USER MOD reduce.3.24.130724 H: found=0, std=0, add=1234, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1236 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 144 TYR OH : rot 69:sc= 1.17 USER MOD Set 1.2: A 183 ASN :FLIP amide:sc= 0.768 F(o=0.47,f=1.9) USER MOD Single : A 19 GLN : amide:sc=-0.00138 K(o=-0.0014,f=-0.82) USER MOD Single : A 22 SER OG : rot -9:sc= 0.978 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -29:sc= 0.844 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot -170:sc= -0.916 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 51:sc= 1.21 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -155:sc=0.000791 (180deg=-0.232) USER MOD Single : A 59 MET CE :methyl -104:sc= -0.863 (180deg=-3.53!) USER MOD Single : A 61 LYS NZ :NH3+ 152:sc= -3.43! (180deg=-6.05!) USER MOD Single : A 63 MET CE :methyl -158:sc= -0.158 (180deg=-0.706) USER MOD Single : A 64 LYS NZ :NH3+ -176:sc= 1.25 (180deg=1.14) USER MOD Single : A 65 TYR OH : rot 18:sc= 0.168 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 3.09 K(o=3.1,f=-7.7!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 22:sc= -2.05! USER MOD Single : A 89 ASN : amide:sc= 1.11 K(o=1.1,f=-0.0097) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.806 F(o=-1.6,f=-0.81) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 GLN :FLIP amide:sc= 0.711 F(o=-3.4!,f=0.71) USER MOD Single : A 111 SER OG : rot 1:sc= 0.594 USER MOD Single : A 116 SER OG : rot -22:sc= 0.0157 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 30:sc= -1.04 USER MOD Single : A 132 SER OG : rot -87:sc= 0.676 USER MOD Single : A 133 THR OG1 : rot 43:sc= 0.632 USER MOD Single : A 134 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.7) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.011) USER MOD Single : A 147 HIS : +bothHN:sc= -0.719! C(o=-0.72!,f=-8.8!) USER MOD Single : A 149 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 THR OG1 : rot 71:sc= 1.27 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot -76:sc= 1.17 USER MOD Single : A 161 THR OG1 : rot 180:sc= -0.291 USER MOD Single : A 162 TYR OH : rot 166:sc= -0.56 USER MOD Single : A 163 GLN : amide:sc= -0.906 X(o=-0.91,f=-0.67) USER MOD Single : A 167 TYR OH : rot 165:sc= 0 USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 CYS SG : rot -1:sc= -0.442 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 18 -6.354 -12.872 -5.398 1.00 20.31 N ATOM 167 CA TRP A 18 -5.325 -12.404 -6.261 1.00 34.15 C ATOM 168 C TRP A 18 -4.590 -13.592 -6.785 1.00 24.12 C ATOM 169 O TRP A 18 -4.837 -14.718 -6.333 1.00 55.22 O ATOM 170 CB TRP A 18 -4.366 -11.414 -5.541 1.00 43.22 C ATOM 171 CG TRP A 18 -3.686 -11.917 -4.283 1.00 41.24 C ATOM 172 CD1 TRP A 18 -2.933 -13.052 -4.131 1.00 65.42 C ATOM 173 CD2 TRP A 18 -3.650 -11.251 -3.014 1.00 55.51 C ATOM 174 NE1 TRP A 18 -2.477 -13.146 -2.848 1.00 44.23 N ATOM 175 CE2 TRP A 18 -2.896 -12.055 -2.141 1.00 74.33 C ATOM 176 CE3 TRP A 18 -4.194 -10.062 -2.528 1.00 72.20 C ATOM 177 CZ2 TRP A 18 -2.670 -11.706 -0.813 1.00 15.14 C ATOM 178 CZ3 TRP A 18 -3.967 -9.715 -1.209 1.00 42.22 C ATOM 179 CH2 TRP A 18 -3.212 -10.536 -0.366 1.00 35.43 C ATOM 0 HA TRP A 18 -5.767 -11.844 -7.085 1.00 34.15 H new ATOM 0 HB2 TRP A 18 -3.593 -11.114 -6.249 1.00 43.22 H new ATOM 0 HB3 TRP A 18 -4.931 -10.517 -5.287 1.00 43.22 H new ATOM 0 HD1 TRP A 18 -2.730 -13.768 -4.913 1.00 65.42 H new ATOM 0 HE1 TRP A 18 -1.913 -13.910 -2.476 1.00 44.23 H new ATOM 0 HE3 TRP A 18 -4.782 -9.424 -3.171 1.00 72.20 H new ATOM 0 HZ2 TRP A 18 -2.087 -12.338 -0.160 1.00 15.14 H new ATOM 0 HZ3 TRP A 18 -4.380 -8.794 -0.823 1.00 42.22 H new ATOM 0 HH2 TRP A 18 -3.054 -10.238 0.660 1.00 35.43 H new ATOM 190 N GLN A 19 -3.718 -13.386 -7.710 1.00 13.00 N ATOM 191 CA GLN A 19 -2.966 -14.480 -8.242 1.00 71.51 C ATOM 192 C GLN A 19 -1.556 -14.424 -7.723 1.00 4.04 C ATOM 193 O GLN A 19 -0.804 -13.549 -8.096 1.00 13.22 O ATOM 194 CB GLN A 19 -2.927 -14.415 -9.767 1.00 24.30 C ATOM 195 CG GLN A 19 -2.085 -15.515 -10.388 1.00 21.32 C ATOM 196 CD GLN A 19 -1.901 -15.358 -11.874 1.00 40.13 C ATOM 197 OE1 GLN A 19 -1.891 -14.243 -12.404 1.00 23.30 O ATOM 198 NE2 GLN A 19 -1.727 -16.449 -12.548 1.00 12.24 N ATOM 0 H GLN A 19 -3.505 -12.475 -8.116 1.00 13.00 H new ATOM 0 HA GLN A 19 -3.447 -15.408 -7.933 1.00 71.51 H new ATOM 0 HB2 GLN A 19 -3.944 -14.482 -10.154 1.00 24.30 H new ATOM 0 HB3 GLN A 19 -2.532 -13.446 -10.074 1.00 24.30 H new ATOM 0 HG2 GLN A 19 -1.107 -15.529 -9.907 1.00 21.32 H new ATOM 0 HG3 GLN A 19 -2.553 -16.479 -10.187 1.00 21.32 H new ATOM 0 HE21 GLN A 19 -1.742 -17.351 -12.072 1.00 12.24 H new ATOM 0 HE22 GLN A 19 -1.574 -16.407 -13.556 1.00 12.24 H new ATOM 207 N VAL A 20 -1.210 -15.332 -6.863 1.00 62.31 N ATOM 208 CA VAL A 20 0.155 -15.434 -6.399 1.00 62.42 C ATOM 209 C VAL A 20 0.880 -16.437 -7.274 1.00 20.23 C ATOM 210 O VAL A 20 0.373 -17.536 -7.521 1.00 52.34 O ATOM 211 CB VAL A 20 0.253 -15.803 -4.881 1.00 23.24 C ATOM 212 CG1 VAL A 20 -0.551 -17.035 -4.564 1.00 54.44 C ATOM 213 CG2 VAL A 20 1.700 -16.006 -4.462 1.00 10.54 C ATOM 0 H VAL A 20 -1.850 -16.018 -6.463 1.00 62.31 H new ATOM 0 HA VAL A 20 0.632 -14.457 -6.483 1.00 62.42 H new ATOM 0 HB VAL A 20 -0.161 -14.967 -4.317 1.00 23.24 H new ATOM 0 HG11 VAL A 20 -0.462 -17.264 -3.502 1.00 54.44 H new ATOM 0 HG12 VAL A 20 -1.598 -16.860 -4.811 1.00 54.44 H new ATOM 0 HG13 VAL A 20 -0.176 -17.875 -5.149 1.00 54.44 H new ATOM 0 HG21 VAL A 20 1.740 -16.261 -3.403 1.00 10.54 H new ATOM 0 HG22 VAL A 20 2.138 -16.815 -5.047 1.00 10.54 H new ATOM 0 HG23 VAL A 20 2.261 -15.088 -4.635 1.00 10.54 H new ATOM 223 N LEU A 21 2.048 -16.082 -7.747 1.00 65.33 N ATOM 224 CA LEU A 21 2.712 -16.937 -8.692 1.00 44.45 C ATOM 225 C LEU A 21 3.558 -17.915 -7.924 1.00 1.25 C ATOM 226 O LEU A 21 3.561 -19.112 -8.220 1.00 33.34 O ATOM 227 CB LEU A 21 3.632 -16.096 -9.599 1.00 52.34 C ATOM 228 CG LEU A 21 3.078 -14.736 -10.076 1.00 51.41 C ATOM 229 CD1 LEU A 21 4.028 -14.070 -11.062 1.00 71.24 C ATOM 230 CD2 LEU A 21 1.682 -14.857 -10.672 1.00 51.33 C ATOM 0 H LEU A 21 2.547 -15.228 -7.500 1.00 65.33 H new ATOM 0 HA LEU A 21 1.975 -17.455 -9.305 1.00 44.45 H new ATOM 0 HB2 LEU A 21 4.564 -15.915 -9.064 1.00 52.34 H new ATOM 0 HB3 LEU A 21 3.879 -16.691 -10.479 1.00 52.34 H new ATOM 0 HG LEU A 21 2.998 -14.103 -9.192 1.00 51.41 H new ATOM 0 HD11 LEU A 21 3.611 -13.114 -11.380 1.00 71.24 H new ATOM 0 HD12 LEU A 21 4.992 -13.903 -10.582 1.00 71.24 H new ATOM 0 HD13 LEU A 21 4.162 -14.715 -11.931 1.00 71.24 H new ATOM 0 HD21 LEU A 21 1.337 -13.874 -10.992 1.00 51.33 H new ATOM 0 HD22 LEU A 21 1.710 -15.529 -11.530 1.00 51.33 H new ATOM 0 HD23 LEU A 21 0.999 -15.254 -9.921 1.00 51.33 H new ATOM 242 N SER A 22 4.205 -17.413 -6.890 1.00 61.14 N ATOM 243 CA SER A 22 5.057 -18.184 -5.992 1.00 50.30 C ATOM 244 C SER A 22 5.477 -17.281 -4.837 1.00 24.33 C ATOM 245 O SER A 22 5.195 -16.071 -4.849 1.00 74.24 O ATOM 246 CB SER A 22 6.343 -18.703 -6.709 1.00 33.15 C ATOM 247 OG SER A 22 6.054 -19.556 -7.818 1.00 64.02 O ATOM 0 H SER A 22 4.153 -16.425 -6.640 1.00 61.14 H new ATOM 0 HA SER A 22 4.492 -19.049 -5.644 1.00 50.30 H new ATOM 0 HB2 SER A 22 6.929 -17.852 -7.055 1.00 33.15 H new ATOM 0 HB3 SER A 22 6.960 -19.244 -5.992 1.00 33.15 H new ATOM 0 HG SER A 22 5.098 -19.770 -7.825 1.00 64.02 H new ATOM 253 N THR A 23 6.068 -17.870 -3.836 1.00 33.44 N ATOM 254 CA THR A 23 6.670 -17.157 -2.743 1.00 51.13 C ATOM 255 C THR A 23 8.046 -17.753 -2.510 1.00 64.22 C ATOM 256 O THR A 23 8.341 -18.836 -3.037 1.00 3.42 O ATOM 257 CB THR A 23 5.842 -17.282 -1.450 1.00 75.33 C ATOM 258 OG1 THR A 23 5.631 -18.668 -1.142 1.00 12.24 O ATOM 259 CG2 THR A 23 4.507 -16.588 -1.571 1.00 54.32 C ATOM 0 H THR A 23 6.147 -18.884 -3.755 1.00 33.44 H new ATOM 0 HA THR A 23 6.724 -16.098 -2.997 1.00 51.13 H new ATOM 0 HB THR A 23 6.403 -16.800 -0.649 1.00 75.33 H new ATOM 0 HG1 THR A 23 5.106 -18.744 -0.318 1.00 12.24 H new ATOM 0 HG21 THR A 23 3.953 -16.699 -0.639 1.00 54.32 H new ATOM 0 HG22 THR A 23 4.665 -15.529 -1.775 1.00 54.32 H new ATOM 0 HG23 THR A 23 3.938 -17.034 -2.386 1.00 54.32 H new ATOM 267 N GLY A 24 8.887 -17.087 -1.764 1.00 21.45 N ATOM 268 CA GLY A 24 10.160 -17.685 -1.451 1.00 53.05 C ATOM 269 C GLY A 24 11.298 -16.723 -1.475 1.00 62.04 C ATOM 270 O GLY A 24 11.944 -16.542 -2.506 1.00 1.01 O ATOM 0 H GLY A 24 8.724 -16.160 -1.372 1.00 21.45 H new ATOM 0 HA2 GLY A 24 10.103 -18.142 -0.463 1.00 53.05 H new ATOM 0 HA3 GLY A 24 10.359 -18.487 -2.162 1.00 53.05 H new ATOM 274 N GLY A 25 11.564 -16.120 -0.350 1.00 53.13 N ATOM 275 CA GLY A 25 12.641 -15.190 -0.258 1.00 54.33 C ATOM 276 C GLY A 25 13.622 -15.571 0.819 1.00 44.52 C ATOM 277 O GLY A 25 14.000 -16.739 0.953 1.00 20.54 O ATOM 0 H GLY A 25 11.044 -16.261 0.516 1.00 53.13 H new ATOM 0 HA2 GLY A 25 13.157 -15.136 -1.217 1.00 54.33 H new ATOM 0 HA3 GLY A 25 12.245 -14.195 -0.053 1.00 54.33 H new ATOM 281 N LYS A 26 13.995 -14.611 1.593 1.00 53.12 N ATOM 282 CA LYS A 26 14.968 -14.761 2.645 1.00 51.44 C ATOM 283 C LYS A 26 14.329 -14.532 3.987 1.00 34.25 C ATOM 284 O LYS A 26 13.138 -14.201 4.078 1.00 62.14 O ATOM 285 CB LYS A 26 16.133 -13.790 2.464 1.00 32.45 C ATOM 286 CG LYS A 26 16.939 -14.005 1.197 1.00 51.52 C ATOM 287 CD LYS A 26 18.093 -13.018 1.093 1.00 70.03 C ATOM 288 CE LYS A 26 19.097 -13.179 2.231 1.00 74.41 C ATOM 289 NZ LYS A 26 20.194 -12.192 2.146 1.00 51.11 N ATOM 0 H LYS A 26 13.625 -13.664 1.517 1.00 53.12 H new ATOM 0 HA LYS A 26 15.353 -15.779 2.595 1.00 51.44 H new ATOM 0 HB2 LYS A 26 15.744 -12.772 2.464 1.00 32.45 H new ATOM 0 HB3 LYS A 26 16.799 -13.877 3.323 1.00 32.45 H new ATOM 0 HG2 LYS A 26 17.328 -15.023 1.181 1.00 51.52 H new ATOM 0 HG3 LYS A 26 16.289 -13.898 0.329 1.00 51.52 H new ATOM 0 HD2 LYS A 26 18.602 -13.157 0.140 1.00 70.03 H new ATOM 0 HD3 LYS A 26 17.700 -12.001 1.099 1.00 70.03 H new ATOM 0 HE2 LYS A 26 18.583 -13.068 3.186 1.00 74.41 H new ATOM 0 HE3 LYS A 26 19.513 -14.186 2.208 1.00 74.41 H new ATOM 0 HZ1 LYS A 26 20.853 -12.337 2.937 1.00 51.11 H new ATOM 0 HZ2 LYS A 26 20.701 -12.313 1.246 1.00 51.11 H new ATOM 0 HZ3 LYS A 26 19.800 -11.231 2.194 1.00 51.11 H new ATOM 303 N GLU A 27 15.093 -14.767 5.027 1.00 11.33 N ATOM 304 CA GLU A 27 14.656 -14.453 6.358 1.00 61.44 C ATOM 305 C GLU A 27 14.494 -12.942 6.458 1.00 53.23 C ATOM 306 O GLU A 27 15.289 -12.183 5.863 1.00 2.31 O ATOM 307 CB GLU A 27 15.694 -14.927 7.375 1.00 70.33 C ATOM 308 CG GLU A 27 15.407 -14.482 8.797 1.00 44.30 C ATOM 309 CD GLU A 27 16.448 -14.933 9.765 1.00 21.20 C ATOM 310 OE1 GLU A 27 17.613 -14.504 9.633 1.00 31.44 O ATOM 311 OE2 GLU A 27 16.117 -15.693 10.702 1.00 22.33 O ATOM 0 H GLU A 27 16.025 -15.177 4.972 1.00 11.33 H new ATOM 0 HA GLU A 27 13.711 -14.952 6.569 1.00 61.44 H new ATOM 0 HB2 GLU A 27 15.744 -16.016 7.348 1.00 70.33 H new ATOM 0 HB3 GLU A 27 16.675 -14.555 7.079 1.00 70.33 H new ATOM 0 HG2 GLU A 27 15.338 -13.395 8.826 1.00 44.30 H new ATOM 0 HG3 GLU A 27 14.437 -14.871 9.106 1.00 44.30 H new ATOM 318 N ASP A 28 13.459 -12.525 7.174 1.00 73.15 N ATOM 319 CA ASP A 28 13.067 -11.122 7.334 1.00 3.32 C ATOM 320 C ASP A 28 12.424 -10.598 6.060 1.00 63.11 C ATOM 321 O ASP A 28 11.243 -10.255 6.055 1.00 21.04 O ATOM 322 CB ASP A 28 14.218 -10.211 7.812 1.00 71.42 C ATOM 323 CG ASP A 28 13.787 -8.765 7.971 1.00 70.21 C ATOM 324 OD1 ASP A 28 13.225 -8.415 9.017 1.00 53.14 O ATOM 325 OD2 ASP A 28 14.008 -7.964 7.049 1.00 11.24 O ATOM 0 H ASP A 28 12.848 -13.169 7.676 1.00 73.15 H new ATOM 0 HA ASP A 28 12.327 -11.094 8.134 1.00 3.32 H new ATOM 0 HB2 ASP A 28 14.598 -10.580 8.765 1.00 71.42 H new ATOM 0 HB3 ASP A 28 15.040 -10.265 7.099 1.00 71.42 H new ATOM 330 N VAL A 29 13.168 -10.582 4.974 1.00 45.23 N ATOM 331 CA VAL A 29 12.624 -10.114 3.724 1.00 3.34 C ATOM 332 C VAL A 29 12.177 -11.333 2.915 1.00 20.44 C ATOM 333 O VAL A 29 12.999 -12.075 2.380 1.00 32.10 O ATOM 334 CB VAL A 29 13.703 -9.348 2.895 1.00 51.01 C ATOM 335 CG1 VAL A 29 13.108 -8.695 1.654 1.00 62.41 C ATOM 336 CG2 VAL A 29 14.462 -8.338 3.745 1.00 51.34 C ATOM 0 H VAL A 29 14.141 -10.885 4.934 1.00 45.23 H new ATOM 0 HA VAL A 29 11.793 -9.439 3.930 1.00 3.34 H new ATOM 0 HB VAL A 29 14.424 -10.092 2.556 1.00 51.01 H new ATOM 0 HG11 VAL A 29 13.892 -8.173 1.106 1.00 62.41 H new ATOM 0 HG12 VAL A 29 12.668 -9.461 1.016 1.00 62.41 H new ATOM 0 HG13 VAL A 29 12.338 -7.983 1.951 1.00 62.41 H new ATOM 0 HG21 VAL A 29 15.203 -7.828 3.129 1.00 51.34 H new ATOM 0 HG22 VAL A 29 13.763 -7.607 4.153 1.00 51.34 H new ATOM 0 HG23 VAL A 29 14.964 -8.855 4.563 1.00 51.34 H new ATOM 346 N SER A 30 10.900 -11.504 2.791 1.00 2.02 N ATOM 347 CA SER A 30 10.341 -12.634 2.081 1.00 24.44 C ATOM 348 C SER A 30 9.441 -12.103 0.987 1.00 5.10 C ATOM 349 O SER A 30 8.696 -11.160 1.235 1.00 74.23 O ATOM 350 CB SER A 30 9.531 -13.477 3.068 1.00 73.14 C ATOM 351 OG SER A 30 10.328 -13.858 4.194 1.00 54.34 O ATOM 0 H SER A 30 10.203 -10.867 3.177 1.00 2.02 H new ATOM 0 HA SER A 30 11.125 -13.251 1.643 1.00 24.44 H new ATOM 0 HB2 SER A 30 8.663 -12.912 3.407 1.00 73.14 H new ATOM 0 HB3 SER A 30 9.155 -14.369 2.566 1.00 73.14 H new ATOM 0 HG SER A 30 11.268 -13.918 3.924 1.00 54.34 H new ATOM 357 N TYR A 31 9.491 -12.676 -0.211 1.00 43.32 N ATOM 358 CA TYR A 31 8.698 -12.120 -1.291 1.00 43.20 C ATOM 359 C TYR A 31 7.627 -13.032 -1.809 1.00 22.34 C ATOM 360 O TYR A 31 7.662 -14.256 -1.611 1.00 55.33 O ATOM 361 CB TYR A 31 9.528 -11.543 -2.452 1.00 10.01 C ATOM 362 CG TYR A 31 10.459 -12.502 -3.180 1.00 3.13 C ATOM 363 CD1 TYR A 31 9.985 -13.630 -3.846 1.00 2.24 C ATOM 364 CD2 TYR A 31 11.807 -12.242 -3.231 1.00 31.42 C ATOM 365 CE1 TYR A 31 10.846 -14.462 -4.530 1.00 43.01 C ATOM 366 CE2 TYR A 31 12.678 -13.071 -3.907 1.00 53.14 C ATOM 367 CZ TYR A 31 12.193 -14.179 -4.555 1.00 61.13 C ATOM 368 OH TYR A 31 13.058 -15.008 -5.233 1.00 32.40 O ATOM 0 H TYR A 31 10.051 -13.494 -0.450 1.00 43.32 H new ATOM 0 HA TYR A 31 8.194 -11.283 -0.809 1.00 43.20 H new ATOM 0 HB2 TYR A 31 8.839 -11.119 -3.183 1.00 10.01 H new ATOM 0 HB3 TYR A 31 10.127 -10.719 -2.064 1.00 10.01 H new ATOM 0 HD1 TYR A 31 8.929 -13.856 -3.826 1.00 2.24 H new ATOM 0 HD2 TYR A 31 12.194 -11.367 -2.730 1.00 31.42 H new ATOM 0 HE1 TYR A 31 10.465 -15.332 -5.044 1.00 43.01 H new ATOM 0 HE2 TYR A 31 13.735 -12.849 -3.926 1.00 53.14 H new ATOM 0 HH TYR A 31 13.972 -14.664 -5.152 1.00 32.40 H new ATOM 378 N GLU A 32 6.702 -12.408 -2.468 1.00 53.22 N ATOM 379 CA GLU A 32 5.579 -13.020 -3.097 1.00 73.33 C ATOM 380 C GLU A 32 5.270 -12.196 -4.335 1.00 51.54 C ATOM 381 O GLU A 32 5.129 -10.967 -4.219 1.00 4.34 O ATOM 382 CB GLU A 32 4.402 -12.931 -2.108 1.00 31.34 C ATOM 383 CG GLU A 32 3.086 -13.505 -2.588 1.00 71.03 C ATOM 384 CD GLU A 32 2.012 -13.469 -1.516 1.00 55.55 C ATOM 385 OE1 GLU A 32 2.112 -14.241 -0.535 1.00 54.44 O ATOM 386 OE2 GLU A 32 1.052 -12.681 -1.625 1.00 14.23 O ATOM 0 H GLU A 32 6.714 -11.395 -2.587 1.00 53.22 H new ATOM 0 HA GLU A 32 5.761 -14.060 -3.368 1.00 73.33 H new ATOM 0 HB2 GLU A 32 4.686 -13.444 -1.189 1.00 31.34 H new ATOM 0 HB3 GLU A 32 4.247 -11.883 -1.852 1.00 31.34 H new ATOM 0 HG2 GLU A 32 2.745 -12.945 -3.459 1.00 71.03 H new ATOM 0 HG3 GLU A 32 3.238 -14.535 -2.911 1.00 71.03 H new ATOM 393 N GLU A 33 5.202 -12.811 -5.507 1.00 32.23 N ATOM 394 CA GLU A 33 4.815 -12.072 -6.654 1.00 52.42 C ATOM 395 C GLU A 33 3.421 -12.427 -6.998 1.00 51.04 C ATOM 396 O GLU A 33 3.085 -13.602 -7.183 1.00 62.22 O ATOM 397 CB GLU A 33 5.794 -12.121 -7.861 1.00 74.31 C ATOM 398 CG GLU A 33 6.205 -13.481 -8.418 1.00 31.11 C ATOM 399 CD GLU A 33 7.125 -14.273 -7.527 1.00 71.32 C ATOM 400 OE1 GLU A 33 8.226 -13.804 -7.232 1.00 4.33 O ATOM 401 OE2 GLU A 33 6.761 -15.394 -7.145 1.00 55.12 O ATOM 0 H GLU A 33 5.408 -13.797 -5.667 1.00 32.23 H new ATOM 0 HA GLU A 33 4.868 -11.016 -6.387 1.00 52.42 H new ATOM 0 HB2 GLU A 33 5.343 -11.553 -8.675 1.00 74.31 H new ATOM 0 HB3 GLU A 33 6.703 -11.595 -7.570 1.00 74.31 H new ATOM 0 HG2 GLU A 33 5.306 -14.069 -8.604 1.00 31.11 H new ATOM 0 HG3 GLU A 33 6.693 -13.332 -9.381 1.00 31.11 H new ATOM 408 N ARG A 34 2.597 -11.440 -7.025 1.00 11.53 N ATOM 409 CA ARG A 34 1.201 -11.640 -7.172 1.00 55.43 C ATOM 410 C ARG A 34 0.577 -10.576 -8.066 1.00 72.14 C ATOM 411 O ARG A 34 1.104 -9.462 -8.186 1.00 33.50 O ATOM 412 CB ARG A 34 0.555 -11.617 -5.772 1.00 75.10 C ATOM 413 CG ARG A 34 0.838 -10.340 -4.988 1.00 24.45 C ATOM 414 CD ARG A 34 0.287 -10.414 -3.585 1.00 22.14 C ATOM 415 NE ARG A 34 0.575 -9.196 -2.814 1.00 10.24 N ATOM 416 CZ ARG A 34 0.530 -9.117 -1.472 1.00 73.45 C ATOM 417 NH1 ARG A 34 0.422 -10.221 -0.743 1.00 22.34 N ATOM 418 NH2 ARG A 34 0.694 -7.940 -0.871 1.00 34.53 N ATOM 0 H ARG A 34 2.877 -10.462 -6.945 1.00 11.53 H new ATOM 0 HA ARG A 34 1.025 -12.603 -7.651 1.00 55.43 H new ATOM 0 HB2 ARG A 34 -0.523 -11.737 -5.877 1.00 75.10 H new ATOM 0 HB3 ARG A 34 0.917 -12.472 -5.200 1.00 75.10 H new ATOM 0 HG2 ARG A 34 1.914 -10.168 -4.948 1.00 24.45 H new ATOM 0 HG3 ARG A 34 0.398 -9.489 -5.508 1.00 24.45 H new ATOM 0 HD2 ARG A 34 -0.791 -10.570 -3.627 1.00 22.14 H new ATOM 0 HD3 ARG A 34 0.714 -11.276 -3.073 1.00 22.14 H new ATOM 0 HE ARG A 34 0.826 -8.354 -3.332 1.00 10.24 H new ATOM 0 HH11 ARG A 34 0.373 -11.131 -1.200 1.00 22.34 H new ATOM 0 HH12 ARG A 34 0.388 -10.159 0.275 1.00 22.34 H new ATOM 0 HH21 ARG A 34 0.853 -7.101 -1.428 1.00 34.53 H new ATOM 0 HH22 ARG A 34 0.660 -7.878 0.147 1.00 34.53 H new ATOM 432 N ALA A 35 -0.519 -10.926 -8.691 1.00 15.41 N ATOM 433 CA ALA A 35 -1.281 -10.008 -9.500 1.00 22.44 C ATOM 434 C ALA A 35 -2.399 -9.450 -8.650 1.00 2.31 C ATOM 435 O ALA A 35 -3.030 -10.191 -7.913 1.00 54.12 O ATOM 436 CB ALA A 35 -1.840 -10.703 -10.731 1.00 13.24 C ATOM 0 H ALA A 35 -0.912 -11.867 -8.652 1.00 15.41 H new ATOM 0 HA ALA A 35 -0.637 -9.201 -9.849 1.00 22.44 H new ATOM 0 HB1 ALA A 35 -2.411 -9.989 -11.324 1.00 13.24 H new ATOM 0 HB2 ALA A 35 -1.019 -11.098 -11.330 1.00 13.24 H new ATOM 0 HB3 ALA A 35 -2.491 -11.521 -10.423 1.00 13.24 H new ATOM 442 N CYS A 36 -2.614 -8.170 -8.743 1.00 53.55 N ATOM 443 CA CYS A 36 -3.579 -7.443 -7.915 1.00 21.21 C ATOM 444 C CYS A 36 -5.045 -7.908 -8.088 1.00 23.14 C ATOM 445 O CYS A 36 -5.436 -8.364 -9.167 1.00 54.33 O ATOM 446 CB CYS A 36 -3.455 -5.963 -8.244 1.00 62.33 C ATOM 447 SG CYS A 36 -1.828 -5.287 -7.880 1.00 33.22 S ATOM 0 H CYS A 36 -2.120 -7.573 -9.407 1.00 53.55 H new ATOM 0 HA CYS A 36 -3.338 -7.649 -6.872 1.00 21.21 H new ATOM 0 HB2 CYS A 36 -3.675 -5.813 -9.301 1.00 62.33 H new ATOM 0 HB3 CYS A 36 -4.206 -5.409 -7.681 1.00 62.33 H new ATOM 0 HG CYS A 36 -1.862 -3.992 -7.987 1.00 33.22 H new ATOM 453 N GLU A 37 -5.840 -7.787 -6.982 1.00 60.32 N ATOM 454 CA GLU A 37 -7.284 -8.056 -6.971 1.00 75.22 C ATOM 455 C GLU A 37 -7.984 -7.298 -8.093 1.00 45.31 C ATOM 456 O GLU A 37 -8.704 -7.873 -8.897 1.00 23.55 O ATOM 457 CB GLU A 37 -7.845 -7.627 -5.575 1.00 71.21 C ATOM 458 CG GLU A 37 -9.364 -7.342 -5.477 1.00 41.43 C ATOM 459 CD GLU A 37 -10.287 -8.498 -5.772 1.00 14.43 C ATOM 460 OE1 GLU A 37 -10.475 -8.836 -6.946 1.00 1.03 O ATOM 461 OE2 GLU A 37 -10.903 -9.021 -4.841 1.00 72.43 O ATOM 0 H GLU A 37 -5.478 -7.497 -6.074 1.00 60.32 H new ATOM 0 HA GLU A 37 -7.468 -9.118 -7.136 1.00 75.22 H new ATOM 0 HB2 GLU A 37 -7.602 -8.412 -4.858 1.00 71.21 H new ATOM 0 HB3 GLU A 37 -7.312 -6.730 -5.259 1.00 71.21 H new ATOM 0 HG2 GLU A 37 -9.579 -6.982 -4.471 1.00 41.43 H new ATOM 0 HG3 GLU A 37 -9.604 -6.530 -6.164 1.00 41.43 H new ATOM 468 N GLY A 38 -7.720 -6.033 -8.165 1.00 44.32 N ATOM 469 CA GLY A 38 -8.407 -5.205 -9.123 1.00 3.45 C ATOM 470 C GLY A 38 -9.543 -4.474 -8.480 1.00 63.35 C ATOM 471 O GLY A 38 -10.360 -3.852 -9.151 1.00 22.44 O ATOM 0 H GLY A 38 -7.040 -5.547 -7.580 1.00 44.32 H new ATOM 0 HA2 GLY A 38 -7.709 -4.490 -9.558 1.00 3.45 H new ATOM 0 HA3 GLY A 38 -8.782 -5.822 -9.940 1.00 3.45 H new ATOM 475 N GLY A 39 -9.589 -4.559 -7.169 1.00 53.50 N ATOM 476 CA GLY A 39 -10.636 -3.955 -6.407 1.00 52.40 C ATOM 477 C GLY A 39 -10.524 -2.460 -6.372 1.00 43.21 C ATOM 478 O GLY A 39 -9.480 -1.889 -6.726 1.00 71.34 O ATOM 0 H GLY A 39 -8.895 -5.053 -6.608 1.00 53.50 H new ATOM 0 HA2 GLY A 39 -11.600 -4.235 -6.832 1.00 52.40 H new ATOM 0 HA3 GLY A 39 -10.612 -4.343 -5.389 1.00 52.40 H new ATOM 482 N LYS A 40 -11.582 -1.833 -5.960 1.00 2.41 N ATOM 483 CA LYS A 40 -11.635 -0.407 -5.866 1.00 30.25 C ATOM 484 C LYS A 40 -11.135 0.031 -4.493 1.00 1.02 C ATOM 485 O LYS A 40 -11.548 -0.518 -3.467 1.00 11.41 O ATOM 486 CB LYS A 40 -13.065 0.083 -6.172 1.00 1.21 C ATOM 487 CG LYS A 40 -14.141 -0.503 -5.265 1.00 52.10 C ATOM 488 CD LYS A 40 -15.547 -0.076 -5.676 1.00 3.15 C ATOM 489 CE LYS A 40 -15.947 -0.614 -7.044 1.00 41.31 C ATOM 490 NZ LYS A 40 -17.346 -0.266 -7.375 1.00 2.31 N ATOM 0 H LYS A 40 -12.442 -2.302 -5.676 1.00 2.41 H new ATOM 0 HA LYS A 40 -10.980 0.050 -6.607 1.00 30.25 H new ATOM 0 HB2 LYS A 40 -13.089 1.170 -6.088 1.00 1.21 H new ATOM 0 HB3 LYS A 40 -13.306 -0.162 -7.206 1.00 1.21 H new ATOM 0 HG2 LYS A 40 -14.075 -1.591 -5.284 1.00 52.10 H new ATOM 0 HG3 LYS A 40 -13.955 -0.190 -4.237 1.00 52.10 H new ATOM 0 HD2 LYS A 40 -16.261 -0.424 -4.930 1.00 3.15 H new ATOM 0 HD3 LYS A 40 -15.603 1.012 -5.687 1.00 3.15 H new ATOM 0 HE2 LYS A 40 -15.280 -0.208 -7.805 1.00 41.31 H new ATOM 0 HE3 LYS A 40 -15.827 -1.697 -7.060 1.00 41.31 H new ATOM 0 HZ1 LYS A 40 -17.586 -0.647 -8.312 1.00 2.31 H new ATOM 0 HZ2 LYS A 40 -17.983 -0.674 -6.662 1.00 2.31 H new ATOM 0 HZ3 LYS A 40 -17.454 0.768 -7.384 1.00 2.31 H new ATOM 504 N PHE A 41 -10.219 0.968 -4.491 1.00 74.41 N ATOM 505 CA PHE A 41 -9.566 1.442 -3.287 1.00 73.43 C ATOM 506 C PHE A 41 -9.634 2.950 -3.205 1.00 20.41 C ATOM 507 O PHE A 41 -9.901 3.607 -4.194 1.00 51.31 O ATOM 508 CB PHE A 41 -8.099 0.995 -3.276 1.00 73.34 C ATOM 509 CG PHE A 41 -7.930 -0.487 -3.302 1.00 13.03 C ATOM 510 CD1 PHE A 41 -8.406 -1.239 -2.267 1.00 41.14 C ATOM 511 CD2 PHE A 41 -7.295 -1.125 -4.357 1.00 41.43 C ATOM 512 CE1 PHE A 41 -8.268 -2.597 -2.254 1.00 2.21 C ATOM 513 CE2 PHE A 41 -7.150 -2.500 -4.359 1.00 23.41 C ATOM 514 CZ PHE A 41 -7.639 -3.239 -3.301 1.00 33.34 C ATOM 0 H PHE A 41 -9.898 1.434 -5.340 1.00 74.41 H new ATOM 0 HA PHE A 41 -10.082 1.018 -2.426 1.00 73.43 H new ATOM 0 HB2 PHE A 41 -7.589 1.426 -4.137 1.00 73.34 H new ATOM 0 HB3 PHE A 41 -7.612 1.393 -2.385 1.00 73.34 H new ATOM 0 HD1 PHE A 41 -8.902 -0.750 -1.442 1.00 41.14 H new ATOM 0 HD2 PHE A 41 -6.911 -0.544 -5.183 1.00 41.43 H new ATOM 0 HE1 PHE A 41 -8.652 -3.170 -1.423 1.00 2.21 H new ATOM 0 HE2 PHE A 41 -6.657 -2.993 -5.184 1.00 23.41 H new ATOM 0 HZ PHE A 41 -7.530 -4.313 -3.293 1.00 33.34 H new ATOM 524 N ALA A 42 -9.376 3.493 -2.040 1.00 21.11 N ATOM 525 CA ALA A 42 -9.417 4.933 -1.856 1.00 30.34 C ATOM 526 C ALA A 42 -8.014 5.462 -1.897 1.00 23.22 C ATOM 527 O ALA A 42 -7.201 5.115 -1.075 1.00 41.11 O ATOM 528 CB ALA A 42 -10.080 5.289 -0.528 1.00 61.31 C ATOM 0 H ALA A 42 -9.135 2.964 -1.202 1.00 21.11 H new ATOM 0 HA ALA A 42 -10.007 5.385 -2.654 1.00 30.34 H new ATOM 0 HB1 ALA A 42 -10.100 6.372 -0.410 1.00 61.31 H new ATOM 0 HB2 ALA A 42 -11.099 4.904 -0.515 1.00 61.31 H new ATOM 0 HB3 ALA A 42 -9.514 4.846 0.291 1.00 61.31 H new ATOM 534 N THR A 43 -7.728 6.273 -2.849 1.00 52.41 N ATOM 535 CA THR A 43 -6.403 6.755 -3.015 1.00 53.42 C ATOM 536 C THR A 43 -6.343 8.282 -3.044 1.00 11.41 C ATOM 537 O THR A 43 -7.261 8.951 -3.544 1.00 23.22 O ATOM 538 CB THR A 43 -5.729 6.121 -4.273 1.00 40.43 C ATOM 539 OG1 THR A 43 -4.399 6.607 -4.450 1.00 75.44 O ATOM 540 CG2 THR A 43 -6.536 6.370 -5.523 1.00 42.55 C ATOM 0 H THR A 43 -8.400 6.621 -3.533 1.00 52.41 H new ATOM 0 HA THR A 43 -5.832 6.442 -2.141 1.00 53.42 H new ATOM 0 HB THR A 43 -5.688 5.046 -4.099 1.00 40.43 H new ATOM 0 HG1 THR A 43 -3.902 6.512 -3.611 1.00 75.44 H new ATOM 0 HG21 THR A 43 -6.035 5.914 -6.377 1.00 42.55 H new ATOM 0 HG22 THR A 43 -7.528 5.933 -5.409 1.00 42.55 H new ATOM 0 HG23 THR A 43 -6.629 7.443 -5.688 1.00 42.55 H new ATOM 548 N VAL A 44 -5.278 8.814 -2.459 1.00 25.14 N ATOM 549 CA VAL A 44 -5.003 10.230 -2.416 1.00 0.03 C ATOM 550 C VAL A 44 -3.574 10.496 -2.880 1.00 62.22 C ATOM 551 O VAL A 44 -2.630 9.878 -2.391 1.00 24.41 O ATOM 552 CB VAL A 44 -5.209 10.824 -0.988 1.00 61.31 C ATOM 553 CG1 VAL A 44 -6.660 10.867 -0.621 1.00 42.34 C ATOM 554 CG2 VAL A 44 -4.467 10.021 0.048 1.00 71.43 C ATOM 0 H VAL A 44 -4.567 8.251 -1.991 1.00 25.14 H new ATOM 0 HA VAL A 44 -5.710 10.721 -3.085 1.00 0.03 H new ATOM 0 HB VAL A 44 -4.814 11.840 -1.008 1.00 61.31 H new ATOM 0 HG11 VAL A 44 -6.770 11.286 0.379 1.00 42.34 H new ATOM 0 HG12 VAL A 44 -7.198 11.489 -1.336 1.00 42.34 H new ATOM 0 HG13 VAL A 44 -7.070 9.857 -0.639 1.00 42.34 H new ATOM 0 HG21 VAL A 44 -4.629 10.459 1.033 1.00 71.43 H new ATOM 0 HG22 VAL A 44 -4.832 8.994 0.043 1.00 71.43 H new ATOM 0 HG23 VAL A 44 -3.401 10.028 -0.181 1.00 71.43 H new ATOM 564 N GLU A 45 -3.414 11.376 -3.820 1.00 65.30 N ATOM 565 CA GLU A 45 -2.095 11.708 -4.302 1.00 41.20 C ATOM 566 C GLU A 45 -1.736 13.146 -3.986 1.00 22.04 C ATOM 567 O GLU A 45 -2.497 14.087 -4.270 1.00 51.30 O ATOM 568 CB GLU A 45 -1.909 11.357 -5.780 1.00 10.15 C ATOM 569 CG GLU A 45 -2.884 12.010 -6.728 1.00 31.31 C ATOM 570 CD GLU A 45 -2.672 11.550 -8.145 1.00 51.15 C ATOM 571 OE1 GLU A 45 -3.275 10.532 -8.546 1.00 23.55 O ATOM 572 OE2 GLU A 45 -1.883 12.183 -8.879 1.00 52.02 O ATOM 0 H GLU A 45 -4.176 11.881 -4.273 1.00 65.30 H new ATOM 0 HA GLU A 45 -1.385 11.082 -3.761 1.00 41.20 H new ATOM 0 HB2 GLU A 45 -0.898 11.635 -6.077 1.00 10.15 H new ATOM 0 HB3 GLU A 45 -1.988 10.276 -5.892 1.00 10.15 H new ATOM 0 HG2 GLU A 45 -3.903 11.779 -6.419 1.00 31.31 H new ATOM 0 HG3 GLU A 45 -2.773 13.093 -6.676 1.00 31.31 H new ATOM 579 N VAL A 46 -0.598 13.305 -3.383 1.00 12.42 N ATOM 580 CA VAL A 46 -0.127 14.587 -2.938 1.00 34.11 C ATOM 581 C VAL A 46 1.090 14.986 -3.758 1.00 23.34 C ATOM 582 O VAL A 46 1.934 14.138 -4.086 1.00 50.43 O ATOM 583 CB VAL A 46 0.266 14.542 -1.425 1.00 40.12 C ATOM 584 CG1 VAL A 46 0.650 15.914 -0.917 1.00 41.12 C ATOM 585 CG2 VAL A 46 -0.858 13.955 -0.584 1.00 64.31 C ATOM 0 H VAL A 46 0.042 12.537 -3.181 1.00 12.42 H new ATOM 0 HA VAL A 46 -0.927 15.316 -3.069 1.00 34.11 H new ATOM 0 HB VAL A 46 1.136 13.892 -1.332 1.00 40.12 H new ATOM 0 HG11 VAL A 46 0.918 15.850 0.138 1.00 41.12 H new ATOM 0 HG12 VAL A 46 1.502 16.287 -1.486 1.00 41.12 H new ATOM 0 HG13 VAL A 46 -0.193 16.595 -1.036 1.00 41.12 H new ATOM 0 HG21 VAL A 46 -0.557 13.936 0.463 1.00 64.31 H new ATOM 0 HG22 VAL A 46 -1.753 14.568 -0.693 1.00 64.31 H new ATOM 0 HG23 VAL A 46 -1.071 12.940 -0.919 1.00 64.31 H new ATOM 595 N THR A 47 1.172 16.250 -4.100 1.00 2.12 N ATOM 596 CA THR A 47 2.286 16.774 -4.847 1.00 1.45 C ATOM 597 C THR A 47 2.780 18.047 -4.183 1.00 42.03 C ATOM 598 O THR A 47 2.146 18.520 -3.210 1.00 34.25 O ATOM 599 CB THR A 47 1.918 17.059 -6.322 1.00 11.24 C ATOM 600 OG1 THR A 47 0.759 17.919 -6.396 1.00 24.35 O ATOM 601 CG2 THR A 47 1.659 15.774 -7.097 1.00 63.25 C ATOM 0 H THR A 47 0.464 16.945 -3.866 1.00 2.12 H new ATOM 0 HA THR A 47 3.072 16.019 -4.850 1.00 1.45 H new ATOM 0 HB THR A 47 2.770 17.562 -6.779 1.00 11.24 H new ATOM 0 HG1 THR A 47 0.539 18.092 -7.335 1.00 24.35 H new ATOM 0 HG21 THR A 47 1.404 16.016 -8.129 1.00 63.25 H new ATOM 0 HG22 THR A 47 2.555 15.153 -7.081 1.00 63.25 H new ATOM 0 HG23 THR A 47 0.833 15.232 -6.637 1.00 63.25 H new ATOM 609 N ASP A 48 3.922 18.585 -4.675 1.00 4.12 N ATOM 610 CA ASP A 48 4.570 19.825 -4.151 1.00 21.13 C ATOM 611 C ASP A 48 5.221 19.588 -2.797 1.00 72.32 C ATOM 612 O ASP A 48 6.326 20.059 -2.521 1.00 11.42 O ATOM 613 CB ASP A 48 3.581 21.010 -4.096 1.00 25.04 C ATOM 614 CG ASP A 48 4.158 22.260 -3.460 1.00 14.24 C ATOM 615 OD1 ASP A 48 4.840 23.043 -4.160 1.00 65.33 O ATOM 616 OD2 ASP A 48 3.910 22.497 -2.251 1.00 34.33 O ATOM 0 H ASP A 48 4.430 18.170 -5.456 1.00 4.12 H new ATOM 0 HA ASP A 48 5.359 20.092 -4.854 1.00 21.13 H new ATOM 0 HB2 ASP A 48 3.255 21.246 -5.109 1.00 25.04 H new ATOM 0 HB3 ASP A 48 2.695 20.706 -3.539 1.00 25.04 H new ATOM 621 N LYS A 49 4.547 18.840 -1.993 1.00 44.01 N ATOM 622 CA LYS A 49 4.982 18.499 -0.684 1.00 3.41 C ATOM 623 C LYS A 49 5.741 17.167 -0.708 1.00 33.23 C ATOM 624 O LYS A 49 5.250 16.182 -1.262 1.00 25.30 O ATOM 625 CB LYS A 49 3.764 18.451 0.247 1.00 43.21 C ATOM 626 CG LYS A 49 3.089 19.817 0.397 1.00 43.11 C ATOM 627 CD LYS A 49 1.819 19.779 1.243 1.00 50.30 C ATOM 628 CE LYS A 49 0.678 19.031 0.554 1.00 61.25 C ATOM 629 NZ LYS A 49 0.265 19.679 -0.719 1.00 31.44 N ATOM 0 H LYS A 49 3.644 18.434 -2.239 1.00 44.01 H new ATOM 0 HA LYS A 49 5.673 19.253 -0.307 1.00 3.41 H new ATOM 0 HB2 LYS A 49 3.042 17.733 -0.141 1.00 43.21 H new ATOM 0 HB3 LYS A 49 4.074 18.093 1.228 1.00 43.21 H new ATOM 0 HG2 LYS A 49 3.795 20.515 0.847 1.00 43.11 H new ATOM 0 HG3 LYS A 49 2.845 20.204 -0.593 1.00 43.11 H new ATOM 0 HD2 LYS A 49 2.037 19.302 2.198 1.00 50.30 H new ATOM 0 HD3 LYS A 49 1.501 20.799 1.461 1.00 50.30 H new ATOM 0 HE2 LYS A 49 0.988 18.006 0.353 1.00 61.25 H new ATOM 0 HE3 LYS A 49 -0.178 18.979 1.227 1.00 61.25 H new ATOM 0 HZ1 LYS A 49 -0.723 19.431 -0.930 1.00 31.44 H new ATOM 0 HZ2 LYS A 49 0.351 20.711 -0.627 1.00 31.44 H new ATOM 0 HZ3 LYS A 49 0.877 19.348 -1.492 1.00 31.44 H new ATOM 643 N PRO A 50 6.969 17.153 -0.134 1.00 30.40 N ATOM 644 CA PRO A 50 7.841 15.950 -0.043 1.00 11.11 C ATOM 645 C PRO A 50 7.141 14.775 0.635 1.00 23.31 C ATOM 646 O PRO A 50 6.188 14.980 1.368 1.00 10.50 O ATOM 647 CB PRO A 50 9.004 16.423 0.836 1.00 65.02 C ATOM 648 CG PRO A 50 9.042 17.893 0.656 1.00 1.23 C ATOM 649 CD PRO A 50 7.619 18.327 0.485 1.00 24.25 C ATOM 0 HA PRO A 50 8.135 15.592 -1.030 1.00 11.11 H new ATOM 0 HB2 PRO A 50 8.844 16.157 1.881 1.00 65.02 H new ATOM 0 HB3 PRO A 50 9.944 15.963 0.530 1.00 65.02 H new ATOM 0 HG2 PRO A 50 9.497 18.380 1.519 1.00 1.23 H new ATOM 0 HG3 PRO A 50 9.639 18.164 -0.215 1.00 1.23 H new ATOM 0 HD2 PRO A 50 7.160 18.582 1.440 1.00 24.25 H new ATOM 0 HD3 PRO A 50 7.543 19.209 -0.151 1.00 24.25 H new ATOM 657 N VAL A 51 7.636 13.554 0.392 1.00 15.45 N ATOM 658 CA VAL A 51 7.069 12.306 0.969 1.00 42.23 C ATOM 659 C VAL A 51 6.791 12.437 2.484 1.00 44.21 C ATOM 660 O VAL A 51 5.753 11.969 2.968 1.00 13.31 O ATOM 661 CB VAL A 51 8.020 11.093 0.682 1.00 70.41 C ATOM 662 CG1 VAL A 51 7.630 9.843 1.473 1.00 71.03 C ATOM 663 CG2 VAL A 51 8.005 10.777 -0.806 1.00 22.32 C ATOM 0 H VAL A 51 8.443 13.393 -0.211 1.00 15.45 H new ATOM 0 HA VAL A 51 6.110 12.128 0.483 1.00 