 15.199 -77.070 1.00 64.42 N ATOM 550 CA TYR A 38 37.722 15.360 -77.165 1.00 41.24 C ATOM 551 C TYR A 38 37.284 16.700 -76.581 1.00 43.51 C ATOM 552 O TYR A 38 36.351 17.332 -77.076 1.00 21.50 O ATOM 553 CB TYR A 38 37.010 14.218 -76.439 1.00 43.32 C ATOM 554 CG TYR A 38 35.995 13.495 -77.296 1.00 13.33 C ATOM 555 CD1 TYR A 38 34.671 13.918 -77.345 1.00 4.31 C ATOM 556 CD2 TYR A 38 36.358 12.392 -78.058 1.00 51.44 C ATOM 557 CE1 TYR A 38 33.741 13.260 -78.125 1.00 34.14 C ATOM 558 CE2 TYR A 38 35.434 11.729 -78.842 1.00 54.22 C ATOM 559 CZ TYR A 38 34.126 12.167 -78.872 1.00 55.13 C ATOM 560 OH TYR A 38 33.202 11.511 -79.652 1.00 12.11 O ATOM 0 H TYR A 38 39.469 14.476 -76.417 1.00 64.42 H new ATOM 0 HA TYR A 38 37.449 15.336 -78.220 1.00 41.24 H new ATOM 0 HB2 TYR A 38 37.753 13.502 -76.089 1.00 43.32 H new ATOM 0 HB3 TYR A 38 36.510 14.616 -75.556 1.00 43.32 H new ATOM 0 HD1 TYR A 38 34.365 14.775 -76.763 1.00 4.31 H new ATOM 0 HD2 TYR A 38 37.381 12.047 -78.037 1.00 51.44 H new ATOM 0 HE1 TYR A 38 32.716 13.600 -78.150 1.00 34.14 H new ATOM 0 HE2 TYR A 38 35.734 10.873 -79.428 1.00 54.22 H new ATOM 0 HH TYR A 38 33.636 10.764 -80.115 1.00 12.11 H new ATOM 569 N HIS A 39 37.967 17.128 -75.524 1.00 12.53 N ATOM 570 CA HIS A 39 37.651 18.393 -74.871 1.00 34.13 C ATOM 571 C HIS A 39 38.798 19.387 -75.026 1.00 62.14 C ATOM 572 O HIS A 39 39.527 19.683 -74.079 1.00 43.33 O ATOM 573 CB HIS A 39 37.355 18.166 -73.388 1.00 10.10 C ATOM 574 CG HIS A 39 37.021 19.423 -72.645 1.00 22.23 C ATOM 575 ND1 HIS A 39 36.091 20.338 -73.091 1.00 70.34 N ATOM 576 CD2 HIS A 39 37.497 19.914 -71.477 1.00 45.50 C ATOM 577 CE1 HIS A 39 36.011 21.338 -72.232 1.00 24.32 C ATOM 578 NE2 HIS A 39 36.855 21.105 -71.243 1.00 34.53 N ATOM 0 H HIS A 39 38.743 16.617 -75.102 1.00 12.53 H new ATOM 0 HA HIS A 39 36.766 18.809 -75.351 1.00 34.13 H new ATOM 0 HB2 HIS A 39 36.524 17.467 -73.295 1.00 10.10 H new ATOM 0 HB3 HIS A 39 38.221 17.697 -72.921 1.00 10.10 H new ATOM 0 HD2 HIS A 39 38.243 19.454 -70.846 1.00 45.50 H new ATOM 0 HE1 HIS A 39 35.366 22.199 -72.323 1.00 24.32 H new ATOM 0 HE2 HIS A 39 37.005 21.711 -70.437 1.00 34.53 H new ATOM 585 N PRO A 40 38.965 19.914 -76.248 1.00 30.41 N ATOM 586 CA PRO A 40 40.022 20.881 -76.556 1.00 70.43 C ATOM 587 C PRO A 40 39.778 22.235 -75.899 1.00 52.41 C ATOM 588 O PRO A 40 38.878 22.381 -75.071 1.00 70.24 O ATOM 589 CB PRO A 40 39.954 21.007 -78.080 1.00 54.02 C ATOM 590 CG PRO A 40 38.552 20.642 -78.429 1.00 72.20 C ATOM 591 CD PRO A 40 38.132 19.606 -77.423 1.00 61.31 C ATOM 0 HA PRO A 40 40.993 20.555 -76.184 1.00 70.43 H new ATOM 0 HB2 PRO A 40 40.192 22.020 -78.404 1.00 54.02 H new ATOM 0 HB3 PRO A 40 40.668 20.341 -78.564 1.00 54.02 H new ATOM 0 HG2 PRO A 40 37.900 21.514 -78.387 1.00 72.20 H new ATOM 0 HG3 PRO A 40 38.492 20.248 -79.443 1.00 72.20 H new ATOM 0 HD2 PRO A 40 37.069 19.678 -77.192 1.00 61.31 H new ATOM 0 HD3 PRO A 40 38.311 18.595 -77.789 1.00 61.31 H new ATOM 596 N ASP A 41 40.584 23.222 -76.273 1.00 10.43 N ATOM 597 CA ASP A 41 40.455 24.566 -75.720 1.00 32.14 C ATOM 598 C ASP A 41 39.290 25.309 -76.365 1.00 33.14 C ATOM 599 O ASP A 41 38.910 25.025 -77.501 1.00 31.05 O ATOM 600 CB ASP A 41 41.752 25.351 -75.923 1.00 31.34 C ATOM 601 CG ASP A 41 42.139 25.460 -77.385 1.00 54.50 C ATOM 602 OD1 ASP A 41 41.335 25.999 -78.173 1.00 24.44 O ATOM 603 OD2 ASP A 41 43.248 25.006 -77.740 1.00 73.12 O ATOM 0 H ASP A 41 41.334 23.117 -76.957 1.00 10.43 H new ATOM 0 HA ASP A 41 40.258 24.475 -74.652 1.00 32.14 H new ATOM 0 HB2 ASP A 41 41.637 26.351 -75.505 1.00 31.34 H new ATOM 0 HB3 ASP A 41 42.557 24.865 -75.372 1.00 31.34 H new ATOM 607 N LYS A 42 38.724 26.262 -75.631 1.00 60.41 N ATOM 608 CA LYS A 42 37.601 27.047 -76.131 1.00 54.32 C ATOM 609 C LYS A 42 37.549 28.413 -75.453 1.00 74.04 C ATOM 610 O LYS A 42 38.200 28.635 -74.433 1.00 51.22 O ATOM 611 CB LYS A 42 36.285 26.300 -75.898 1.00 44.50 C ATOM 612 CG LYS A 42 35.431 26.171 -77.147 1.00 31.31 C ATOM 613 CD LYS A 42 34.576 24.915 -77.109 1.00 54.44 C ATOM 614 CE LYS A 42 33.990 24.600 -78.476 1.00 74.44 C ATOM 615 NZ LYS A 42 35.049 24.297 -79.479 1.00 3.34 N ATOM 0 H LYS A 42 39.025 26.509 -74.688 1.00 60.41 H new ATOM 0 HA LYS A 42 37.742 27.196 -77.202 1.00 54.32 H new ATOM 0 HB2 LYS A 42 36.505 25.304 -75.514 1.00 44.50 H new ATOM 0 HB3 LYS A 42 35.713 26.819 -75.129 1.00 44.50 H new ATOM 0 HG2 LYS A 42 34.789 27.047 -77.242 1.00 31.31 H new ATOM 0 HG3 LYS A 42 36.073 26.149 -78.028 1.00 31.31 H new ATOM 0 HD2 LYS A 42 35.178 24.073 -76.767 1.00 54.44 H new ATOM 0 HD3 LYS A 42 33.770 25.044 -76.387 1.00 54.44 H new ATOM 0 HE2 LYS A 42 33.314 23.749 -78.394 1.00 74.44 H new ATOM 0 HE3 LYS A 42 33.396 25.447 -78.820 1.00 74.44 H new ATOM 0 HZ1 LYS A 42 34.637 23.757 -80.266 1.00 3.34 H new ATOM 0 HZ2 LYS A 42 35.449 25.186 -79.841 1.00 3.34 H new ATOM 0 HZ3 LYS A 42 35.802 23.736 -79.031 1.00 3.34 H new ATOM 625 N GLN A 43 36.769 29.323 -76.028 1.00 0.21 N ATOM 626 CA GLN A 43 36.632 30.667 -75.478 1.00 71.31 C ATOM 627 C GLN A 43 35.212 30.907 -74.976 1.00 52.23 C ATOM 628 O GLN A 43 34.239 30.513 -75.621 1.00 42.44 O ATOM 629 CB GLN A 43 36.996 31.712 -76.534 1.00 1.24 C ATOM 630 CG GLN A 43 38.085 32.675 -76.086 1.00 74.21 C ATOM 631 CD GLN A 43 38.469 33.664 -77.168 1.00 54.31 C ATOM 632 OE1 GLN A 43 38.281 34.872 -77.016 1.00 2.52 O ATOM 633 NE2 GLN A 43 39.011 33.158 -78.270 1.00 32.24 N ATOM 0 H GLN A 43 36.223 29.155 -76.873 1.00 0.21 H new ATOM 0 HA GLN A 43 37.316 30.759 -74.635 1.00 71.31 H new ATOM 0 HB2 GLN A 43 37.323 31.202 -77.440 1.00 1.24 H new ATOM 0 HB3 GLN A 43 36.103 32.281 -76.793 1.00 1.24 H new ATOM 0 HG2 GLN A 43 37.744 33.220 -75.206 1.00 74.21 H new ATOM 0 HG3 GLN A 43 38.967 32.108 -75.788 1.00 74.21 H new ATOM 0 HE21 GLN A 43 39.149 32.151 -78.354 1.00 32.24 H new ATOM 0 HE22 GLN A 43 39.289 33.777 -79.032 1.00 32.24 H new ATOM 640 N SER A 44 35.099 31.557 -73.822 1.00 54.14 N ATOM 641 CA SER A 44 33.798 31.846 -73.231 1.00 15.11 C ATOM 642 C SER A 44 33.945 32.736 -72.001 1.00 4.55 C ATOM 643 O SER A 44 35.042 32.896 -71.462 1.00 70.20 O ATOM 644 CB SER A 44 33.086 30.547 -72.852 1.00 71.22 C ATOM 645 OG SER A 44 31.693 30.638 -73.097 1.00 2.14 O ATOM 0 H SER A 44 35.893 31.894 -73.278 1.00 54.14 H new ATOM 0 HA SER A 44 33.200 32.376 -73.972 1.00 15.11 H new ATOM 0 HB2 SER A 44 33.505 29.719 -73.423 1.00 71.22 H new ATOM 0 HB3 SER A 44 33.259 30.328 -71.798 1.00 71.22 H new ATOM 0 HG SER A 44 31.371 29.791 -73.470 1.00 2.14 H new ATOM 650 N THR A 45 32.833 33.314 -71.559 1.00 32.34 N ATOM 651 CA THR A 45 32.837 34.188 -70.393 1.00 74.34 C ATOM 652 C THR A 45 33.316 33.446 -69.151 1.00 50.51 C ATOM 653 O THR A 45 34.168 33.940 -68.412 1.00 52.53 O ATOM 654 CB THR A 45 31.436 34.768 -70.121 1.00 14.10 C ATOM 655 OG1 THR A 45 30.528 33.716 -69.777 1.00 5.34 O ATOM 656 CG2 THR A 45 30.914 35.516 -71.339 1.00 64.25 C ATOM 0 H THR A 45 31.917 33.192 -71.991 1.00 32.34 H new ATOM 0 HA THR A 45 33.525 35.005 -70.613 1.00 74.34 H new ATOM 0 HB THR A 45 31.513 35.468 -69.289 1.00 14.10 H new ATOM 0 HG1 THR A 45 29.640 34.094 -69.604 1.00 5.34 H new ATOM 0 HG21 THR A 45 29.924 35.917 -71.123 1.00 64.25 H new ATOM 0 HG22 THR A 45 31.592 36.335 -71.581 1.00 64.25 H new ATOM 0 HG23 THR A 45 30.852 34.833 -72.186 1.00 64.25 H new ATOM 664 N ASP A 46 32.766 32.259 -68.927 1.00 63.21 N ATOM 665 CA ASP A 46 33.140 31.448 -67.775 1.00 5.21 C ATOM 666 C ASP A 46 32.542 30.048 -67.879 1.00 42.21 C ATOM 667 O ASP A 46 33.245 29.081 -68.172 1.00 43.43 O ATOM 668 CB ASP A 46 32.678 32.118 -66.480 1.00 75.45 C ATOM 669 CG ASP A 46 33.809 32.819 -65.755 1.00 70.23 C ATOM 670 OD1 ASP A 46 34.877 32.195 -65.578 1.00 53.30 O ATOM 671 OD2 ASP A 46 33.628 33.991 -65.366 1.00 32.44 O ATOM 0 H ASP A 46 32.059 31.836 -69.528 1.00 63.21 H new ATOM 0 HA ASP A 46 34.226 31.360 -67.762 1.00 5.21 H new ATOM 0 HB2 ASP A 46 31.894 32.840 -66.708 1.00 75.45 H new ATOM 0 HB3 ASP A 46 32.239 31.367 -65.823 1.00 75.45 H new ATOM 675 N VAL A 47 31.239 29.946 -67.635 1.00 11.12 N ATOM 676 CA VAL A 47 30.547 28.665 -67.700 1.00 73.45 C ATOM 677 C VAL A 47 29.073 28.854 -68.045 1.00 44.33 C ATOM 678 O VAL A 47 28.191 28.742 -67.193 1.00 24.11 O ATOM 679 CB VAL A 47 30.657 27.898 -66.369 1.00 54.31 C ATOM 680 CG1 VAL A 47 32.055 27.324 -66.198 1.00 33.34 C ATOM 681 CG2 VAL A 47 30.297 28.804 -65.202 1.00 54.40 C ATOM 0 H VAL A 47 30.642 30.736 -67.390 1.00 11.12 H new ATOM 0 HA VAL A 47 31.030 28.084 -68.486 1.00 73.45 H new ATOM 0 HB VAL A 47 29.950 27.069 -66.387 1.00 54.31 H new ATOM 0 HG11 VAL A 47 32.114 26.786 -65.252 1.00 33.34 H new ATOM 0 HG12 VAL A 47 32.270 26.640 -67.019 1.00 33.34 H new ATOM 0 HG13 VAL A 47 32.784 28.134 -66.200 1.00 33.34 H new ATOM 0 HG21 VAL A 47 30.380 28.246 -64.269 1.00 54.40 H new ATOM 0 HG22 VAL A 47 30.978 29.654 -65.178 1.00 54.40 H new ATOM 0 HG23 VAL A 47 29.274 29.162 -65.321 1.00 54.40 H new ATOM 691 N PRO A 48 28.798 29.148 -69.324 1.00 73.30 N ATOM 692 CA PRO A 48 27.432 29.359 -69.812 1.00 31.42 C ATOM 693 C PRO A 48 26.618 28.069 -69.831 1.00 24.03 C ATOM 694 O PRO A 48 27.165 26.977 -69.681 1.00 23.12 O ATOM 695 CB PRO A 48 27.639 29.881 -71.236 1.00 23.31 C ATOM 696 CG PRO A 48 28.968 29.345 -71.646 1.00 11.53 C ATOM 697 CD PRO A 48 29.800 29.298 -70.393 1.00 74.21 C ATOM 0 HA PRO A 48 26.872 30.040 -69.172 1.00 31.42 H new ATOM 0 HB2 PRO A 48 26.850 29.535 -71.903 1.00 23.31 H new ATOM 0 HB3 PRO A 48 27.626 30.971 -71.264 1.00 23.31 H new ATOM 0 HG2 PRO A 48 28.870 28.353 -72.087 1.00 11.53 H new ATOM 0 HG3 PRO A 48 29.431 29.983 -72.398 1.00 11.53 H new ATOM 0 HD2 PRO A 48 30.501 28.463 -70.407 1.00 74.21 H new ATOM 0 HD3 PRO A 48 30.389 30.207 -70.267 1.00 74.21 H new ATOM 702 N ALA A 49 25.309 28.202 -70.018 1.00 14.41 N ATOM 703 CA ALA A 49 24.422 27.047 -70.059 1.00 75.31 C ATOM 704 C ALA A 49 24.927 26.002 -71.046 1.00 65.31 C ATOM 705 O ALA A 49 24.701 24.805 -70.868 1.00 41.05 O ATOM 706 CB ALA A 49 23.009 27.480 -70.422 1.00 72.13 C ATOM 0 H ALA A 49 24.840 29.099 -70.144 1.00 14.41 H new ATOM 0 HA ALA A 49 24.408 26.595 -69.067 1.00 75.31 H new ATOM 0 HB1 ALA A 49 22.357 26.607 -70.449 1.00 72.13 H new ATOM 0 HB2 ALA A 49 22.641 28.185 -69.676 1.00 72.13 H new ATOM 0 HB3 ALA A 49 23.015 27.959 -71.401 1.00 72.13 H new ATOM 712 N GLY A 50 25.612 26.461 -72.090 1.00 2.34 N ATOM 713 CA GLY A 50 26.139 25.551 -73.090 1.00 35.23 C ATOM 714 C GLY A 50 27.325 24.755 -72.584 1.00 53.00 C ATOM 715 O GLY A 50 27.525 23.605 -72.976 1.00 33.33 O ATOM 0 H GLY A 50 25.811 27.447 -72.260 1.00 2.34 H new ATOM 0 HA2 GLY A 50 25.352 24.865 -73.403 1.00 35.23 H new ATOM 0 HA3 GLY A 50 26.436 26.118 -73.972 1.00 35.23 H new ATOM 719 N THR A 51 28.116 25.368 -71.709 1.00 44.55 N ATOM 720 CA THR A 51 29.292 24.710 -71.150 1.00 71.43 C ATOM 721 C THR A 51 28.918 23.838 -69.958 1.00 64.22 C ATOM 722 O THR A 51 29.550 22.812 -69.705 1.00 61.51 O ATOM 723 CB THR A 51 30.353 25.735 -70.709 1.00 52.24 C ATOM 724 OG1 THR A 51 30.762 26.531 -71.828 1.00 24.43 O ATOM 725 CG2 THR A 51 31.563 25.038 -70.107 1.00 25.11 C ATOM 0 H THR A 51 27.964 26.319 -71.372 1.00 44.55 H new ATOM 0 HA THR A 51 29.709 24.084 -71.939 1.00 71.43 H new ATOM 0 HB THR A 51 29.909 26.378 -69.949 1.00 52.24 H