42.23 H new ATOM 0 HB VAL A 51 9.021 11.382 1.002 1.00 70.41 H new ATOM 0 HG11 VAL A 51 8.320 9.033 1.237 1.00 71.03 H new ATOM 0 HG12 VAL A 51 7.675 10.059 2.540 1.00 71.03 H new ATOM 0 HG13 VAL A 51 6.616 9.545 1.206 1.00 71.03 H new ATOM 0 HG21 VAL A 51 8.666 9.934 -1.006 1.00 22.32 H new ATOM 0 HG22 VAL A 51 6.991 10.524 -1.114 1.00 22.32 H new ATOM 0 HG23 VAL A 51 8.348 11.647 -1.366 1.00 22.32 H new ATOM 673 N ASP A 52 7.693 13.099 3.211 1.00 72.14 N ATOM 674 CA ASP A 52 7.491 13.358 4.651 1.00 61.13 C ATOM 675 C ASP A 52 6.181 14.100 4.896 1.00 3.25 C ATOM 676 O ASP A 52 5.350 13.671 5.697 1.00 13.15 O ATOM 677 CB ASP A 52 8.651 14.183 5.240 1.00 21.33 C ATOM 678 CG ASP A 52 9.949 13.423 5.368 1.00 34.33 C ATOM 679 OD1 ASP A 52 10.659 13.242 4.356 1.00 72.32 O ATOM 680 OD2 ASP A 52 10.301 13.022 6.505 1.00 3.23 O ATOM 0 H ASP A 52 8.567 13.466 2.836 1.00 72.14 H new ATOM 0 HA ASP A 52 7.456 12.388 5.146 1.00 61.13 H new ATOM 0 HB2 ASP A 52 8.816 15.058 4.611 1.00 21.33 H new ATOM 0 HB3 ASP A 52 8.359 14.549 6.224 1.00 21.33 H new ATOM 685 N GLU A 53 5.987 15.175 4.164 1.00 45.45 N ATOM 686 CA GLU A 53 4.803 16.009 4.288 1.00 53.53 C ATOM 687 C GLU A 53 3.583 15.361 3.652 1.00 60.53 C ATOM 688 O GLU A 53 2.501 15.350 4.237 1.00 61.35 O ATOM 689 CB GLU A 53 5.059 17.374 3.663 1.00 51.33 C ATOM 690 CG GLU A 53 6.058 18.218 4.423 1.00 34.24 C ATOM 691 CD GLU A 53 5.557 18.574 5.805 1.00 42.41 C ATOM 692 OE1 GLU A 53 4.722 19.491 5.918 1.00 15.15 O ATOM 693 OE2 GLU A 53 5.996 17.954 6.799 1.00 22.13 O ATOM 0 H GLU A 53 6.649 15.501 3.460 1.00 45.45 H new ATOM 0 HA GLU A 53 4.593 16.129 5.351 1.00 53.53 H new ATOM 0 HB2 GLU A 53 5.417 17.234 2.643 1.00 51.33 H new ATOM 0 HB3 GLU A 53 4.115 17.916 3.598 1.00 51.33 H new ATOM 0 HG2 GLU A 53 7.001 17.678 4.506 1.00 34.24 H new ATOM 0 HG3 GLU A 53 6.262 19.131 3.864 1.00 34.24 H new ATOM 700 N ALA A 54 3.771 14.806 2.472 1.00 71.54 N ATOM 701 CA ALA A 54 2.717 14.192 1.712 1.00 42.21 C ATOM 702 C ALA A 54 2.022 13.093 2.491 1.00 51.34 C ATOM 703 O ALA A 54 0.796 13.020 2.490 1.00 25.21 O ATOM 704 CB ALA A 54 3.266 13.665 0.401 1.00 53.32 C ATOM 0 H ALA A 54 4.680 14.772 2.011 1.00 71.54 H new ATOM 0 HA ALA A 54 1.966 14.953 1.502 1.00 42.21 H new ATOM 0 HB1 ALA A 54 2.462 13.201 -0.170 1.00 53.32 H new ATOM 0 HB2 ALA A 54 3.690 14.489 -0.173 1.00 53.32 H new ATOM 0 HB3 ALA A 54 4.041 12.926 0.602 1.00 53.32 H new ATOM 710 N LEU A 55 2.790 12.261 3.183 1.00 25.43 N ATOM 711 CA LEU A 55 2.221 11.188 3.953 1.00 21.21 C ATOM 712 C LEU A 55 1.348 11.737 5.083 1.00 13.14 C ATOM 713 O LEU A 55 0.178 11.374 5.207 1.00 22.54 O ATOM 714 CB LEU A 55 3.324 10.288 4.514 1.00 41.13 C ATOM 715 CG LEU A 55 2.849 9.123 5.371 1.00 41.23 C ATOM 716 CD1 LEU A 55 1.965 8.177 4.569 1.00 3.53 C ATOM 717 CD2 LEU A 55 4.017 8.380 5.986 1.00 13.15 C ATOM 0 H LEU A 55 3.808 12.317 3.220 1.00 25.43 H new ATOM 0 HA LEU A 55 1.590 10.591 3.295 1.00 21.21 H new ATOM 0 HB2 LEU A 55 3.903 9.890 3.680 1.00 41.13 H new ATOM 0 HB3 LEU A 55 4.001 10.901 5.109 1.00 41.13 H new ATOM 0 HG LEU A 55 2.251 9.535 6.184 1.00 41.23 H new ATOM 0 HD11 LEU A 55 1.640 7.354 5.206 1.00 3.53 H new ATOM 0 HD12 LEU A 55 1.093 8.718 4.202 1.00 3.53 H new ATOM 0 HD13 LEU A 55 2.528 7.781 3.724 1.00 3.53 H new ATOM 0 HD21 LEU A 55 3.644 7.554 6.592 1.00 13.15 H new ATOM 0 HD22 LEU A 55 4.657 7.990 5.195 1.00 13.15 H new ATOM 0 HD23 LEU A 55 4.591 9.061 6.614 1.00 13.15 H new ATOM 729 N ARG A 56 1.907 12.643 5.865 1.00 3.24 N ATOM 730 CA ARG A 56 1.200 13.230 6.999 1.00 72.43 C ATOM 731 C ARG A 56 0.012 14.074 6.588 1.00 74.10 C ATOM 732 O ARG A 56 -0.887 14.281 7.358 1.00 71.25 O ATOM 733 CB ARG A 56 2.154 13.970 7.954 1.00 23.20 C ATOM 734 CG ARG A 56 3.042 15.056 7.339 1.00 12.20 C ATOM 735 CD ARG A 56 2.597 16.482 7.674 1.00 63.11 C ATOM 736 NE ARG A 56 1.294 16.867 7.128 1.00 24.43 N ATOM 737 CZ ARG A 56 0.690 18.032 7.403 1.00 30.41 C ATOM 738 NH1 ARG A 56 1.263 18.883 8.248 1.00 31.31 N ATOM 739 NH2 ARG A 56 -0.476 18.346 6.835 1.00 34.52 N ATOM 0 H ARG A 56 2.856 12.993 5.737 1.00 3.24 H new ATOM 0 HA ARG A 56 0.781 12.395 7.561 1.00 72.43 H new ATOM 0 HB2 ARG A 56 1.557 14.426 8.744 1.00 23.20 H new ATOM 0 HB3 ARG A 56 2.800 13.231 8.429 1.00 23.20 H new ATOM 0 HG2 ARG A 56 4.066 14.914 7.685 1.00 12.20 H new ATOM 0 HG3 ARG A 56 3.052 14.934 6.256 1.00 12.20 H new ATOM 0 HD2 ARG A 56 2.567 16.592 8.758 1.00 63.11 H new ATOM 0 HD3 ARG A 56 3.350 17.178 7.304 1.00 63.11 H new ATOM 0 HE ARG A 56 0.820 16.213 6.505 1.00 24.43 H new ATOM 0 HH11 ARG A 56 2.156 18.648 8.682 1.00 31.31 H new ATOM 0 HH12 ARG A 56 0.810 19.771 8.463 1.00 31.31 H new ATOM 0 HH21 ARG A 56 -0.917 17.697 6.184 1.00 34.52 H new ATOM 0 HH22 ARG A 56 -0.926 19.235 7.052 1.00 34.52 H new ATOM 753 N GLU A 57 0.043 14.585 5.389 1.00 51.14 N ATOM 754 CA GLU A 57 -1.058 15.380 4.864 1.00 61.35 C ATOM 755 C GLU A 57 -2.151 14.445 4.279 1.00 71.14 C ATOM 756 O GLU A 57 -3.344 14.723 4.354 1.00 20.13 O ATOM 757 CB GLU A 57 -0.484 16.387 3.834 1.00 40.13 C ATOM 758 CG GLU A 57 -1.425 17.475 3.311 1.00 61.15 C ATOM 759 CD GLU A 57 -2.457 16.994 2.337 1.00 60.01 C ATOM 760 OE1 GLU A 57 -2.088 16.549 1.244 1.00 50.25 O ATOM 761 OE2 GLU A 57 -3.658 17.015 2.649 1.00 74.15 O ATOM 0 H GLU A 57 0.823 14.469 4.742 1.00 51.14 H new ATOM 0 HA GLU A 57 -1.546 15.956 5.650 1.00 61.35 H new ATOM 0 HB2 GLU A 57 0.378 16.877 4.287 1.00 40.13 H new ATOM 0 HB3 GLU A 57 -0.116 15.821 2.979 1.00 40.13 H new ATOM 0 HG2 GLU A 57 -1.932 17.936 4.159 1.00 61.15 H new ATOM 0 HG3 GLU A 57 -0.829 18.253 2.834 1.00 61.15 H new ATOM 768 N ALA A 58 -1.731 13.340 3.718 1.00 65.20 N ATOM 769 CA ALA A 58 -2.656 12.353 3.159 1.00 4.21 C ATOM 770 C ALA A 58 -3.350 11.517 4.230 1.00 41.03 C ATOM 771 O ALA A 58 -4.492 11.120 4.036 1.00 24.51 O ATOM 772 CB ALA A 58 -1.964 11.472 2.143 1.00 60.25 C ATOM 0 H ALA A 58 -0.747 13.088 3.630 1.00 65.20 H new ATOM 0 HA ALA A 58 -3.439 12.916 2.651 1.00 4.21 H new ATOM 0 HB1 ALA A 58 -2.675 10.748 1.744 1.00 60.25 H new ATOM 0 HB2 ALA A 58 -1.579 12.088 1.330 1.00 60.25 H new ATOM 0 HB3 ALA A 58 -1.139 10.944 2.621 1.00 60.25 H new ATOM 778 N MET A 59 -2.661 11.245 5.339 1.00 72.34 N ATOM 779 CA MET A 59 -3.260 10.472 6.459 1.00 74.41 C ATOM 780 C MET A 59 -4.642 11.032 6.905 1.00 35.24 C ATOM 781 O MET A 59 -5.604 10.262 6.985 1.00 1.54 O ATOM 782 CB MET A 59 -2.304 10.309 7.663 1.00 44.24 C ATOM 783 CG MET A 59 -0.996 9.511 7.437 1.00 74.43 C ATOM 784 SD MET A 59 -1.189 7.730 7.049 1.00 43.44 S ATOM 785 CE MET A 59 -1.717 7.707 5.328 1.00 71.52 C ATOM 0 H MET A 59 -1.697 11.539 5.498 1.00 72.34 H new ATOM 0 HA MET A 59 -3.432 9.474 6.057 1.00 74.41 H new ATOM 0 HB2 MET A 59 -2.034 11.305 8.014 1.00 44.24 H new ATOM 0 HB3 MET A 59 -2.857 9.826 8.468 1.00 44.24 H new ATOM 0 HG2 MET A 59 -0.445 9.981 6.623 1.00 74.43 H new ATOM 0 HG3 MET A 59 -0.381 9.602 8.332 1.00 74.43 H new ATOM 0 HE1 MET A 59 -2.785 7.494 5.278 1.00 71.52 H new ATOM 0 HE2 MET A 59 -1.519 8.678 4.874 1.00 71.52 H new ATOM 0 HE3 MET A 59 -1.167 6.935 4.789 1.00 71.52 H new ATOM 795 N PRO A 60 -4.773 12.381 7.195 1.00 10.22 N ATOM 796 CA PRO A 60 -6.071 12.999 7.513 1.00 3.14 C ATOM 797 C PRO A 60 -7.119 12.684 6.450 1.00 1.40 C ATOM 798 O PRO A 60 -8.262 12.397 6.764 1.00 63.44 O ATOM 799 CB PRO A 60 -5.765 14.500 7.492 1.00 62.41 C ATOM 800 CG PRO A 60 -4.342 14.590 7.868 1.00 43.35 C ATOM 801 CD PRO A 60 -3.686 13.374 7.290 1.00 64.33 C ATOM 0 HA PRO A 60 -6.474 12.638 8.459 1.00 3.14 H new ATOM 0 HB2 PRO A 60 -5.943 14.928 6.505 1.00 62.41 H new ATOM 0 HB3 PRO A 60 -6.397 15.044 8.194 1.00 62.41 H new ATOM 0 HG2 PRO A 60 -3.891 15.501 7.475 1.00 43.35 H new ATOM 0 HG3 PRO A 60 -4.225 14.619 8.951 1.00 43.35 H new ATOM 0 HD2 PRO A 60 -3.252 13.583 6.312 1.00 64.33 H new ATOM 0 HD3 PRO A 60 -2.877 13.018 7.928 1.00 64.33 H new ATOM 809 N LYS A 61 -6.698 12.686 5.191 1.00 70.22 N ATOM 810 CA LYS A 61 -7.608 12.458 4.082 1.00 3.23 C ATOM 811 C LYS A 61 -8.103 11.015 4.040 1.00 51.34 C ATOM 812 O LYS A 61 -9.233 10.751 3.638 1.00 61.13 O ATOM 813 CB LYS A 61 -6.991 12.896 2.747 1.00 70.34 C ATOM 814 CG LYS A 61 -6.529 14.351 2.762 1.00 72.51 C ATOM 815 CD LYS A 61 -6.292 14.910 1.366 1.00 72.22 C ATOM 816 CE LYS A 61 -5.134 14.258 0.666 1.00 11.13 C ATOM 817 NZ LYS A 61 -3.869 14.563 1.332 1.00 22.23 N ATOM 0 H LYS A 61 -5.729 12.844 4.915 1.00 70.22 H new ATOM 0 HA LYS A 61 -8.484 13.084 4.249 1.00 3.23 H new ATOM 0 HB2 LYS A 61 -6.143 12.252 2.514 1.00 70.34 H new ATOM 0 HB3 LYS A 61 -7.723 12.759 1.951 1.00 70.34 H new ATOM 0 HG2 LYS A 61 -7.277 14.960 3.270 1.00 72.51 H new ATOM 0 HG3 LYS A 61 -5.609 14.429 3.341 1.00 72.51 H new ATOM 0 HD2 LYS A 61 -7.194 14.776 0.768 1.00 72.22 H new ATOM 0 HD3 LYS A 61 -6.111 15.983 1.435 1.00 72.22 H new ATOM 0 HE2 LYS A 61 -5.283 13.179 0.641 1.00 11.13 H new ATOM 0 HE3 LYS A 61 -5.094 14.598 -0.369 1.00 11.13 H new ATOM 0 HZ1 LYS A 61 -3.195 13.788 1.168 1.00 22.23 H new ATOM 0 HZ2 LYS A 61 -3.480 15.448 0.949 1.00 22.23 H new ATOM 0 HZ3 LYS A 61 -4.031 14.670 2.354 1.00 22.23 H new ATOM 831 N ILE A 62 -7.271 10.098 4.464 1.00 51.43 N ATOM 832 CA ILE A 62 -7.671 8.709 4.538 1.00 33.10 C ATOM 833 C ILE A 62 -8.576 8.466 5.753 1.00 60.23 C ATOM 834 O ILE A 62 -9.631 7.825 5.645 1.00 52.11 O ATOM 835 CB ILE A 62 -6.448 7.736 4.554 1.00 61.20 C ATOM 836 CG1 ILE A 62 -5.669 7.799 3.225 1.00 73.11 C ATOM 837 CG2 ILE A 62 -6.862 6.306 4.871 1.00 42.13 C ATOM 838 CD1 ILE A 62 -6.520 7.533 1.988 1.00 24.52 C ATOM 0 H ILE A 62 -6.314 10.284 4.763 1.00 51.43 H new ATOM 0 HA ILE A 62 -8.237 8.493 3.632 1.00 33.10 H new ATOM 0 HB ILE A 62 -5.786 8.069 5.354 1.00 61.20 H new ATOM 0 HG12 ILE A 62 -5.211 8.784 3.132 1.00 73.11 H new ATOM 0 HG13 ILE A 62 -4.858 7.072 3.257 1.00 73.11 H new ATOM 0 HG21 ILE A 62 -5.981 5.664 4.872 1.00 42.13 H new ATOM 0 HG22 ILE A 62 -7.336 6.273 5.852 1.00 42.13 H new ATOM 0 HG23 ILE A 62 -7.566 5.955 4.116 1.00 42.13 H new ATOM 0 HD11 ILE A 62 -5.896 7.596 1.097 1.00 24.52 H new ATOM 0 HD12 ILE A 62 -6.958 6.537 2.055 1.00 24.52 H new ATOM 0 HD13 ILE A 62 -7.316 8.276 1.927 1.00 24.52 H new ATOM 850 N MET A 63 -8.186 9.014 6.897 1.00 23.44 N ATOM 851 CA MET A 63 -8.943 8.810 8.130 1.00 71.03 C ATOM 852 C MET A 63 -10.289 9.526 8.107 1.00 12.43 C ATOM 853 O MET A 63 -11.239 9.054 8.702 1.00 23.42 O ATOM 854 CB MET A 63 -8.144 9.192 9.390 1.00 21.43 C ATOM 855 CG MET A 63 -7.728 10.649 9.461 1.00 74.30 C ATOM 856 SD MET A 63 -6.855 11.071 10.986 1.00 52.44 S ATOM 857 CE MET A 63 -8.136 10.737 12.202 1.00 44.44 C ATOM 0 H MET A 63 -7.357 9.599 6.999 1.00 23.44 H new ATOM 0 HA MET A 63 -9.136 7.738 8.181 1.00 71.03 H new ATOM 0 HB2 MET A 63 -8.744 8.957 10.269 1.00 21.43 H new ATOM 0 HB3 MET A 63 -7.250 8.570 9.439 1.00 21.43 H new ATOM 0 HG2 MET A 63 -7.088 10.879 8.609 1.00 74.30 H new ATOM 0 HG3 MET A 63 -8.614 11.277 9.372 1.00 74.30 H new ATOM 0 HE1 MET A 63 -7.924 11.292 13.116 1.00 44.44 H new ATOM 0 HE2 MET A 63 -9.103 11.046 11.806 1.00 44.44 H new ATOM 0 HE3 MET A 63 -8.159 9.670 12.423 1.00 44.44 H new ATOM 867 N LYS A 64 -10.378 10.654 7.405 1.00 43.11 N ATOM 868 CA LYS A 64 -11.640 11.391 7.332 1.00 4.23 C ATOM 869 C LYS A 64 -12.670 10.584 6.541 1.00 5.23 C ATOM 870 O LYS A 64 -13.866 10.651 6.813 1.00 34.44 O ATOM 871 CB LYS A 64 -11.438 12.804 6.728 1.00 60.52 C ATOM 872 CG LYS A 64 -11.038 12.818 5.255 1.00 25.35 C ATOM 873 CD LYS A 64 -10.593 14.203 4.777 1.00 32.34 C ATOM 874 CE LYS A 64 -11.645 15.268 4.981 1.00 23.23 C ATOM 875 NZ LYS A 64 -11.198 16.571 4.444 1.00 72.41 N ATOM 0 H LYS A 64 -9.606 11.073 6.886 1.00 43.11 H new ATOM 0 HA LYS A 64 -12.017 11.533 8.345 1.00 4.23 H new ATOM 0 HB2 LYS A 64 -12.363 13.369 6.845 1.00 60.52 H new ATOM 0 HB3 LYS A 64 -10.672 13.324 7.303 1.00 60.52 H new ATOM 0 HG2 LYS A 64 -10.228 12.106 5.096 1.00 25.35 H new ATOM 0 HG3 LYS A 64 -11.881 12.483 4.651 1.00 25.35 H new ATOM 0 HD2 LYS A 64 -9.686 14.490 5.309 1.00 32.34 H new ATOM 0 HD3 LYS A 64 -10.338 14.151 3.718 1.00 32.34 H new ATOM 0 HE2 LYS A 64 -12.570 14.967 4.490 1.00 23.23 H new ATOM 0 HE3 LYS A 64 -11.866 15.366 6.044 1.00 23.23 H new ATOM 0 HZ1 LYS A 64 -11.911 17.298 4.658 1.00 72.41 H new ATOM 0 HZ2 LYS A 64 -10.292 16.835 4.882 1.00 72.41 H new ATOM 0 HZ3 LYS A 64 -11.076 16.499 3.414 1.00 72.41 H new ATOM 889 N TYR A 65 -12.185 9.793 5.587 1.00 73.13 N ATOM 890 CA TYR A 65 -13.038 8.949 4.777 1.00 11.40 C ATOM 891 C TYR A 65 -13.751 7.903 5.634 1.00 42.42 C ATOM 892 O TYR A 65 -14.982 7.848 5.651 1.00 1.12 O ATOM 893 CB TYR A 65 -12.232 8.297 3.630 1.00 72.51 C ATOM 894 CG TYR A 65 -12.999 7.253 2.831 1.00 5.13 C ATOM 895 CD1 TYR A 65 -14.107 7.595 2.063 1.00 23.11 C ATOM 896 CD2 TYR A 65 -12.605 5.919 2.852 1.00 63.34 C ATOM 897 CE1 TYR A 65 -14.801 6.634 1.347 1.00 72.42 C ATOM 898 CE2 TYR A 65 -13.289 4.959 2.140 1.00 32.33 C ATOM 899 CZ TYR A 65 -14.386 5.317 1.393 1.00 13.42 C ATOM 900 OH TYR A 65 -15.069 4.357 0.692 1.00 21.00 O ATOM 0 H TYR A 65 -11.193 9.724 5.360 1.00 73.13 H new ATOM 0 HA TYR A 65 -13.808 9.574 4.325 1.00 11.40 H new ATOM 0 HB2 TYR A 65 -11.894 9.079 2.951 1.00 72.51 H new ATOM 0 HB3 TYR A 65 -11.340 7.832 4.049 1.00 72.51 H new ATOM 0 HD1 TYR A 65 -14.431 8.625 2.024 1.00 23.11 H new ATOM 0 HD2 TYR A 65 -11.745 5.630 3.439 1.00 63.34 H new ATOM 0 HE1 TYR A 65 -15.661 6.912 0.756 1.00 72.42 H new ATOM 0 HE2 TYR A 65 -12.965 3.929 2.168 1.00 32.33 H new ATOM 0 HH TYR A 65 -15.622 4.785 0.006 1.00 21.00 H new ATOM 910 N VAL A 66 -12.987 7.116 6.368 1.00 4.04 N ATOM 911 CA VAL A 66 -13.567 6.064 7.212 1.00 63.13 C ATOM 912 C VAL A 66 -14.132 6.629 8.514 1.00 24.14 C ATOM 913 O VAL A 66 -14.895 5.972 9.203 1.00 24.02 O ATOM 914 CB VAL A 66 -12.554 4.924 7.526 1.00 74.44 C ATOM 915 CG1 VAL A 66 -12.117 4.232 6.251 1.00 71.25 C ATOM 916 CG2 VAL A 66 -11.339 5.452 8.289 1.00 21.11 C ATOM 0 H VAL A 66 -11.969 7.177 6.404 1.00 4.04 H new ATOM 0 HA VAL A 66 -14.385 5.635 6.632 1.00 63.13 H new ATOM 0 HB VAL A 66 -13.060 4.198 8.162 1.00 74.44 H new ATOM 0 HG11 VAL A 66 -11.409 3.439 6.492 1.00 71.25 H new ATOM 0 HG12 VAL A 66 -12.987 3.804 5.753 1.00 71.25 H new ATOM 0 HG13 VAL A 66 -11.640 4.955 5.590 1.00 71.25 H new ATOM 0 HG21 VAL A 66 -10.652 4.631 8.492 1.00 21.11 H new ATOM 0 HG22 VAL A 66 -10.833 6.208 7.689 1.00 21.11 H new ATOM 0 HG23 VAL A 66 -11.665 5.894 9.231 1.00 21.11 H new ATOM 926 N GLY A 67 -13.750 7.854 8.828 1.00 23.30 N ATOM 927 CA GLY A 67 -14.199 8.496 10.036 1.00 44.23 C ATOM 928 C GLY A 67 -15.633 8.958 9.962 1.00 52.35 C ATOM 929 O GLY A 67 -16.279 9.156 10.992 1.00 53.33 O ATOM 0 H GLY A 67 -13.126 8.422 8.255 1.00 23.30 H new ATOM 0 HA2 GLY A 67 -14.089 7.804 10.871 1.00 44.23 H new ATOM 0 HA3 GLY A 67 -13.558 9.352 10.245 1.00 44.23 H new ATOM 933 N GLY A 68 -16.137 9.146 8.763 1.00 35.44 N ATOM 934 CA GLY A 68 -17.512 9.558 8.629 1.00 70.24 C ATOM 935 C GLY A 68 -17.735 10.556 7.522 1.00 72.30 C ATOM 936 O GLY A 68 -18.868 10.786 7.121 1.00 71.35 O ATOM 0 H GLY A 68 -15.629 9.023 7.887 1.00 35.44 H new ATOM 0 HA2 GLY A 68 -18.130 8.679 8.445 1.00 70.24 H new ATOM 0 HA3 GLY A 68 -17.847 9.992 9.571 1.00 70.24 H new ATOM 940 N THR A 69 -16.663 11.126 6.992 1.00 45.33 N ATOM 941 CA THR A 69 -16.759 12.130 5.926 1.00 45.13 C ATOM 942 C THR A 69 -16.912 11.431 4.533 1.00 2.22 C ATOM 943 O THR A 69 -16.528 11.949 3.481 1.00 31.14 O ATOM 944 CB THR A 69 -15.505 13.054 5.972 1.00 51.12 C ATOM 945 OG1 THR A 69 -15.340 13.509 7.327 1.00 71.12 O ATOM 946 CG2 THR A 69 -15.685 14.291 5.086 1.00 40.31 C ATOM 0 H THR A 69 -15.708 10.913 7.280 1.00 45.33 H new ATOM 0 HA THR A 69 -17.645 12.746 6.079 1.00 45.13 H new ATOM 0 HB THR A 69 -14.644 12.488 5.616 1.00 51.12 H new ATOM 0 HG1 THR A 69 -14.554 14.092 7.383 1.00 71.12 H new ATOM 0 HG21 THR A 69 -14.791 14.912 5.143 1.00 40.31 H new ATOM 0 HG22 THR A 69 -15.845 13.979 4.054 1.00 40.31 H new ATOM 0 HG23 THR A 69 -16.547 14.863 5.430 1.00 40.31 H new ATOM 954 N ASN A 70 -17.510 10.272 4.549 1.00 30.42 N ATOM 955 CA ASN A 70 -17.819 9.559 3.340 1.00 13.42 C ATOM 956 C ASN A 70 -19.270 9.830 2.995 1.00 31.44 C ATOM 957 O ASN A 70 -20.040 10.235 3.858 1.00 32.13 O ATOM 958 CB ASN A 70 -17.554 8.055 3.465 1.00 4.33 C ATOM 959 CG ASN A 70 -18.310 7.401 4.596 1.00 23.13 C ATOM 960 OD1 ASN A 70 -19.450 6.989 4.430 1.00 22.20 O ATOM 961 ND2 ASN A 70 -17.662 7.251 5.723 1.00 1.40 N ATOM 0 H ASN A 70 -17.798 9.794 5.403 1.00 30.42 H new ATOM 0 HA ASN A 70 -17.165 9.911 2.542 1.00 13.42 H new ATOM 0 HB2 ASN A 70 -17.825 7.568 2.528 1.00 4.33 H new ATOM 0 HB3 ASN A 70 -16.486 7.893 3.611 1.00 4.33 H new ATOM 0 HD21 ASN A 70 -18.107 6.774 6.507 1.00 1.40 H new ATOM 0 HD22 ASN A 70 -16.712 7.611 5.817 1.00 1.40 H new ATOM 968 N ASP A 71 -19.647 9.600 1.763 1.00 35.12 N ATOM 969 CA ASP A 71 -20.996 9.958 1.280 1.00 13.22 C ATOM 970 C ASP A 71 -22.095 9.123 1.929 1.00 42.14 C ATOM 971 O ASP A 71 -23.191 9.618 2.190 1.00 44.43 O ATOM 972 CB ASP A 71 -21.071 9.826 -0.238 1.00 63.25 C ATOM 973 CG ASP A 71 -22.434 10.175 -0.805 1.00 22.54 C ATOM 974 OD1 ASP A 71 -23.300 9.270 -0.915 1.00 62.04 O ATOM 975 OD2 ASP A 71 -22.658 11.355 -1.152 1.00 62.12 O ATOM 0 H ASP A 71 -19.051 9.166 1.059 1.00 35.12 H new ATOM 0 HA ASP A 71 -21.166 10.996 1.567 1.00 13.22 H new ATOM 0 HB2 ASP A 71 -20.321 10.475 -0.689 1.00 63.25 H new ATOM 0 HB3 ASP A 71 -20.819 8.804 -0.520 1.00 63.25 H new ATOM 980 N LYS A 72 -21.784 7.883 2.230 1.00 23.43 N ATOM 981 CA LYS A 72 -22.765 6.965 2.798 1.00 52.13 C ATOM 982 C LYS A 72 -22.962 7.249 4.303 1.00 41.04 C ATOM 983 O LYS A 72 -23.914 6.763 4.930 1.00 44.54 O ATOM 984 CB LYS A 72 -22.310 5.511 2.558 1.00 1.21 C ATOM 985 CG LYS A 72 -23.301 4.429 3.000 1.00 70.03 C ATOM 986 CD LYS A 72 -24.597 4.446 2.189 1.00 2.43 C ATOM 987 CE LYS A 72 -24.354 4.101 0.717 1.00 30.01 C ATOM 988 NZ LYS A 72 -25.610 4.034 -0.059 1.00 23.24 N ATOM 0 H LYS A 72 -20.858 7.479 2.093 1.00 23.43 H new ATOM 0 HA LYS A 72 -23.726 7.113 2.306 1.00 52.13 H new ATOM 0 HB2 LYS A 72 -22.109 5.382 1.494 1.00 1.21 H new ATOM 0 HB3 LYS A 72 -21.368 5.352 3.082 1.00 1.21 H new ATOM 0 HG2 LYS A 72 -22.830 3.451 2.904 1.00 70.03 H new ATOM 0 HG3 LYS A 72 -23.536 4.567 4.055 1.00 70.03 H new ATOM 0 HD2 LYS A 72 -25.302 3.734 2.617 1.00 2.43 H new ATOM 0 HD3 LYS A 72 -25.057 5.432 2.260 1.00 2.43 H new ATOM 0 HE2 LYS A 72 -23.696 4.849 0.275 1.00 30.01 H new ATOM 0 HE3 LYS A 72 -23.838 3.143 0.651 1.00 30.01 H new ATOM 0 HZ1 LYS A 72 -25.394 3.798 -1.049 1.00 23.24 H new ATOM 0 HZ2 LYS A 72 -26.229 3.302 0.345 1.00 23.24 H new ATOM 0 HZ3 LYS A 72 -26.092 4.955 -0.020 1.00 23.24 H new ATOM 1002 N GLY A 73 -22.071 8.047 4.858 1.00 42.04 N ATOM 1003 CA GLY A 73 -22.137 8.406 6.256 1.00 74.33 C ATOM 1004 C GLY A 73 -21.807 7.245 7.160 1.00 53.45 C ATOM 1005 O GLY A 73 -22.391 7.093 8.229 1.00 14.12 O ATOM 0 H GLY A 73 -21.287 8.461 4.354 1.00 42.04 H new ATOM 0 HA2 GLY A 73 -21.445 9.225 6.452 1.00 74.33 H new ATOM 0 HA3 GLY A 73 -23.137 8.772 6.488 1.00 74.33 H new ATOM 1009 N VAL A 74 -20.879 6.432 6.723 1.00 64.02 N ATOM 1010 CA VAL A 74 -20.440 5.293 7.475 1.00 31.55 C ATOM 1011 C VAL A 74 -19.446 5.741 8.538 1.00 10.51 C ATOM 1012 O VAL A 74 -18.431 6.361 8.218 1.00 23.04 O ATOM 1013 CB VAL A 74 -19.783 4.248 6.532 1.00 20.11 C ATOM 1014 CG1 VAL A 74 -19.213 3.088 7.306 1.00 22.51 C ATOM 1015 CG2 VAL A 74 -20.794 3.744 5.521 1.00 74.44 C ATOM 0 H VAL A 74 -20.405 6.546 5.827 1.00 64.02 H new ATOM 0 HA VAL A 74 -21.299 4.829 7.959 1.00 31.55 H new ATOM 0 HB VAL A 74 -18.964 4.743 6.010 1.00 20.11 H new ATOM 0 HG11 VAL A 74 -18.761 2.376 6.615 1.00 22.51 H new ATOM 0 HG12 VAL A 74 -18.455 3.451 8.000 1.00 22.51 H new ATOM 0 HG13 VAL A 74 -20.010 2.596 7.864 1.00 22.51 H new ATOM 0 HG21 VAL A 74 -20.320 3.012 4.866 1.00 74.44 H new ATOM 0 HG22 VAL A 74 -21.629 3.277 6.043 1.00 74.44 H new ATOM 0 HG23 VAL A 74 -21.161 4.580 4.925 1.00 74.44 H new ATOM 1025 N GLY A 75 -19.754 5.448 9.784 1.00 31.24 N ATOM 1026 CA GLY A 75 -18.889 5.829 10.879 1.00 63.34 C ATOM 1027 C GLY A 75 -17.980 4.699 11.299 1.00 51.41 C ATOM 1028 O GLY A 75 -17.212 4.829 12.254 1.00 10.43 O ATOM 0 H GLY A 75 -20.597 4.947 10.063 1.00 31.24 H new ATOM 0 HA2 GLY A 75 -18.287 6.688 10.584 1.00 63.34 H new ATOM 0 HA3 GLY A 75 -19.496 6.142 11.729 1.00 63.34 H new ATOM 1032 N MET A 76 -18.082 3.588 10.598 1.00 74.45 N ATOM 1033 CA MET A 76 -17.254 2.430 10.855 1.00 13.30 C ATOM 1034 C MET A 76 -15.836 2.672 10.380 1.00 70.42 C ATOM 1035 O MET A 76 -15.531 2.561 9.179 1.00 43.11 O ATOM 1036 CB MET A 76 -17.838 1.165 10.199 1.00 34.23 C ATOM 1037 CG MET A 76 -16.973 -0.085 10.352 1.00 25.12 C ATOM 1038 SD MET A 76 -16.674 -0.535 12.072 1.00 4.14 S ATOM 1039 CE MET A 76 -15.629 -1.979 11.861 1.00 54.01 C ATOM 0 H MET A 76 -18.744 3.464 9.832 1.00 74.45 H new ATOM 0 HA MET A 76 -17.236 2.267 11.933 1.00 13.30 H new ATOM 0 HB2 MET A 76 -18.819 0.967 10.630 1.00 34.23 H new ATOM 0 HB3 MET A 76 -17.990 1.359 9.137 1.00 34.23 H new ATOM 0 HG2 MET A 76 -17.458 -0.919 9.844 1.00 25.12 H new ATOM 0 HG3 MET A 76 -16.017 0.079 9.855 1.00 25.12 H new ATOM 0 HE1 MET A 76 -15.357 -2.377 12.839 1.00 54.01 H new ATOM 0 HE2 MET A 76 -16.169 -2.740 11.297 1.00 54.01 H new ATOM 0 HE3 MET A 76 -14.726 -1.699 11.319 1.00 54.01 H new ATOM 1049 N GLY A 77 -14.993 3.036 11.308 1.00 4.13 N ATOM 1050 CA GLY A 77 -13.612 3.254 11.016 1.00 2.41 C ATOM 1051 C GLY A 77 -12.891 1.946 10.850 1.00 64.24 C ATOM 1052 O GLY A 77 -12.364 1.386 11.813 1.00 13.45 O ATOM 0 H GLY A 77 -15.248 3.188 12.284 1.00 4.13 H new ATOM 0 HA2 GLY A 77 -13.517 3.845 10.105 1.00 2.41 H new ATOM 0 HA3 GLY A 77 -13.152 3.829 11.819 1.00 2.41 H new ATOM 1056 N MET A 78 -12.871 1.449 9.644 1.00 4.25 N ATOM 1057 CA MET A 78 -12.236 0.189 9.365 1.00 33.40 C ATOM 1058 C MET A 78 -10.821 0.390 8.869 1.00 5.24 C ATOM 1059 O MET A 78 -10.564 1.183 7.980 1.00 40.54 O ATOM 1060 CB MET A 78 -13.124 -0.702 8.445 1.00 34.11 C ATOM 1061 CG MET A 78 -13.749 -0.026 7.194 1.00 60.45 C ATOM 1062 SD MET A 78 -12.587 0.490 5.922 1.00 62.42 S ATOM 1063 CE MET A 78 -13.706 1.143 4.676 1.00 45.15 C ATOM 0 H MET A 78 -13.291 1.901 8.832 1.00 4.25 H new ATOM 0 HA MET A 78 -12.139 -0.372 10.294 1.00 33.40 H new ATOM 0 HB2 MET A 78 -12.522 -1.546 8.108 1.00 34.11 H new ATOM 0 HB3 MET A 78 -13.934 -1.110 9.049 1.00 34.11 H new ATOM 0 HG2 MET A 78 -14.463 -0.719 6.748 1.00 60.45 H new ATOM 0 HG3 MET A 78 -14.314 0.848 7.520 1.00 60.45 H new ATOM 0 HE1 MET A 78 -13.131 1.502 3.823 1.00 45.15 H new ATOM 0 HE2 MET A 78 -14.386 0.356 4.350 1.00 45.15 H new ATOM 0 HE3 MET A 78 -14.281 1.967 5.099 1.00 45.15 H new ATOM 1073 N THR A 79 -9.896 -0.247 9.531 1.00 20.33 N ATOM 1074 CA THR A 79 -8.514 -0.080 9.216 1.00 72.03 C ATOM 1075 C THR A 79 -7.763 -1.405 8.984 1.00 31.52 C ATOM 1076 O THR A 79 -7.676 -2.254 9.875 1.00 34.24 O ATOM 1077 CB THR A 79 -7.819 0.772 10.294 1.00 1.20 C ATOM 1078 OG1 THR A 79 -8.539 2.015 10.419 1.00 34.44 O ATOM 1079 CG2 THR A 79 -6.375 1.076 9.906 1.00 21.32 C ATOM 0 H THR A 79 -10.082 -0.892 10.299 1.00 20.33 H new ATOM 0 HA THR A 79 -8.477 0.445 8.262 1.00 72.03 H new ATOM 0 HB THR A 79 -7.814 0.221 11.235 1.00 1.20 H new ATOM 0 HG1 THR A 79 -8.113 2.573 11.103 1.00 34.44 H new ATOM 0 HG21 THR A 79 -5.908 1.679 10.685 1.00 21.32 H new ATOM 0 HG22 THR A 79 -5.825 0.142 9.791 1.00 21.32 H new ATOM 0 HG23 THR A 79 -6.359 1.625 8.964 1.00 21.32 H new ATOM 1087 N VAL A 80 -7.251 -1.563 7.799 1.00 65.44 N ATOM 1088 CA VAL A 80 -6.331 -2.637 7.469 1.00 21.41 C ATOM 1089 C VAL A 80 -5.023 -1.926 7.100 1.00 31.42 C ATOM 1090 O VAL A 80 -4.999 -0.692 7.186 1.00 62.55 O ATOM 1091 CB VAL A 80 -6.858 -3.529 6.299 1.00 65.01 C ATOM 1092 CG1 VAL A 80 -8.165 -4.205 6.680 1.00 13.23 C ATOM 1093 CG2 VAL A 80 -7.020 -2.730 5.025 1.00 74.11 C ATOM 0 H VAL A 80 -7.458 -0.945 7.015 1.00 65.44 H new ATOM 0 HA VAL A 80 -6.202 -3.328 8.302 1.00 21.41 H new ATOM 0 HB VAL A 80 -6.113 -4.303 6.113 1.00 65.01 H new ATOM 0 HG11 VAL A 80 -8.512 -4.820 5.850 1.00 13.23 H new ATOM 0 HG12 VAL A 80 -8.008 -4.834 7.556 1.00 13.23 H new ATOM 0 HG13 VAL A 80 -8.914 -3.447 6.907 1.00 13.23 H new ATOM 0 HG21 VAL A 80 -7.388 -3.381 4.232 1.00 74.11 H new ATOM 0 HG22 VAL A 80 -7.732 -1.921 5.191 1.00 74.11 H new ATOM 0 HG23 VAL A 80 -6.057 -2.311 4.733 1.00 74.11 H new ATOM 1103 N PRO A 81 -3.904 -2.601 6.719 1.00 73.34 N ATOM 1104 CA PRO A 81 -2.698 -1.858 6.391 1.00 20.01 C ATOM 1105 C PRO A 81 -2.919 -0.938 5.192 1.00 42.12 C ATOM 1106 O PRO A 81 -3.526 -1.333 4.173 1.00 23.22 O ATOM 1107 CB PRO A 81 -1.666 -2.936 6.047 1.00 11.42 C ATOM 1108 CG PRO A 81 -2.212 -4.194 6.619 1.00 61.12 C ATOM 1109 CD PRO A 81 -3.711 -4.055 6.598 1.00 21.04 C ATOM 0 HA PRO A 81 -2.383 -1.216 7.213 1.00 20.01 H new ATOM 0 HB2 PRO A 81 -1.529 -3.020 4.969 1.00 11.42 H new ATOM 0 HB3 PRO A 81 -0.692 -2.699 6.475 1.00 11.42 H new ATOM 0 HG2 PRO A 81 -1.894 -5.057 6.034 1.00 61.12 H new ATOM 0 HG3 PRO A 81 -1.850 -4.347 7.636 1.00 61.12 H new ATOM 0 HD2 PRO A 81 -4.141 -4.445 5.675 1.00 21.04 H new ATOM 0 HD3 PRO A 81 -4.179 -4.595 7.421 1.00 21.04 H new ATOM 1117 N VAL A 82 -2.396 0.245 5.309 1.00 32.12 N ATOM 1118 CA VAL A 82 -2.513 1.275 4.301 1.00 10.52 C ATOM 1119 C VAL A 82 -1.197 1.330 3.561 1.00 13.12 C ATOM 1120 O VAL A 82 -0.148 1.182 4.178 1.00 23.13 O ATOM 1121 CB VAL A 82 -2.788 2.660 4.965 1.00 23.22 C ATOM 1122 CG1 VAL A 82 -3.009 3.748 3.923 1.00 53.34 C ATOM 1123 CG2 VAL A 82 -3.968 2.582 5.928 1.00 22.34 C ATOM 0 H VAL A 82 -1.860 0.536 6.127 1.00 32.12 H new ATOM 0 HA VAL A 82 -3.339 1.050 3.627 1.00 10.52 H new ATOM 0 HB VAL A 82 -1.900 2.928 5.537 1.00 23.22 H new ATOM 0 HG11 VAL A 82 -3.198 4.698 4.423 1.00 53.34 H new ATOM 0 HG12 VAL A 82 -2.121 3.838 3.297 1.00 53.34 H new ATOM 0 HG13 VAL A 82 -3.867 3.488 3.302 1.00 53.34 H new ATOM 0 HG21 VAL A 82 -4.137 3.561 6.376 1.00 22.34 H new ATOM 0 HG22 VAL A 82 -4.861 2.272 5.385 1.00 22.34 H new ATOM 0 HG23 VAL A 82 -3.750 1.857 6.712 1.00 22.34 H new ATOM 1133 N SER A 83 -1.231 1.532 2.276 1.00 52.35 N ATOM 1134 CA SER A 83 -0.026 1.513 1.503 1.00 52.52 C ATOM 1135 C SER A 83 0.091 2.796 0.698 1.00 25.13 C ATOM 1136 O SER A 83 -0.902 3.361 0.291 1.00 61.23 O ATOM 1137 CB SER A 83 -0.034 0.281 0.585 1.00 12.24 C ATOM 1138 OG SER A 83 1.187 0.134 -0.111 1.00 1.11 O ATOM 0 H SER A 83 -2.081 1.712 1.742 1.00 52.35 H new ATOM 0 HA SER A 83 0.839 1.450 2.163 1.00 52.52 H new ATOM 0 HB2 SER A 83 -0.223 -0.613 1.179 1.00 12.24 H new ATOM 0 HB3 SER A 83 -0.852 0.367 -0.131 1.00 12.24 H new ATOM 0 HG SER A 83 1.896 0.612 0.368 1.00 1.11 H new ATOM 1144 N PHE A 84 1.283 3.265 0.503 1.00 43.13 N ATOM 1145 CA PHE A 84 1.493 4.452 -0.286 1.00 51.51 C ATOM 1146 C PHE A 84 2.645 4.248 -1.232 1.00 43.03 C ATOM 1147 O PHE A 84 3.630 3.589 -0.885 1.00 44.23 O ATOM 1148 CB PHE A 84 1.683 5.715 0.591 1.00 61.13 C ATOM 1149 CG PHE A 84 2.879 5.708 1.515 1.00 35.43 C ATOM 1150 CD1 PHE A 84 2.820 5.073 2.740 1.00 1.10 C ATOM 1151 CD2 PHE A 84 4.054 6.356 1.160 1.00 12.35 C ATOM 1152 CE1 PHE A 84 3.908 5.078 3.595 1.00 11.14 C ATOM 1153 CE2 PHE A 84 5.142 6.362 2.010 1.00 50.31 C ATOM 1154 CZ PHE A 84 5.070 5.724 3.226 1.00 2.33 C ATOM 0 H PHE A 84 2.134 2.846 0.879 1.00 43.13 H new ATOM 0 HA PHE A 84 0.592 4.627 -0.874 1.00 51.51 H new ATOM 0 HB2 PHE A 84 1.762 6.581 -0.067 1.00 61.13 H new ATOM 0 HB3 PHE A 84 0.785 5.853 1.193 1.00 61.13 H new ATOM 0 HD1 PHE A 84 1.913 4.566 3.034 1.00 1.10 H new ATOM 0 HD2 PHE A 84 4.118 6.861 0.208 1.00 12.35 H new ATOM 0 HE1 PHE A 84 3.848 4.577 4.550 1.00 11.14 H new ATOM 0 HE2 PHE A 84 6.051 6.868 1.720 1.00 50.31 H new ATOM 0 HZ PHE A 84 5.921 5.729 3.891 1.00 2.33 H new ATOM 1164 N ALA A 85 2.513 4.789 -2.412 1.00 12.54 N ATOM 1165 CA ALA A 85 3.506 4.654 -3.434 1.00 31.43 C ATOM 1166 C ALA A 85 4.461 5.811 -3.392 1.00 3.50 C ATOM 1167 O ALA A 85 4.051 6.976 -3.271 1.00 64.11 O ATOM 1168 CB ALA A 85 2.848 4.585 -4.800 1.00 25.32 C ATOM 0 H ALA A 85 1.702 5.342 -2.691 1.00 12.54 H new ATOM 0 HA ALA A 85 4.059 3.731 -3.256 1.00 31.43 H new ATOM 0 HB1 ALA A 85 3.614 4.482 -5.568 1.00 25.32 H new ATOM 0 HB2 ALA A 85 2.178 3.726 -4.838 1.00 25.32 H new ATOM 0 HB3 ALA A 85 2.278 5.497 -4.976 1.00 25.32 H new ATOM 1174 N VAL A 86 5.711 5.487 -3.489 1.00 51.32 N ATOM 1175 CA VAL A 86 6.792 6.441 -3.514 1.00 64.15 C ATOM 1176 C VAL A 86 7.638 6.169 -4.741 1.00 33.32 C ATOM 1177 O VAL A 86 7.727 5.016 -5.195 1.00 41.33 O ATOM 1178 CB VAL A 86 7.662 6.327 -2.232 1.00 1.02 C ATOM 1179 CG1 VAL A 86 6.918 6.858 -1.030 1.00 10.13 C ATOM 1180 CG2 VAL A 86 7.983 4.881 -1.979 1.00 43.31 C ATOM 0 H VAL A 86 6.026 4.519 -3.556 1.00 51.32 H new ATOM 0 HA VAL A 86 6.385 7.451 -3.550 1.00 64.15 H new ATOM 0 HB VAL A 86 8.571 6.909 -2.383 1.00 1.02 H new ATOM 0 HG11 VAL A 86 7.547 6.768 -0.144 1.00 10.13 H new ATOM 0 HG12 VAL A 86 6.667 7.906 -1.192 1.00 10.13 H new ATOM 0 HG13 VAL A 86 6.003 6.284 -0.885 1.00 10.13 H new ATOM 0 HG21 VAL A 86 8.594 4.796 -1.080 1.00 43.31 H new ATOM 0 HG22 VAL A 86 7.058 4.321 -1.844 1.00 43.31 H new ATOM 0 HG23 VAL A 86 8.531 4.476 -2.830 1.00 43.31 H new ATOM 1190 N PHE A 87 8.253 7.187 -5.281 1.00 3.13 N ATOM 1191 CA PHE A 87 9.011 7.020 -6.502 1.00 41.45 C ATOM 1192 C PHE A 87 10.458 7.412 -6.280 1.00 14.44 C ATOM 1193 O PHE A 87 10.769 8.586 -6.166 1.00 2.22 O ATOM 1194 CB PHE A 87 8.408 7.877 -7.624 1.00 62.20 C ATOM 1195 CG PHE A 87 6.929 7.681 -7.802 1.00 35.44 C ATOM 1196 CD1 PHE A 87 6.424 6.500 -8.298 1.00 62.13 C ATOM 1197 CD2 PHE A 87 6.046 8.683 -7.448 1.00 22.44 C ATOM 1198 CE1 PHE A 87 5.064 6.320 -8.443 1.00 24.54 C ATOM 1199 CE2 PHE A 87 4.689 8.510 -7.586 1.00 12.34 C ATOM 1200 CZ PHE A 87 4.196 7.327 -8.083 1.00 54.35 C ATOM 0 H PHE A 87 8.248 8.134 -4.903 1.00 3.13 H new ATOM 0 HA PHE A 87 8.968 5.971 -6.794 1.00 41.45 H new ATOM 0 HB2 PHE A 87 8.604 8.928 -7.412 1.00 62.20 H new ATOM 0 HB3 PHE A 87 8.913 7.641 -8.561 1.00 62.20 H new ATOM 0 HD1 PHE A 87 7.100 5.705 -8.577 1.00 62.13 H new ATOM 0 HD2 PHE A 87 6.427 9.615 -7.057 1.00 22.44 H new ATOM 0 HE1 PHE A 87 4.680 5.391 -8.838 1.00 24.54 H new ATOM 0 HE2 PHE A 87 4.011 9.302 -7.304 1.00 12.34 H new ATOM 0 HZ PHE A 87 3.131 7.187 -8.191 1.00 54.35 H new ATOM 1210 N PRO A 88 11.356 6.452 -6.163 1.00 2.22 N ATOM 1211 CA PRO A 88 12.758 6.734 -5.992 1.00 43.32 C ATOM 1212 C PRO A 88 13.477 6.921 -7.334 1.00 3.10 C ATOM 1213 O PRO A 88 13.292 6.145 -8.282 1.00 5.23 O ATOM 1214 CB PRO A 88 13.270 5.496 -5.271 1.00 72.50 C ATOM 1215 