new ATOM 0 HG1 THR A 51 31.629 26.945 -71.636 1.00 24.43 H new ATOM 0 HG21 THR A 51 32.298 25.783 -69.803 1.00 25.11 H new ATOM 0 HG22 THR A 51 31.254 24.458 -69.238 1.00 25.11 H new ATOM 0 HG23 THR A 51 32.006 24.373 -70.848 1.00 25.11 H new ATOM 733 N VAL A 52 27.887 24.250 -69.228 1.00 73.54 N ATOM 734 CA VAL A 52 27.427 23.504 -68.063 1.00 61.22 C ATOM 735 C VAL A 52 26.985 22.097 -68.450 1.00 71.14 C ATOM 736 O VAL A 52 27.505 21.109 -67.934 1.00 62.23 O ATOM 737 CB VAL A 52 26.259 24.223 -67.361 1.00 71.44 C ATOM 738 CG1 VAL A 52 25.838 23.463 -66.112 1.00 53.24 C ATOM 739 CG2 VAL A 52 26.643 25.654 -67.020 1.00 72.25 C ATOM 0 H VAL A 52 27.354 25.097 -69.423 1.00 73.54 H new ATOM 0 HA VAL A 52 28.270 23.440 -67.375 1.00 61.22 H new ATOM 0 HB VAL A 52 25.410 24.252 -68.043 1.00 71.44 H new ATOM 0 HG11 VAL A 52 25.012 23.985 -65.629 1.00 53.24 H new ATOM 0 HG12 VAL A 52 25.520 22.458 -66.388 1.00 53.24 H new ATOM 0 HG13 VAL A 52 26.680 23.401 -65.423 1.00 53.24 H new ATOM 0 HG21 VAL A 52 25.806 26.147 -66.525 1.00 72.25 H new ATOM 0 HG22 VAL A 52 27.507 25.650 -66.356 1.00 72.25 H new ATOM 0 HG23 VAL A 52 26.891 26.192 -67.935 1.00 72.25 H new ATOM 749 N GLU A 53 26.021 22.016 -69.362 1.00 73.35 N ATOM 750 CA GLU A 53 25.509 20.729 -69.819 1.00 75.31 C ATOM 751 C GLU A 53 26.589 19.944 -70.556 1.00 63.43 C ATOM 752 O GLU A 53 26.750 18.742 -70.345 1.00 23.51 O ATOM 753 CB GLU A 53 24.298 20.932 -70.732 1.00 63.02 C ATOM 754 CG GLU A 53 22.970 20.634 -70.057 1.00 72.11 C ATOM 755 CD GLU A 53 21.894 20.221 -71.043 1.00 63.41 C ATOM 756 OE1 GLU A 53 22.193 20.155 -72.254 1.00 64.04 O ATOM 757 OE2 GLU A 53 20.753 19.963 -70.606 1.00 5.54 O ATOM 0 H GLU A 53 25.579 22.825 -69.798 1.00 73.35 H new ATOM 0 HA GLU A 53 25.203 20.157 -68.943 1.00 75.31 H new ATOM 0 HB2 GLU A 53 24.291 21.962 -71.089 1.00 63.02 H new ATOM 0 HB3 GLU A 53 24.403 20.292 -71.608 1.00 63.02 H new ATOM 0 HG2 GLU A 53 23.110 19.840 -69.324 1.00 72.11 H new ATOM 0 HG3 GLU A 53 22.638 21.517 -69.511 1.00 72.11 H new ATOM 762 N GLU A 54 27.328 20.632 -71.421 1.00 23.32 N ATOM 763 CA GLU A 54 28.392 19.998 -72.191 1.00 2.54 C ATOM 764 C GLU A 54 29.484 19.462 -71.269 1.00 10.43 C ATOM 765 O GLU A 54 30.197 18.520 -71.616 1.00 72.11 O ATOM 766 CB GLU A 54 28.992 20.991 -73.187 1.00 55.25 C ATOM 767 CG GLU A 54 28.153 21.180 -74.439 1.00 35.22 C ATOM 768 CD GLU A 54 28.566 20.253 -75.565 1.00 63.14 C ATOM 769 OE1 GLU A 54 28.964 19.105 -75.273 1.00 55.33 O ATOM 770 OE2 GLU A 54 28.492 20.676 -76.738 1.00 21.05 O ATOM 0 H GLU A 54 27.209 21.628 -71.606 1.00 23.32 H new ATOM 0 HA GLU A 54 27.960 19.161 -72.740 1.00 2.54 H new ATOM 0 HB2 GLU A 54 29.117 21.955 -72.695 1.00 55.25 H new ATOM 0 HB3 GLU A 54 29.986 20.648 -73.474 1.00 55.25 H new ATOM 0 HG2 GLU A 54 27.104 21.007 -74.198 1.00 35.22 H new ATOM 0 HG3 GLU A 54 28.237 22.213 -74.775 1.00 35.22 H new ATOM 775 N CYS A 55 29.609 20.070 -70.094 1.00 63.50 N ATOM 776 CA CYS A 55 30.615 19.656 -69.123 1.00 3.31 C ATOM 777 C CYS A 55 30.236 18.325 -68.481 1.00 61.25 C ATOM 778 O CYS A 55 31.018 17.374 -68.492 1.00 73.42 O ATOM 779 CB CYS A 55 30.782 20.726 -68.043 1.00 12.21 C ATOM 780 SG CYS A 55 32.161 21.858 -68.334 1.00 0.53 S ATOM 0 H CYS A 55 29.026 20.851 -69.791 1.00 63.50 H new ATOM 0 HA CYS A 55 31.561 19.529 -69.649 1.00 3.31 H new ATOM 0 HB2 CYS A 55 29.860 21.304 -67.973 1.00 12.21 H new ATOM 0 HB3 CYS A 55 30.925 20.236 -67.080 1.00 12.21 H new ATOM 0 HG CYS A 55 32.220 22.727 -67.369 1.00 0.53 H new ATOM 785 N VAL A 56 29.032 18.264 -67.922 1.00 72.13 N ATOM 786 CA VAL A 56 28.549 17.050 -67.276 1.00 1.55 C ATOM 787 C VAL A 56 28.287 15.950 -68.298 1.00 41.02 C ATOM 788 O VAL A 56 28.418 14.764 -67.995 1.00 52.20 O ATOM 789 CB VAL A 56 27.258 17.314 -66.479 1.00 0.31 C ATOM 790 CG1 VAL A 56 26.788 16.043 -65.787 1.00 13.12 C ATOM 791 CG2 VAL A 56 27.474 18.432 -65.470 1.00 21.45 C ATOM 0 H VAL A 56 28.373 19.042 -67.904 1.00 72.13 H new ATOM 0 HA VAL A 56 29.331 16.725 -66.590 1.00 1.55 H new ATOM 0 HB VAL A 56 26.480 17.629 -67.175 1.00 0.31 H new ATOM 0 HG11 VAL A 56 25.875 16.249 -65.229 1.00 13.12 H new ATOM 0 HG12 VAL A 56 26.591 15.274 -66.534 1.00 13.12 H new ATOM 0 HG13 VAL A 56 27.561 15.694 -65.102 1.00 13.12 H new ATOM 0 HG21 VAL A 56 26.552 18.605 -64.916 1.00 21.45 H new ATOM 0 HG22 VAL A 56 28.266 18.149 -64.777 1.00 21.45 H new ATOM 0 HG23 VAL A 56 27.759 19.344 -65.994 1.00 21.45 H new ATOM 801 N GLN A 57 27.915 16.352 -69.510 1.00 4.23 N ATOM 802 CA GLN A 57 27.635 15.400 -70.576 1.00 73.23 C ATOM 803 C GLN A 57 28.903 14.670 -71.003 1.00 45.34 C ATOM 804 O GLN A 57 29.023 13.457 -70.833 1.00 30.25 O ATOM 805 CB GLN A 57 27.015 16.116 -71.778 1.00 11.13 C ATOM 806 CG GLN A 57 26.454 15.170 -72.828 1.00 0.14 C ATOM 807 CD GLN A 57 24.977 15.396 -73.086 1.00 70.25 C ATOM 808 OE1 GLN A 57 24.165 15.388 -72.162 1.00 25.45 O ATOM 809 NE2 GLN A 57 24.622 15.601 -74.349 1.00 70.53 N ATOM 0 H GLN A 57 27.801 17.330 -69.777 1.00 4.23 H new ATOM 0 HA GLN A 57 26.927 14.665 -70.194 1.00 73.23 H new ATOM 0 HB2 GLN A 57 26.217 16.771 -71.428 1.00 11.13 H new ATOM 0 HB3 GLN A 57 27.770 16.752 -72.240 1.00 11.13 H new ATOM 0 HG2 GLN A 57 27.006 15.298 -73.759 1.00 0.14 H new ATOM 0 HG3 GLN A 57 26.609 14.141 -72.505 1.00 0.14 H new ATOM 0 HE21 GLN A 57 25.329 15.599 -75.084 1.00 70.53 H new ATOM 0 HE22 GLN A 57 23.642 15.760 -74.584 1.00 70.53 H new ATOM 816 N LYS A 58 29.850 15.417 -71.560 1.00 45.44 N ATOM 817 CA LYS A 58 31.113 14.842 -72.012 1.00 15.41 C ATOM 818 C LYS A 58 31.765 14.023 -70.903 1.00 23.23 C ATOM 819 O LYS A 58 32.447 13.032 -71.169 1.00 13.24 O ATOM 820 CB LYS A 58 32.066 15.950 -72.470 1.00 31.05 C ATOM 821 CG LYS A 58 32.667 16.746 -71.325 1.00 40.45 C ATOM 822 CD LYS A 58 33.588 17.844 -71.832 1.00 34.41 C ATOM 823 CE LYS A 58 34.516 18.345 -70.736 1.00 33.14 C ATOM 824 NZ LYS A 58 35.618 17.383 -70.461 1.00 0.43 N ATOM 0 H LYS A 58 29.767 16.423 -71.710 1.00 45.44 H new ATOM 0 HA LYS A 58 30.903 14.181 -72.853 1.00 15.41 H new ATOM 0 HB2 LYS A 58 32.871 15.506 -73.055 1.00 31.05 H new ATOM 0 HB3 LYS A 58 31.529 16.630 -73.131 1.00 31.05 H new ATOM 0 HG2 LYS A 58 31.868 17.187 -70.728 1.00 40.45 H new ATOM 0 HG3 LYS A 58 33.224 16.077 -70.668 1.00 40.45 H new ATOM 0 HD2 LYS A 58 34.179 17.467 -72.667 1.00 34.41 H new ATOM 0 HD3 LYS A 58 32.992 18.673 -72.212 1.00 34.41 H new ATOM 0 HE2 LYS A 58 34.938 19.307 -71.028 1.00 33.14 H new ATOM 0 HE3 LYS A 58 33.944 18.512 -69.824 1.00 33.14 H new ATOM 0 HZ1 LYS A 58 36.437 17.894 -70.074 1.00 0.43 H new ATOM 0 HZ2 LYS A 58 35.296 16.673 -69.773 1.00 0.43 H new ATOM 0 HZ3 LYS A 58 35.893 16.908 -71.345 1.00 0.43 H new ATOM 834 N PHE A 59 31.550 14.440 -69.659 1.00 75.22 N ATOM 835 CA PHE A 59 32.116 13.744 -68.510 1.00 44.45 C ATOM 836 C PHE A 59 31.709 12.274 -68.511 1.00 3.12 C ATOM 837 O PHE A 59 32.558 11.383 -68.550 1.00 15.53 O ATOM 838 CB PHE A 59 31.664 14.410 -67.210 1.00 54.12 C ATOM 839 CG PHE A 59 32.556 14.109 -66.039 1.00 61.31 C ATOM 840 CD1 PHE A 59 33.899 14.444 -66.071 1.00 52.43 C ATOM 841 CD2 PHE A 59 32.050 13.488 -64.909 1.00 2.51 C ATOM 842 CE1 PHE A 59 34.722 14.167 -64.996 1.00 22.11 C ATOM 843 CE2 PHE A 59 32.869 13.208 -63.830 1.00 33.03 C ATOM 844 CZ PHE A 59 34.206 13.549 -63.874 1.00 13.34 C ATOM 0 H PHE A 59 30.987 15.257 -69.422 1.00 75.22 H new ATOM 0 HA PHE A 59 33.202 13.802 -68.580 1.00 44.45 H new ATOM 0 HB2 PHE A 59 31.625 15.489 -67.359 1.00 54.12 H new ATOM 0 HB3 PHE A 59 30.650 14.084 -66.977 1.00 54.12 H new ATOM 0 HD1 PHE A 59 34.308 14.927 -66.946 1.00 52.43 H new ATOM 0 HD2 PHE A 59 31.005 13.219 -64.870 1.00 2.51 H new ATOM 0 HE1 PHE A 59 35.768 14.434 -65.033 1.00 22.11 H new ATOM 0 HE2 PHE A 59 32.463 12.723 -62.954 1.00 33.03 H new ATOM 0 HZ PHE A 59 34.847 13.333 -63.032 1.00 13.34 H new ATOM 853 N ILE A 60 30.404 12.028 -68.466 1.00 51.04 N ATOM 854 CA ILE A 60 29.883 10.667 -68.462 1.00 61.14 C ATOM 855 C ILE A 60 30.402 9.875 -69.658 1.00 10.01 C ATOM 856 O ILE A 60 30.494 8.649 -69.611 1.00 21.04 O ATOM 857 CB ILE A 60 28.343 10.652 -68.481 1.00 74.25 C ATOM 858 CG1 ILE A 60 27.789 11.429 -67.285 1.00 42.54 C ATOM 859 CG2 ILE A 60 27.826 9.222 -68.477 1.00 1.22 C ATOM 860 CD1 ILE A 60 26.296 11.659 -67.352 1.00 70.43 C ATOM 0 H ILE A 60 29.688 12.754 -68.432 1.00 51.04 H new ATOM 0 HA ILE A 60 30.231 10.200 -67.541 1.00 61.14 H new ATOM 0 HB ILE A 60 28.001 11.137 -69.395 1.00 74.25 H new ATOM 0 HG12 ILE A 60 28.024 10.886 -66.369 1.00 42.54 H new ATOM 0 HG13 ILE A 60 28.294 12.393 -67.223 1.00 42.54 H new ATOM 0 HG21 ILE A 60 26.736 9.229 -68.491 1.00 1.22 H new ATOM 0 HG22 ILE A 60 28.196 8.699 -69.358 1.00 1.22 H new ATOM 0 HG23 ILE A 60 28.174 8.712 -67.579 1.00 1.22 H new ATOM 0 HD11 ILE A 60 25.974 12.215 -66.472 1.00 70.43 H new ATOM 0 HD12 ILE A 60 26.056 12.229 -68.250 1.00 70.43 H new ATOM 0 HD13 ILE A 60 25.781 10.699 -67.383 1.00 70.43 H new ATOM 871 N GLU A 61 30.743 10.586 -70.729 1.00 13.22 N ATOM 872 CA GLU A 61 31.254 9.950 -71.936 1.00 51.02 C ATOM 873 C GLU A 61 32.704 9.512 -71.749 1.00 63.02 C ATOM 874 O GLU A 61 33.006 8.318 -71.737 1.00 22.02 O ATOM 875 CB GLU A 61 31.149 10.905 -73.127 1.00 74.23 C ATOM 876 CG GLU A 61 29.943 10.643 -74.013 1.00 54.15 C ATOM 877 CD GLU A 61 30.107 11.218 -75.407 1.00 24.24 C ATOM 878 OE1 GLU A 61 30.784 12.258 -75.543 1.00 42.33 O ATOM 879 OE2 GLU A 61 29.558 10.628 -76.361 1.00 20.01 O ATOM 0 H GLU A 61 30.674 11.602 -70.784 1.00 13.22 H new ATOM 0 HA GLU A 61 30.648 9.066 -72.133 1.00 51.02 H new ATOM 0 HB2 GLU A 61 31.102 11.929 -72.757 1.00 74.23 H new ATOM 0 HB3 GLU A 61 32.055 10.824 -73.728 1.00 74.23 H new ATOM 0 HG2 GLU A 61 29.776 9.568 -74.085 1.00 54.15 H new ATOM 0 HG3 GLU A 61 29.056 11.073 -73.549 1.00 54.15 H new ATOM 884 N ILE A 62 33.596 10.486 -71.603 1.00 61.11 N ATOM 885 CA ILE A 62 35.013 10.201 -71.416 1.00 42.23 C ATOM 886 C ILE A 62 35.231 9.237 -70.255 1.00 2.34 C ATOM 887 O ILE A 62 36.142 8.409 -70.285 1.00 61.23 O ATOM 888 CB ILE A 62 35.816 11.489 -71.157 1.00 54.21 C ATOM 889 CG1 ILE A 62 35.339 12.164 -69.869 1.00 3.02 C ATOM 890 CG2 ILE A 62 35.688 12.441 -72.337 1.00 63.55 C ATOM 891 CD1 ILE A 62 36.044 13.469 -69.573 1.00 44.01 C ATOM 0 H ILE A 62 33.363 11.479 -71.611 1.00 61.11 H new ATOM 0 HA ILE A 62 35.367 9.741 -72.338 1.00 42.23 H new ATOM 0 HB ILE A 62 36.867 11.225 -71.040 1.00 54.21 H new ATOM 0 HG12 ILE A 62 34.267 12.348 -69.940 1.00 3.02 H new ATOM 0 HG13 ILE A 62 35.490 11.481 -69.033 1.00 3.02 H new ATOM 0 HG21 ILE A 62 36.261 13.346 -72.138 1.00 63.55 H new ATOM 0 HG22 ILE A 62 36.071 11.959 -73.236 1.00 63.55 H new ATOM 0 HG23 ILE A 62 34.639 12.700 -72.483 1.00 63.55 H new ATOM 0 HD11 ILE A 62 35.655 13.891 -68.646 1.00 44.01 H new ATOM 0 HD12 ILE A 62 37.114 13.289 -69.469 1.00 44.01 H new ATOM 0 HD13 ILE A 62 35.872 14.169 -70.390 1.00 44.01 H new ATOM 902 N ASP A 63 34.389 9.349 -69.234 1.00 0.45 N ATOM 903 CA ASP A 63 34.487 8.486 -68.063 1.00 43.32 C ATOM 904 C ASP A 63 33.984 7.081 -68.380 1.00 40.43 C ATOM 905 O ASP A 63 34.476 6.097 -67.827 1.00 31.30 O ATOM 906 CB ASP A 63 33.689 9.076 -66.899 1.00 4.11 C ATOM 907 CG ASP A 63 34.355 10.300 -66.302 1.00 73.14 C ATOM 908 OD1 ASP A 63 35.597 10.401 -66.388 1.00 73.14 O ATOM 