CG PRO A 88 12.407 4.387 -5.768 1.00 62.53 C ATOM 1216 CD PRO A 88 11.084 5.001 -6.169 1.00 15.03 C ATOM 0 HA PRO A 88 12.934 7.662 -5.448 1.00 43.32 H new ATOM 0 HB2 PRO A 88 14.320 5.312 -5.496 1.00 72.50 H new ATOM 0 HB3 PRO A 88 13.190 5.606 -4.189 1.00 72.50 H new ATOM 0 HG2 PRO A 88 12.873 3.887 -6.617 1.00 62.53 H new ATOM 0 HG3 PRO A 88 12.263 3.634 -4.994 1.00 62.53 H new ATOM 0 HD2 PRO A 88 10.765 4.657 -7.153 1.00 15.03 H new ATOM 0 HD3 PRO A 88 10.292 4.739 -5.468 1.00 15.03 H new ATOM 1224 N ASN A 89 14.271 7.952 -7.423 1.00 13.21 N ATOM 1225 CA ASN A 89 15.057 8.192 -8.612 1.00 62.02 C ATOM 1226 C ASN A 89 16.341 7.426 -8.486 1.00 64.32 C ATOM 1227 O ASN A 89 16.732 7.043 -7.372 1.00 24.32 O ATOM 1228 CB ASN A 89 15.380 9.690 -8.796 1.00 72.00 C ATOM 1229 CG ASN A 89 14.158 10.565 -9.012 1.00 20.42 C ATOM 1230 OD1 ASN A 89 13.720 10.761 -10.134 1.00 3.41 O ATOM 1231 ND2 ASN A 89 13.623 11.108 -7.950 1.00 65.13 N ATOM 0 H ASN A 89 14.394 8.645 -6.685 1.00 13.21 H new ATOM 0 HA ASN A 89 14.483 7.868 -9.480 1.00 62.02 H new ATOM 0 HB2 ASN A 89 15.918 10.046 -7.917 1.00 72.00 H new ATOM 0 HB3 ASN A 89 16.051 9.804 -9.648 1.00 72.00 H new ATOM 0 HD21 ASN A 89 12.812 11.719 -8.043 1.00 65.13 H new ATOM 0 HD22 ASN A 89 14.017 10.921 -7.028 1.00 65.13 H new ATOM 1238 N GLU A 90 17.023 7.224 -9.590 1.00 51.25 N ATOM 1239 CA GLU A 90 18.294 6.501 -9.581 1.00 11.15 C ATOM 1240 C GLU A 90 19.386 7.301 -8.841 1.00 1.25 C ATOM 1241 O GLU A 90 20.444 6.781 -8.504 1.00 1.31 O ATOM 1242 CB GLU A 90 18.715 6.096 -11.001 1.00 73.05 C ATOM 1243 CG GLU A 90 18.849 7.247 -11.963 1.00 72.21 C ATOM 1244 CD GLU A 90 19.160 6.805 -13.368 1.00 25.25 C ATOM 1245 OE1 GLU A 90 18.214 6.563 -14.149 1.00 50.24 O ATOM 1246 OE2 GLU A 90 20.346 6.695 -13.725 1.00 42.12 O ATOM 0 H GLU A 90 16.727 7.547 -10.511 1.00 51.25 H new ATOM 0 HA GLU A 90 18.155 5.575 -9.023 1.00 11.15 H new ATOM 0 HB2 GLU A 90 19.668 5.570 -10.948 1.00 73.05 H new ATOM 0 HB3 GLU A 90 17.984 5.391 -11.396 1.00 73.05 H new ATOM 0 HG2 GLU A 90 17.923 7.821 -11.965 1.00 72.21 H new ATOM 0 HG3 GLU A 90 19.637 7.915 -11.615 1.00 72.21 H new ATOM 1253 N ASP A 91 19.099 8.572 -8.584 1.00 10.11 N ATOM 1254 CA ASP A 91 19.998 9.448 -7.824 1.00 53.31 C ATOM 1255 C ASP A 91 19.851 9.171 -6.321 1.00 72.34 C ATOM 1256 O ASP A 91 20.586 9.716 -5.497 1.00 21.14 O ATOM 1257 CB ASP A 91 19.651 10.921 -8.092 1.00 45.44 C ATOM 1258 CG ASP A 91 19.682 11.285 -9.557 1.00 64.22 C ATOM 1259 OD1 ASP A 91 18.647 11.122 -10.229 1.00 15.24 O ATOM 1260 OD2 ASP A 91 20.736 11.740 -10.059 1.00 71.44 O ATOM 0 H ASP A 91 18.241 9.028 -8.893 1.00 10.11 H new ATOM 0 HA ASP A 91 21.023 9.249 -8.138 1.00 53.31 H new ATOM 0 HB2 ASP A 91 18.659 11.132 -7.693 1.00 45.44 H new ATOM 0 HB3 ASP A 91 20.353 11.556 -7.552 1.00 45.44 H new ATOM 1265 N GLY A 92 18.888 8.321 -5.977 1.00 45.12 N ATOM 1266 CA GLY A 92 18.650 7.951 -4.590 1.00 51.53 C ATOM 1267 C GLY A 92 17.615 8.819 -3.924 1.00 44.14 C ATOM 1268 O GLY A 92 17.158 8.519 -2.832 1.00 75.33 O ATOM 0 H GLY A 92 18.259 7.875 -6.645 1.00 45.12 H new ATOM 0 HA2 GLY A 92 18.328 6.911 -4.546 1.00 51.53 H new ATOM 0 HA3 GLY A 92 19.586 8.018 -4.035 1.00 51.53 H new ATOM 1272 N SER A 93 17.242 9.876 -4.581 1.00 1.14 N ATOM 1273 CA SER A 93 16.292 10.813 -4.043 1.00 41.44 C ATOM 1274 C SER A 93 14.881 10.438 -4.478 1.00 72.20 C ATOM 1275 O SER A 93 14.672 10.033 -5.625 1.00 0.02 O ATOM 1276 CB SER A 93 16.643 12.198 -4.571 1.00 15.32 C ATOM 1277 OG SER A 93 18.004 12.499 -4.301 1.00 73.11 O ATOM 0 H SER A 93 17.588 10.117 -5.510 1.00 1.14 H new ATOM 0 HA SER A 93 16.330 10.800 -2.954 1.00 41.44 H new ATOM 0 HB2 SER A 93 16.460 12.242 -5.645 1.00 15.32 H new ATOM 0 HB3 SER A 93 15.999 12.945 -4.107 1.00 15.32 H new ATOM 0 HG SER A 93 18.217 13.391 -4.647 1.00 73.11 H new ATOM 1283 N LEU A 94 13.936 10.525 -3.576 1.00 35.34 N ATOM 1284 CA LEU A 94 12.546 10.305 -3.919 1.00 2.24 C ATOM 1285 C LEU A 94 11.963 11.489 -4.673 1.00 2.43 C ATOM 1286 O LEU A 94 12.249 12.655 -4.361 1.00 42.53 O ATOM 1287 CB LEU A 94 11.669 9.934 -2.696 1.00 23.12 C ATOM 1288 CG LEU A 94 11.804 8.492 -2.143 1.00 3.42 C ATOM 1289 CD1 LEU A 94 13.186 8.182 -1.614 1.00 31.23 C ATOM 1290 CD2 LEU A 94 10.755 8.213 -1.090 1.00 42.34 C ATOM 0 H LEU A 94 14.101 10.747 -2.594 1.00 35.34 H new ATOM 0 HA LEU A 94 12.533 9.440 -4.582 1.00 2.24 H new ATOM 0 HB2 LEU A 94 11.902 10.629 -1.889 1.00 23.12 H new ATOM 0 HB3 LEU A 94 10.626 10.097 -2.966 1.00 23.12 H new ATOM 0 HG LEU A 94 11.640 7.827 -2.991 1.00 3.42 H new ATOM 0 HD11 LEU A 94 13.212 7.158 -1.242 1.00 31.23 H new ATOM 0 HD12 LEU A 94 13.916 8.296 -2.415 1.00 31.23 H new ATOM 0 HD13 LEU A 94 13.427 8.869 -0.803 1.00 31.23 H new ATOM 0 HD21 LEU A 94 10.873 7.195 -0.720 1.00 42.34 H new ATOM 0 HD22 LEU A 94 10.872 8.915 -0.265 1.00 42.34 H new ATOM 0 HD23 LEU A 94 9.763 8.328 -1.526 1.00 42.34 H new ATOM 1302 N GLN A 95 11.184 11.177 -5.680 1.00 13.15 N ATOM 1303 CA GLN A 95 10.527 12.151 -6.508 1.00 55.14 C ATOM 1304 C GLN A 95 9.304 12.595 -5.722 1.00 2.44 C ATOM 1305 O GLN A 95 8.550 11.752 -5.229 1.00 2.54 O ATOM 1306 CB GLN A 95 10.138 11.459 -7.849 1.00 4.05 C ATOM 1307 CG GLN A 95 9.789 12.368 -9.046 1.00 14.04 C ATOM 1308 CD GLN A 95 8.559 13.230 -8.873 1.00 44.32 C ATOM 1309 OE1 GLN A 95 7.426 12.727 -9.267 1.00 52.01 O flip ATOM 1310 NE2 GLN A 95 8.639 14.359 -8.403 1.00 63.04 N flip ATOM 0 H GLN A 95 10.986 10.214 -5.951 1.00 13.15 H new ATOM 0 HA GLN A 95 11.148 13.014 -6.750 1.00 55.14 H new ATOM 0 HB2 GLN A 95 10.965 10.814 -8.147 1.00 4.05 H new ATOM 0 HB3 GLN A 95 9.282 10.812 -7.657 1.00 4.05 H new ATOM 0 HG2 GLN A 95 10.641 13.018 -9.247 1.00 14.04 H new ATOM 0 HG3 GLN A 95 9.651 11.742 -9.927 1.00 14.04 H new ATOM 0 HE21 GLN A 95 9.543 14.724 -8.103 1.00 63.04 H new ATOM 0 HE22 GLN A 95 7.801 14.934 -8.311 1.00 63.04 H new ATOM 1319 N LYS A 96 9.130 13.889 -5.581 1.00 32.40 N ATOM 1320 CA LYS A 96 8.072 14.441 -4.770 1.00 52.03 C ATOM 1321 C LYS A 96 6.685 14.272 -5.390 1.00 63.31 C ATOM 1322 O LYS A 96 6.168 15.146 -6.092 1.00 55.15 O ATOM 1323 CB LYS A 96 8.379 15.890 -4.373 1.00 2.20 C ATOM 1324 CG LYS A 96 9.675 16.005 -3.576 1.00 71.04 C ATOM 1325 CD LYS A 96 10.040 17.439 -3.247 1.00 2.22 C ATOM 1326 CE LYS A 96 11.344 17.488 -2.458 1.00 43.21 C ATOM 1327 NZ LYS A 96 11.794 18.870 -2.189 1.00 74.13 N ATOM 0 H LYS A 96 9.721 14.590 -6.028 1.00 32.40 H new ATOM 0 HA LYS A 96 8.038 13.855 -3.851 1.00 52.03 H new ATOM 0 HB2 LYS A 96 8.451 16.504 -5.271 1.00 2.20 H new ATOM 0 HB3 LYS A 96 7.554 16.286 -3.781 1.00 2.20 H new ATOM 0 HG2 LYS A 96 9.577 15.439 -2.650 1.00 71.04 H new ATOM 0 HG3 LYS A 96 10.486 15.550 -4.144 1.00 71.04 H new ATOM 0 HD2 LYS A 96 10.142 18.015 -4.167 1.00 2.22 H new ATOM 0 HD3 LYS A 96 9.240 17.901 -2.669 1.00 2.22 H new ATOM 0 HE2 LYS A 96 11.212 16.962 -1.512 1.00 43.21 H new ATOM 0 HE3 LYS A 96 12.119 16.959 -3.012 1.00 43.21 H new ATOM 0 HZ1 LYS A 96 12.684 18.847 -1.651 1.00 74.13 H new ATOM 0 HZ2 LYS A 96 11.947 19.367 -3.090 1.00 74.13 H new ATOM 0 HZ3 LYS A 96 11.068 19.370 -1.637 1.00 74.13 H new ATOM 1341 N LYS A 97 6.161 13.100 -5.188 1.00 52.55 N ATOM 1342 CA LYS A 97 4.842 12.698 -5.568 1.00 64.24 C ATOM 1343 C LYS A 97 4.543 11.499 -4.721 1.00 71.40 C ATOM 1344 O LYS A 97 5.328 10.553 -4.702 1.00 70.33 O ATOM 1345 CB LYS A 97 4.790 12.272 -7.045 1.00 21.52 C ATOM 1346 CG LYS A 97 3.387 11.887 -7.535 1.00 61.23 C ATOM 1347 CD LYS A 97 3.414 11.236 -8.924 1.00 53.21 C ATOM 1348 CE LYS A 97 4.064 12.108 -9.947 1.00 23.15 C ATOM 1349 NZ LYS A 97 4.090 11.469 -11.281 1.00 40.30 N ATOM 0 H LYS A 97 6.677 12.353 -4.724 1.00 52.55 H new ATOM 0 HA LYS A 97 4.134 13.516 -5.435 1.00 64.24 H new ATOM 0 HB2 LYS A 97 5.168 13.088 -7.661 1.00 21.52 H new ATOM 0 HB3 LYS A 97 5.460 11.425 -7.192 1.00 21.52 H new ATOM 0 HG2 LYS A 97 2.932 11.199 -6.823 1.00 61.23 H new ATOM 0 HG3 LYS A 97 2.758 12.777 -7.565 1.00 61.23 H new ATOM 0 HD2 LYS A 97 3.947 10.287 -8.867 1.00 53.21 H new ATOM 0 HD3 LYS A 97 2.394 11.011 -9.237 1.00 53.21 H new ATOM 0 HE2 LYS A 97 3.529 13.056 -10.009 1.00 23.15 H new ATOM 0 HE3 LYS A 97 5.083 12.337 -9.634 1.00 23.15 H new ATOM 0 HZ1 LYS A 97 4.549 12.107 -11.962 1.00 40.30 H new ATOM 0 HZ2 LYS A 97 4.622 10.577 -11.228 1.00 40.30 H new ATOM 0 HZ3 LYS A 97 3.117 11.274 -11.591 1.00 40.30 H new ATOM 1363 N LEU A 98 3.472 11.521 -4.014 1.00 55.52 N ATOM 1364 CA LEU A 98 3.156 10.415 -3.168 1.00 51.05 C ATOM 1365 C LEU A 98 1.702 10.086 -3.331 1.00 14.42 C ATOM 1366 O LEU A 98 0.844 10.963 -3.251 1.00 53.32 O ATOM 1367 CB LEU A 98 3.552 10.749 -1.704 1.00 60.10 C ATOM 1368 CG LEU A 98 3.420 9.645 -0.627 1.00 43.24 C ATOM 1369 CD1 LEU A 98 4.122 10.079 0.624 1.00 60.22 C ATOM 1370 CD2 LEU A 98 1.985 9.397 -0.273 1.00 61.42 C ATOM 0 H LEU A 98 2.798 12.287 -4.000 1.00 55.52 H new ATOM 0 HA LEU A 98 3.724 9.528 -3.446 1.00 51.05 H new ATOM 0 HB2 LEU A 98 4.590 11.082 -1.710 1.00 60.10 H new ATOM 0 HB3 LEU A 98 2.947 11.597 -1.383 1.00 60.10 H new ATOM 0 HG LEU A 98 3.859 8.735 -1.035 1.00 43.24 H new ATOM 0 HD11 LEU A 98 4.029 9.301 1.382 1.00 60.22 H new ATOM 0 HD12 LEU A 98 5.177 10.251 0.408 1.00 60.22 H new ATOM 0 HD13 LEU A 98 3.672 11.001 0.993 1.00 60.22 H new ATOM 0 HD21 LEU A 98 1.927 8.616 0.486 1.00 61.42 H new ATOM 0 HD22 LEU A 98 1.542 10.314 0.115 1.00 61.42 H new ATOM 0 HD23 LEU A 98 1.440 9.080 -1.162 1.00 61.42 H new ATOM 1382 N LYS A 99 1.424 8.844 -3.573 1.00 72.03 N ATOM 1383 CA LYS A 99 0.076 8.412 -3.791 1.00 70.25 C ATOM 1384 C LYS A 99 -0.276 7.339 -2.776 1.00 34.32 C ATOM 1385 O LYS A 99 0.302 6.265 -2.776 1.00 22.14 O ATOM 1386 CB LYS A 99 -0.047 7.903 -5.236 1.00 41.23 C ATOM 1387 CG LYS A 99 -1.444 7.478 -5.679 1.00 1.12 C ATOM 1388 CD LYS A 99 -1.450 7.046 -7.154 1.00 45.31 C ATOM 1389 CE LYS A 99 -1.051 8.189 -8.093 1.00 51.04 C ATOM 1390 NZ LYS A 99 -0.982 7.765 -9.513 1.00 75.31 N ATOM 0 H LYS A 99 2.121 8.101 -3.625 1.00 72.03 H new ATOM 0 HA LYS A 99 -0.627 9.234 -3.658 1.00 70.25 H new ATOM 0 HB2 LYS A 99 0.303 8.687 -5.907 1.00 41.23 H new ATOM 0 HB3 LYS A 99 0.626 7.054 -5.360 1.00 41.23 H new ATOM 0 HG2 LYS A 99 -1.792 6.655 -5.055 1.00 1.12 H new ATOM 0 HG3 LYS A 99 -2.141 8.304 -5.536 1.00 1.12 H new ATOM 0 HD2 LYS A 99 -0.763 6.210 -7.289 1.00 45.31 H new ATOM 0 HD3 LYS A 99 -2.444 6.688 -7.422 1.00 45.31 H new ATOM 0 HE2 LYS A 99 -1.770 9.002 -7.995 1.00 51.04 H new ATOM 0 HE3 LYS A 99 -0.081 8.583 -7.788 1.00 51.04 H new ATOM 0 HZ1 LYS A 99 -0.708 8.575 -10.104 1.00 75.31 H new ATOM 0 HZ2 LYS A 99 -0.277 7.008 -9.615 1.00 75.31 H new ATOM 0 HZ3 LYS A 99 -1.913 7.414 -9.816 1.00 75.31 H new ATOM 1404 N VAL A 100 -1.209 7.649 -1.917 1.00 54.22 N ATOM 1405 CA VAL A 100 -1.634 6.752 -0.863 1.00 24.52 C ATOM 1406 C VAL A 100 -2.795 5.932 -1.339 1.00 63.23 C ATOM 1407 O VAL A 100 -3.754 6.473 -1.849 1.00 24.41 O ATOM 1408 CB VAL A 100 -2.078 7.531 0.415 1.00 24.12 C ATOM 1409 CG1 VAL A 100 -2.571 6.579 1.498 1.00 31.44 C ATOM 1410 CG2 VAL A 100 -0.947 8.360 0.960 1.00 14.13 C ATOM 0 H VAL A 100 -1.705 8.541 -1.925 1.00 54.22 H new ATOM 0 HA VAL A 100 -0.784 6.118 -0.611 1.00 24.52 H new ATOM 0 HB VAL A 100 -2.897 8.189 0.123 1.00 24.12 H new ATOM 0 HG11 VAL A 100 -2.873 7.151 2.375 1.00 31.44 H new ATOM 0 HG12 VAL A 100 -3.423 6.012 1.124 1.00 31.44 H new ATOM 0 HG13 VAL A 100 -1.770 5.892 1.771 1.00 31.44 H new ATOM 0 HG21 VAL A 100 -1.282 8.893 1.850 1.00 14.13 H new ATOM 0 HG22 VAL A 100 -0.111 7.710 1.219 1.00 14.13 H new ATOM 0 HG23 VAL A 100 -0.627 9.079 0.206 1.00 14.13 H new ATOM 1420 N TRP A 101 -2.699 4.661 -1.180 1.00 21.42 N ATOM 1421 CA TRP A 101 -3.748 3.753 -1.507 1.00 54.41 C ATOM 1422 C TRP A 101 -4.309 3.169 -0.226 1.00 43.32 C ATOM 1423 O TRP A 101 -3.581 2.560 0.576 1.00 42.23 O ATOM 1424 CB TRP A 101 -3.234 2.616 -2.398 1.00 34.42 C ATOM 1425 CG TRP A 101 -2.879 3.028 -3.793 1.00 20.23 C ATOM 1426 CD1 TRP A 101 -1.682 3.504 -4.240 1.00 52.14 C ATOM 1427 CD2 TRP A 101 -3.749 2.986 -4.928 1.00 35.21 C ATOM 1428 NE1 TRP A 101 -1.755 3.760 -5.590 1.00 10.44 N ATOM 1429 CE2 TRP A 101 -3.019 3.450 -6.034 1.00 22.53 C ATOM 1430 CE3 TRP A 101 -5.081 2.597 -5.111 1.00 40.44 C ATOM 1431 CZ2 TRP A 101 -3.577 3.537 -7.308 1.00 61.42 C ATOM 1432 CZ3 TRP A 101 -5.634 2.685 -6.373 1.00 4.35 C ATOM 1433 CH2 TRP A 101 -4.884 3.148 -7.457 1.00 1.11 C ATOM 0 H TRP A 101 -1.865 4.207 -0.808 1.00 21.42 H new ATOM 0 HA TRP A 101 -4.522 4.294 -2.052 1.00 54.41 H new ATOM 0 HB2 TRP A 101 -2.355 2.174 -1.929 1.00 34.42 H new ATOM 0 HB3 TRP A 101 -3.995 1.837 -2.446 1.00 34.42 H new ATOM 0 HD1 TRP A 101 -0.807 3.657 -3.626 1.00 52.14 H new ATOM 0 HE1 TRP A 101 -0.995 4.121 -6.167 1.00 10.44 H new ATOM 0 HE3 TRP A 101 -5.666 2.234 -4.279 1.00 40.44 H new ATOM 0 HZ2 TRP A 101 -3.001 3.898 -8.148 1.00 61.42 H new ATOM 0 HZ3 TRP A 101 -6.662 2.391 -6.525 1.00 4.35 H new ATOM 0 HH2 TRP A 101 -5.343 3.201 -8.433 1.00 1.11 H new ATOM 1444 N PHE A 102 -5.569 3.323 -0.028 1.00 43.52 N ATOM 1445 CA PHE A 102 -6.195 2.775 1.116 1.00 43.02 C ATOM 1446 C PHE A 102 -6.916 1.551 0.699 1.00 43.23 C ATOM 1447 O PHE A 102 -7.880 1.603 -0.080 1.00 55.02 O ATOM 1448 CB PHE A 102 -7.177 3.760 1.762 1.00 31.10 C ATOM 1449 CG PHE A 102 -7.926 3.177 2.937 1.00 65.24 C ATOM 1450 CD1 PHE A 102 -7.290 2.974 4.145 1.00 54.45 C ATOM 1451 CD2 PHE A 102 -9.260 2.816 2.819 1.00 11.13 C ATOM 1452 CE1 PHE A 102 -7.964 2.428 5.218 1.00 60.34 C ATOM 1453 CE2 PHE A 102 -9.938 2.267 3.885 1.00 33.03 C ATOM 1454 CZ PHE A 102 -9.288 2.074 5.087 1.00 62.15 C ATOM 0 H PHE A 102 -6.193 3.832 -0.655 1.00 43.52 H new ATOM 0 HA PHE A 102 -5.432 2.549 1.861 1.00 43.02 H new ATOM 0 HB2 PHE A 102 -6.630 4.643 2.091 1.00 31.10 H new ATOM 0 HB3 PHE A 102 -7.895 4.091 1.011 1.00 31.10 H new ATOM 0 HD1 PHE A 102 -6.250 3.246 4.252 1.00 54.45 H new ATOM 0 HD2 PHE A 102 -9.773 2.967 1.881 1.00 11.13 H new ATOM 0 HE1 PHE A 102 -7.454 2.279 6.158 1.00 60.34 H new ATOM 0 HE2 PHE A 102 -10.976 1.988 3.780 1.00 33.03 H new ATOM 0 HZ PHE A 102 -9.818 1.645 5.925 1.00 62.15 H new ATOM 1464 N ARG A 103 -6.427 0.459 1.173 1.00 43.11 N ATOM 1465 CA ARG A 103 -6.983 -0.802 0.887 1.00 52.12 C ATOM 1466 C ARG A 103 -8.232 -1.010 1.706 1.00 32.01 C ATOM 1467 O ARG A 103 -8.211 -0.923 2.919 1.00 32.22 O ATOM 1468 CB ARG A 103 -5.931 -1.892 1.088 1.00 35.00 C ATOM 1469 CG ARG A 103 -6.447 -3.300 0.966 1.00 11.10 C ATOM 1470 CD ARG A 103 -5.307 -4.299 0.873 1.00 61.44 C ATOM 1471 NE ARG A 103 -4.301 -4.144 1.949 1.00 43.04 N ATOM 1472 CZ ARG A 103 -3.207 -4.927 2.100 1.00 5.02 C ATOM 1473 NH1 ARG A 103 -3.060 -6.030 1.367 1.00 22.23 N ATOM 1474 NH2 ARG A 103 -2.289 -4.615 3.003 1.00 51.32 N ATOM 0 H ARG A 103 -5.611 0.425 1.784 1.00 43.11 H new ATOM 0 HA ARG A 103 -7.287 -0.855 -0.158 1.00 52.12 H new ATOM 0 HB2 ARG A 103 -5.135 -1.748 0.357 1.00 35.00 H new ATOM 0 HB3 ARG A 103 -5.484 -1.768 2.075 1.00 35.00 H new ATOM 0 HG2 ARG A 103 -7.071 -3.537 1.827 1.00 11.10 H new ATOM 0 HG3 ARG A 103 -7.079 -3.383 0.082 1.00 11.10 H new ATOM 0 HD2 ARG A 103 -5.715 -5.309 0.910 1.00 61.44 H new ATOM 0 HD3 ARG A 103 -4.815 -4.189 -0.093 1.00 61.44 H new ATOM 0 HE ARG A 103 -4.443 -3.393 2.625 1.00 43.04 H new ATOM 0 HH11 ARG A 103 -3.774 -6.289 0.687 1.00 22.23 H new