909 OD2 ASP A 63 33.635 11.158 -65.748 1.00 64.43 O ATOM 0 H ASP A 63 33.630 10.030 -69.194 1.00 0.45 H new ATOM 0 HA ASP A 63 35.537 8.421 -67.777 1.00 43.32 H new ATOM 0 HB2 ASP A 63 32.690 9.342 -67.245 1.00 4.11 H new ATOM 0 HB3 ASP A 63 33.567 8.318 -66.125 1.00 4.11 H new ATOM 913 N GLN A 64 33.003 6.996 -69.272 1.00 54.22 N ATOM 914 CA GLN A 64 32.433 5.713 -69.661 1.00 62.23 C ATOM 915 C GLN A 64 33.519 4.763 -70.157 1.00 61.20 C ATOM 916 O GLN A 64 33.782 3.730 -69.542 1.00 50.10 O ATOM 917 CB GLN A 64 31.375 5.908 -70.748 1.00 41.51 C ATOM 918 CG GLN A 64 30.003 5.379 -70.364 1.00 20.30 C ATOM 919 CD GLN A 64 28.912 5.846 -71.307 1.00 14.11 C ATOM 920 OE1 GLN A 64 29.151 6.665 -72.195 1.00 10.31 O ATOM 921 NE2 GLN A 64 27.704 5.326 -71.120 1.00 52.04 N ATOM 0 H GLN A 64 32.586 7.801 -69.739 1.00 54.22 H new ATOM 0 HA GLN A 64 31.963 5.272 -68.782 1.00 62.23 H new ATOM 0 HB2 GLN A 64 31.294 6.970 -70.978 1.00 41.51 H new ATOM 0 HB3 GLN A 64 31.706 5.409 -71.659 1.00 41.51 H new ATOM 0 HG2 GLN A 64 30.028 4.289 -70.355 1.00 20.30 H new ATOM 0 HG3 GLN A 64 29.764 5.701 -69.350 1.00 20.30 H new ATOM 0 HE21 GLN A 64 27.550 4.650 -70.372 1.00 52.04 H new ATOM 0 HE22 GLN A 64 26.931 5.603 -71.725 1.00 52.04 H new ATOM 928 N ALA A 65 34.146 5.120 -71.273 1.00 22.12 N ATOM 929 CA ALA A 65 35.204 4.301 -71.851 1.00 25.34 C ATOM 930 C ALA A 65 36.300 4.020 -70.828 1.00 45.11 C ATOM 931 O ALA A 65 36.845 2.917 -70.776 1.00 65.44 O ATOM 932 CB ALA A 65 35.788 4.982 -73.079 1.00 62.43 C ATOM 0 H ALA A 65 33.939 5.972 -71.795 1.00 22.12 H new ATOM 0 HA ALA A 65 34.769 3.348 -72.151 1.00 25.34 H new ATOM 0 HB1 ALA A 65 36.577 4.359 -73.500 1.00 62.43 H new ATOM 0 HB2 ALA A 65 35.004 5.126 -73.822 1.00 62.43 H new ATOM 0 HB3 ALA A 65 36.202 5.950 -72.796 1.00 62.43 H new ATOM 938 N TRP A 66 36.619 5.023 -70.019 1.00 41.03 N ATOM 939 CA TRP A 66 37.652 4.883 -68.999 1.00 24.34 C ATOM 940 C TRP A 66 37.458 3.598 -68.201 1.00 11.34 C ATOM 941 O TRP A 66 38.426 2.936 -67.826 1.00 3.41 O ATOM 942 CB TRP A 66 37.635 6.089 -68.058 1.00 43.42 C ATOM 943 CG TRP A 66 38.869 6.202 -67.215 1.00 34.13 C ATOM 944 CD1 TRP A 66 40.110 5.715 -67.510 1.00 4.24 C ATOM 945 CD2 TRP A 66 38.979 6.840 -65.938 1.00 53.02 C ATOM 946 NE1 TRP A 66 40.985 6.012 -66.492 1.00 43.14 N ATOM 947 CE2 TRP A 66 40.316 6.703 -65.517 1.00 30.52 C ATOM 948 CE3 TRP A 66 38.078 7.516 -65.110 1.00 52.23 C ATOM 949 CZ2 TRP A 66 40.771 7.216 -64.305 1.00 30.53 C ATOM 950 CZ3 TRP A 66 38.531 8.024 -63.907 1.00 51.32 C ATOM 951 CH2 TRP A 66 39.867 7.872 -63.514 1.00 40.34 C ATOM 0 H TRP A 66 36.178 5.942 -70.049 1.00 41.03 H new ATOM 0 HA TRP A 66 38.619 4.835 -69.500 1.00 24.34 H new ATOM 0 HB2 TRP A 66 37.522 6.999 -68.647 1.00 43.42 H new ATOM 0 HB3 TRP A 66 36.764 6.020 -67.407 1.00 43.42 H new ATOM 0 HD1 TRP A 66 40.366 5.176 -68.410 1.00 4.24 H new ATOM 0 HE1 TRP A 66 41.973 5.759 -66.467 1.00 43.14 H new ATOM 0 HE3 TRP A 66 37.046 7.639 -65.405 1.00 52.23 H new ATOM 0 HZ2 TRP A 66 41.801 7.100 -64.000 1.00 30.53 H new ATOM 0 HZ3 TRP A 66 37.843 8.547 -63.259 1.00 51.32 H new ATOM 0 HH2 TRP A 66 40.190 8.281 -62.568 1.00 40.34 H new ATOM 961 N LYS A 67 36.202 3.250 -67.944 1.00 50.11 N ATOM 962 CA LYS A 67 35.880 2.043 -67.191 1.00 41.54 C ATOM 963 C LYS A 67 35.419 0.928 -68.124 1.00 33.33 C ATOM 964 O LYS A 67 36.075 -0.108 -68.240 1.00 21.03 O ATOM 965 CB LYS A 67 34.794 2.338 -66.155 1.00 31.32 C ATOM 966 CG LYS A 67 35.177 3.423 -65.163 1.00 60.31 C ATOM 967 CD LYS A 67 35.786 2.836 -63.901 1.00 60.12 C ATOM 968 CE LYS A 67 37.304 2.806 -63.977 1.00 44.30 C ATOM 969 NZ LYS A 67 37.928 2.903 -62.628 1.00 44.13 N ATOM 0 H LYS A 67 35.389 3.787 -68.246 1.00 50.11 H new ATOM 0 HA LYS A 67 36.783 1.713 -66.677 1.00 41.54 H new ATOM 0 HB2 LYS A 67 33.882 2.636 -66.672 1.00 31.32 H new ATOM 0 HB3 LYS A 67 34.566 1.422 -65.609 1.00 31.32 H new ATOM 0 HG2 LYS A 67 35.888 4.107 -65.627 1.00 60.31 H new ATOM 0 HG3 LYS A 67 34.295 4.008 -64.904 1.00 60.31 H new ATOM 0 HD2 LYS A 67 35.475 3.425 -63.038 1.00 60.12 H new ATOM 0 HD3 LYS A 67 35.408 1.825 -63.750 1.00 60.12 H new ATOM 0 HE2 LYS A 67 37.625 1.884 -64.461 1.00 44.30 H new ATOM 0 HE3 LYS A 67 37.653 3.630 -64.599 1.00 44.30 H new ATOM 0 HZ1 LYS A 67 38.963 2.879 -62.722 1.00 44.13 H new ATOM 0 HZ2 LYS A 67 37.642 3.795 -62.176 1.00 44.13 H new ATOM 0 HZ3 LYS A 67 37.615 2.103 -62.042 1.00 44.13 H new ATOM 979 N ILE A 68 34.288 1.146 -68.786 1.00 0.21 N ATOM 980 CA ILE A 68 33.742 0.160 -69.710 1.00 32.41 C ATOM 981 C ILE A 68 34.281 0.370 -71.121 1.00 23.03 C ATOM 982 O ILE A 68 33.519 0.417 -72.087 1.00 54.25 O ATOM 983 CB ILE A 68 32.203 0.215 -69.746 1.00 71.33 C ATOM 984 CG1 ILE A 68 31.649 -0.945 -70.576 1.00 63.14 C ATOM 985 CG2 ILE A 68 31.733 1.548 -70.310 1.00 4.30 C ATOM 986 CD1 ILE A 68 30.384 -1.548 -70.005 1.00 43.43 C ATOM 0 H ILE A 68 33.732 1.997 -68.700 1.00 0.21 H new ATOM 0 HA ILE A 68 34.054 -0.819 -69.347 1.00 32.41 H new ATOM 0 HB ILE A 68 31.827 0.121 -68.727 1.00 71.33 H new ATOM 0 HG12 ILE A 68 31.449 -0.594 -71.588 1.00 63.14 H new ATOM 0 HG13 ILE A 68 32.410 -1.722 -70.652 1.00 63.14 H new ATOM 0 HG21 ILE A 68 30.643 1.571 -70.329 1.00 4.30 H new ATOM 0 HG22 ILE A 68 32.102 2.359 -69.683 1.00 4.30 H new ATOM 0 HG23 ILE A 68 32.116 1.670 -71.323 1.00 4.30 H new ATOM 0 HD11 ILE A 68 30.049 -2.364 -70.645 1.00 43.43 H new ATOM 0 HD12 ILE A 68 30.583 -1.930 -69.004 1.00 43.43 H new ATOM 0 HD13 ILE A 68 29.608 -0.785 -69.954 1.00 43.43 H new ATOM 997 N LEU A 69 35.598 0.494 -71.233 1.00 2.53 N ATOM 998 CA LEU A 69 36.240 0.698 -72.526 1.00 43.51 C ATOM 999 C LEU A 69 35.721 -0.301 -73.555 1.00 50.31 C ATOM 1000 O LEU A 69 35.605 0.016 -74.739 1.00 20.13 O ATOM 1001 CB LEU A 69 37.759 0.564 -72.390 1.00 71.20 C ATOM 1002 CG LEU A 69 38.583 1.025 -73.592 1.00 55.34 C ATOM 1003 CD1 LEU A 69 38.502 0.008 -74.719 1.00 34.15 C ATOM 1004 CD2 LEU A 69 38.112 2.392 -74.070 1.00 20.34 C ATOM 0 H LEU A 69 36.243 0.457 -70.443 1.00 2.53 H new ATOM 0 HA LEU A 69 35.999 1.704 -72.869 1.00 43.51 H new ATOM 0 HB2 LEU A 69 38.077 1.133 -71.517 1.00 71.20 H new ATOM 0 HB3 LEU A 69 37.995 -0.482 -72.192 1.00 71.20 H new ATOM 0 HG LEU A 69 39.624 1.109 -73.281 1.00 55.34 H new ATOM 0 HD11 LEU A 69 39.095 0.355 -75.565 1.00 34.15 H new ATOM 0 HD12 LEU A 69 38.889 -0.950 -74.373 1.00 34.15 H new ATOM 0 HD13 LEU A 69 37.464 -0.111 -75.028 1.00 34.15 H new ATOM 0 HD21 LEU A 69 38.710 2.704 -74.926 1.00 20.34 H new ATOM 0 HD22 LEU A 69 37.063 2.334 -74.362 1.00 20.34 H new ATOM 0 HD23 LEU A 69 38.225 3.118 -73.265 1.00 20.34 H new ATOM 1015 N GLY A 70 35.407 -1.508 -73.095 1.00 33.41 N ATOM 1016 CA GLY A 70 34.901 -2.533 -73.988 1.00 72.51 C ATOM 1017 C GLY A 70 33.565 -3.090 -73.535 1.00 51.41 C ATOM 1018 O GLY A 70 32.790 -2.399 -72.876 1.00 32.15 O ATOM 0 H GLY A 70 35.494 -1.794 -72.120 1.00 33.41 H new ATOM 0 HA2 GLY A 70 34.797 -2.118 -74.990 1.00 72.51 H new ATOM 0 HA3 GLY A 70 35.626 -3.344 -74.053 1.00 72.51 H new ATOM 1022 N ASN A 71 33.297 -4.342 -73.889 1.00 62.23 N ATOM 1023 CA ASN A 71 32.045 -4.991 -73.516 1.00 54.02 C ATOM 1024 C ASN A 71 31.831 -4.932 -72.006 1.00 70.45 C ATOM 1025 O ASN A 71 32.699 -4.475 -71.265 1.00 14.02 O ATOM 1026 CB ASN A 71 32.039 -6.446 -73.988 1.00 52.10 C ATOM 1027 CG ASN A 71 30.746 -6.824 -74.683 1.00 41.35 C ATOM 1028 OD1 ASN A 71 30.300 -6.138 -75.604 1.00 52.03 O ATOM 1029 ND2 ASN A 71 30.137 -7.920 -74.246 1.00 13.12 N ATOM 0 H ASN A 71 33.930 -4.928 -74.434 1.00 62.23 H new ATOM 0 HA ASN A 71 31.229 -4.457 -74.002 1.00 54.02 H new ATOM 0 HB2 ASN A 71 32.875 -6.607 -74.669 1.00 52.10 H new ATOM 0 HB3 ASN A 71 32.194 -7.103 -73.132 1.00 52.10 H new ATOM 0 HD21 ASN A 71 29.264 -8.224 -74.676 1.00 13.12 H new ATOM 0 HD22 ASN A 71 30.543 -8.458 -73.480 1.00 13.12 H new ATOM 1035 N GLU A 72 30.669 -5.399 -71.561 1.00 24.34 N ATOM 1036 CA GLU A 72 30.341 -5.399 -70.140 1.00 22.42 C ATOM 1037 C GLU A 72 31.295 -6.301 -69.362 1.00 64.22 C ATOM 1038 O GLU A 72 31.485 -6.130 -68.159 1.00 22.01 O ATOM 1039 CB GLU A 72 28.897 -5.860 -69.927 1.00 43.12 C ATOM 1040 CG GLU A 72 28.634 -7.278 -70.407 1.00 42.21 C ATOM 1041 CD GLU A 72 28.508 -8.267 -69.265 1.00 5.13 C ATOM 1042 OE1 GLU A 72 29.149 -8.046 -68.216 1.00 15.45 O ATOM 1043 OE2 GLU A 72 27.771 -9.262 -69.420 1.00 24.35 O ATOM 0 H GLU A 72 29.940 -5.782 -72.163 1.00 24.34 H new ATOM 0 HA GLU A 72 30.448 -4.380 -69.768 1.00 22.42 H new ATOM 0 HB2 GLU A 72 28.656 -5.794 -68.866 1.00 43.12 H new ATOM 0 HB3 GLU A 72 28.226 -5.178 -70.449 1.00 43.12 H new ATOM 0 HG2 GLU A 72 27.719 -7.293 -70.998 1.00 42.21 H new ATOM 0 HG3 GLU A 72 29.444 -7.591 -71.066 1.00 42.21 H new ATOM 1048 N GLU A 73 31.891 -7.264 -70.059 1.00 43.12 N ATOM 1049 CA GLU A 73 32.823 -8.194 -69.434 1.00 42.42 C ATOM 1050 C GLU A 73 34.208 -7.567 -69.297 1.00 43.40 C ATOM 1051 O GLU A 73 35.048 -8.048 -68.536 1.00 1.24 O ATOM 1052 CB GLU A 73 32.915 -9.486 -70.249 1.00 31.14 C ATOM 1053 CG GLU A 73 31.837 -10.500 -69.906 1.00 40.10 C ATOM 1054 CD GLU A 73 31.437 -11.351 -71.095 1.00 30.42 C ATOM 1055 OE1 GLU A 73 30.812 -10.809 -72.029 1.00 34.30 O ATOM 1056 OE2 GLU A 73 31.749 -12.561 -71.090 1.00 32.10 O ATOM 0 H GLU A 73 31.745 -7.420 -71.056 1.00 43.12 H new ATOM 0 HA GLU A 73 32.448 -8.428 -68.438 1.00 42.42 H new ATOM 0 HB2 GLU A 73 32.849 -9.242 -71.309 1.00 31.14 H new ATOM 0 HB3 GLU A 73 33.893 -9.939 -70.087 1.00 31.14 H new ATOM 0 HG2 GLU A 73 32.194 -11.147 -69.105 1.00 40.10 H new ATOM 0 HG3 GLU A 73 30.959 -9.977 -69.527 1.00 40.10 H new ATOM 1127 N TYR A 78 32.924 1.011 -62.574 1.00 3.04 N ATOM 1128 CA TYR A 78 31.997 2.064 -62.177 1.00 31.31 C ATOM 1129 C TYR A 78 30.577 1.519 -62.048 1.00 21.23 C ATOM 1130 O TYR A 78 29.828 1.913 -61.154 1.00 35.34 O ATOM 1131 CB TYR A 78 32.025 3.207 -63.192 1.00 75.50 C ATOM 1132 CG TYR A 78 32.192 4.572 -62.563 1.00 34.21 C ATOM 1133 CD1 TYR A 78 33.284 4.856 -61.753 1.00 12.21 C ATOM 1134 CD2 TYR A 78 31.256 5.576 -62.777 1.00 34.12 C ATOM 1135 CE1 TYR A 78 33.440 6.102 -61.175 1.00 23.55 C ATOM 1136 CE2 TYR A 78 31.404 6.825 -62.204 1.00 72.01 C ATOM 1137 CZ TYR A 78 32.498 7.082 -61.404 1.00 0.20 C ATOM 1138 OH TYR A 78 32.649 8.324 -60.830 1.00 73.51 O ATOM 0 HA TYR A 78 32.312 2.443 -61.205 1.00 31.31 H new ATOM 0 HB2 TYR A 78 32.841 3.038 -63.895 1.00 75.50 H new ATOM 0 HB3 TYR A 78 31.100 3.193 -63.768 1.00 75.50 H new ATOM 0 HD1 TYR A 78 34.024 4.090 -61.572 1.00 12.21 H new ATOM 0 HD2 TYR A 78 30.398 5.377 -63.402 1.00 34.12 H new ATOM 0 HE1 TYR A 78 34.295 6.306 -60.548 1.00 23.55 H new ATOM 0 HE2 TYR A 78 30.668 7.595 -62.381 1.00 72.01 H new ATOM 0 HH TYR A 78 31.900 8.899 -61.092 1.00 73.51 H new ATOM 1147 N ASP A 79 30.216 0.609 -62.945 1.00 62.34 N ATOM 1148 CA ASP A 79 28.888 0.007 -62.932 1.00 73.02 C ATOM 1149 C ASP A 79 28.598 -0.640 -61.582 1.00 24.33 C ATOM 1150 O ASP A 79 27.742 -0.173 -60.828 1.00 42.50 O ATOM 1151 CB ASP A 79 28.765 -1.033 -64.047 1.00 22.13 C ATOM 1152 CG ASP A 79 27.820 -0.594 -65.147 1.00 34.51 C ATOM 1153 OD1 ASP A 79 26.605 -0.855 -65.025 1.00 63.40 O ATOM 1154 OD2 ASP A 79 28.295 0.011 -66.131 1.00 35.01 O ATOM 0 H ASP A 79 30.825 0.272 -63.691 1.00 62.34 H new ATOM 0 HA ASP A 79 28.156 0.797 -63.101 1.00 73.02 H new ATOM 0 HB2 ASP A 79 29.750 -1.223 -64.473 1.00 22.13 H new ATOM 0 HB3 ASP A 79 28.414 -1.974 -63.625 1.00 22.13 H new ATOM 1158 N LEU A 80 29.315 -1.718 -61.282 1.00 32.24 N ATOM 1159 CA LEU A 80 29.134 -2.431 -60.021 1.00 75.11 C ATOM 1160 C LEU A 80 29.352 -1.500 -58.833 1.00 50.34 C ATOM 1161 O LEU A 80 28.845 -1.746 -57.739 1.00 15.20 O ATOM 1162 CB LEU A 80 30.097 -3.615 -59.940 1.00 60.12 C ATOM 1163 CG LEU A 80 29.724 -4.717 -58.948 1.00 60.43 C ATOM 1164 CD1 LEU A 80 28.612 -5.589 -59.511 1.00 33.10 C ATOM 1165 CD2 LEU A 80 30.943 -5.562 -58.605 1.00 12.13 C ATOM 0 H LEU A 80 30.027 -2.117 -61.894 1.00 32.24 H new ATOM 0 HA LEU A 80 28.109 -2.801 -59.985 1.00 75.11 H new ATOM 0 HB2 LEU A 80 30.179 -4.059 -60.932 1.00 60.12 H new ATOM 0 HB3 LEU A 80 31.085 -3.237 -59.677 1.00 60.12 H new ATOM 0 HG LEU A 80 29.362 -4.247 -58.033 1.00 60.43 H new ATOM 0 HD11 LEU A 80 28.360 -6.368 -58.791 1.00 33.10 H new ATOM 0 HD12 LEU A 80 27.732 -4.976 -59.705 1.00 33.10 H new ATOM 0 HD13 LEU A 80 28.946 -6.049 -60.441 1.00 33.10 H new ATOM 0 HD21 LEU A 80 30.658 -6.341 -57.898 1.00 12.13 H new ATOM 0 HD22 LEU A 80 31.334 -6.021 -59.513 1.00 12.13 H new ATOM 0 HD23 LEU A 80 31.710 -4.929 -58.159 1.00 12.13 H new ATOM 1176 N GLN A 81 30.109 -0.431 -59.057 1.00 52.13 N ATOM 1177 CA GLN A 81 30.394 0.537 -58.005 1.00 53.42 C ATOM 1178 C GLN A 81 29.106 1.009 -57.335 1.00 63.13 C ATOM 1179 O GLN A 81 28.892 0.774 -56.146 1.00 60.10 O ATOM 1180 CB GLN A 81 31.153 1.736 -58.577 1.00 31.43 C ATOM 1181 CG GLN A 81 32.264 2.242 -57.670 1.00 14.12 C ATOM 1182 CD GLN A 81 33.584 1.540 -57.918 1.00 25.15 C ATOM 1183 OE1 GLN A 81 34.042 0.747 -57.094 1.00 42.42 O ATOM 1184 NE2 GLN A 81 34.204 1.827 -59.056 1.00 32.12 N ATOM 0 H GLN A 81 30.536 -0.213 -59.957 1.00 52.13 H new ATOM 0 HA GLN A 81 31.015 0.047 -57.255 1.00 53.42 H new ATOM 0 HB2 GLN A 81 31.580 1.459 -59.541 1.00 31.43 H new ATOM 0 HB3 GLN A 81 30.448 2.547 -58.762 1.00 31.43 H new ATOM 0 HG2 GLN A 81 32.392 3.314 -57.822 1.00 14.12 H new ATOM 0 HG3 GLN A 81 31.971 2.101 -56.630 1.00 14.12 H new ATOM 0 HE21 GLN A 81 33.788 2.490 -59.710 1.00 32.12 H new ATOM 0 HE22 GLN A 81 35.096 1.384 -59.276 1.00 32.12 H new ATOM 1191 N ARG A 82 28.253 1.673 -58.108 1.00 11.12 N ATOM 1192 CA ARG A 82 26.988 2.178 -57.589 1.00 72.24 C ATOM 1193 C ARG A 82 26.066 1.029 -57.190 1.00 22.32 C ATOM 1194 O ARG A 82 25.178 1.194 -56.352 1.00 74.24 O ATOM 1195 CB ARG A 82 26.299 3.059 -58.634 1.00 1.21 C ATOM 1196 CG ARG A 82 26.125 4.503 -58.193 1.00 74.42 C ATOM 1197 CD ARG A 82 25.146 5.244 -59.090 1.00 33.32 C ATOM 1198 NE ARG A 82 23.764 5.082 -58.644 1.00 11.14 N ATOM 1199 CZ ARG A 82 22.709 5.388 -59.391 1.00 44.14 C ATOM 1200 NH1 ARG A 82 22.878 5.869 -60.616 1.00 2.24 N ATOM 1201 NH2 ARG A 82 21.483 5.213 -58.915 1.00 4.21 N ATOM 0 H ARG A 82 28.415 1.874 -59.095 1.00 11.12 H new ATOM 0 HA ARG A 82 27.201 2.775 -56.702 1.00 72.24 H new ATOM 0 HB2 ARG A 82 26.880 3.037 -59.556 1.00 1.21 H new ATOM 0 HB3 ARG A 82 25.320 2.638 -58.864 1.00 1.21 H new ATOM 0 HG2 ARG A 82 25.769 4.530 -57.163 1.00 74.42 H new ATOM 0 HG3 ARG A 82 27.090 5.009 -58.210 1.00 74.42 H new ATOM 0 HD2 ARG A 82 25.400 6.304 -59.106 1.00 33.32 H new ATOM 0 HD3 ARG A 82 25.242 4.878 -60.112 1.00 33.32 H new ATOM 0 HE ARG A 82 23.600 4.714 -57.707 1.00 11.14 H new ATOM 0 HH11 ARG A 82 23.819 6.004 -60.985 1.00 2.24 H new ATOM 0 HH12 ARG A 82 22.067 6.103 -61.188 1.00 2.24 H new ATOM 0 HH21 ARG A 82 21.349 4.843 -57.974 1.00 4.21 H new ATOM 0 HH22 ARG A 82 20.674 5.449 -59.490 1.00 4.21 H new ATOM 1212 N CYS A 83 26.284 -0.134 -57.795 1.00 1.14 N ATOM 1213 CA CYS A 83 25.472 -1.310 -57.503 1.00 41.31 C ATOM 1214 C CYS A 83 25.702 -1.789 -56.074 1.00 31.12 C ATOM 1215 O CYS A 83 24.776 -1.820 -55.264 1.00 21.14 O ATOM 1216 CB CYS A 83 25.794 -2.435 -58.489 1.00 5.34 C ATOM 1217 SG CYS A 83 25.363 -2.060 -60.204 1.00 21.15 S ATOM 0 H CYS A 83 27.015 -0.287 -58.490 1.00 1.14 H new ATOM 0 HA CYS A 83 24.423 -1.032 -57.609 1.00 41.31 H new ATOM 0 HB2 CYS A 83 26.860 -2.658 -58.434 1.00 5.34 H new ATOM 0 HB3 CYS A 83 25.264 -3.336 -58.181 1.00 5.34 H new ATOM 0 HG CYS A 83 26.258 -1.267 -60.713 1.00 21.15 H new ATOM 1222 N GLU A 84 26.942 -2.162 -55.772 1.00 54.20 N ATOM 1223 CA GLU A 84 27.292 -2.642 -54.439 1.00 74.05 C ATOM 1224 C GLU A 84 26.873 -1.636 -53.371 1.00 54.53 C ATOM 1225 O GLU A 84 26.595 -2.004 -52.231 1.00 4.35 O ATOM 1226 CB GLU A 84 28.796 -2.904 -54.347 1.00 5.41 C ATOM 1227 CG GLU A 84 29.290 -3.120 -52.926 1.00 51.13 C ATOM 1228 CD GLU A 84 30.411 -4.138 -52.847 1.00 75.13 C ATOM 1229 OE1 GLU A 84 30.155 -5.328 -53.128 1.00 34.22 O ATOM 1230 OE2 GLU A 84 31.545 -3.744 -52.504 1.00 45.42 O ATOM 0 H GLU A 84 27.720 -2.141 -56.431 1.00 54.20 H new ATOM 0 HA GLU A 84 26.756 -3.575 -54.264 1.00 74.05 H new ATOM 0 HB2 GLU A 84 29.041 -3.782 -54.945 1.00 5.41 H new ATOM 0 HB3 GLU A 84 29.331 -2.061 -54.784 1.00 5.41 H new ATOM 0 HG2 GLU A 84 29.637 -2.171 -52.518 1.00 51.13 H new ATOM 0 HG3 GLU A 84 28.459 -3.451 -52.303 1.00 51.13 H new ATOM 1235 N ASP A 85 26.831 -0.363 -53.750 1.00 53.32 N ATOM 1236 CA ASP A 85 26.447 0.698 -52.826 1.00 73.51 C ATOM 1237 C ASP A 85 24.929 0.827 -52.749 1.00 24.45 C ATOM 1238 O ASP A 85 24.381 1.219 -51.717 1.00 70.35 O ATOM 1239 CB ASP A 85 27.062 2.030 -53.260 1.00 63.54 C ATOM 1240 CG ASP A 85 26.664 3.175 -52.351 1.00 34.23 C ATOM 1241 OD1 ASP A 85 26.781 3.021 -51.116 1.00 35.12 O ATOM 1242 OD2 ASP A 85 26.236 4.226 -52.873 1.00 5.05 O ATOM 0 H ASP A 85 27.058 -0.041 -54.691 1.00 53.32 H new ATOM 0 HA ASP A 85 26.824 0.438 -51.837 1.00 73.51 H new ATOM 0 HB2 ASP A 85 28.148 1.939 -53.270 1.00 63.54 H new ATOM 0 HB3 ASP A 85 26.751 2.255 -54.280 1.00 63.54 H new ATOM 1246 N ASP A 86 24.255 0.494 -53.844 1.00 22.02 N ATOM 1247 CA ASP A 86 22.800 0.572 -53.900 1.00 24.04 C ATOM 1248 C ASP A 86 22.165 -0.676 -53.294 1.00 65.43 C ATOM 1249 O ASP A 86 20.997 -0.666 -52.904 1.00 74.00 O ATOM 1250 CB ASP A 86 22.332 0.748 -55.345 1.00 10.03 C ATOM 1251 CG ASP A 86 20.831 0.938 -55.449 1.00 2.11 C ATOM 1252 OD1 ASP A 86 20.306 1.871 -54.807 1.00 32.11 O ATOM 1253 OD2 ASP A 86 20.183 0.154 -56.173 1.00 23.43 O ATOM 0 H ASP A 86 24.693 0.167 -54.705 1.00 22.02 H new ATOM 0 HA ASP A 86 22.485 1.437 -53.317 1.00 24.04 H new ATOM 0 HB2 ASP A 86 22.836 1.609 -55.784 1.00 10.03 H new ATOM 0 HB3 ASP A 86 22.626 -0.125 -55.928 1.00 10.03 H new ATOM 1257 N LEU A 87 22.942 -1.752 -53.220 1.00 60.01 N ATOM 1258 CA LEU A 87 22.455 -3.010 -52.664 1.00 45.22 C ATOM 1259 C LEU A 87 22.544 -3.002 -51.141 1.00 31.20 C ATOM 1260 O LEU A 87 21.651 -3.500 -50.456 1.00 12.35 O ATOM 1261 CB LEU A 87 23.259 -4.183 -53.226 1.00 45.23 C ATOM 1262 CG LEU A 87 22.774 -5.579 -52.833 1.00 4.40 C ATOM 1263 CD1 LEU A 87 22.131 -6.276 -54.021 1.00 34.44 C ATOM 1264 CD2 LEU A 87 23.927 -6.409 -52.285 1.00 61.34 C ATOM 0 H LEU A 87 23.911 -1.778 -53.538 1.00 60.01 H new ATOM 0 HA LEU A 87 21.409 -3.124 -52.949 1.00 45.22 H new ATOM 0 HB2 LEU A 87 23.255 -4.112 -54.314 1.00 45.23 H new ATOM 0 HB3 LEU A 87 24.294 -4.076 -52.903 1.00 45.23 H new ATOM 0 HG LEU A 87 22.023 -5.474 -52.050 1.00 4.40 H new ATOM 0 HD11 LEU A 87 21.792 -7.268 -53.721 1.00 34.44 H new ATOM 0 HD12 LEU A 87 21.279 -5.691 -54.369 1.00 34.44 H new ATOM 0 HD13 LEU A 87 22.860 -6.369 -54.826 1.00 34.44 H new ATOM 0 HD21 LEU A 87 23.564 -7.399 -52.010 1.00 61.34 H new ATOM 0 HD22 LEU A 87 24.701 -6.505 -53.047 1.00 61.34 H new ATOM 0 HD23 LEU A 87 24.343 -5.918 -51.405 1.00 61.34 H new ATOM 1275 N ARG A 88 23.625 -2.431 -50.620 1.00 32.55 N ATOM 1276 CA ARG A 88 23.828 -2.357 -49.178 1.00 44.40 C ATOM 1277 C ARG A 88 23.088 -1.162 -48.585 1.00 4.52 C ATOM 1278 O ARG A 88 22.794 -1.132 -47.390 1.00 63.13 O ATOM 1279 CB ARG A 88 25.321 -2.257 -48.857 1.00 4.12 C ATOM 1280 CG ARG A 88 25.687 -2.797 -47.484 1.00 30.31 C ATOM 1281 CD ARG A 88 26.439 -4.116 -47.587 1.00 34.45 C ATOM 1282 NE ARG A 88 27.836 -3.921 -47.964 1.00 1.41 N ATOM 1283 CZ ARG A 88 28.657 -4.917 -48.280 1.00 15.11 C ATOM 1284 NH1 ARG A 88 28.222 -6.169 -48.264 1.00 44.33 N ATOM 1285 NH2 ARG A 88 29.916 -4.659 -48.613 1.00 1.01 N ATOM 0 H ARG A 88 24.373 -2.013 -51.174 1.00 32.55 H new ATOM 0 HA ARG A 88 23.427 -3.267 -48.732 1.00 44.40 H new ATOM 0 HB2 ARG A 88 25.884 -2.802 -49.614 1.00 4.12 H new ATOM 0 HB3 ARG A 88 25.629 -1.213 -48.921 1.00 4.12 H new ATOM 0 HG2 ARG A 88 26.301 -2.067 -46.956 1.00 30.31 H new ATOM 0 HG3 ARG A 88 24.781 -2.938 -46.894 1.00 30.31 H new ATOM 0 HD2 ARG A 88 26.391 -4.636 -46.630 1.00 34.45 H new ATOM 0 HD3 ARG A 88 25.951 -4.755 -48.323 1.00 34.45 H new ATOM 0 HE ARG A 88 28.201 -2.969 -47.986 1.00 1.41 H new ATOM 0 HH11 ARG A 88 27.255 -6.370 -48.009 1.00 44.33 H new ATOM 0 HH12 ARG A 88 28.854 -6.932 -48.507 1.00 44.33 H new ATOM 0 HH21 ARG A 88 30.253 -3.696 -48.626 1.00 1.01 H new ATOM 0 HH22 ARG A 88 30.546 -5.423 -48.856 1.00 1.01 H new ATOM 1359 N ASP A 94 23.188 5.403 -43.078 1.00 23.52 N ATOM 1360 CA ASP A 94 23.386 6.770 -43.546 1.00 32.35 C ATOM 1361 C ASP A 94 24.192 6.790 -44.839 1.00 40.54 C ATOM 1362 O ASP A 94 23.676 7.140 -45.899 1.00 73.04 O ATOM 1363 CB ASP A 94 24.094 7.600 -42.475 1.00 3.44 C ATOM 1364 CG ASP A 94 24.806 8.806 -43.054 1.00 52.53 C ATOM 1365 OD1 ASP A 94 24.120 9.690 -43.610 1.00 73.35 O ATOM 1366 OD2 ASP A 94 26.048 8.869 -42.950 1.00 64.13 O ATOM 0 HA ASP A 94 22.407 7.206 -43.744 1.00 32.35 H new ATOM 0 HB2 ASP A 94 23.365 7.932 -41.736 1.00 3.44 H new ATOM 0 HB3 ASP A 94 24.815 6.973 -41.951 1.00 3.44 H new ATOM 1370 N ALA A 95 25.465 6.414 -44.744 1.00 74.53 N ATOM 1371 CA ALA A 95 26.343 6.389 -45.907 1.00 20.43 C ATOM 1372 C ALA A 95 27.719 5.841 -45.544 1.00 10.14 C ATOM 1373 O ALA A 95 27.959 5.450 -44.401 1.00 53.03 O ATOM 1374 CB ALA A 95 26.467 7.782 -46.505 1.00 41.42 C ATOM 0 H ALA A 95 25.910 6.123 -43.873 1.00 74.53 H new ATOM 0 HA ALA A 95 25.902 5.725 -46.651 1.00 20.43 H new ATOM 0 HB1 ALA A 95 27.126 7.748 -47.373 1.00 41.42 H new ATOM 0 HB2 ALA A 95 25.482 8.136 -46.810 1.00 41.42 H new ATOM 0 HB3 ALA A 95 26.882 8.462 -45.761 1.00 41.42 H new ATOM 1380 N GLN A 96 28.618 5.815 -46.523 1.00 34.15 N ATOM 1381 CA GLN A 96 29.969 5.313 -46.305 1.00 14.41 C ATOM 1382 C GLN A 96 30.916 6.448 -45.929 1.00 52.54 C ATOM 1383 O GLN A 96 30.760 7.579 -46.389 1.00 54.32 O ATOM 1384 CB GLN A 96 30.480 4.601 -47.558 1.00 23.50 C ATOM 1385 CG GLN A 96 30.664 5.524 -48.751 1.00 1.11 C ATOM 1386 CD GLN A 96 29.398 5.680 -49.570 1.00 33.32 C ATOM 1387 OE1 GLN A 96 28.920 4.726 -50.183 1.00 51.11 O ATOM 1388 NE2 GLN A 96 28.846 6.888 -49.582 1.00 53.11 N ATOM 0 H GLN A 96 28.435 6.135 -47.474 1.00 34.15 H new ATOM 0 HA GLN A 96 29.937 4.602 -45.480 1.00 14.41 H new ATOM 0 HB2 GLN A 96 31.432 4.121 -47.330 1.00 23.50 H new ATOM 0 HB3 GLN A 96 29.780 3.809 -47.826 1.00 23.50 H new ATOM 0 HG2 GLN A 96 30.988 6.504 -48.401 1.00 1.11 H new ATOM 0 HG3 GLN A 96 31.458 5.134 -49.388 1.00 1.11 H new ATOM 0 HE21 GLN A 96 29.276 7.651 -49.059 1.00 53.11 H new ATOM 0 HE22 GLN A 96 27.992 7.053 -50.114 1.00 53.11 H new ATOM 1395 N VAL A 97 31.900 6.139 -45.091 1.00 22.43 N ATOM 1396 CA VAL A 97 32.874 7.132 -44.653 1.00 50.24 C ATOM 1397 C VAL A 97 34.285 6.744 -45.082 1.00 22.12 C ATOM 1398 O VAL A 