ATOM 0 HH12 ARG A 103 -2.233 -6.615 1.486 1.00 22.23 H new ATOM 0 HH21 ARG A 103 -2.407 -3.785 3.584 1.00 51.32 H new ATOM 0 HH22 ARG A 103 -1.465 -5.205 3.117 1.00 51.32 H new ATOM 1488 N ILE A 104 -9.309 -1.227 1.023 1.00 4.32 N ATOM 1489 CA ILE A 104 -10.587 -1.396 1.632 1.00 41.52 C ATOM 1490 C ILE A 104 -10.809 -2.869 1.978 1.00 44.33 C ATOM 1491 O ILE A 104 -10.519 -3.739 1.164 1.00 34.52 O ATOM 1492 CB ILE A 104 -11.676 -0.917 0.646 1.00 72.32 C ATOM 1493 CG1 ILE A 104 -11.435 0.548 0.276 1.00 2.54 C ATOM 1494 CG2 ILE A 104 -13.064 -1.094 1.229 1.00 54.14 C ATOM 1495 CD1 ILE A 104 -12.396 1.075 -0.747 1.00 74.14 C ATOM 0 H ILE A 104 -9.324 -1.293 0.005 1.00 4.32 H new ATOM 0 HA ILE A 104 -10.638 -0.811 2.550 1.00 41.52 H new ATOM 0 HB ILE A 104 -11.614 -1.529 -0.254 1.00 72.32 H new ATOM 0 HG12 ILE A 104 -11.506 1.158 1.177 1.00 2.54 H new ATOM 0 HG13 ILE A 104 -10.419 0.656 -0.103 1.00 2.54 H new ATOM 0 HG21 ILE A 104 -13.807 -0.748 0.511 1.00 54.14 H new ATOM 0 HG22 ILE A 104 -13.235 -2.148 1.448 1.00 54.14 H new ATOM 0 HG23 ILE A 104 -13.149 -0.514 2.148 1.00 54.14 H new ATOM 0 HD11 ILE A 104 -12.165 2.119 -0.960 1.00 74.14 H new ATOM 0 HD12 ILE A 104 -12.310 0.490 -1.663 1.00 74.14 H new ATOM 0 HD13 ILE A 104 -13.413 1.000 -0.363 1.00 74.14 H new ATOM 1507 N PRO A 105 -11.278 -3.161 3.211 1.00 15.35 N ATOM 1508 CA PRO A 105 -11.612 -4.524 3.634 1.00 63.23 C ATOM 1509 C PRO A 105 -12.658 -5.162 2.708 1.00 74.35 C ATOM 1510 O PRO A 105 -13.472 -4.463 2.099 1.00 54.02 O ATOM 1511 CB PRO A 105 -12.199 -4.334 5.033 1.00 44.22 C ATOM 1512 CG PRO A 105 -11.643 -3.044 5.508 1.00 44.30 C ATOM 1513 CD PRO A 105 -11.484 -2.187 4.292 1.00 34.00 C ATOM 0 HA PRO A 105 -10.746 -5.185 3.610 1.00 63.23 H new ATOM 0 HB2 PRO A 105 -13.288 -4.308 5.004 1.00 44.22 H new ATOM 0 HB3 PRO A 105 -11.917 -5.153 5.694 1.00 44.22 H new ATOM 0 HG2 PRO A 105 -12.310 -2.575 6.231 1.00 44.30 H new ATOM 0 HG3 PRO A 105 -10.686 -3.193 6.008 1.00 44.30 H new ATOM 0 HD2 PRO A 105 -12.367 -1.572 4.116 1.00 34.00 H new ATOM 0 HD3 PRO A 105 -10.637 -1.508 4.387 1.00 34.00 H new ATOM 1521 N ASN A 106 -12.653 -6.478 2.655 1.00 5.34 N ATOM 1522 CA ASN A 106 -13.497 -7.263 1.744 1.00 73.14 C ATOM 1523 C ASN A 106 -14.969 -6.932 1.828 1.00 33.23 C ATOM 1524 O ASN A 106 -15.627 -6.765 0.796 1.00 10.32 O ATOM 1525 CB ASN A 106 -13.289 -8.739 1.980 1.00 23.52 C ATOM 1526 CG ASN A 106 -14.214 -9.612 1.141 1.00 4.10 C ATOM 1527 OD1 ASN A 106 -15.306 -9.985 1.579 1.00 34.24 O ATOM 1528 ND2 ASN A 106 -13.808 -9.917 -0.055 1.00 72.32 N ATOM 0 H ASN A 106 -12.056 -7.053 3.249 1.00 5.34 H new ATOM 0 HA ASN A 106 -13.180 -6.991 0.737 1.00 73.14 H new ATOM 0 HB2 ASN A 106 -12.254 -8.995 1.755 1.00 23.52 H new ATOM 0 HB3 ASN A 106 -13.449 -8.959 3.035 1.00 23.52 H new ATOM 0 HD21 ASN A 106 -14.398 -10.482 -0.665 1.00 72.32 H new ATOM 0 HD22 ASN A 106 -12.899 -9.591 -0.384 1.00 72.32 H new ATOM 1535 N GLN A 107 -15.485 -6.818 3.034 1.00 31.41 N ATOM 1536 CA GLN A 107 -16.897 -6.525 3.219 1.00 30.14 C ATOM 1537 C GLN A 107 -17.265 -5.189 2.600 1.00 35.22 C ATOM 1538 O GLN A 107 -18.361 -5.008 2.087 1.00 23.11 O ATOM 1539 CB GLN A 107 -17.279 -6.569 4.688 1.00 42.44 C ATOM 1540 CG GLN A 107 -17.087 -7.935 5.318 1.00 3.14 C ATOM 1541 CD GLN A 107 -17.489 -7.960 6.767 1.00 55.04 C ATOM 1542 OE1 GLN A 107 -16.674 -7.713 7.659 1.00 33.54 O ATOM 1543 NE2 GLN A 107 -18.734 -8.258 7.020 1.00 42.15 N ATOM 0 H GLN A 107 -14.954 -6.923 3.899 1.00 31.41 H new ATOM 0 HA GLN A 107 -17.466 -7.299 2.704 1.00 30.14 H new ATOM 0 HB2 GLN A 107 -16.682 -5.838 5.233 1.00 42.44 H new ATOM 0 HB3 GLN A 107 -18.322 -6.271 4.794 1.00 42.44 H new ATOM 0 HG2 GLN A 107 -17.674 -8.671 4.768 1.00 3.14 H new ATOM 0 HG3 GLN A 107 -16.041 -8.229 5.229 1.00 3.14 H new ATOM 0 HE21 GLN A 107 -19.377 -8.456 6.253 1.00 42.15 H new ATOM 0 HE22 GLN A 107 -19.064 -8.293 7.984 1.00 42.15 H new ATOM 1552 N PHE A 108 -16.330 -4.276 2.601 1.00 33.30 N ATOM 1553 CA PHE A 108 -16.568 -2.979 2.048 1.00 54.44 C ATOM 1554 C PHE A 108 -16.144 -2.914 0.580 1.00 43.22 C ATOM 1555 O PHE A 108 -16.366 -1.924 -0.078 1.00 55.41 O ATOM 1556 CB PHE A 108 -15.911 -1.883 2.894 1.00 51.23 C ATOM 1557 CG PHE A 108 -16.478 -1.774 4.284 1.00 43.24 C ATOM 1558 CD1 PHE A 108 -15.951 -2.519 5.329 1.00 4.03 C ATOM 1559 CD2 PHE A 108 -17.545 -0.929 4.544 1.00 73.15 C ATOM 1560 CE1 PHE A 108 -16.477 -2.423 6.601 1.00 23.41 C ATOM 1561 CE2 PHE A 108 -18.075 -0.828 5.817 1.00 2.23 C ATOM 1562 CZ PHE A 108 -17.541 -1.576 6.845 1.00 5.53 C ATOM 0 H PHE A 108 -15.394 -4.412 2.982 1.00 33.30 H new ATOM 0 HA PHE A 108 -17.642 -2.795 2.074 1.00 54.44 H new ATOM 0 HB2 PHE A 108 -14.841 -2.080 2.961 1.00 51.23 H new ATOM 0 HB3 PHE A 108 -16.027 -0.925 2.387 1.00 51.23 H new ATOM 0 HD1 PHE A 108 -15.119 -3.182 5.145 1.00 4.03 H new ATOM 0 HD2 PHE A 108 -17.968 -0.342 3.742 1.00 73.15 H new ATOM 0 HE1 PHE A 108 -16.057 -3.009 7.405 1.00 23.41 H new ATOM 0 HE2 PHE A 108 -18.906 -0.164 6.006 1.00 2.23 H new ATOM 0 HZ PHE A 108 -17.954 -1.500 7.840 1.00 5.53 H new ATOM 1572 N GLN A 109 -15.525 -3.982 0.073 1.00 52.00 N ATOM 1573 CA GLN A 109 -15.199 -4.050 -1.349 1.00 55.44 C ATOM 1574 C GLN A 109 -16.485 -4.222 -2.136 1.00 61.33 C ATOM 1575 O GLN A 109 -16.651 -3.636 -3.207 1.00 1.44 O ATOM 1576 CB GLN A 109 -14.227 -5.204 -1.675 1.00 73.04 C ATOM 1577 CG GLN A 109 -12.810 -5.104 -1.083 1.00 11.20 C ATOM 1578 CD GLN A 109 -11.875 -4.080 -1.748 1.00 74.41 C ATOM 1579 OE1 GLN A 109 -12.400 -2.997 -2.285 1.00 53.13 O flip ATOM 1580 NE2 GLN A 109 -10.671 -4.285 -1.773 1.00 13.12 N flip ATOM 0 H GLN A 109 -15.244 -4.798 0.617 1.00 52.00 H new ATOM 0 HA GLN A 109 -14.697 -3.123 -1.627 1.00 55.44 H new ATOM 0 HB2 GLN A 109 -14.676 -6.135 -1.328 1.00 73.04 H new ATOM 0 HB3 GLN A 109 -14.138 -5.278 -2.759 1.00 73.04 H new ATOM 0 HG2 GLN A 109 -12.896 -4.855 -0.025 1.00 11.20 H new ATOM 0 HG3 GLN A 109 -12.342 -6.087 -1.143 1.00 11.20 H new ATOM 0 HE21 GLN A 109 -10.289 -5.131 -1.350 1.00 13.12 H new ATOM 0 HE22 GLN A 109 -10.048 -3.610 -2.217 1.00 13.12 H new ATOM 1589 N GLY A 110 -17.397 -5.020 -1.572 1.00 72.23 N ATOM 1590 CA GLY A 110 -18.682 -5.273 -2.195 1.00 23.02 C ATOM 1591 C GLY A 110 -19.499 -4.011 -2.348 1.00 3.20 C ATOM 1592 O GLY A 110 -20.212 -3.836 -3.340 1.00 54.12 O ATOM 0 H GLY A 110 -17.260 -5.499 -0.682 1.00 72.23 H new ATOM 0 HA2 GLY A 110 -18.526 -5.724 -3.175 1.00 23.02 H new ATOM 0 HA3 GLY A 110 -19.239 -5.994 -1.597 1.00 23.02 H new ATOM 1596 N SER A 111 -19.409 -3.134 -1.370 1.00 45.14 N ATOM 1597 CA SER A 111 -20.093 -1.857 -1.403 1.00 13.31 C ATOM 1598 C SER A 111 -19.369 -0.824 -0.540 1.00 13.04 C ATOM 1599 O SER A 111 -19.568 -0.769 0.676 1.00 50.12 O ATOM 1600 CB SER A 111 -21.567 -1.994 -0.980 1.00 24.04 C ATOM 1601 OG SER A 111 -22.277 -2.834 -1.890 1.00 5.23 O ATOM 0 H SER A 111 -18.857 -3.287 -0.526 1.00 45.14 H new ATOM 0 HA SER A 111 -20.079 -1.505 -2.434 1.00 13.31 H new ATOM 0 HB2 SER A 111 -21.625 -2.409 0.026 1.00 24.04 H new ATOM 0 HB3 SER A 111 -22.034 -1.010 -0.946 1.00 24.04 H new ATOM 0 HG SER A 111 -21.664 -3.159 -2.582 1.00 5.23 H new ATOM 1607 N PRO A 112 -18.468 -0.044 -1.144 1.00 1.14 N ATOM 1608 CA PRO A 112 -17.755 1.002 -0.443 1.00 70.42 C ATOM 1609 C PRO A 112 -18.505 2.336 -0.510 1.00 21.33 C ATOM 1610 O PRO A 112 -19.252 2.597 -1.473 1.00 0.44 O ATOM 1611 CB PRO A 112 -16.445 1.098 -1.218 1.00 51.53 C ATOM 1612 CG PRO A 112 -16.808 0.740 -2.619 1.00 34.32 C ATOM 1613 CD PRO A 112 -18.041 -0.141 -2.553 1.00 54.35 C ATOM 0 HA PRO A 112 -17.629 0.786 0.618 1.00 70.42 H new ATOM 0 HB2 PRO A 112 -16.024 2.102 -1.162 1.00 51.53 H new ATOM 0 HB3 PRO A 112 -15.696 0.416 -0.816 1.00 51.53 H new ATOM 0 HG2 PRO A 112 -17.007 1.637 -3.206 1.00 34.32 H new ATOM 0 HG3 PRO A 112 -15.986 0.216 -3.107 1.00 34.32 H new ATOM 0 HD2 PRO A 112 -18.819 0.208 -3.232 1.00 54.35 H new ATOM 0 HD3 PRO A 112 -17.813 -1.170 -2.832 1.00 54.35 H new ATOM 1621 N PRO A 113 -18.366 3.176 0.516 1.00 1.24 N ATOM 1622 CA PRO A 113 -18.951 4.514 0.522 1.00 24.40 C ATOM 1623 C PRO A 113 -18.310 5.410 -0.545 1.00 73.14 C ATOM 1624 O PRO A 113 -17.113 5.286 -0.842 1.00 64.54 O ATOM 1625 CB PRO A 113 -18.599 5.051 1.912 1.00 32.50 C ATOM 1626 CG PRO A 113 -18.257 3.855 2.721 1.00 45.44 C ATOM 1627 CD PRO A 113 -17.650 2.886 1.768 1.00 11.32 C ATOM 0 HA PRO A 113 -20.020 4.495 0.310 1.00 24.40 H new ATOM 0 HB2 PRO A 113 -17.761 5.746 1.864 1.00 32.50 H new ATOM 0 HB3 PRO A 113 -19.438 5.593 2.348 1.00 32.50 H new ATOM 0 HG2 PRO A 113 -17.560 4.108 3.519 1.00 45.44 H new ATOM 0 HG3 PRO A 113 -19.145 3.435 3.194 1.00 45.44 H new ATOM 0 HD2 PRO A 113 -16.576 3.038 1.665 1.00 11.32 H new ATOM 0 HD3 PRO A 113 -17.797 1.855 2.090 1.00 11.32 H new ATOM 1635 N ALA A 114 -19.086 6.300 -1.119 1.00 14.31 N ATOM 1636 CA ALA A 114 -18.559 7.201 -2.120 1.00 72.43 C ATOM 1637 C ALA A 114 -17.699 8.279 -1.466 1.00 52.41 C ATOM 1638 O ALA A 114 -17.951 8.683 -0.305 1.00 41.22 O ATOM 1639 CB ALA A 114 -19.677 7.836 -2.942 1.00 42.33 C ATOM 0 H ALA A 114 -20.078 6.420 -0.913 1.00 14.31 H new ATOM 0 HA ALA A 114 -17.937 6.618 -2.799 1.00 72.43 H new ATOM 0 HB1 ALA A 114 -19.246 8.507 -3.685 1.00 42.33 H new ATOM 0 HB2 ALA A 114 -20.247 7.055 -3.446 1.00 42.33 H new ATOM 0 HB3 ALA A 114 -20.338 8.400 -2.283 1.00 42.33 H new ATOM 1645 N PRO A 115 -16.657 8.732 -2.164 1.00 20.43 N ATOM 1646 CA PRO A 115 -15.794 9.788 -1.680 1.00 61.12 C ATOM 1647 C PRO A 115 -16.525 11.136 -1.633 1.00 64.25 C ATOM 1648 O PRO A 115 -16.935 11.676 -2.663 1.00 64.53 O ATOM 1649 CB PRO A 115 -14.652 9.826 -2.701 1.00 13.40 C ATOM 1650 CG PRO A 115 -15.215 9.233 -3.941 1.00 1.35 C ATOM 1651 CD PRO A 115 -16.233 8.232 -3.494 1.00 5.32 C ATOM 0 HA PRO A 115 -15.450 9.606 -0.662 1.00 61.12 H new ATOM 0 HB2 PRO A 115 -14.312 10.847 -2.873 1.00 13.40 H new ATOM 0 HB3 PRO A 115 -13.791 9.258 -2.349 1.00 13.40 H new ATOM 0 HG2 PRO A 115 -15.671 9.999 -4.568 1.00 1.35 H new ATOM 0 HG3 PRO A 115 -14.435 8.757 -4.535 1.00 1.35 H new ATOM 0 HD2 PRO A 115 -17.072 8.177 -4.187 1.00 5.32 H new ATOM 0 HD3 PRO A 115 -15.808 7.230 -3.428 1.00 5.32 H new ATOM 1659 N SER A 116 -16.731 11.647 -0.437 1.00 72.14 N ATOM 1660 CA SER A 116 -17.379 12.935 -0.268 1.00 3.34 C ATOM 1661 C SER A 116 -16.315 14.053 -0.235 1.00 13.10 C ATOM 1662 O SER A 116 -16.627 15.247 -0.326 1.00 52.11 O ATOM 1663 CB SER A 116 -18.239 12.930 1.010 1.00 64.11 C ATOM 1664 OG SER A 116 -18.992 14.124 1.148 1.00 3.31 O ATOM 0 H SER A 116 -16.460 11.191 0.434 1.00 72.14 H new ATOM 0 HA SER A 116 -18.042 13.126 -1.112 1.00 3.34 H new ATOM 0 HB2 SER A 116 -18.915 12.075 0.989 1.00 64.11 H new ATOM 0 HB3 SER A 116 -17.595 12.805 1.880 1.00 64.11 H new ATOM 0 HG SER A 116 -18.569 14.839 0.629 1.00 3.31 H new ATOM 1670 N ASP A 117 -15.068 13.657 -0.102 1.00 53.03 N ATOM 1671 CA ASP A 117 -13.960 14.590 -0.135 1.00 73.43 C ATOM 1672 C ASP A 117 -13.343 14.516 -1.515 1.00 42.50 C ATOM 1673 O ASP A 117 -13.168 13.424 -2.052 1.00 62.11 O ATOM 1674 CB ASP A 117 -12.922 14.262 0.952 1.00 12.24 C ATOM 1675 CG ASP A 117 -11.743 15.219 0.947 1.00 11.53 C ATOM 1676 OD1 ASP A 117 -10.869 15.089 0.090 1.00 34.22 O ATOM 1677 OD2 ASP A 117 -11.690 16.110 1.819 1.00 63.11 O ATOM 0 H ASP A 117 -14.793 12.684 0.032 1.00 53.03 H new ATOM 0 HA ASP A 117 -14.314 15.601 0.068 1.00 73.43 H new ATOM 0 HB2 ASP A 117 -13.404 14.292 1.929 1.00 12.24 H new ATOM 0 HB3 ASP A 117 -12.559 13.245 0.806 1.00 12.24 H new ATOM 1682 N GLU A 118 -13.022 15.657 -2.081 1.00 34.22 N ATOM 1683 CA GLU A 118 -12.546 15.739 -3.462 1.00 54.21 C ATOM 1684 C GLU A 118 -11.124 15.209 -3.642 1.00 3.31 C ATOM 1685 O GLU A 118 -10.719 14.891 -4.755 1.00 12.22 O ATOM 1686 CB GLU A 118 -12.603 17.178 -3.934 1.00 24.22 C ATOM 1687 CG GLU A 118 -11.654 18.096 -3.184 1.00 14.14 C ATOM 1688 CD GLU A 118 -11.795 19.514 -3.603 1.00 73.23 C ATOM 1689 OE1 GLU A 118 -11.291 19.872 -4.672 1.00 13.22 O ATOM 1690 OE2 GLU A 118 -12.413 20.301 -2.856 1.00 41.31 O ATOM 0 H GLU A 118 -13.080 16.558 -1.607 1.00 34.22 H new ATOM 0 HA GLU A 118 -13.203 15.106 -4.058 1.00 54.21 H new ATOM 0 HB2 GLU A 118 -12.367 17.214 -4.997 1.00 24.22 H new ATOM 0 HB3 GLU A 118 -13.621 17.550 -3.821 1.00 24.22 H new ATOM 0 HG2 GLU A 118 -11.843 18.015 -2.114 1.00 14.14 H new ATOM 0 HG3 GLU A 118 -10.628 17.770 -3.352 1.00 14.14 H new ATOM 1697 N SER A 119 -10.376 15.118 -2.571 1.00 61.40 N ATOM 1698 CA SER A 119 -9.007 14.707 -2.672 1.00 44.24 C ATOM 1699 C SER A 119 -8.885 13.194 -2.640 1.00 20.35 C ATOM 1700 O SER A 119 -7.929 12.633 -3.168 1.00 75.24 O ATOM 1701 CB SER A 119 -8.195 15.344 -1.562 1.00 1.05 C ATOM 1702 OG SER A 119 -8.290 16.764 -1.627 1.00 55.14 O ATOM 0 H SER A 119 -10.695 15.323 -1.624 1.00 61.40 H new ATOM 0 HA SER A 119 -8.612 15.044 -3.631 1.00 44.24 H new ATOM 0 HB2 SER A 119 -8.553 14.993 -0.594 1.00 1.05 H new ATOM 0 HB3 SER A 119 -7.152 15.039 -1.645 1.00 1.05 H new ATOM 0 HG SER A 119 -7.762 17.161 -0.903 1.00 55.14 H new ATOM 1708 N VAL A 120 -9.844 12.539 -2.036 1.00 12.05 N ATOM 1709 CA VAL A 120 -9.819 11.099 -1.977 1.00 0.45 C ATOM 1710 C VAL A 120 -10.689 10.527 -3.086 1.00 11.11 C ATOM 1711 O VAL A 120 -11.828 10.952 -3.284 1.00 62.20 O ATOM 1712 CB VAL A 120 -10.216 10.551 -0.565 1.00 1.02 C ATOM 1713 CG1 VAL A 120 -11.622 10.945 -0.169 1.00 45.15 C ATOM 1714 CG2 VAL A 120 -10.019 9.047 -0.479 1.00 32.44 C ATOM 0 H VAL A 120 -10.646 12.975 -1.581 1.00 12.05 H new ATOM 0 HA VAL A 120 -8.793 10.767 -2.137 1.00 0.45 H new ATOM 0 HB VAL A 120 -9.543 11.019 0.154 1.00 1.02 H new ATOM 0 HG11 VAL A 120 -11.849 10.541 0.818 1.00 45.15 H new ATOM 0 HG12 VAL A 120 -11.702 12.032 -0.143 1.00 45.15 H new ATOM 0 HG13 VAL A 120 -12.330 10.547 -0.896 1.00 45.15 H new ATOM 0 HG21 VAL A 120 -10.304 8.699 0.514 1.00 32.44 H new ATOM 0 HG22 VAL A 120 -10.640 8.555 -1.228 1.00 32.44 H new ATOM 0 HG23 VAL A 120 -8.972 8.806 -0.661 1.00 32.44 H new ATOM 1724 N LYS A 121 -10.138 9.616 -3.840 1.00 70.41 N ATOM 1725 CA LYS A 121 -10.849 9.020 -4.949 1.00 1.02 C ATOM 1726 C LYS A 121 -10.879 7.521 -4.803 1.00 13.15 C ATOM 1727 O LYS A 121 -9.916 6.925 -4.330 1.00 24.22 O ATOM 1728 CB LYS A 121 -10.150 9.373 -6.277 1.00 1.33 C ATOM 1729 CG LYS A 121 -10.094 10.857 -6.605 1.00 35.01 C ATOM 1730 CD LYS A 121 -11.479 11.429 -6.811 1.00 74.41 C ATOM 1731 CE LYS A 121 -11.424 12.912 -7.111 1.00 31.33 C ATOM 1732 NZ LYS A 121 -12.771 13.477 -7.323 1.00 33.33 N ATOM 0 H LYS A 121 -9.190 9.264 -3.709 1.00 70.41 H new ATOM 0 HA LYS A 121 -11.867 9.409 -4.952 1.00 1.02 H new ATOM 0 HB2 LYS A 121 -9.132 8.985 -6.247 1.00 1.33 H new ATOM 0 HB3 LYS A 121 -10.664 8.857 -7.088 1.00 1.33 H new ATOM 0 HG2 LYS A 121 -9.595 11.391 -5.797 1.00 35.01 H new ATOM 0 HG3 LYS A 121 -9.498 11.010 -7.505 1.00 35.01 H new ATOM 0 HD2 LYS A 121 -11.971 10.908 -7.632 1.00 74.41 H new ATOM 0 HD3 LYS A 121 -12.081 11.259 -5.919 1.00 74.41 H new ATOM 0 HE2 LYS A 121 -10.937 13.432 -6.286 1.00 31.33 H new ATOM 0 HE3 LYS A 121 -10.815 13.081 -7.999 1.00 31.33 H new ATOM 0 HZ1 LYS A 121 -12.693 14.494 -7.526 1.00 33.33 H new ATOM 0 HZ2 LYS A 121 -13.226 12.998 -8.126 1.00 33.33 H new ATOM 0 HZ3 LYS A 121 -13.345 13.338 -6.467 1.00 33.33 H new ATOM 1746 N ILE A 122 -11.977 6.918 -5.187 1.00 