97 34.641 5.565 -45.089 1.00 34.30 O ATOM 1399 CB VAL A 97 32.845 7.312 -43.125 1.00 11.45 C ATOM 1400 CG1 VAL A 97 32.966 5.967 -42.426 1.00 34.33 C ATOM 1401 CG2 VAL A 97 33.952 8.255 -42.678 1.00 51.42 C ATOM 0 H VAL A 97 32.044 5.208 -44.701 1.00 22.43 H new ATOM 0 HA VAL A 97 32.599 8.075 -45.127 1.00 50.24 H new ATOM 0 HB VAL A 97 31.888 7.754 -42.848 1.00 11.45 H new ATOM 0 HG11 VAL A 97 32.944 6.115 -41.346 1.00 34.33 H new ATOM 0 HG12 VAL A 97 32.135 5.327 -42.722 1.00 34.33 H new ATOM 0 HG13 VAL A 97 33.907 5.494 -42.708 1.00 34.33 H new ATOM 0 HG21 VAL A 97 33.916 8.370 -41.595 1.00 51.42 H new ATOM 0 HG22 VAL A 97 34.919 7.844 -42.967 1.00 51.42 H new ATOM 0 HG23 VAL A 97 33.815 9.227 -43.151 1.00 51.42 H new ATOM 1411 N TYR A 98 35.085 7.742 -45.438 1.00 12.03 N ATOM 1412 CA TYR A 98 36.458 7.506 -45.868 1.00 73.14 C ATOM 1413 C TYR A 98 37.402 7.451 -44.673 1.00 4.45 C ATOM 1414 O TYR A 98 37.409 8.349 -43.829 1.00 53.53 O ATOM 1415 CB TYR A 98 36.905 8.601 -46.837 1.00 41.34 C ATOM 1416 CG TYR A 98 36.192 8.561 -48.169 1.00 70.04 C ATOM 1417 CD1 TYR A 98 36.172 7.402 -48.935 1.00 43.34 C ATOM 1418 CD2 TYR A 98 35.534 9.683 -48.663 1.00 5.43 C ATOM 1419 CE1 TYR A 98 35.522 7.362 -50.153 1.00 64.34 C ATOM 1420 CE2 TYR A 98 34.880 9.650 -49.879 1.00 1.41 C ATOM 1421 CZ TYR A 98 34.877 8.488 -50.621 1.00 4.31 C ATOM 1422 OH TYR A 98 34.227 8.451 -51.833 1.00 21.25 O ATOM 0 H TYR A 98 34.806 8.723 -45.437 1.00 12.03 H new ATOM 0 HA TYR A 98 36.492 6.543 -46.377 1.00 73.14 H new ATOM 0 HB2 TYR A 98 36.738 9.574 -46.374 1.00 41.34 H new ATOM 0 HB3 TYR A 98 37.978 8.509 -47.006 1.00 41.34 H new ATOM 0 HD1 TYR A 98 36.673 6.517 -48.572 1.00 43.34 H new ATOM 0 HD2 TYR A 98 35.535 10.596 -48.085 1.00 5.43 H new ATOM 0 HE1 TYR A 98 35.519 6.453 -50.736 1.00 64.34 H new ATOM 0 HE2 TYR A 98 34.373 10.530 -50.247 1.00 1.41 H new ATOM 0 HH TYR A 98 33.824 9.326 -52.015 1.00 21.25 H new ATOM 1431 N LEU A 99 38.201 6.391 -44.606 1.00 0.41 N ATOM 1432 CA LEU A 99 39.152 6.218 -43.514 1.00 2.11 C ATOM 1433 C LEU A 99 40.011 7.465 -43.336 1.00 12.42 C ATOM 1434 O LEU A 99 40.518 7.731 -42.247 1.00 34.54 O ATOM 1435 CB LEU A 99 40.046 5.004 -43.778 1.00 70.53 C ATOM 1436 CG LEU A 99 39.707 3.737 -42.991 1.00 11.41 C ATOM 1437 CD1 LEU A 99 40.090 3.900 -41.529 1.00 4.24 C ATOM 1438 CD2 LEU A 99 38.227 3.408 -43.123 1.00 23.32 C ATOM 0 H LEU A 99 38.209 5.639 -45.295 1.00 0.41 H new ATOM 0 HA LEU A 99 38.587 6.054 -42.596 1.00 2.11 H new ATOM 0 HB2 LEU A 99 40.002 4.770 -44.842 1.00 70.53 H new ATOM 0 HB3 LEU A 99 41.076 5.281 -43.555 1.00 70.53 H new ATOM 0 HG LEU A 99 40.281 2.909 -43.406 1.00 11.41 H new ATOM 0 HD11 LEU A 99 39.842 2.989 -40.984 1.00 4.24 H new ATOM 0 HD12 LEU A 99 41.161 4.088 -41.452 1.00 4.24 H new ATOM 0 HD13 LEU A 99 39.542 4.740 -41.101 1.00 4.24 H new ATOM 0 HD21 LEU A 99 38.003 2.504 -42.557 1.00 23.32 H new ATOM 0 HD22 LEU A 99 37.634 4.236 -42.734 1.00 23.32 H new ATOM 0 HD23 LEU A 99 37.982 3.249 -44.173 1.00 23.32 H new ATOM 1449 N GLU A 100 40.167 8.229 -44.413 1.00 0.50 N ATOM 1450 CA GLU A 100 40.963 9.450 -44.374 1.00 72.44 C ATOM 1451 C GLU A 100 40.523 10.349 -43.222 1.00 55.54 C ATOM 1452 O GLU A 100 41.315 11.128 -42.693 1.00 50.54 O ATOM 1453 CB GLU A 100 40.844 10.205 -45.700 1.00 41.42 C ATOM 1454 CG GLU A 100 41.960 11.210 -45.930 1.00 11.41 C ATOM 1455 CD GLU A 100 43.282 10.547 -46.267 1.00 41.31 C ATOM 1456 OE1 GLU A 100 43.272 9.564 -47.036 1.00 65.41 O ATOM 1457 OE2 GLU A 100 44.325 11.011 -45.761 1.00 53.43 O ATOM 0 H GLU A 100 39.753 8.024 -45.322 1.00 0.50 H new ATOM 0 HA GLU A 100 42.005 9.170 -44.216 1.00 72.44 H new ATOM 0 HB2 GLU A 100 40.840 9.486 -46.519 1.00 41.42 H new ATOM 0 HB3 GLU A 100 39.887 10.725 -45.728 1.00 41.42 H new ATOM 0 HG2 GLU A 100 41.678 11.882 -46.741 1.00 11.41 H new ATOM 0 HG3 GLU A 100 42.082 11.822 -45.037 1.00 11.41 H new ATOM 1462 N GLU A 101 39.255 10.236 -42.841 1.00 64.25 N ATOM 1463 CA GLU A 101 38.710 11.040 -41.753 1.00 72.43 C ATOM 1464 C GLU A 101 39.001 10.394 -40.402 1.00 12.05 C ATOM 1465 O GLU A 101 39.287 11.083 -39.423 1.00 45.43 O ATOM 1466 CB GLU A 101 37.201 11.221 -41.931 1.00 41.03 C ATOM 1467 CG GLU A 101 36.643 12.430 -41.199 1.00 41.31 C ATOM 1468 CD GLU A 101 35.192 12.251 -40.798 1.00 35.11 C ATOM 1469 OE1 GLU A 101 34.312 12.415 -41.669 1.00 63.54 O ATOM 1470 OE2 GLU A 101 34.935 11.948 -39.614 1.00 61.14 O ATOM 0 H GLU A 101 38.586 9.596 -43.269 1.00 64.25 H new ATOM 0 HA GLU A 101 39.191 12.018 -41.780 1.00 72.43 H new ATOM 0 HB2 GLU A 101 36.978 11.315 -42.994 1.00 41.03 H new ATOM 0 HB3 GLU A 101 36.692 10.325 -41.576 1.00 41.03 H new ATOM 0 HG2 GLU A 101 37.242 12.619 -40.308 1.00 41.31 H new ATOM 0 HG3 GLU A 101 36.734 13.310 -41.836 1.00 41.31 H new ATOM 1475 N MET A 102 38.923 9.069 -40.356 1.00 62.34 N ATOM 1476 CA MET A 102 39.178 8.330 -39.126 1.00 24.15 C ATOM 1477 C MET A 102 40.622 8.513 -38.671 1.00 13.05 C ATOM 1478 O MET A 102 41.542 7.933 -39.247 1.00 52.13 O ATOM 1479 CB MET A 102 38.879 6.843 -39.326 1.00 62.31 C ATOM 1480 CG MET A 102 37.562 6.579 -40.037 1.00 33.23 C ATOM 1481 SD MET A 102 37.148 4.824 -40.103 1.00 52.24 S ATOM 1482 CE MET A 102 35.619 4.873 -41.035 1.00 44.04 C ATOM 0 H MET A 102 38.685 8.484 -41.157 1.00 62.34 H new ATOM 0 HA MET A 102 38.519 8.724 -38.353 1.00 24.15 H new ATOM 0 HB2 MET A 102 39.689 6.392 -39.899 1.00 62.31 H new ATOM 0 HB3 MET A 102 38.863 6.350 -38.354 1.00 62.31 H new ATOM 0 HG2 MET A 102 36.764 7.118 -39.527 1.00 33.23 H new ATOM 0 HG3 MET A 102 37.616 6.974 -41.051 1.00 33.23 H new ATOM 0 HE1 MET A 102 34.882 4.225 -40.560 1.00 44.04 H new ATOM 0 HE2 MET A 102 35.241 5.895 -41.060 1.00 44.04 H new ATOM 0 HE3 MET A 102 35.802 4.529 -42.053 1.00 44.04 H new ATOM 1490 N SER A 103 40.814 9.323 -37.634 1.00 73.32 N ATOM 1491 CA SER A 103 42.146 9.586 -37.105 1.00 43.13 C ATOM 1492 C SER A 103 42.893 8.282 -36.843 1.00 40.30 C ATOM 1493 O SER A 103 42.443 7.441 -36.065 1.00 35.15 O ATOM 1494 CB SER A 103 42.055 10.404 -35.815 1.00 30.53 C ATOM 1495 OG SER A 103 42.196 11.788 -36.078 1.00 13.21 O ATOM 0 H SER A 103 40.063 9.808 -37.144 1.00 73.32 H new ATOM 0 HA SER A 103 42.699 10.158 -37.850 1.00 43.13 H new ATOM 0 HB2 SER A 103 41.097 10.219 -35.330 1.00 30.53 H new ATOM 0 HB3 SER A 103 42.831 10.082 -35.121 1.00 30.53 H new ATOM 0 HG SER A 103 42.132 12.289 -35.238 1.00 13.21 H new ATOM 1500 N TRP A 104 44.038 8.121 -37.497 1.00 14.32 N ATOM 1501 CA TRP A 104 44.849 6.920 -37.335 1.00 33.23 C ATOM 1502 C TRP A 104 45.844 7.084 -36.191 1.00 35.34 C ATOM 1503 O TRP A 104 46.463 8.137 -36.042 1.00 30.45 O ATOM 1504 CB TRP A 104 45.593 6.603 -38.632 1.00 43.15 C ATOM 1505 CG TRP A 104 46.848 7.404 -38.808 1.00 43.01 C ATOM 1506 CD1 TRP A 104 48.089 7.101 -38.322 1.00 20.45 C ATOM 1507 CD2 TRP A 104 46.984 8.640 -39.517 1.00 1.12 C ATOM 1508 NE1 TRP A 104 48.987 8.074 -38.686 1.00 72.32 N ATOM 1509 CE2 TRP A 104 48.334 9.029 -39.420 1.00 45.34 C ATOM 1510 CE3 TRP A 104 46.097 9.455 -40.225 1.00 12.51 C ATOM 1511 CZ2 TRP A 104 48.815 10.197 -40.005 1.00 41.44 C ATOM 1512 CZ3 TRP A 104 46.576 10.614 -40.804 1.00 52.41 C ATOM 1513 CH2 TRP A 104 47.925 10.977 -40.693 1.00 4.31 C ATOM 0 H TRP A 104 44.426 8.807 -38.144 1.00 14.32 H new ATOM 0 HA TRP A 104 44.182 6.092 -37.095 1.00 33.23 H new ATOM 0 HB2 TRP A 104 45.842 5.542 -38.649 1.00 43.15 H new ATOM 0 HB3 TRP A 104 44.930 6.789 -39.477 1.00 43.15 H new ATOM 0 HD1 TRP A 104 48.328 6.225 -37.737 1.00 20.45 H new ATOM 0 HE1 TRP A 104 49.979 8.084 -38.449 1.00 72.32 H new ATOM 0 HE3 TRP A 104 45.056 9.184 -40.318 1.00 12.51 H new ATOM 0 HZ2 TRP A 104 49.854 10.478 -39.919 1.00 41.44 H new ATOM 0 HZ3 TRP A 104 45.899 11.252 -41.352 1.00 52.41 H new ATOM 0 HH2 TRP A 104 48.269 11.889 -41.159 1.00 4.31 H new ATOM 1523 N ASN A 105 45.990 6.038 -35.385 1.00 63.34 N ATOM 1524 CA ASN A 105 46.910 6.066 -34.254 1.00 53.44 C ATOM 1525 C ASN A 105 48.057 5.082 -34.460 1.00 2.23 C ATOM 1526 O ASN A 105 47.840 3.875 -34.561 1.00 65.43 O ATOM 1527 CB ASN A 105 46.167 5.739 -32.957 1.00 64.41 C ATOM 1528 CG ASN A 105 47.106 5.578 -31.778 1.00 4.23 C ATOM 1529 OD1 ASN A 105 48.036 6.364 -31.599 1.00 12.25 O ATOM 1530 ND2 ASN A 105 46.868 4.554 -30.966 1.00 75.30 N ATOM 0 H ASN A 105 45.483 5.160 -35.494 1.00 63.34 H new ATOM 0 HA ASN A 105 47.327 7.071 -34.182 1.00 53.44 H new ATOM 0 HB2 ASN A 105 45.451 6.532 -32.742 1.00 64.41 H new ATOM 0 HB3 ASN A 105 45.595 4.821 -33.091 1.00 64.41 H new ATOM 0 HD21 ASN A 105 47.468 4.395 -30.156 1.00 75.30 H new ATOM 0 HD22 ASN A 105 46.086 3.927 -31.152 1.00 75.30 H new ATOM 1536 N GLU A 106 49.277 5.606 -34.518 1.00 13.32 N ATOM 1537 CA GLU A 106 50.458 4.772 -34.711 1.00 71.40 C ATOM 1538 C GLU A 106 50.808 4.020 -33.431 1.00 25.14 C ATOM 1539 O GLU A 106 51.574 3.057 -33.453 1.00 12.04 O ATOM 1540 CB GLU A 106 51.647 5.627 -35.155 1.00 11.24 C ATOM 1541 CG GLU A 106 51.912 6.817 -34.247 1.00 74.24 C ATOM 1542 CD GLU A 106 51.493 8.133 -34.874 1.00 73.14 C ATOM 1543 OE1 GLU A 106 50.278 8.422 -34.892 1.00 52.44 O ATOM 1544 OE2 GLU A 106 52.382 8.874 -35.347 1.00 32.14 O ATOM 0 H GLU A 106 49.474 6.603 -34.434 1.00 13.32 H new ATOM 0 HA GLU A 106 50.233 4.043 -35.490 1.00 71.40 H new ATOM 0 HB2 GLU A 106 52.540 5.002 -35.192 1.00 11.24 H new ATOM 0 HB3 GLU A 106 51.467 5.986 -36.168 1.00 11.24 H new ATOM 0 HG2 GLU A 106 51.376 6.679 -33.308 1.00 74.24 H new ATOM 0 HG3 GLU A 106 52.974 6.856 -34.005 1.00 74.24 H new ATOM 1549 N GLY A 107 50.241 4.467 -32.314 1.00 73.00 N ATOM 1550 CA GLY A 107 50.505 3.825 -31.039 1.00 61.12 C ATOM 1551 C GLY A 107 49.988 2.402 -30.989 1.00 23.53 C ATOM 1552 O GLY A 107 50.723 1.479 -30.637 1.00 12.12 O ATOM 0 H GLY A 107 49.604 5.262 -32.269 1.00 73.00 H new ATOM 0 HA2 GLY A 107 51.579 3.825 -30.851 1.00 61.12 H new ATOM 0 HA3 GLY A 107 50.042 4.405 -30.241 1.00 61.12 H new ATOM 1556 N ASP A 108 48.719 2.221 -31.339 1.00 55.12 N ATOM 1557 CA ASP A 108 48.103 0.900 -31.332 1.00 63.21 C ATOM 1558 C ASP A 108 47.677 0.490 -32.738 1.00 71.21 C ATOM 1559 O ASP A 108 47.020 -0.534 -32.926 1.00 33.01 O ATOM 1560 CB ASP A 108 46.895 0.881 -30.394 1.00 62.13 C ATOM 1561 CG ASP A 108 46.361 -0.519 -30.166 1.00 61.23 C ATOM 1562 OD1 ASP A 108 47.129 -1.376 -29.681 1.00 61.22 O ATOM 1563 OD2 ASP A 108 45.174 -0.758 -30.471 1.00 51.12 O ATOM 0 H ASP A 108 48.096 2.974 -31.631 1.00 55.12 H new ATOM 0 HA ASP A 108 48.843 0.185 -30.973 1.00 63.21 H new ATOM 0 HB2 ASP A 108 47.175 1.320 -29.437 1.00 62.13 H new ATOM 0 HB3 ASP A 108 46.105 1.505 -30.812 1.00 62.13 H new ATOM 1567 N HIS A 109 48.055 1.298 -33.724 1.00 43.52 N ATOM 1568 CA HIS A 109 47.712 1.020 -35.114 1.00 71.23 C ATOM 1569 C HIS A 109 46.215 0.765 -35.264 1.00 0.32 C ATOM 1570 O HIS A 109 45.793 -0.352 -35.558 1.00 70.55 O ATOM 1571 CB HIS A 109 48.500 -0.187 -35.626 1.00 21.13 C ATOM 1572 CG HIS A 109 48.690 -0.193 -37.111 1.00 1.22 C ATOM 1573 ND1 HIS A 109 49.210 -1.269 -37.799 1.00 22.02 N ATOM 1574 CD2 HIS A 109 48.424 0.753 -38.042 1.00 3.41 C ATOM 1575 CE1 HIS A 109 49.257 -0.984 -39.087 1.00 75.14 C ATOM 1576 NE2 HIS A 109 48.786 0.237 -39.261 1.00 74.15 N ATOM 0 H HIS A 109 48.599 2.150 -33.586 1.00 43.52 H new ATOM 0 HA HIS A 109 47.976 1.895 -35.708 1.00 71.23 H new