12.30 N ATOM 1747 CA ILE A 122 -12.055 5.480 -5.213 1.00 51.34 C ATOM 1748 C ILE A 122 -11.667 5.021 -6.610 1.00 31.13 C ATOM 1749 O ILE A 122 -12.392 5.253 -7.575 1.00 53.42 O ATOM 1750 CB ILE A 122 -13.486 4.951 -4.825 1.00 52.53 C ATOM 1751 CG1 ILE A 122 -13.786 5.176 -3.324 1.00 55.43 C ATOM 1752 CG2 ILE A 122 -13.659 3.476 -5.185 1.00 11.34 C ATOM 1753 CD1 ILE A 122 -12.913 4.349 -2.370 1.00 11.32 C ATOM 0 H ILE A 122 -12.826 7.399 -5.485 1.00 12.30 H new ATOM 0 HA ILE A 122 -11.373 5.070 -4.469 1.00 51.34 H new ATOM 0 HB ILE A 122 -14.204 5.528 -5.407 1.00 52.53 H new ATOM 0 HG12 ILE A 122 -13.653 6.233 -3.094 1.00 55.43 H new ATOM 0 HG13 ILE A 122 -14.833 4.939 -3.136 1.00 55.43 H new ATOM 0 HG21 ILE A 122 -14.659 3.147 -4.902 1.00 11.34 H new ATOM 0 HG22 ILE A 122 -13.524 3.345 -6.259 1.00 11.34 H new ATOM 0 HG23 ILE A 122 -12.917 2.882 -4.651 1.00 11.34 H new ATOM 0 HD11 ILE A 122 -13.191 4.569 -1.339 1.00 11.32 H new ATOM 0 HD12 ILE A 122 -13.063 3.288 -2.567 1.00 11.32 H new ATOM 0 HD13 ILE A 122 -11.864 4.602 -2.525 1.00 11.32 H new ATOM 1765 N GLU A 123 -10.536 4.388 -6.698 1.00 32.32 N ATOM 1766 CA GLU A 123 -9.985 3.913 -7.943 1.00 2.04 C ATOM 1767 C GLU A 123 -9.702 2.448 -7.834 1.00 71.05 C ATOM 1768 O GLU A 123 -9.275 1.971 -6.792 1.00 2.13 O ATOM 1769 CB GLU A 123 -8.679 4.641 -8.277 1.00 42.22 C ATOM 1770 CG GLU A 123 -8.814 6.124 -8.590 1.00 20.23 C ATOM 1771 CD GLU A 123 -9.636 6.379 -9.831 1.00 4.34 C ATOM 1772 OE1 GLU A 123 -9.205 5.969 -10.932 1.00 75.25 O ATOM 1773 OE2 GLU A 123 -10.702 7.016 -9.736 1.00 12.30 O ATOM 0 H GLU A 123 -9.952 4.180 -5.888 1.00 32.32 H new ATOM 0 HA GLU A 123 -10.711 4.105 -8.733 1.00 2.04 H new ATOM 0 HB2 GLU A 123 -7.995 4.526 -7.436 1.00 42.22 H new ATOM 0 HB3 GLU A 123 -8.218 4.148 -9.133 1.00 42.22 H new ATOM 0 HG2 GLU A 123 -9.275 6.631 -7.742 1.00 20.23 H new ATOM 0 HG3 GLU A 123 -7.822 6.557 -8.719 1.00 20.23 H new ATOM 1780 N GLU A 124 -9.933 1.747 -8.881 1.00 22.40 N ATOM 1781 CA GLU A 124 -9.669 0.342 -8.920 1.00 40.13 C ATOM 1782 C GLU A 124 -8.365 0.106 -9.634 1.00 0.31 C ATOM 1783 O GLU A 124 -8.091 0.738 -10.662 1.00 3.35 O ATOM 1784 CB GLU A 124 -10.841 -0.418 -9.568 1.00 33.23 C ATOM 1785 CG GLU A 124 -11.206 0.043 -10.970 1.00 54.04 C ATOM 1786 CD GLU A 124 -12.416 -0.668 -11.506 1.00 71.23 C ATOM 1787 OE1 GLU A 124 -13.546 -0.198 -11.265 1.00 54.34 O ATOM 1788 OE2 GLU A 124 -12.272 -1.707 -12.171 1.00 3.32 O ATOM 0 H GLU A 124 -10.314 2.127 -9.747 1.00 22.40 H new ATOM 0 HA GLU A 124 -9.576 -0.046 -7.906 1.00 40.13 H new ATOM 0 HB2 GLU A 124 -10.592 -1.479 -9.603 1.00 33.23 H new ATOM 0 HB3 GLU A 124 -11.718 -0.318 -8.928 1.00 33.23 H new ATOM 0 HG2 GLU A 124 -11.393 1.117 -10.960 1.00 54.04 H new ATOM 0 HG3 GLU A 124 -10.361 -0.127 -11.638 1.00 54.04 H new ATOM 1795 N ARG A 125 -7.538 -0.755 -9.095 1.00 42.04 N ATOM 1796 CA ARG A 125 -6.259 -1.006 -9.707 1.00 73.20 C ATOM 1797 C ARG A 125 -6.071 -2.488 -9.972 1.00 53.01 C ATOM 1798 O ARG A 125 -6.112 -3.306 -9.052 1.00 63.02 O ATOM 1799 CB ARG A 125 -5.117 -0.461 -8.828 1.00 51.13 C ATOM 1800 CG ARG A 125 -3.732 -0.572 -9.463 1.00 3.40 C ATOM 1801 CD ARG A 125 -3.672 0.211 -10.768 1.00 23.34 C ATOM 1802 NE ARG A 125 -2.369 0.111 -11.430 1.00 64.31 N ATOM 1803 CZ ARG A 125 -2.152 0.436 -12.717 1.00 74.43 C ATOM 1804 NH1 ARG A 125 -3.152 0.881 -13.468 1.00 11.32 N ATOM 1805 NH2 ARG A 125 -0.939 0.318 -13.243 1.00 14.23 N ATOM 0 H ARG A 125 -7.724 -1.287 -8.245 1.00 42.04 H new ATOM 0 HA ARG A 125 -6.232 -0.483 -10.663 1.00 73.20 H new ATOM 0 HB2 ARG A 125 -5.317 0.586 -8.600 1.00 51.13 H new ATOM 0 HB3 ARG A 125 -5.114 -0.999 -7.880 1.00 51.13 H new ATOM 0 HG2 ARG A 125 -2.979 -0.194 -8.772 1.00 3.40 H new ATOM 0 HG3 ARG A 125 -3.496 -1.619 -9.651 1.00 3.40 H new ATOM 0 HD2 ARG A 125 -4.446 -0.155 -11.442 1.00 23.34 H new ATOM 0 HD3 ARG A 125 -3.893 1.259 -10.568 1.00 23.34 H new ATOM 0 HE ARG A 125 -1.578 -0.226 -10.881 1.00 64.31 H new ATOM 0 HH11 ARG A 125 -4.086 0.977 -13.069 1.00 11.32 H new ATOM 0 HH12 ARG A 125 -2.986 1.127 -14.444 1.00 11.32 H new ATOM 0 HH21 ARG A 125 -0.166 -0.021 -12.671 1.00 14.23 H new ATOM 0 HH22 ARG A 125 -0.780 0.566 -14.220 1.00 14.23 H new ATOM 1819 N GLU A 126 -5.845 -2.812 -11.221 1.00 51.32 N ATOM 1820 CA GLU A 126 -5.640 -4.167 -11.668 1.00 74.22 C ATOM 1821 C GLU A 126 -4.605 -4.148 -12.767 1.00 31.42 C ATOM 1822 O GLU A 126 -4.113 -3.081 -13.137 1.00 51.14 O ATOM 1823 CB GLU A 126 -6.942 -4.734 -12.245 1.00 21.30 C ATOM 1824 CG GLU A 126 -7.443 -3.961 -13.454 1.00 43.12 C ATOM 1825 CD GLU A 126 -8.688 -4.539 -14.045 1.00 33.30 C ATOM 1826 OE1 GLU A 126 -8.584 -5.482 -14.852 1.00 24.03 O ATOM 1827 OE2 GLU A 126 -9.787 -4.046 -13.735 1.00 13.22 O ATOM 0 H GLU A 126 -5.797 -2.124 -11.973 1.00 51.32 H new ATOM 0 HA GLU A 126 -5.317 -4.783 -10.829 1.00 74.22 H new ATOM 0 HB2 GLU A 126 -6.785 -5.775 -12.526 1.00 21.30 H new ATOM 0 HB3 GLU A 126 -7.710 -4.725 -11.471 1.00 21.30 H new ATOM 0 HG2 GLU A 126 -7.632 -2.927 -13.164 1.00 43.12 H new ATOM 0 HG3 GLU A 126 -6.662 -3.941 -14.214 1.00 43.12 H new ATOM 1834 N GLY A 127 -4.259 -5.305 -13.259 1.00 0.22 N ATOM 1835 CA GLY A 127 -3.427 -5.381 -14.419 1.00 11.41 C ATOM 1836 C GLY A 127 -1.963 -5.475 -14.132 1.00 63.30 C ATOM 1837 O GLY A 127 -1.186 -5.805 -15.025 1.00 21.32 O ATOM 0 H GLY A 127 -4.542 -6.206 -12.873 1.00 0.22 H new ATOM 0 HA2 GLY A 127 -3.725 -6.249 -15.007 1.00 11.41 H new ATOM 0 HA3 GLY A 127 -3.607 -4.501 -15.037 1.00 11.41 H new ATOM 1841 N ILE A 128 -1.551 -5.225 -12.910 1.00 23.34 N ATOM 1842 CA ILE A 128 -0.136 -5.241 -12.644 1.00 45.12 C ATOM 1843 C ILE A 128 0.267 -6.237 -11.596 1.00 25.20 C ATOM 1844 O ILE A 128 -0.542 -6.664 -10.747 1.00 45.22 O ATOM 1845 CB ILE A 128 0.503 -3.818 -12.425 1.00 64.23 C ATOM 1846 CG1 ILE A 128 -0.155 -3.016 -11.299 1.00 3.12 C ATOM 1847 CG2 ILE A 128 0.505 -3.009 -13.711 1.00 54.34 C ATOM 1848 CD1 ILE A 128 0.200 -3.444 -9.898 1.00 14.10 C ATOM 0 H ILE A 128 -2.152 -5.016 -12.113 1.00 23.34 H new ATOM 0 HA ILE A 128 0.304 -5.599 -13.575 1.00 45.12 H new ATOM 0 HB ILE A 128 1.531 -4.007 -12.117 1.00 64.23 H new ATOM 0 HG12 ILE A 128 0.116 -1.967 -11.418 1.00 3.12 H new ATOM 0 HG13 ILE A 128 -1.237 -3.081 -11.416 1.00 3.12 H new ATOM 0 HG21 ILE A 128 0.952 -2.032 -13.526 1.00 54.34 H new ATOM 0 HG22 ILE A 128 1.083 -3.535 -14.471 1.00 54.34 H new ATOM 0 HG23 ILE A 128 -0.519 -2.878 -14.060 1.00 54.34 H new ATOM 0 HD11 ILE A 128 -0.321 -2.810 -9.181 1.00 14.10 H new ATOM 0 HD12 ILE A 128 -0.098 -4.482 -9.748 1.00 14.10 H new ATOM 0 HD13 ILE A 128 1.276 -3.351 -9.751 1.00 14.10 H new ATOM 1860 N THR A 129 1.504 -6.591 -11.660 1.00 1.14 N ATOM 1861 CA THR A 129 2.079 -7.597 -10.826 1.00 13.42 C ATOM 1862 C THR A 129 3.012 -6.937 -9.844 1.00 50.42 C ATOM 1863 O THR A 129 3.838 -6.091 -10.225 1.00 12.00 O ATOM 1864 CB THR A 129 2.873 -8.610 -11.681 1.00 32.52 C ATOM 1865 OG1 THR A 129 2.014 -9.130 -12.708 1.00 12.34 O ATOM 1866 CG2 THR A 129 3.392 -9.769 -10.828 1.00 34.33 C ATOM 0 H THR A 129 2.167 -6.177 -12.315 1.00 1.14 H new ATOM 0 HA THR A 129 1.286 -8.126 -10.298 1.00 13.42 H new ATOM 0 HB THR A 129 3.729 -8.096 -12.119 1.00 32.52 H new ATOM 0 HG1 THR A 129 2.511 -9.772 -13.256 1.00 12.34 H new ATOM 0 HG21 THR A 129 3.946 -10.465 -11.458 1.00 34.33 H new ATOM 0 HG22 THR A 129 4.049 -9.382 -10.049 1.00 34.33 H new ATOM 0 HG23 THR A 129 2.551 -10.287 -10.368 1.00 34.33 H new ATOM 1874 N VAL A 130 2.903 -7.313 -8.615 1.00 45.02 N ATOM 1875 CA VAL A 130 3.712 -6.734 -7.598 1.00 41.03 C ATOM 1876 C VAL A 130 4.471 -7.793 -6.869 1.00 65.20 C ATOM 1877 O VAL A 130 4.082 -8.967 -6.859 1.00 45.10 O ATOM 1878 CB VAL A 130 2.882 -5.902 -6.564 1.00 64.15 C ATOM 1879 CG1 VAL A 130 2.209 -4.729 -7.230 1.00 60.02 C ATOM 1880 CG2 VAL A 130 1.844 -6.770 -5.854 1.00 30.35 C ATOM 0 H VAL A 130 2.253 -8.028 -8.288 1.00 45.02 H new ATOM 0 HA VAL A 130 4.399 -6.054 -8.103 1.00 41.03 H new ATOM 0 HB VAL A 130 3.580 -5.525 -5.816 1.00 64.15 H new ATOM 0 HG11 VAL A 130 1.639 -4.168 -6.489 1.00 60.02 H new ATOM 0 HG12 VAL A 130 2.964 -4.081 -7.674 1.00 60.02 H new ATOM 0 HG13 VAL A 130 1.537 -5.089 -8.009 1.00 60.02 H new ATOM 0 HG21 VAL A 130 1.285 -6.161 -5.143 1.00 30.35 H new ATOM 0 HG22 VAL A 130 1.158 -7.191 -6.589 1.00 30.35 H new ATOM 0 HG23 VAL A 130 2.347 -7.578 -5.323 1.00 30.35 H new ATOM 1890 N TYR A 131 5.538 -7.381 -6.277 1.00 21.20 N ATOM 1891 CA TYR A 131 6.323 -8.216 -5.456 1.00 2.14 C ATOM 1892 C TYR A 131 6.153 -7.638 -4.109 1.00 43.11 C ATOM 1893 O TYR A 131 6.432 -6.466 -3.897 1.00 35.41 O ATOM 1894 CB TYR A 131 7.807 -8.114 -5.855 1.00 24.23 C ATOM 1895 CG TYR A 131 8.068 -8.397 -7.310 1.00 54.12 C ATOM 1896 CD1 TYR A 131 8.242 -9.688 -7.759 1.00 43.22 C ATOM 1897 CD2 TYR A 131 8.121 -7.362 -8.239 1.00 15.12 C ATOM 1898 CE1 TYR A 131 8.463 -9.952 -9.091 1.00 4.45 C ATOM 1899 CE2 TYR A 131 8.335 -7.615 -9.571 1.00 61.22 C ATOM 1900 CZ TYR A 131 8.504 -8.914 -9.992 1.00 3.13 C ATOM 1901 OH TYR A 131 8.704 -9.179 -11.319 1.00 54.43 O ATOM 0 H TYR A 131 5.892 -6.428 -6.357 1.00 21.20 H new ATOM 0 HA TYR A 131 6.032 -9.264 -5.527 1.00 2.14 H new ATOM 0 HB2 TYR A 131 8.169 -7.113 -5.619 1.00 24.23 H new ATOM 0 HB3 TYR A 131 8.385 -8.813 -5.250 1.00 24.23 H new ATOM 0 HD1 TYR A 131 8.204 -10.505 -7.054 1.00 43.22 H new ATOM 0 HD2 TYR A 131 7.992 -6.343 -7.906 1.00 15.12 H new ATOM 0 HE1 TYR A 131 8.603 -10.969 -9.427 1.00 4.45 H new ATOM 0 HE2 TYR A 131 8.370 -6.802 -10.282 1.00 61.22 H new ATOM 0 HH TYR A 131 8.335 -10.061 -11.536 1.00 54.43 H new ATOM 1911 N SER A 132 5.687 -8.406 -3.220 1.00 45.23 N ATOM 1912 CA SER A 132 5.395 -7.919 -1.932 1.00 30.32 C ATOM 1913 C SER A 132 6.207 -8.636 -0.911 1.00 63.35 C ATOM 1914 O SER A 132 6.304 -9.863 -0.933 1.00 42.44 O ATOM 1915 CB SER A 132 3.913 -8.090 -1.667 1.00 62.33 C ATOM 1916 OG SER A 132 3.154 -7.441 -2.686 1.00 3.50 O ATOM 0 H SER A 132 5.493 -9.398 -3.358 1.00 45.23 H new ATOM 0 HA SER A 132 5.648 -6.861 -1.871 1.00 30.32 H new ATOM 0 HB2 SER A 132 3.661 -9.150 -1.635 1.00 62.33 H new ATOM 0 HB3 SER A 132 3.659 -7.673 -0.692 1.00 62.33 H new ATOM 0 HG SER A 132 3.016 -6.502 -2.443 1.00 3.50 H new ATOM 1922 N THR A 133 6.804 -7.895 -0.045 1.00 51.10 N ATOM 1923 CA THR A 133 7.542 -8.472 0.998 1.00 21.42 C ATOM 1924 C THR A 133 6.845 -8.182 2.313 1.00 22.35 C ATOM 1925 O THR A 133 6.465 -7.038 2.595 1.00 40.20 O ATOM 1926 CB THR A 133 9.041 -8.018 0.996 1.00 40.13 C ATOM 1927 OG1 THR A 133 9.766 -8.712 2.010 1.00 51.13 O ATOM 1928 CG2 THR A 133 9.196 -6.517 1.189 1.00 70.53 C ATOM 0 H THR A 133 6.789 -6.875 -0.048 1.00 51.10 H new ATOM 0 HA THR A 133 7.577 -9.551 0.850 1.00 21.42 H new ATOM 0 HB THR A 133 9.447 -8.264 0.015 1.00 40.13 H new ATOM 0 HG1 THR A 133 9.511 -9.658 2.005 1.00 51.13 H new ATOM 0 HG21 THR A 133 10.254 -6.256 1.180 1.00 70.53 H new ATOM 0 HG22 THR A 133 8.686 -5.992 0.382 1.00 70.53 H new ATOM 0 HG23 THR A 133 8.759 -6.226 2.144 1.00 70.53 H new ATOM 1936 N GLN A 134 6.618 -9.226 3.069 1.00 41.41 N ATOM 1937 CA GLN A 134 5.926 -9.130 4.324 1.00 50.25 C ATOM 1938 C GLN A 134 6.950 -9.412 5.403 1.00 43.54 C ATOM 1939 O GLN A 134 7.622 -10.456 5.377 1.00 33.02 O ATOM 1940 CB GLN A 134 4.775 -10.175 4.320 1.00 34.15 C ATOM 1941 CG GLN A 134 3.714 -10.090 5.442 1.00 20.23 C ATOM 1942 CD GLN A 134 4.219 -10.385 6.838 1.00 61.32 C ATOM 1943 OE1 GLN A 134 4.627 -9.497 7.567 1.00 64.40 O ATOM 1944 NE2 GLN A 134 4.202 -11.638 7.209 1.00 23.30 N ATOM 0 H GLN A 134 6.911 -10.172 2.827 1.00 41.41 H new ATOM 0 HA GLN A 134 5.483 -8.149 4.497 1.00 50.25 H new ATOM 0 HB2 GLN A 134 4.257 -10.098 3.364 1.00 34.15 H new ATOM 0 HB3 GLN A 134 5.225 -11.167 4.360 1.00 34.15 H new ATOM 0 HG2 GLN A 134 3.282 -9.090 5.434 1.00 20.23 H new ATOM 0 HG3 GLN A 134 2.909 -10.787 5.211 1.00 20.23 H new ATOM 0 HE21 GLN A 134 3.853 -12.354 6.572 1.00 23.30 H new ATOM 0 HE22 GLN A 134 4.537 -11.900 8.136 1.00 23.30 H new ATOM 1953 N PHE A 135 7.067 -8.504 6.324 1.00 23.02 N ATOM 1954 CA PHE A 135 8.050 -8.580 7.366 1.00 51.40 C ATOM 1955 C PHE A 135 7.473 -8.084 8.677 1.00 22.33 C ATOM 1956 O PHE A 135 6.511 -7.300 8.679 1.00 73.31 O ATOM 1957 CB PHE A 135 9.313 -7.791 6.968 1.00 13.53 C ATOM 1958 CG PHE A 135 9.070 -6.369 6.517 1.00 11.31 C ATOM 1959 CD1 PHE A 135 8.698 -6.103 5.208 1.00 2.24 C ATOM 1960 CD2 PHE A 135 9.236 -5.309 7.385 1.00 70.31 C ATOM 1961 CE1 PHE A 135 8.496 -4.816 4.779 1.00 31.00 C ATOM 1962 CE2 PHE A 135 9.034 -4.010 6.961 1.00 32.53 C ATOM 1963 CZ PHE A 135 8.663 -3.764 5.654 1.00 23.35 C ATOM 0 H PHE A 135 6.474 -7.676 6.375 1.00 23.02 H new ATOM 0 HA PHE A 135 8.338 -9.622 7.506 1.00 51.40 H new ATOM 0 HB2 PHE A 135 9.994 -7.774 7.819 1.00 13.53 H new ATOM 0 HB3 PHE A 135 9.819 -8.328 6.166 1.00 13.53 H new ATOM 0 HD1 PHE A 135 8.565 -6.921 4.516 1.00 2.24 H new ATOM 0 HD2 PHE A 135 9.527 -5.497 8.408 1.00 70.31 H new ATOM 0 HE1 PHE A 135 8.206 -4.627 3.756 1.00 31.00 H new ATOM 0 HE2 PHE A 135 9.166 -3.189 7.650 1.00 32.53 H new ATOM 0 HZ PHE A 135 8.504 -2.750 5.318 1.00 23.35 H new ATOM 1973 N GLY A 136 8.032 -8.548 9.774 1.00 51.34 N ATOM 1974 CA GLY A 136 7.539 -8.168 11.067 1.00 22.30 C ATOM 1975 C GLY A 136 8.618 -7.647 11.982 1.00 2.34 C ATOM 1976 O GLY A 136 9.764 -8.129 11.960 1.00 30.13 O ATOM 0 H GLY A 136 8.826 -9.188 9.790 1.00 51.34 H new ATOM 0 HA2 GLY A 136 6.772 -7.403 10.946 1.00 22.30 H new ATOM 0 HA3 GLY A 136 7.059 -9.028 11.534 1.00 22.30 H new ATOM 1980 N GLY A 137 8.259 -6.676 12.774 1.00 13.21 N ATOM 1981 CA GLY A 137 9.166 -6.070 13.709 1.00 53.45 C ATOM 1982 C GLY A 137 8.868 -4.607 13.806 1.00 2.21 C ATOM 1983 O GLY A 137 7.926 -4.147 13.180 1.00 51.53 O ATOM 0 H GLY A 137 7.320 -6.279 12.789 1.00 13.21 H new ATOM 0 HA2 GLY A 137 9.066 -6.539 14.688 1.00 53.45 H new ATOM 0 HA3 GLY A 137 10.196 -6.223 13.386 1.00 53.45 H new ATOM 1987 N TYR A 138 9.633 -3.876 14.565 1.00 11.05 N ATOM 1988 CA TYR A 138 9.404 -2.441 14.677 1.00 31.24 C ATOM 1989 C TYR A 138 10.030 -1.739 13.486 1.00 61.01 C ATOM 1990 O TYR A 138 11.259 -1.671 13.370 1.00 33.24 O ATOM 1991 CB TYR A 138 9.974 -1.889 15.985 1.00 63.13 C ATOM 1992 CG TYR A 138 9.404 -2.543 17.223 1.00 3.12 C ATOM 1993 CD1 TYR A 138 8.140 -2.211 17.690 1.00 40.12 C ATOM 1994 CD2 TYR A 138 10.128 -3.499 17.918 1.00 24.52 C ATOM 1995 CE1 TYR A 138 7.616 -2.813 18.814 1.00 61.25 C ATOM 1996 CE2 TYR A 138 9.611 -4.106 19.040 1.00 25.12 C ATOM 1997 CZ TYR A 138 8.357 -3.761 19.484 1.00 71.23 C ATOM 1998 OH TYR A 138 7.840 -4.371 20.605 1.00 5.22 O ATOM 0 H TYR A 138 10.415 -4.232 15.114 1.00 11.05 H new ATOM 0 HA TYR A 138 8.330 -2.257 14.685 1.00 31.24 H new ATOM 0 HB2 TYR A 138 11.056 -2.019 15.982 1.00 63.13 H new ATOM 0 HB3 TYR A 138 9.782 -0.817 16.030 1.00 63.13 H new ATOM 0 HD1 TYR A 138 7.557 -1.469 17.164 1.00 40.12 H new ATOM 0 HD2 TYR A 138 11.114 -3.772 17.573 1.00 24.52 H new ATOM 0 HE1 TYR A 138 6.631 -2.543 19.167 1.00 61.25 H new ATOM 0 HE2 TYR A 138 10.188 -4.850 19.569 1.00 25.12 H new ATOM 0 HH TYR A 138 8.490 -5.015 20.956 1.00 5.22 H new ATOM 2008 N ALA A 139 9.207 -1.263 12.588 1.00 4.11 N ATOM 2009 CA ALA A 139 9.702 -0.634 11.386 1.00 2.50 C ATOM 2010 C ALA A 139 9.759 0.871 11.503 1.00 62.43 C ATOM 2011 O ALA A 139 8.878 1.500 12.062 1.00 52.13 