ATOM 0 HB2 HIS A 109 49.477 -0.204 -35.143 1.00 21.13 H new ATOM 0 HB3 HIS A 109 47.983 -1.100 -35.331 1.00 21.13 H new ATOM 0 HD2 HIS A 109 48.005 1.732 -37.859 1.00 3.41 H new ATOM 0 HE1 HIS A 109 49.619 -1.638 -39.866 1.00 75.14 H new ATOM 0 HE2 HIS A 109 48.704 0.719 -40.156 1.00 74.15 H new ATOM 1583 N SER A 110 45.418 1.809 -35.057 1.00 44.55 N ATOM 1584 CA SER A 110 43.969 1.697 -35.164 1.00 15.42 C ATOM 1585 C SER A 110 43.346 3.041 -35.528 1.00 74.01 C ATOM 1586 O SER A 110 44.011 4.077 -35.492 1.00 53.23 O ATOM 1587 CB SER A 110 43.377 1.188 -33.848 1.00 51.02 C ATOM 1588 OG SER A 110 43.679 2.066 -32.779 1.00 40.44 O ATOM 0 H SER A 110 45.752 2.742 -34.814 1.00 44.55 H new ATOM 0 HA SER A 110 43.742 0.984 -35.956 1.00 15.42 H new ATOM 0 HB2 SER A 110 42.296 1.089 -33.946 1.00 51.02 H new ATOM 0 HB3 SER A 110 43.770 0.195 -33.629 1.00 51.02 H new ATOM 0 HG SER A 110 43.288 1.719 -31.950 1.00 40.44 H new ATOM 1593 N PHE A 111 42.064 3.016 -35.880 1.00 0.34 N ATOM 1594 CA PHE A 111 41.350 4.233 -36.251 1.00 64.22 C ATOM 1595 C PHE A 111 40.083 4.396 -35.417 1.00 52.21 C ATOM 1596 O PHE A 111 39.317 3.449 -35.239 1.00 42.14 O ATOM 1597 CB PHE A 111 40.994 4.204 -37.740 1.00 14.34 C ATOM 1598 CG PHE A 111 42.088 3.653 -38.608 1.00 22.15 C ATOM 1599 CD1 PHE A 111 43.131 4.462 -39.028 1.00 14.21 C ATOM 1600 CD2 PHE A 111 42.073 2.325 -39.004 1.00 11.11 C ATOM 1601 CE1 PHE A 111 44.140 3.957 -39.827 1.00 54.55 C ATOM 1602 CE2 PHE A 111 43.079 1.815 -39.802 1.00 64.10 C ATOM 1603 CZ PHE A 111 44.113 2.632 -40.215 1.00 44.45 C ATOM 0 H PHE A 111 41.499 2.168 -35.916 1.00 0.34 H new ATOM 0 HA PHE A 111 42.004 5.083 -36.056 1.00 64.22 H new ATOM 0 HB2 PHE A 111 40.095 3.604 -37.879 1.00 14.34 H new ATOM 0 HB3 PHE A 111 40.756 5.216 -38.068 1.00 14.34 H new ATOM 0 HD1 PHE A 111 43.156 5.499 -38.728 1.00 14.21 H new ATOM 0 HD2 PHE A 111 41.266 1.682 -38.685 1.00 11.11 H new ATOM 0 HE1 PHE A 111 44.948 4.598 -40.147 1.00 54.55 H new ATOM 0 HE2 PHE A 111 43.057 0.778 -40.103 1.00 64.10 H new ATOM 0 HZ PHE A 111 44.899 2.235 -40.840 1.00 44.45 H new ATOM 1612 N TYR A 112 39.871 5.604 -34.906 1.00 21.42 N ATOM 1613 CA TYR A 112 38.700 5.892 -34.086 1.00 75.13 C ATOM 1614 C TYR A 112 37.872 7.018 -34.697 1.00 72.24 C ATOM 1615 O TYR A 112 38.412 8.039 -35.129 1.00 20.44 O ATOM 1616 CB TYR A 112 39.125 6.269 -32.666 1.00 74.32 C ATOM 1617 CG TYR A 112 40.370 7.125 -32.615 1.00 23.25 C ATOM 1618 CD1 TYR A 112 40.324 8.474 -32.946 1.00 63.33 C ATOM 1619 CD2 TYR A 112 41.593 6.585 -32.234 1.00 32.23 C ATOM 1620 CE1 TYR A 112 41.460 9.259 -32.900 1.00 54.05 C ATOM 1621 CE2 TYR A 112 42.732 7.363 -32.184 1.00 44.42 C ATOM 1622 CZ TYR A 112 42.661 8.700 -32.518 1.00 64.15 C ATOM 1623 OH TYR A 112 43.795 9.478 -32.471 1.00 2.54 O ATOM 0 H TYR A 112 40.495 6.399 -35.045 1.00 21.42 H new ATOM 0 HA TYR A 112 38.085 4.993 -34.047 1.00 75.13 H new ATOM 0 HB2 TYR A 112 38.308 6.802 -32.180 1.00 74.32 H new ATOM 0 HB3 TYR A 112 39.297 5.358 -32.093 1.00 74.32 H new ATOM 0 HD1 TYR A 112 39.385 8.916 -33.244 1.00 63.33 H new ATOM 0 HD2 TYR A 112 41.653 5.539 -31.973 1.00 32.23 H new ATOM 0 HE1 TYR A 112 41.407 10.305 -33.162 1.00 54.05 H new ATOM 0 HE2 TYR A 112 43.674 6.928 -31.885 1.00 44.42 H new ATOM 0 HH TYR A 112 44.555 8.931 -32.182 1.00 2.54 H new ATOM 1632 N LEU A 113 36.557 6.827 -34.731 1.00 4.33 N ATOM 1633 CA LEU A 113 35.652 7.826 -35.288 1.00 25.43 C ATOM 1634 C LEU A 113 34.620 8.262 -34.254 1.00 41.01 C ATOM 1635 O LEU A 113 34.326 7.531 -33.308 1.00 71.54 O ATOM 1636 CB LEU A 113 34.947 7.269 -36.526 1.00 73.31 C ATOM 1637 CG LEU A 113 34.676 8.270 -37.650 1.00 60.30 C ATOM 1638 CD1 LEU A 113 35.950 9.010 -38.025 1.00 4.21 C ATOM 1639 CD2 LEU A 113 34.091 7.562 -38.865 1.00 24.23 C ATOM 0 H LEU A 113 36.094 5.989 -34.379 1.00 4.33 H new ATOM 0 HA LEU A 113 36.242 8.697 -35.574 1.00 25.43 H new ATOM 0 HB2 LEU A 113 35.551 6.456 -36.928 1.00 73.31 H new ATOM 0 HB3 LEU A 113 33.996 6.836 -36.215 1.00 73.31 H new ATOM 0 HG LEU A 113 33.949 8.999 -37.293 1.00 60.30 H new ATOM 0 HD11 LEU A 113 35.737 9.718 -38.826 1.00 4.21 H new ATOM 0 HD12 LEU A 113 36.327 9.549 -37.156 1.00 4.21 H new ATOM 0 HD13 LEU A 113 36.700 8.295 -38.362 1.00 4.21 H new ATOM 0 HD21 LEU A 113 33.904 8.289 -39.655 1.00 24.23 H new ATOM 0 HD22 LEU A 113 34.795 6.811 -39.222 1.00 24.23 H new ATOM 0 HD23 LEU A 113 33.154 7.079 -38.588 1.00 24.23 H new ATOM 1650 N SER A 114 34.072 9.459 -34.441 1.00 2.41 N ATOM 1651 CA SER A 114 33.073 9.994 -33.522 1.00 62.33 C ATOM 1652 C SER A 114 31.979 10.735 -34.283 1.00 52.30 C ATOM 1653 O SER A 114 32.261 11.582 -35.132 1.00 52.13 O ATOM 1654 CB SER A 114 33.731 10.932 -32.510 1.00 4.51 C ATOM 1655 OG SER A 114 34.587 11.861 -33.154 1.00 75.31 O ATOM 0 H SER A 114 34.303 10.076 -35.220 1.00 2.41 H new ATOM 0 HA SER A 114 32.619 9.158 -32.989 1.00 62.33 H new ATOM 0 HB2 SER A 114 32.962 11.467 -31.953 1.00 4.51 H new ATOM 0 HB3 SER A 114 34.301 10.349 -31.787 1.00 4.51 H new ATOM 0 HG SER A 114 34.127 12.247 -33.928 1.00 75.31 H new ATOM 1660 N CYS A 115 30.728 10.412 -33.973 1.00 2.34 N ATOM 1661 CA CYS A 115 29.589 11.046 -34.626 1.00 74.30 C ATOM 1662 C CYS A 115 29.583 12.550 -34.370 1.00 40.50 C ATOM 1663 O CYS A 115 30.235 13.036 -33.446 1.00 4.43 O ATOM 1664 CB CYS A 115 28.281 10.427 -34.129 1.00 13.01 C ATOM 1665 SG CYS A 115 26.858 10.713 -35.230 1.00 13.15 S ATOM 0 H CYS A 115 30.477 9.714 -33.273 1.00 2.34 H new ATOM 0 HA CYS A 115 29.678 10.879 -35.699 1.00 74.30 H new ATOM 0 HB2 CYS A 115 28.423 9.353 -34.008 1.00 13.01 H new ATOM 0 HB3 CYS A 115 28.051 10.832 -33.143 1.00 13.01 H new ATOM 0 HG CYS A 115 25.854 9.985 -34.840 1.00 13.15 H new ATOM 1669 N ARG A 116 28.841 13.282 -35.195 1.00 43.22 N ATOM 1670 CA ARG A 116 28.751 14.730 -35.058 1.00 53.25 C ATOM 1671 C ARG A 116 27.978 15.111 -33.800 1.00 15.02 C ATOM 1672 O ARG A 116 27.991 16.268 -33.376 1.00 31.45 O ATOM 1673 CB ARG A 116 28.075 15.339 -36.289 1.00 31.35 C ATOM 1674 CG ARG A 116 26.735 14.703 -36.624 1.00 3.15 C ATOM 1675 CD ARG A 116 25.614 15.731 -36.619 1.00 20.42 C ATOM 1676 NE ARG A 116 25.142 16.020 -35.268 1.00 64.02 N ATOM 1677 CZ ARG A 116 23.988 16.622 -35.006 1.00 20.23 C ATOM 1678 NH1 ARG A 116 23.192 16.997 -35.998 1.00 21.52 N ATOM 1679 NH2 ARG A 116 23.626 16.851 -33.750 1.00 4.41 N ATOM 0 H ARG A 116 28.294 12.896 -35.965 1.00 43.22 H new ATOM 0 HA ARG A 116 29.763 15.125 -34.974 1.00 53.25 H new ATOM 0 HB2 ARG A 116 27.930 16.406 -36.123 1.00 31.35 H new ATOM 0 HB3 ARG A 116 28.740 15.238 -37.146 1.00 31.35 H new ATOM 0 HG2 ARG A 116 26.791 14.229 -37.604 1.00 3.15 H new ATOM 0 HG3 ARG A 116 26.513 13.917 -35.902 1.00 3.15 H new ATOM 0 HD2 ARG A 116 25.965 16.652 -37.085 1.00 20.42 H new ATOM 0 HD3 ARG A 116 24.784 15.365 -37.222 1.00 20.42 H new ATOM 0 HE ARG A 116 25.731 15.744 -34.482 1.00 64.02 H new ATOM 0 HH11 ARG A 116 23.466 16.823 -36.965 1.00 21.52 H new ATOM 0 HH12 ARG A 116 22.306 17.459 -35.794 1.00 21.52 H new ATOM 0 HH21 ARG A 116 24.235 16.564 -32.983 1.00 4.41 H new ATOM 0 HH22 ARG A 116 22.739 17.314 -33.551 1.00 4.41 H new ATOM 1690 N CYS A 117 27.305 14.132 -33.206 1.00 61.41 N ATOM 1691 CA CYS A 117 26.525 14.363 -31.996 1.00 23.03 C ATOM 1692 C CYS A 117 27.384 14.168 -30.750 1.00 25.42 C ATOM 1693 O CYS A 117 27.315 14.954 -29.807 1.00 4.42 O ATOM 1694 CB CYS A 117 25.322 13.419 -31.952 1.00 73.32 C ATOM 1695 SG CYS A 117 25.763 11.652 -31.936 1.00 30.32 S ATOM 0 H CYS A 117 27.284 13.170 -33.543 1.00 61.41 H new ATOM 0 HA CYS A 117 26.170 15.393 -32.014 1.00 23.03 H new ATOM 0 HB2 CYS A 117 24.731 13.643 -31.064 1.00 73.32 H new ATOM 0 HB3 CYS A 117 24.687 13.616 -32.816 1.00 73.32 H new ATOM 0 HG CYS A 117 26.038 11.263 -33.145 1.00 30.32 H new ATOM 1699 N GLY A 118 28.193 13.113 -30.754 1.00 64.10 N ATOM 1700 CA GLY A 118 29.053 12.833 -29.620 1.00 45.13 C ATOM 1701 C GLY A 118 29.574 11.409 -29.624 1.00 23.33 C ATOM 1702 O GLY A 118 30.593 11.111 -29.003 1.00 13.03 O ATOM 0 H GLY A 118 28.268 12.447 -31.523 1.00 64.10 H new ATOM 0 HA2 GLY A 118 29.895 13.525 -29.627 1.00 45.13 H new ATOM 0 HA3 GLY A 118 28.502 13.012 -28.697 1.00 45.13 H new ATOM 1706 N GLY A 119 28.871 10.525 -30.327 1.00 12.42 N ATOM 1707 CA GLY A 119 29.283 9.135 -30.395 1.00 11.02 C ATOM 1708 C GLY A 119 30.769 8.982 -30.651 1.00 12.35 C ATOM 1709 O GLY A 119 31.420 9.904 -31.143 1.00 52.53 O ATOM 0 H GLY A 119 28.024 10.747 -30.850 1.00 12.42 H new ATOM 0 HA2 GLY A 119 29.025 8.637 -29.460 1.00 11.02 H new ATOM 0 HA3 GLY A 119 28.728 8.633 -31.187 1.00 11.02 H new ATOM 1713 N LYS A 120 31.309 7.816 -30.315 1.00 40.52 N ATOM 1714 CA LYS A 120 32.729 7.545 -30.510 1.00 73.41 C ATOM 1715 C LYS A 120 32.993 6.043 -30.561 1.00 51.15 C ATOM 1716 O LYS A 120 32.294 5.258 -29.920 1.00 73.01 O ATOM 1717 CB LYS A 120 33.550 8.180 -29.387 1.00 12.41 C ATOM 1718 CG LYS A 120 35.032 8.283 -29.700 1.00 42.45 C ATOM 1719 CD LYS A 120 35.824 8.778 -28.501 1.00 74.21 C ATOM 1720 CE LYS A 120 36.387 7.622 -27.689 1.00 72.32 C ATOM 1721 NZ LYS A 120 37.434 6.875 -28.441 1.00 53.11 N ATOM 0 H LYS A 120 30.785 7.043 -29.906 1.00 40.52 H new ATOM 0 HA LYS A 120 33.030 7.982 -31.462 1.00 73.41 H new ATOM 0 HB2 LYS A 120 33.160 9.177 -29.183 1.00 12.41 H new ATOM 0 HB3 LYS A 120 33.419 7.594 -28.477 1.00 12.41 H new ATOM 0 HG2 LYS A 120 35.408 7.307 -30.008 1.00 42.45 H new ATOM 0 HG3 LYS A 120 35.181 8.961 -30.540 1.00 42.45 H new ATOM 0 HD2 LYS A 120 36.639 9.416 -28.841 1.00 74.21 H new ATOM 0 HD3 LYS A 120 35.182 9.390 -27.868 1.00 74.21 H new ATOM 0 HE2 LYS A 120 36.810 8.003 -26.759 1.00 72.32 H new ATOM 0 HE3 LYS A 120 35.580 6.942 -27.417 1.00 72.32 H new ATOM 0 HZ1 LYS A 120 38.053 6.375 -27.771 1.00 53.11 H new ATOM 0 HZ2 LYS A 120 36.981 6.186 -29.075 1.00 53.11 H new ATOM 0 HZ3 LYS A 120 38.000 7.542 -29.003 1.00 53.11 H new ATOM 1731 N TYR A 121 34.006 5.651 -31.325 1.00 75.14 N ATOM 1732 CA TYR A 121 34.362 4.244 -31.460 1.00 50.15 C ATOM 1733 C TYR A 121 35.800 4.090 -31.948 1.00 25.50 C ATOM 1734 O TYR A 121 36.436 5.061 -32.357 1.00 11.12 O ATOM 1735 CB TYR A 121 33.406 3.545 -32.429 1.00 23.43 C ATOM 1736 CG TYR A 121 32.147 3.030 -31.770 1.00 20.43 C ATOM 1737 CD1 TYR A 121 32.198 2.012 -30.826 1.00 60.24 C ATOM 1738 CD2 TYR A 121 30.903 3.563 -32.092 1.00 3.52 C ATOM 1739 CE1 TYR A 121 31.050 1.538 -30.223 1.00 12.45 C ATOM 1740 CE2 TYR A 121 29.750 3.096 -31.491 1.00 54.50 C ATOM 1741 CZ TYR A 121 29.828 2.084 -30.559 1.00 2.53 C ATOM 1742 OH TYR A 121 28.682 1.616 -29.958 1.00 34.40 O ATOM 0 H TYR A 121 34.595 6.288 -31.861 1.00 75.14 H new ATOM 0 HA TYR A 121 34.279 3.779 -30.478 1.00 50.15 H new ATOM 0 HB2 TYR A 121 33.133 4.241 -33.222 1.00 23.43 H new ATOM 0 HB3 TYR A 121 33.926 2.712 -32.902 1.00 23.43 H new ATOM 0 HD1 TYR A 121 33.153 1.584 -30.559 1.00 60.24 H new ATOM 0 HD2 TYR A 121 30.838 4.355 -32.824 1.00 3.52 H new ATOM 0 HE1 TYR A 121 31.108 0.745 -29.493 1.00 12.45 H new ATOM 0 HE2 TYR A 121 28.792 3.522 -31.750 1.00 54.50 H new ATOM 0 HH TYR A 121 28.893 1.297 -29.056 1.00 34.40 H new ATOM 1751 N SER A 122 36.305 2.861 -31.901 1.00 73.43 N ATOM 1752 CA SER A 122 37.668 2.578 -32.335 1.00 0.35 C ATOM 1753 C SER A 122 37.775 1.169 -32.907 1.00 61.44 C ATOM 1754 O SER A 122 37.630 0.181 -32.187 1.00 21.14 O ATOM 1755 CB SER A 122 38.641 2.741 -31.166 1.00 12.24 C ATOM 1756 OG SER A 122 39.885 2.124 -31.448 1.00 5.21 O ATOM 0 H SER A 122 35.791 2.046 -31.567 1.00 73.43 H new ATOM 0 HA SER A 122 37.929 3.290 -33.118 1.00 0.35 H new ATOM 0 HB2 SER A 122 38.795 3.801 -30.962 1.00 12.24 H new ATOM 0 HB3 SER A 122 38.210 2.303 -30.266 1.00 12.24 H new ATOM 0 HG SER A 122 40.490 2.244 -30.686 1.00 5.21 H new ATOM 1761 N VAL A 123 38.029 1.083 -34.209 1.00 32.11 N ATOM 1762 CA VAL A 123 38.157 -0.206 -34.880 1.00 13.12 C ATOM 1763 C VAL A 123 39.587 -0.440 -35.352 1.00 23.43 C ATOM 1764 O VAL A 123 40.084 0.260 -36.234 1.00 11.32 O ATOM 1765 CB VAL A 123 37.206 -0.305 -36.089 1.00 25.15 C ATOM 1766 CG1 VAL A 123 37.386 0.892 -37.009 1.00 52.24 C ATOM 1767 CG2 VAL A 123 37.438 -1.607 -36.841 1.00 55.05 C ATOM 0 H VAL A 123 38.150 1.890 -34.820 1.00 32.11 H new ATOM 0 HA VAL A 123 37.889 -0.971 -34.151 1.00 13.12 H new ATOM 0 HB VAL A 123 36.179 -0.300 -35.725 1.00 25.15 H new ATOM 0 HG11 VAL A 123 36.706 0.805 -37.857 1.00 52.24 H new ATOM 0 HG12 VAL A 123 37.167 1.808 -36.461 1.00 52.24 H new ATOM 0 HG13 VAL A 123 38.414 0.922 -37.370 1.00 52.24 H new ATOM 0 HG21 VAL A 123 36.759 -1.662 -37.692 1.00 55.05 H new ATOM 0 HG22 VAL A 123 38.468 -1.644 -37.196 1.00 55.05 H new ATOM 0 HG23 VAL A 123 37.254 -2.450 -36.175 1.00 55.05 H new ATOM 1777 N SER A 124 40.245 -1.431 -34.758 1.00 10.01 N ATOM 1778 CA SER A 124 41.621 -1.757 -35.115 1.00 25.33 C ATOM 1779 C SER A 124 41.763 -1.936 -36.623 1.00 1.10 C ATOM 1780 O SER A 124 40.808 -2.300 -37.310 1.00 70.25 O ATOM 1781 CB SER A 124 42.069 -3.031 -34.394 1.00 54.14 C ATOM 1782 OG SER A 124 43.244 -2.801 -33.637 1.00 1.13 O ATOM 0 H SER A 124 39.847 -2.022 -34.028 1.00 10.01 H new ATOM 0 HA SER A 124 42.257 -0.929 -34.804 1.00 25.33 H new ATOM 0 HB2 SER A 124 41.272 -3.381 -33.738 1.00 54.14 H new ATOM 0 HB3 SER A 124 42.251 -3.821 -35.123 1.00 54.14 H new ATOM 0 HG SER A 124 43.509 -3.629 -33.185 1.00 1.13 H new ATOM 1787 N LYS A 125 42.962 -1.677 -37.133 1.00 52.22 N ATOM 1788 CA LYS A 125 43.233 -1.810 -38.560 1.00 4.34 C ATOM 1789 C LYS A 125 42.784 -3.174 -39.074 1.00 43.02 C ATOM 1790 O LYS A 125 42.190 -3.278 -40.147 1.00 12.31 O ATOM 1791 CB LYS A 125 44.726 -1.614 -38.837 1.00 21.22 C ATOM 1792 CG LYS A 125 45.110 -1.845 -40.288 1.00 13.41 C ATOM 1793 CD LYS A 125 46.153 -0.844 -40.754 1.00 71.12 C ATOM 1794 CE LYS A 125 45.940 -0.454 -42.209 1.00 10.34 C ATOM 1795 NZ LYS A 125 46.952 0.538 -42.671 1.00 20.41 N ATOM 0 H LYS A 125 43.763 -1.373 -36.579 1.00 52.22 H new ATOM 0 HA LYS A 125 42.668 -1.040 -39.085 1.00 4.34 H new ATOM 0 HB2 LYS A 125 45.010 -0.601 -38.551 1.00 21.22 H new ATOM 0 HB3 LYS A 125 45.297 -2.295 -38.206 1.00 21.22 H new ATOM 0 HG2 LYS A 125 45.497 -2.857 -40.406 1.00 13.41 H new ATOM 0 HG3 LYS A 125 44.223 -1.767 -40.917 1.00 13.41 H new ATOM 0 HD2 LYS A 125 46.110 0.047 -40.127 1.00 71.12 H new ATOM 0 HD3 LYS A 125 47.149 -1.271 -40.633 1.00 71.12 H new ATOM 0 HE2 LYS A 125 45.992 -1.345 -42.835 1.00 10.34 H new ATOM 0 HE3 LYS A 125 44.940 -0.037 -42.331 1.00 10.34 H new ATOM 0 HZ1 LYS A 125 46.773 0.778 -43.667 1.00 20.41 H new ATOM 0 HZ2 LYS A 125 46.886 1.398 -42.090 1.00 20.41 H new ATOM 0 HZ3 LYS A 125 47.905 0.131 -42.579 1.00 20.41 H new ATOM 1805 N ASP A 126 43.071 -4.216 -38.301 1.00 21.12 N ATOM 1806 CA ASP A 126 42.694 -5.574 -38.678 1.00 52.11 C ATOM 1807 C ASP A 126 41.274 -5.891 -38.220 1.00 14.23 C ATOM 1808 O ASP A 126 40.664 -6.854 -38.682 1.00 15.11 O ATOM 1809 CB ASP A 126 43.674 -6.583 -38.077 1.00 53.22 C ATOM 1810 CG ASP A 126 45.051 -6.497 -38.706 1.00 0.23 C ATOM 1811 OD1 ASP A 126 45.462 -5.380 -39.083 1.00 73.21 O ATOM 1812 OD2 ASP A 126 45.718 -7.546 -38.821 1.00 21.24 O ATOM 0 H ASP A 126 43.563 -4.147 -37.410 1.00 21.12 H new ATOM 0 HA ASP A 126 42.730 -5.646 -39.765 1.00 52.11 H new ATOM 0 HB2 ASP A 126 43.756 -6.410 -37.004 1.00 53.22 H new ATOM 0 HB3 ASP A 126 43.280 -7.591 -38.208 1.00 53.22 H new ATOM 1816 N GLU A 127 40.755 -5.072 -37.309 1.00 23.44 N ATOM 1817 CA GLU A 127 39.408 -5.268 -36.787 1.00 71.54 C ATOM 1818 C GLU A 127 38.362 -5.002 -37.867 1.00 41.50 C ATOM 1819 O GLU A 127 37.337 -5.679 -37.934 1.00 12.00 O ATOM 1820 CB GLU A 127 39.163 -4.350 -35.587 1.00 72.34 C ATOM 1821 CG GLU A 127 37.849 -4.619 -34.873 1.00 24.55 C ATOM 1822 CD GLU A 127 37.887 -5.887 -34.041 1.00 31.01 C ATOM 1823 OE1 GLU A 127 38.770 -5.995 -33.164 1.00 51.12 O ATOM 1824 OE2 GLU A 127 37.034 -6.771 -34.266 1.00 31.31 O ATOM 0 H GLU A 127 41.247 -4.268 -36.918 1.00 23.44 H new ATOM 0 HA GLU A 127 39.318 -6.306 -36.466 1.00 71.54 H new ATOM 0 HB2 GLU A 127 39.983 -4.466 -34.878 1.00 72.34 H new ATOM 0 HB3 GLU A 127 39.178 -3.314 -35.924 1.00 72.34 H new ATOM 0 HG2 GLU A 127 37.610 -3.773 -34.229 1.00 24.55 H new ATOM 0 HG3 GLU A 127 37.049 -4.695 -35.609 1.00 24.55 H new ATOM 1829 N ALA A 128 38.631 -4.009 -38.710 1.00 23.22 N ATOM 1830 CA ALA A 128 37.716 -3.654 -39.787 1.00 33.04 C ATOM 1831 C ALA A 128 37.404 -4.861 -40.664 1.00 45.43 C ATOM 1832 O ALA A 128 36.355 -4.921 -41.303 1.00 32.41 O ATOM 1833 CB ALA A 128 38.300 -2.526 -40.625 1.00 42.04 C ATOM 0 H ALA A 128 39.475 -3.437 -38.667 1.00 23.22 H new ATOM 0 HA ALA A 128 36.782 -3.314 -39.339 1.00 33.04 H new ATOM 0 HB1 ALA A 128 37.606 -2.271 -41.426 1.00 42.04 H new ATOM 0 HB2 ALA A 128 38.464 -1.652 -39.995 1.00 42.04 H new ATOM 0 HB3 ALA A 128 39.249 -2.846 -41.055 1.00 42.04 H new ATOM 1839 N GLU A 129 38.324 -5.821 -40.690 1.00 61.03 N ATOM 1840 CA GLU A 129 38.146 -7.026 -41.492 1.00 44.44 C ATOM 1841 C GLU A 129 36.931 -7.819 -41.020 1.00 44.34 C ATOM 1842 O GLU A 129 36.260 -8.476 -41.816 1.00 13.33 O ATOM 1843 CB GLU A 129 39.400 -7.902 -41.420 1.00 4.24 C ATOM 1844 CG GLU A 129 39.435 -9.001 -42.467 1.00 61.34 C ATOM 1845 CD GLU A 129 40.802 -9.643 -42.595 1.00 44.31 C ATOM 1846 OE1 GLU A 129 41.665 -9.067 -43.290 1.00 72.43 O ATOM 1847 OE2 GLU A 129 41.011 -10.721 -41.999 1.00 22.21 O ATOM 0 H GLU A 129 39.198 -5.788 -40.166 1.00 61.03 H new ATOM 0 HA GLU A 129 37.981 -6.723 -42.526 1.00 44.44 H new ATOM 0 HB2 GLU A 129 40.281 -7.271 -41.538 1.00 4.24 H new ATOM 0 HB3 GLU A 129 39.461 -8.353 -40.430 1.00 4.24 H new ATOM 0 HG2 GLU A 129 38.702 -9.765 -42.210 1.00 61.34 H new ATOM 0 HG3 GLU A 129 39.140 -8.588 -43.432 1.00 61.34 H new ATOM 1852 N GLU A 130 36.656 -7.752 -39.722 1.00 54.03 N ATOM 1853 CA GLU A 130 35.522 -8.464 -39.145 1.00 0.32 C ATOM 1854 C GLU A 130 34.259 -7.608 -39.194 1.00 22.34 C ATOM 1855 O GLU A 130 33.150 -8.126 -39.321 1.00 32.40 O ATOM 1856 CB GLU A 130 35.824 -8.863 -37.698 1.00 41.05 C ATOM 1857 CG GLU A 130 35.684 -10.353 -37.437 1.00 3.41 C ATOM 1858 CD GLU A 130 36.591 -10.837 -36.321 1.00 22.10 C ATOM 1859 OE1 GLU A 130 36.378 -10.423 -35.162 1.00 73.24 O ATOM 1860 OE2 GLU A 130 37.513 -11.629 -36.607 1.00 33.23 O ATOM 0 H GLU A 130 37.202 -7.213 -39.050 1.00 54.03 H new ATOM 0 HA GLU A 130 35.353 -9.364 -39.736 1.00 0.32 H new ATOM 0 HB2 GLU A 130 36.839 -8.552 -37.448 1.00 41.05 H new ATOM 0 HB3 GLU A 130 35.152 -8.321 -37.033 1.00 41.05 H new ATOM 0 HG2 GLU A 130 34.648 -10.578 -37.182 1.00 3.41 H new ATOM 0 HG3 GLU A 130 35.914 -10.901 -38.351 1.00 3.41 H new ATOM 1865 N VAL A 131 34.437 -6.296 -39.092 1.00 13.24 N ATOM 1866 CA VAL A 131 33.314 -5.367 -39.125 1.00 31.43 C ATOM 1867 C VAL A 131 33.548 -4.258 -40.144 1.00 14.43 C ATOM 1868 O VAL A 131 34.539 -3.531 -40.070 1.00 22.45 O ATOM 1869 CB VAL A 131 33.066 -4.736 -37.743 1.00 31.13 C ATOM 1870 CG1 VAL A 131 32.577 -5.785 -36.755 1.00 43.33 C ATOM 1871 CG2 VAL A 131 34.329 -4.058 -37.232 1.00 22.12 C ATOM 0 H VAL A 131 35.349 -5.851 -38.986 1.00 13.24 H new ATOM 0 HA VAL A 131 32.435 -5.943 -39.415 1.00 31.43 H new ATOM 0 HB VAL A 131 32.289 -3.978 -37.844 1.00 31.13 H new ATOM 0 HG11 VAL A 131 32.407 -5.319 -35.784 1.00 43.33 H new ATOM 0 HG12 VAL A 131 31.645 -6.219 -37.117 1.00 43.33 H new ATOM 0 HG13 VAL A 131 33.328 -6.569 -36.655 1.00 43.33 H new ATOM 0 HG21 VAL A 131 34.135 -3.617 -36.254 1.00 22.12 H new ATOM 0 HG22 VAL A 131 35.128 -4.794 -37.146 1.00 22.12 H new ATOM 0 HG23 VAL A 131 34.630 -3.276 -37.929 1.00 22.12 H new ATOM 1881 N SER A 132 32.628 -4.130 -41.095 1.00 31.23 N ATOM 1882 CA SER A 132 32.735 -3.111 -42.131 1.00 53.03 C ATOM 1883 C SER A 132 31.750 -1.974 -41.879 1.00 54.12 C ATOM 1884 O SER A 132 31.893 -0.879 -42.427 1.00 1.15 O ATOM 1885 CB SER A 132 32.481 -3.725 -43.509 1.00 52.15 C ATOM 1886 OG SER A 132 31.167 -3.444 -43.958 1.00 23.44 O ATOM 0 H SER A 132 31.800 -4.720 -41.169 1.00 31.23 H new ATOM 0 HA SER A 132 33.746 -2.705 -42.103 1.00 53.03 H new ATOM 0 HB2 SER A 132 33.205 -3.333 -44.224 1.00 52.15 H new ATOM 0 HB3 SER A 132 32.630 -4.804 -43.463 1.00 52.15 H new ATOM 0 HG SER A 132 31.030 -3.846 -44.841 1.00 23.44 H new ATOM 1891 N LEU A 133 30.749 -2.240 -41.047 1.00 42.44 N ATOM 1892 CA LEU A 133 29.738 -1.240 -40.721 1.00 70.25 C ATOM 1893 C LEU A 133 29.720 -0.953 -39.223 1.00 52.03 C ATOM 1894 O LEU A 133 29.807 -1.867 -38.404 1.00 63.34 O ATOM 1895 CB LEU A 133 28.357 -1.715 -41.178 1.00 4.32 C ATOM 1896 CG LEU A 133 27.714 -0.916 -42.311 1.00 31.21 C ATOM 1897 CD1 LEU A 133 27.649 0.561 -41.953 1.00 51.44 C ATOM 1898 CD2 LEU A 133 28.480 -1.119 -43.610 1.00 2.12 C ATOM 0 H LEU A 133 30.616 -3.140 -40.586 1.00 42.44 H new ATOM 0 HA LEU A 133 29.990 -0.319 -41.246 1.00 70.25 H new ATOM 0 HB2 LEU A 133 28.439 -2.755 -41.495 1.00 4.32 H new ATOM 0 HB3 LEU A 133 27.686 -1.695 -40.320 1.00 4.32 H new ATOM 0 HG LEU A 133 26.696 -1.279 -42.453 1.00 31.21 H new ATOM 0 HD11 LEU A 133 27.188 1.114 -42.772 1.00 51.44 H new ATOM 0 HD12 LEU A 133 27.055 0.690 -41.048 1.00 51.44 H new ATOM 0 HD13 LEU A 133 28.657 0.939 -41.782 1.00 51.44 H new ATOM 0 HD21 LEU A 133 28.007 -0.542 -44.405 1.00 2.12 H new ATOM 0 HD22 LEU A 133 29.509 -0.784 -43.482 1.00 2.12 H new ATOM 0 HD23 LEU A 133 28.473 -2.176 -43.875 1.00 2.12 H new ATOM 1909 N ILE A 134 29.605 0.324 -38.873 1.00 12.11 N ATOM 1910 CA ILE A 134 29.572 0.731 -37.474 1.00 0.11 C ATOM 1911 C ILE A 134 28.448 1.730 -37.218 1.00 74.31 C ATOM 1912 O ILE A 134 28.464 2.845 -37.739 1.00 62.43 O ATOM 1913 CB ILE A 134 30.910 1.359 -37.039 1.00 21.33 C ATOM 1914 CG1 ILE A 134 30.835 1.810 -35.578 1.00 73.20 C ATOM 1915 CG2 ILE A 134 31.264 2.530 -37.943 1.00 41.21 C ATOM 1916 CD1 ILE A 134 32.158 2.293 -35.027 1.00 11.13 C ATOM 0 H ILE A 134 29.533 1.094 -39.539 1.00 12.11 H new ATOM 0 HA ILE A 134 29.395 -0.170 -36.887 1.00 0.11 H new ATOM 0 HB ILE A 134 31.694 0.607 -37.128 1.00 21.33 H new ATOM 0 HG12 ILE A 134 30.100 2.610 -35.490 1.00 73.20 H new ATOM 0 HG13 ILE A 134 30.477 0.981 -34.968 1.00 73.20 H new ATOM 0 HG21 ILE A 134 32.212 2.963 -37.623 1.00 41.21 H new ATOM 0 HG22 ILE A 134 31.353 2.181 -38.972 1.00 41.21 H new ATOM 0 HG23 ILE A 134 30.481 3.286 -37.883 1.00 41.21 H new ATOM 0 HD11 ILE A 134 32.030 2.597 -33.988 1.00 11.13 H new ATOM 0 HD12 ILE A 134 32.891 1.488 -35.082 1.00 11.13 H new ATOM 0 HD13 ILE A 134 32.508 3.143 -35.613 1.00 11.13 H new ATOM 1927 N SER A 135 27.474 1.322 -36.411 1.00 2.41 N ATOM 1928 CA SER A 135 26.340 2.179 -36.087 1.00 0.41 C ATOM 1929 C SER A 135 26.654 3.063 -34.882 1.00 62.41 C ATOM 1930 O SER A 135 27.286 2.620 -33.923 1.00 33.54 O ATOM 1931 CB SER A 135 25.098 1.334 -35.804 1.00 22.41 C ATOM 1932 OG SER A 135 25.409 0.237 -34.962 1.00 1.03 O ATOM 0 H SER A 135 27.448 0.403 -35.969 1.00 2.41 H new ATOM 0 HA SER A 135 26.145 2.821 -36.946 1.00 0.41 H new ATOM 0 HB2 SER A 135 24.333 1.952 -35.334 1.00 22.41 H new ATOM 0 HB3 SER A 135 24.681 0.969 -36.743 1.00 22.41 H new ATOM 0 HG SER A 135 24.598 -0.287 -34.794 1.00 1.03 H new ATOM 1937 N CYS A 136 26.207 4.312 -34.941 1.00 72.43 N ATOM 1938 CA CYS A 136 26.439 5.258 -33.856 1.00 1.42 C ATOM 1939 C CYS A 136 25.553 4.939 -32.657 1.00 1.43 C ATOM 1940 O CYS A 136 24.333 4.840 -32.782 1.00 52.24 O ATOM 1941 CB CYS A 136 26.177 6.687 -34.333 1.00 14.33 C ATOM 1942 SG CYS A 136 26.267 7.932 -33.024 1.00 2.13 S ATOM 0 H CYS A 136 25.682 4.693 -35.728 1.00 72.43 H new ATOM 0 HA CYS A 136 27.481 5.171 -33.548 1.00 1.42 H new ATOM 0 HB2 CYS A 136 26.901 6.938 -35.108 1.00 14.33 H new ATOM 0 HB3 CYS A 136 25.190 6.730 -34.793 1.00 14.33 H new ATOM 0 HG CYS A 136 25.285 8.773 -33.157 1.00 2.13 H new ATOM 1946 N ASP A 137 26.176 4.777 -31.494 1.00 3.21 N ATOM 1947 CA ASP A 137 25.445 4.468 -30.271 1.00 74.21 C ATOM 1948 C ASP A 137 25.013 5.746 -29.558 1.00 3.01 C ATOM 1949 O ASP A 137 25.321 5.948 -28.382 1.00 60.32 O ATOM 1950 CB ASP A 137 26.305 3.614 -29.339 1.00 31.15 C ATOM 1951 CG ASP A 137 25.543 3.146 -28.114 1.00 62.54 C ATOM 1952 OD1 ASP A 137 24.307 2.989 -28.209 1.00 34.21 O ATOM 1953 OD2 ASP A 137 26.182 2.935 -27.063 1.00 75.12 O ATOM 0 H ASP A 137 27.186 4.855 -31.373 1.00 3.21 H new ATOM 0 HA ASP A 137 24.552 3.906 -30.543 1.00 74.21 H new ATOM 0 HB2 ASP A 137 26.677 2.747 -29.885 1.00 31.15 H new ATOM 0 HB3 ASP A 137 27.175 4.189 -29.024 1.00 31.15 H new ATOM 1957 N THR A 138 24.300 6.607 -30.276 1.00 42.13 N ATOM 1958 CA THR A 138 23.830 7.866 -29.714 1.00 12.11 C ATOM 1959 C THR A 138 22.522 8.304 -30.364 1.00 3.35 C ATOM 1960 O THR A 138 21.590 8.732 -29.681 1.00 43.12 O ATOM 1961 CB THR A 138 24.875 8.985 -29.886 1.00 62.22 C ATOM 1962 OG1 THR A 138 26.148 8.544 -29.402 1.00 10.12 O ATOM 1963 CG2 THR A 138 24.450 10.242 -29.141 1.00 45.30 C ATOM 0 H THR A 138 24.035 6.455 -31.249 1.00 42.13 H new ATOM 0 HA THR A 138 23.665 7.694 -28.650 1.00 12.11 H new ATOM 0 HB THR A 138 24.952 9.220 -30.947 1.00 62.22 H new ATOM 0 HG1 THR A 138 26.684 8.208 -30.150 1.00 10.12 H new ATOM 0 HG21 THR A 138 25.203 11.018 -29.277 1.00 45.30 H new ATOM 0 HG22 THR A 138 23.495 10.591 -29.532 1.00 45.30 H new ATOM 0 HG23 THR A 138 24.347 10.018 -28.079 1.00 45.30 H new ATOM 1971 N CYS A 139 22.458 8.195 -31.687 1.00 25.02 N ATOM 1972 CA CYS A 139 21.264 8.579 -32.430 1.00 4.24 C ATOM 1973 C CYS A 139 20.771 7.426 -33.299 1.00 75.33 C ATOM 1974 O CYS A 139 19.798 6.752 -32.962 1.00 64.13 O ATOM 1975 CB CYS A 139 21.552 9.803 -33.301 1.00 12.23 C ATOM 1976 SG CYS A 139 23.278 9.920 -33.872 1.00 10.24 S ATOM 0 H CYS A 139 23.220 7.843 -32.267 1.00 25.02 H new ATOM 0 HA CYS A 139 20.483 8.829 -31.712 1.00 4.24 H new ATOM 0 HB2 CYS A 139 20.894 9.780 -34.170 1.00 12.23 H new ATOM 0 HB3 CYS A 139 21.305 10.703 -32.737 1.00 12.23 H new ATOM 0 HG CYS A 139 23.977 10.591 -33.006 1.00 10.24 H new ATOM 1980 N SER A 140 21.450 7.207 -34.422 1.00 21.32 N ATOM 1981 CA SER A 140 21.079 6.139 -35.343 1.00 52.32 C ATOM 1982 C SER A 140 21.970 6.156 -36.581 1.00 32.33 C ATOM 1983 O SER A 140 23.045 6.758 -36.579 1.00 33.12 O ATOM 1984 CB SER A 140 19.612 6.278 -35.754 1.00 74.41 C ATOM 1985 OG SER A 140 18.930 5.040 -35.641 1.00 43.44 O ATOM 0 H SER A 140 22.259 7.755 -34.715 1.00 21.32 H new ATOM 0 HA SER A 140 21.216 5.187 -34.831 1.00 52.32 H new ATOM 0 HB2 SER A 140 19.124 7.024 -35.126 1.00 74.41 H new ATOM 0 HB3 SER A 140 19.552 6.637 -36.781 1.00 74.41 H new ATOM 0 HG SER A 140 17.994 5.156 -35.908 1.00 43.44 H new ATOM 1990 N LEU A 141 21.516 5.491 -37.638 1.00 74.02 N ATOM 1991 CA LEU A 141 22.271 5.429 -38.884 1.00 72.32 C ATOM 1992 C LEU A 141 23.579 4.670 -38.691 1.00 50.44 C ATOM 1993 O LEU A 141 24.123 4.622 -37.588 1.00 0.42 O ATOM 1994 CB LEU A 141 22.557 6.840 -39.401 1.00 70.44 C ATOM 1995 CG LEU A 141 21.367 7.590 -40.001 1.00 40.01 C ATOM 1996 CD1 LEU A 141 21.683 9.071 -40.137 1.00 23.21 C ATOM 1997 CD2 LEU A 141 20.988 6.997 -41.350 1.00 54.20 C ATOM 0 H LEU A 141 20.629 4.987 -37.657 1.00 74.02 H new ATOM 0 HA LEU A 141 21.669 4.895 -39.619 1.00 72.32 H new ATOM 0 HB2 LEU A 141 22.957 7.433 -38.578 1.00 70.44 H new ATOM 0 HB3 LEU A 141 23.339 6.776 -40.157 1.00 70.44 H new ATOM 0 HG LEU A 141 20.517 7.482 -39.328 1.00 40.01 H new ATOM 0 HD11 LEU A 141 20.825 9.588 -40.566 1.00 23.21 H new ATOM 0 HD12 LEU A 141 21.904 9.488 -39.154 1.00 23.21 H new ATOM 0 HD13 LEU A 141 22.547 9.200 -40.789 1.00 23.21 H new ATOM 0 HD21 LEU A 141 20.139 7.543 -41.762 1.00 54.20 H new ATOM 0 HD22 LEU A 141 21.835 7.074 -42.032 1.00 54.20 H new ATOM 0 HD23 LEU A 141 20.718 5.949 -41.224 1.00 54.20 H new ATOM 2008 N ILE A 142 24.082 4.081 -39.772 1.00 53.31 N ATOM 2009 CA ILE A 142 25.329 3.328 -39.721 1.00 14.22 C ATOM 2010 C ILE A 142 26.292 3.786 -40.811 1.00 62.24 C ATOM 2011 O ILE A 142 25.873 4.161 -41.906 1.00 31.11 O ATOM 2012 CB ILE A 142 25.080 1.816 -39.873 1.00 74.44 C ATOM 2013 CG1 ILE A 142 23.735 1.433 -39.250 1.00 42.41 C ATOM 2014 CG2 ILE A 142 26.211 1.026 -39.233 1.00 60.04 C ATOM 2015 CD1 ILE A 142 23.472 -0.057 -39.251 1.00 51.44 C ATOM 0 H ILE A 142 23.645 4.111 -40.693 1.00 53.31 H new ATOM 0 HA ILE A 142 25.773 3.518 -38.744 1.00 14.22 H new ATOM 0 HB ILE A 142 25.049 1.573 -40.935 1.00 74.44 H new ATOM 0 HG12 ILE A 142 23.701 1.799 -38.224 1.00 42.41 H new ATOM 0 HG13 ILE A 142 22.935 1.935 -39.794 1.00 42.41 H new ATOM 0 HG21 ILE A 142 26.020 -0.041 -39.349 1.00 60.04 H new ATOM 0 HG22 ILE A 142 27.153 1.281 -39.718 1.00 60.04 H new ATOM 0 HG23 ILE A 142 26.271 1.271 -38.173 1.00 60.04 H new ATOM 0 HD11 ILE A 142 22.502 -0.256 -38.795 1.00 51.44 H new ATOM 0 HD12 ILE A 142 23.473 -0.426 -40.277 1.00 51.44 H new ATOM 0 HD13 ILE A 142 24.251 -0.564 -38.682 1.00 51.44 H new ATOM 2026 N ILE A 143 27.584 3.750 -40.504 1.00 2.43 N ATOM 2027 CA ILE A 143 28.607 4.159 -41.458 1.00 51.32 C ATOM 2028 C ILE A 143 29.554 3.007 -41.775 1.00 62.33 C ATOM 2029 O ILE A 143 29.826 2.161 -40.924 1.00 13.32 O ATOM 2030 CB ILE A 143 29.426 5.352 -40.930 1.00 71.52 C ATOM 2031 CG1 ILE A 143 29.876 5.091 -39.491 1.00 4.22 C ATOM 2032 CG2 ILE A 143 28.609 6.633 -41.012 1.00 43.04 C ATOM 2033 CD1 ILE A 143 31.352 5.338 -39.265 1.00 63.34 C ATOM 0 H ILE A 143 27.947 3.442 -39.602 1.00 2.43 H new ATOM 0 HA ILE A 143 28.088 4.461 -42.368 1.00 51.32 H new ATOM 0 HB ILE A 143 30.313 5.470 -41.553 1.00 71.52 H new ATOM 0 HG12 ILE A 143 29.302 5.728 -38.818 1.00 4.22 H new ATOM 0 HG13 ILE A 143 29.644 4.059 -39.228 1.00 4.22 H new ATOM 0 HG21 ILE A 143 29.201 7.467 -40.635 1.00 43.04 H new ATOM 0 HG22 ILE A 143 28.333 6.823 -42.049 1.00 43.04 H new ATOM 0 HG23 ILE A 143 27.706 6.528 -40.410 1.00 43.04 H new ATOM 0 HD11 ILE A 143 31.600 5.133 -38.224 1.00 63.34 H new ATOM 0 HD12 ILE A 143 31.934 4.682 -39.912 1.00 63.34 H new ATOM 0 HD13 ILE A 143 31.587 6.377 -39.496 1.00 63.34 H new ATOM 2044 N GLU A 144 30.055 2.982 -43.007 1.00 25.34 N ATOM 2045 CA GLU A 144 30.973 1.933 -43.436 1.00 51.10 C ATOM 2046 C GLU A 144 32.408 2.449 -43.474 1.00 5.32 C ATOM 2047 O GLU A 144 32.669 3.560 -43.937 1.00 73.11 O ATOM 2048 CB GLU A 144 30.572 1.406 -44.815 1.00 54.42 C ATOM 2049 CG GLU A 144 31.347 0.171 -45.244 1.00 54.22 C ATOM 2050 CD GLU A 144 31.118 -0.184 -46.701 1.00 21.34 C ATOM 2051 OE1 GLU A 144 30.131 0.311 -47.284 1.00 21.44 O ATOM 2052 OE2 GLU A 144 31.925 -0.958 -47.257 1.00 31.42 O ATOM 0 H GLU A 144 29.841 3.675 -43.724 1.00 25.34 H new ATOM 0 HA GLU A 144 30.917 1.119 -42.714 1.00 51.10 H new ATOM 0 HB2 GLU A 144 29.507 1.173 -44.810 1.00 54.42 H new ATOM 0 HB3 GLU A 144 30.722 2.194 -45.553 1.00 54.42 H new ATOM 0 HG2 GLU A 144 32.411 0.338 -45.077 1.00 54.22 H new ATOM 0 HG3 GLU A 144 31.055 -0.672 -44.618 1.00 54.22 H new ATOM 2057 N LEU A 145 33.337 1.635 -42.982 1.00 62.50 N ATOM 2058 CA LEU A 145 34.747 2.008 -42.959 1.00 23.22 C ATOM 2059 C LEU A 145 35.462 1.513 -44.212 1.00 22.12 C ATOM 2060 O LEU A 145 35.652 0.309 -44.397 1.00 0.32 O ATOM 2061 CB LEU A 145 35.424 1.438 -41.712 1.00 0.12 C ATOM 2062 CG LEU A 145 34.495 1.042 -40.564 1.00 62.33 C ATOM 2063 CD1 LEU A 145 34.132 -0.432 -40.655 1.00 50.03 C ATOM 2064 CD2 LEU A 145 35.142 1.352 -39.222 1.00 21.32 C ATOM 0 H LEU A 145 33.139 0.713 -42.594 1.00 62.50 H new ATOM 0 HA LEU A 145 34.810 3.096 -42.934 1.00 23.22 H new ATOM 0 HB2 LEU A 145 36.000 0.561 -42.005 1.00 0.12 H new ATOM 0 HB3 LEU A 145 36.134 2.176 -41.340 1.00 0.12 H new ATOM 0 HG LEU A 145 33.579 1.627 -40.646 1.00 62.33 H new ATOM 0 HD11 LEU A 145 33.470 -0.695 -39.830 1.00 50.03 H new ATOM 0 HD12 LEU A 145 33.626 -0.624 -41.601 1.00 50.03 H new ATOM 0 HD13 LEU A 145 35.039 -1.034 -40.599 1.00 50.03 H new ATOM 0 HD21 LEU A 145 34.466 1.063 -38.417 1.00 21.32 H new ATOM 0 HD22 LEU A 145 36.074 0.795 -39.130 1.00 21.32 H new ATOM 0 HD23 LEU A 145 35.350 2.420 -39.156 1.00 21.32 H new ATOM 2075 N LEU A 146 35.858 2.447 -45.069 1.00 31.20 N ATOM 2076 CA LEU A 146 36.555 2.106 -46.304 1.00 41.33 C ATOM 2077 C LEU A 146 37.630 3.140 -46.625 1.00 64.24 C ATOM 2078 O LEU A 146 37.475 4.325 -46.328 1.00 4.10 O ATOM 2079 CB LEU A 146 35.562 2.009 -47.463 1.00 74.03 C ATOM 2080 CG LEU A 146 34.366 2.959 -47.404 1.00 31.22 C ATOM 2081 CD1 LEU A 146 34.126 3.601 -48.761 1.00 12.31 C ATOM 2082 CD2 LEU A 146 33.121 2.221 -46.933 1.00 30.12 C ATOM 0 H LEU A 146 35.708 3.447 -44.932 1.00 31.20 H new ATOM 0 HA LEU A 146 37.037 1.138 -46.165 1.00 41.33 H new ATOM 0 HB2 LEU A 146 36.101 2.193 -48.393 1.00 74.03 H new ATOM 0 HB3 LEU A 146 35.186 0.987 -47.509 1.00 74.03 H new ATOM 0 HG LEU A 146 34.589 3.749 -46.686 1.00 31.22 H new ATOM 0 HD11 LEU A 146 33.271 4.274 -48.699 1.00 12.31 H new ATOM 0 HD12 LEU A 146 35.010 4.165 -49.058 1.00 12.31 H new ATOM 0 HD13 LEU A 146 33.925 2.825 -49.500 1.00 12.31 H new ATOM 0 HD21 LEU A 146 32.280 2.913 -46.897 1.00 30.12 H new ATOM 0 HD22 LEU A 146 32.895 1.410 -47.626 1.00 30.12 H new ATOM 0 HD23 LEU A 146 33.296 1.810 -45.939 1.00 30.12 H new ATOM 2093 N HIS A 147 38.718 2.683 -47.237 1.00 43.04 N ATOM 2094 CA HIS A 147 39.818 3.569 -47.602 1.00 65.30 C ATOM 2095 C HIS A 147 39.433 4.456 -48.781 1.00 0.21 C ATOM 2096 O HIS A 147 38.568 4.100 -49.582 1.00 50.35 O ATOM 2097 CB HIS A 147 41.064 2.753 -47.949 1.00 44.41 C ATOM 2098 CG HIS A 147 42.204 2.968 -47.000 1.00 31.31 C ATOM 2099 ND1 HIS A 147 42.732 1.961 -46.219 1.00 33.23 N ATOM 2100 CD2 HIS A 147 42.918 4.081 -46.711 1.00 31.25 C ATOM 2101 CE1 HIS A 147 43.720 2.447 -45.488 1.00 51.01 C ATOM 2102 NE2 HIS A 147 43.853 3.731 -45.768 1.00 62.21 N ATOM 0 H HIS A 147 38.862 1.705 -47.490 1.00 43.04 H new ATOM 0 HA HIS A 147 40.037 4.207 -46.746 1.00 65.30 H new ATOM 0 HB2 HIS A 147 40.804 1.694 -47.958 1.00 44.41 H new ATOM 0 HB3 HIS A 147 41.388 3.010 -48.957 1.00 44.41 H new ATOM 0 HD2 HIS A 147 42.778 5.062 -47.142 1.00 31.25 H new ATOM 0 HE1 HIS A 147 44.317 1.889 -44.782 1.00 51.01 H new ATOM 0 HE2 HIS A 147 44.539 4.361 -45.351 1.00 62.21 H new