O ATOM 2012 CB ALA A 139 8.862 -1.023 10.185 1.00 70.31 C ATOM 0 H ALA A 139 8.190 -1.298 12.664 1.00 4.11 H new ATOM 0 HA ALA A 139 10.721 -0.995 11.246 1.00 2.50 H new ATOM 0 HB1 ALA A 139 9.256 -0.536 9.293 1.00 70.31 H new ATOM 0 HB2 ALA A 139 8.895 -2.104 10.053 1.00 70.31 H new ATOM 0 HB3 ALA A 139 7.831 -0.708 10.345 1.00 70.31 H new ATOM 2018 N LYS A 140 10.823 1.423 11.004 1.00 2.13 N ATOM 2019 CA LYS A 140 10.989 2.840 10.869 1.00 31.10 C ATOM 2020 C LYS A 140 10.932 3.143 9.381 1.00 23.31 C ATOM 2021 O LYS A 140 10.836 2.211 8.570 1.00 53.31 O ATOM 2022 CB LYS A 140 12.338 3.316 11.478 1.00 42.33 C ATOM 2023 CG LYS A 140 12.433 3.349 13.032 1.00 22.21 C ATOM 2024 CD LYS A 140 12.177 2.001 13.734 1.00 30.34 C ATOM 2025 CE LYS A 140 13.154 0.901 13.313 1.00 15.24 C ATOM 2026 NZ LYS A 140 14.564 1.247 13.567 1.00 53.32 N ATOM 0 H LYS A 140 11.623 0.886 10.670 1.00 2.13 H new ATOM 0 HA LYS A 140 10.205 3.370 11.410 1.00 31.10 H new ATOM 0 HB2 LYS A 140 13.128 2.666 11.103 1.00 42.33 H new ATOM 0 HB3 LYS A 140 12.545 4.318 11.103 1.00 42.33 H new ATOM 0 HG2 LYS A 140 13.425 3.704 13.312 1.00 22.21 H new ATOM 0 HG3 LYS A 140 11.716 4.078 13.408 1.00 22.21 H new ATOM 0 HD2 LYS A 140 12.244 2.143 14.813 1.00 30.34 H new ATOM 0 HD3 LYS A 140 11.160 1.675 13.518 1.00 30.34 H new ATOM 0 HE2 LYS A 140 12.910 -0.017 13.848 1.00 15.24 H new ATOM 0 HE3 LYS A 140 13.023 0.695 12.251 1.00 15.24 H new ATOM 0 HZ1 LYS A 140 15.171 0.443 13.308 1.00 53.32 H new ATOM 0 HZ2 LYS A 140 14.826 2.076 12.997 1.00 53.32 H new ATOM 0 HZ3 LYS A 140 14.691 1.466 14.576 1.00 53.32 H new ATOM 2040 N GLU A 141 10.995 4.402 9.006 1.00 12.34 N ATOM 2041 CA GLU A 141 10.922 4.770 7.590 1.00 24.21 C ATOM 2042 C GLU A 141 12.080 4.180 6.776 1.00 3.32 C ATOM 2043 O GLU A 141 11.892 3.766 5.621 1.00 4.14 O ATOM 2044 CB GLU A 141 10.837 6.277 7.415 1.00 2.44 C ATOM 2045 CG GLU A 141 9.583 6.877 8.012 1.00 25.41 C ATOM 2046 CD GLU A 141 9.539 8.364 7.865 1.00 73.52 C ATOM 2047 OE1 GLU A 141 9.051 8.847 6.832 1.00 52.45 O ATOM 2048 OE2 GLU A 141 9.998 9.073 8.782 1.00 62.21 O ATOM 0 H GLU A 141 11.096 5.189 9.647 1.00 12.34 H new ATOM 0 HA GLU A 141 10.004 4.334 7.197 1.00 24.21 H new ATOM 0 HB2 GLU A 141 11.709 6.740 7.877 1.00 2.44 H new ATOM 0 HB3 GLU A 141 10.876 6.516 6.352 1.00 2.44 H new ATOM 0 HG2 GLU A 141 8.709 6.441 7.529 1.00 25.41 H new ATOM 0 HG3 GLU A 141 9.526 6.617 9.069 1.00 25.41 H new ATOM 2055 N ALA A 142 13.254 4.116 7.386 1.00 73.43 N ATOM 2056 CA ALA A 142 14.438 3.551 6.748 1.00 4.31 C ATOM 2057 C ALA A 142 14.243 2.069 6.433 1.00 23.21 C ATOM 2058 O ALA A 142 14.737 1.575 5.427 1.00 5.42 O ATOM 2059 CB ALA A 142 15.664 3.751 7.626 1.00 60.44 C ATOM 0 H ALA A 142 13.415 4.453 8.335 1.00 73.43 H new ATOM 0 HA ALA A 142 14.593 4.077 5.806 1.00 4.31 H new ATOM 0 HB1 ALA A 142 16.538 3.323 7.134 1.00 60.44 H new ATOM 0 HB2 ALA A 142 15.825 4.817 7.789 1.00 60.44 H new ATOM 0 HB3 ALA A 142 15.509 3.257 8.585 1.00 60.44 H new ATOM 2065 N ASP A 143 13.479 1.380 7.279 1.00 2.33 N ATOM 2066 CA ASP A 143 13.228 -0.050 7.117 1.00 64.32 C ATOM 2067 C ASP A 143 12.474 -0.337 5.850 1.00 64.51 C ATOM 2068 O ASP A 143 12.695 -1.366 5.221 1.00 22.21 O ATOM 2069 CB ASP A 143 12.482 -0.646 8.312 1.00 1.44 C ATOM 2070 CG ASP A 143 13.276 -0.583 9.585 1.00 53.51 C ATOM 2071 OD1 ASP A 143 13.290 0.466 10.219 1.00 31.23 O ATOM 2072 OD2 ASP A 143 13.901 -1.588 9.964 1.00 23.24 O ATOM 0 H ASP A 143 13.020 1.794 8.090 1.00 2.33 H new ATOM 0 HA ASP A 143 14.207 -0.526 7.059 1.00 64.32 H new ATOM 0 HB2 ASP A 143 11.541 -0.113 8.449 1.00 1.44 H new ATOM 0 HB3 ASP A 143 12.231 -1.685 8.097 1.00 1.44 H new ATOM 2077 N TYR A 144 11.583 0.560 5.462 1.00 44.00 N ATOM 2078 CA TYR A 144 10.856 0.393 4.210 1.00 13.22 C ATOM 2079 C TYR A 144 11.813 0.471 3.041 1.00 24.44 C ATOM 2080 O TYR A 144 11.766 -0.353 2.127 1.00 43.15 O ATOM 2081 CB TYR A 144 9.752 1.435 4.031 1.00 63.01 C ATOM 2082 CG TYR A 144 8.579 1.322 4.978 1.00 74.13 C ATOM 2083 CD1 TYR A 144 7.606 0.350 4.785 1.00 21.13 C ATOM 2084 CD2 TYR A 144 8.424 2.197 6.038 1.00 4.31 C ATOM 2085 CE1 TYR A 144 6.516 0.254 5.621 1.00 54.11 C ATOM 2086 CE2 TYR A 144 7.331 2.114 6.878 1.00 22.53 C ATOM 2087 CZ TYR A 144 6.380 1.140 6.663 1.00 64.12 C ATOM 2088 OH TYR A 144 5.284 1.059 7.487 1.00 23.24 O ATOM 0 H TYR A 144 11.346 1.402 5.987 1.00 44.00 H new ATOM 0 HA TYR A 144 10.382 -0.588 4.246 1.00 13.22 H new ATOM 0 HB2 TYR A 144 10.192 2.426 4.145 1.00 63.01 H new ATOM 0 HB3 TYR A 144 9.378 1.368 3.010 1.00 63.01 H new ATOM 0 HD1 TYR A 144 7.706 -0.344 3.963 1.00 21.13 H new ATOM 0 HD2 TYR A 144 9.170 2.958 6.212 1.00 4.31 H new ATOM 0 HE1 TYR A 144 5.773 -0.513 5.459 1.00 54.11 H new ATOM 0 HE2 TYR A 144 7.222 2.808 7.698 1.00 22.53 H new ATOM 0 HH TYR A 144 5.338 0.241 8.024 1.00 23.24 H new ATOM 2098 N VAL A 145 12.710 1.439 3.103 1.00 33.31 N ATOM 2099 CA VAL A 145 13.688 1.658 2.054 1.00 73.24 C ATOM 2100 C VAL A 145 14.648 0.472 1.998 1.00 33.13 C ATOM 2101 O VAL A 145 14.936 -0.066 0.925 1.00 5.43 O ATOM 2102 CB VAL A 145 14.499 2.960 2.300 1.00 73.15 C ATOM 2103 CG1 VAL A 145 15.441 3.240 1.140 1.00 24.22 C ATOM 2104 CG2 VAL A 145 13.575 4.146 2.548 1.00 2.31 C ATOM 0 H VAL A 145 12.780 2.094 3.881 1.00 33.31 H new ATOM 0 HA VAL A 145 13.155 1.758 1.109 1.00 73.24 H new ATOM 0 HB VAL A 145 15.101 2.813 3.197 1.00 73.15 H new ATOM 0 HG11 VAL A 145 15.997 4.157 1.336 1.00 24.22 H new ATOM 0 HG12 VAL A 145 16.138 2.409 1.029 1.00 24.22 H new ATOM 0 HG13 VAL A 145 14.864 3.355 0.222 1.00 24.22 H new ATOM 0 HG21 VAL A 145 14.171 5.043 2.717 1.00 2.31 H new ATOM 0 HG22 VAL A 145 12.933 4.295 1.680 1.00 2.31 H new ATOM 0 HG23 VAL A 145 12.958 3.950 3.425 1.00 2.31 H new ATOM 2114 N ALA A 146 15.113 0.057 3.164 1.00 60.34 N ATOM 2115 CA ALA A 146 16.020 -1.070 3.298 1.00 32.20 C ATOM 2116 C ALA A 146 15.380 -2.354 2.780 1.00 30.02 C ATOM 2117 O ALA A 146 16.020 -3.144 2.095 1.00 22.35 O ATOM 2118 CB ALA A 146 16.439 -1.229 4.740 1.00 50.44 C ATOM 0 H ALA A 146 14.870 0.497 4.052 1.00 60.34 H new ATOM 0 HA ALA A 146 16.905 -0.872 2.694 1.00 32.20 H new ATOM 0 HB1 ALA A 146 17.119 -2.076 4.830 1.00 50.44 H new ATOM 0 HB2 ALA A 146 16.943 -0.322 5.075 1.00 50.44 H new ATOM 0 HB3 ALA A 146 15.558 -1.403 5.358 1.00 50.44 H new ATOM 2124 N HIS A 147 14.107 -2.548 3.082 1.00 61.14 N ATOM 2125 CA HIS A 147 13.395 -3.720 2.589 1.00 41.00 C ATOM 2126 C HIS A 147 13.207 -3.678 1.097 1.00 64.05 C ATOM 2127 O HIS A 147 13.244 -4.701 0.458 1.00 33.04 O ATOM 2128 CB HIS A 147 12.081 -3.995 3.329 1.00 23.34 C ATOM 2129 CG HIS A 147 12.268 -4.646 4.668 1.00 5.34 C ATOM 2130 ND1 HIS A 147 12.537 -3.959 5.819 1.00 72.42 N ATOM 2131 CD2 HIS A 147 12.218 -5.942 5.019 1.00 73.40 C ATOM 2132 CE1 HIS A 147 12.648 -4.805 6.822 1.00 41.11 C ATOM 2133 NE2 HIS A 147 12.459 -6.015 6.359 1.00 72.20 N ATOM 0 H HIS A 147 13.549 -1.919 3.659 1.00 61.14 H new ATOM 0 HA HIS A 147 14.039 -4.571 2.812 1.00 41.00 H new ATOM 0 HB2 HIS A 147 11.546 -3.055 3.463 1.00 23.34 H new ATOM 0 HB3 HIS A 147 11.452 -4.634 2.709 1.00 23.34 H new ATOM 0 HD1 HIS A 147 12.636 -2.946 5.890 1.00 72.42 H new ATOM 0 HD2 HIS A 147 12.022 -6.775 4.360 1.00 73.40 H new ATOM 0 HE1 HIS A 147 12.859 -4.546 7.849 1.00 41.11 H new ATOM 0 HE2 HIS A 147 12.487 -6.872 6.911 1.00 72.20 H new ATOM 2142 N ALA A 148 13.026 -2.492 0.542 1.00 30.41 N ATOM 2143 CA ALA A 148 12.929 -2.343 -0.904 1.00 41.44 C ATOM 2144 C ALA A 148 14.283 -2.659 -1.542 1.00 70.01 C ATOM 2145 O ALA A 148 14.362 -3.356 -2.557 1.00 15.21 O ATOM 2146 CB ALA A 148 12.474 -0.939 -1.268 1.00 31.10 C ATOM 0 H ALA A 148 12.943 -1.621 1.066 1.00 30.41 H new ATOM 0 HA ALA A 148 12.186 -3.043 -1.287 1.00 41.44 H new ATOM 0 HB1 ALA A 148 12.408 -0.848 -2.352 1.00 31.10 H new ATOM 0 HB2 ALA A 148 11.496 -0.748 -0.827 1.00 31.10 H new ATOM 0 HB3 ALA A 148 13.192 -0.213 -0.886 1.00 31.10 H new ATOM 2152 N THR A 149 15.346 -2.173 -0.906 1.00 63.11 N ATOM 2153 CA THR A 149 16.692 -2.398 -1.334 1.00 65.21 C ATOM 2154 C THR A 149 16.992 -3.908 -1.333 1.00 22.52 C ATOM 2155 O THR A 149 17.474 -4.472 -2.331 1.00 63.15 O ATOM 2156 CB THR A 149 17.658 -1.677 -0.367 1.00 32.44 C ATOM 2157 OG1 THR A 149 17.316 -0.281 -0.290 1.00 41.53 O ATOM 2158 CG2 THR A 149 19.072 -1.804 -0.843 1.00 52.34 C ATOM 0 H THR A 149 15.276 -1.602 -0.063 1.00 63.11 H new ATOM 0 HA THR A 149 16.824 -2.009 -2.344 1.00 65.21 H new ATOM 0 HB THR A 149 17.568 -2.139 0.616 1.00 32.44 H new ATOM 0 HG1 THR A 149 16.604 -0.155 0.372 1.00 41.53 H new ATOM 0 HG21 THR A 149 19.737 -1.290 -0.149 1.00 52.34 H new ATOM 0 HG22 THR A 149 19.345 -2.858 -0.894 1.00 52.34 H new ATOM 0 HG23 THR A 149 19.164 -1.357 -1.833 1.00 52.34 H new ATOM 2166 N GLN A 150 16.677 -4.561 -0.225 1.00 51.23 N ATOM 2167 CA GLN A 150 16.898 -5.979 -0.105 1.00 73.34 C ATOM 2168 C GLN A 150 15.955 -6.778 -0.973 1.00 10.40 C ATOM 2169 O GLN A 150 16.312 -7.842 -1.434 1.00 53.42 O ATOM 2170 CB GLN A 150 16.847 -6.456 1.332 1.00 40.31 C ATOM 2171 CG GLN A 150 17.959 -5.907 2.190 1.00 53.35 C ATOM 2172 CD GLN A 150 17.967 -6.524 3.556 1.00 0.24 C ATOM 2173 OE1 GLN A 150 18.602 -7.555 3.776 1.00 55.12 O ATOM 2174 NE2 GLN A 150 17.290 -5.920 4.473 1.00 45.02 N ATOM 0 H GLN A 150 16.267 -4.124 0.601 1.00 51.23 H new ATOM 0 HA GLN A 150 17.911 -6.155 -0.468 1.00 73.34 H new ATOM 0 HB2 GLN A 150 15.889 -6.171 1.767 1.00 40.31 H new ATOM 0 HB3 GLN A 150 16.892 -7.545 1.346 1.00 40.31 H new ATOM 0 HG2 GLN A 150 18.917 -6.090 1.703 1.00 53.35 H new ATOM 0 HG3 GLN A 150 17.848 -4.826 2.280 1.00 53.35 H new ATOM 0 HE21 GLN A 150 16.777 -5.067 4.250 1.00 45.02 H new ATOM 0 HE22 GLN A 150 17.268 -6.295 5.421 1.00 45.02 H new ATOM 2183 N LEU A 151 14.762 -6.258 -1.216 1.00 14.15 N ATOM 2184 CA LEU A 151 13.823 -6.942 -2.075 1.00 3.20 C ATOM 2185 C LEU A 151 14.370 -6.987 -3.502 1.00 22.21 C ATOM 2186 O LEU A 151 14.242 -7.982 -4.194 1.00 5.22 O ATOM 2187 CB LEU A 151 12.424 -6.314 -2.018 1.00 13.23 C ATOM 2188 CG LEU A 151 11.333 -7.044 -2.808 1.00 71.41 C ATOM 2189 CD1 LEU A 151 11.248 -8.493 -2.371 1.00 23.11 C ATOM 2190 CD2 LEU A 151 9.988 -6.365 -2.604 1.00 32.32 C ATOM 0 H LEU A 151 14.428 -5.374 -0.833 1.00 14.15 H new ATOM 0 HA LEU A 151 13.708 -7.964 -1.714 1.00 3.20 H new ATOM 0 HB2 LEU A 151 12.114 -6.257 -0.975 1.00 13.23 H new ATOM 0 HB3 LEU A 151 12.490 -5.291 -2.387 1.00 13.23 H new ATOM 0 HG LEU A 151 11.591 -7.007 -3.866 1.00 71.41 H new ATOM 0 HD11 LEU A 151 10.469 -9.000 -2.940 1.00 23.11 H new ATOM 0 HD12 LEU A 151 12.205 -8.984 -2.549 1.00 23.11 H new ATOM 0 HD13 LEU A 151 11.009 -8.539 -1.309 1.00 23.11 H new ATOM 0 HD21 LEU A 151 9.223 -6.895 -3.171 1.00 32.32 H new ATOM 0 HD22 LEU A 151 9.730 -6.380 -1.545 1.00 32.32 H new ATOM 0 HD23 LEU A 151 10.046 -5.333 -2.949 1.00 32.32 H new ATOM 2202 N ARG A 152 15.029 -5.918 -3.900 1.00 42.20 N ATOM 2203 CA ARG A 152 15.694 -5.871 -5.193 1.00 23.21 C ATOM 2204 C ARG A 152 16.889 -6.801 -5.201 1.00 14.41 C ATOM 2205 O ARG A 152 17.182 -7.452 -6.199 1.00 22.30 O ATOM 2206 CB ARG A 152 16.159 -4.459 -5.542 1.00 32.01 C ATOM 2207 CG ARG A 152 15.061 -3.494 -5.950 1.00 44.53 C ATOM 2208 CD ARG A 152 15.643 -2.130 -6.322 1.00 13.30 C ATOM 2209 NE ARG A 152 16.807 -2.253 -7.240 1.00 31.45 N ATOM 2210 CZ ARG A 152 17.365 -1.259 -7.947 1.00 62.23 C ATOM 2211 NH1 ARG A 152 16.722 -0.119 -8.138 1.00 71.41 N ATOM 2212 NH2 ARG A 152 18.540 -1.450 -8.527 1.00 52.24 N ATOM 0 H ARG A 152 15.120 -5.066 -3.347 1.00 42.20 H new ATOM 0 HA ARG A 152 14.967 -6.189 -5.941 1.00 23.21 H new ATOM 0 HB2 ARG A 152 16.683 -4.044 -4.681 1.00 32.01 H new ATOM 0 HB3 ARG A 152 16.883 -4.524 -6.354 1.00 32.01 H new ATOM 0 HG2 ARG A 152 14.510 -3.902 -6.797 1.00 44.53 H new ATOM 0 HG3 ARG A 152 14.350 -3.379 -5.132 1.00 44.53 H new ATOM 0 HD2 ARG A 152 14.871 -1.523 -6.795 1.00 13.30 H new ATOM 0 HD3 ARG A 152 15.949 -1.607 -5.416 1.00 13.30 H new ATOM 0 HE ARG A 152 17.220 -3.180 -7.341 1.00 31.45 H new ATOM 0 HH11 ARG A 152 15.790 0.013 -7.746 1.00 71.41 H new ATOM 0 HH12 ARG A 152 17.158 0.628 -8.678 1.00 71.41 H new ATOM 0 HH21 ARG A 152 19.014 -2.348 -8.435 1.00 52.24 H new ATOM 0 HH22 ARG A 152 18.971 -0.699 -9.066 1.00 52.24 H new ATOM 2226 N THR A 153 17.567 -6.862 -4.082 1.00 14.13 N ATOM 2227 CA THR A 153 18.735 -7.693 -3.939 1.00 10.51 C ATOM 2228 C THR A 153 18.338 -9.185 -3.960 1.00 21.24 C ATOM 2229 O THR A 153 19.054 -10.025 -4.494 1.00 25.25 O ATOM 2230 CB THR A 153 19.481 -7.346 -2.624 1.00 0.23 C ATOM 2231 OG1 THR A 153 19.769 -5.928 -2.608 1.00 64.24 O ATOM 2232 CG2 THR A 153 20.793 -8.115 -2.517 1.00 52.12 C ATOM 0 H THR A 153 17.323 -6.335 -3.243 1.00 14.13 H new ATOM 0 HA THR A 153 19.405 -7.504 -4.778 1.00 10.51 H new ATOM 0 HB THR A 153 18.846 -7.622 -1.783 1.00 0.23 H new ATOM 0 HG1 THR A 153 18.937 -5.427 -2.478 1.00 64.24 H new ATOM 0 HG21 THR A 153 21.294 -7.852 -1.586 1.00 52.12 H new ATOM 0 HG22 THR A 153 20.589 -9.186 -2.529 1.00 52.12 H new ATOM 0 HG23 THR A 153 21.435 -7.858 -3.360 1.00 52.12 H new ATOM 2240 N THR A 154 17.197 -9.499 -3.395 1.00 61.13 N ATOM 2241 CA THR A 154 16.736 -10.867 -3.378 1.00 54.01 C ATOM 2242 C THR A 154 16.133 -11.269 -4.753 1.00 44.42 C ATOM 2243 O THR A 154 16.259 -12.417 -5.190 1.00 22.35 O ATOM 2244 CB THR A 154 15.793 -11.183 -2.167 1.00 33.54 C ATOM 2245 OG1 THR A 154 15.536 -12.588 -2.078 1.00 65.13 O ATOM 2246 CG2 THR A 154 14.494 -10.451 -2.285 1.00 4.52 C ATOM 0 H THR A 154 16.573 -8.830 -2.943 1.00 61.13 H new ATOM 0 HA THR A 154 17.608 -11.501 -3.217 1.00 54.01 H new ATOM 0 HB THR A 154 16.304 -10.850 -1.263 1.00 33.54 H new ATOM 0 HG1 THR A 154 14.947 -12.765 -1.315 1.00 65.13 H new ATOM 0 HG21 THR A 154 13.862 -10.691 -1.430 1.00 4.52 H new ATOM 0 HG22 THR A 154 14.682 -9.378 -2.307 1.00 4.52 H new ATOM 0 HG23 THR A 154 13.990 -10.750 -3.204 1.00 4.52 H new ATOM 2254 N LEU A 155 15.499 -10.305 -5.443 1.00 35.12 N ATOM 2255 CA LEU A 155 14.937 -10.525 -6.794 1.00 52.42 C ATOM 2256 C LEU A 155 16.031 -10.482 -7.873 1.00 24.12 C ATOM 2257 O LEU A 155 15.752 -10.565 -9.061 1.00 71.31 O ATOM 2258 CB LEU A 155 13.845 -9.475 -7.102 1.00 1.55 C ATOM 2259 CG LEU A 155 12.570 -9.560 -6.260 1.00 55.43 C ATOM 2260 CD1 LEU A 155 11.679 -8.365 -6.521 1.00 0.50 C ATOM 2261 CD2 LEU A 155 11.814 -10.839 -6.579 1.00 20.10 C ATOM 0 H LEU A 155 15.361 -9.359 -5.087 1.00 35.12 H new ATOM 0 HA LEU A 155 14.490 -11.519 -6.808 1.00 52.42 H new ATOM 0 HB2 LEU A 155 14.277 -8.483 -6.971 1.00 1.55 H new ATOM 0 HB3 LEU A 155 13.569 -9.566 -8.152 1.00 1.55 H new ATOM 0 HG LEU A 155 12.856 -9.564 -5.208 1.00 55.43 H new ATOM 0 HD11 LEU A 155 10.778 -8.444 -5.913 1.00 0.50 H new ATOM 0 HD12 LEU A 155 12.212 -7.450 -6.263 1.00 0.50 H new ATOM 0 HD13 LEU A 155 11.404 -8.339 -7.576 1.00 0.50 H new ATOM 0 HD21 LEU A 155 10.909 -10.887 -5.973 1.00 20.10 H new ATOM 0 HD22 LEU A 155 11.545 -10.849 -7.635 1.00 20.10 H new ATOM 0 HD23 LEU A 155 12.445 -11.700 -6.358 1.00 20.10 H new ATOM 2273 N GLU A 156 17.256 -10.392 -7.441 1.00 45.23 N ATOM 2274 CA GLU A 156 18.406 -10.322 -8.330 1.00 44.51 C ATOM 2275 C GLU A 156 18.607 -11.680 -9.006 1.00 53.42 C ATOM 2276 O GLU A 156 18.581 -12.726 -8.340 1.00 25.02 O ATOM 2277 CB GLU A 156 19.642 -9.868 -7.506 1.00 44.11 C ATOM 2278 CG GLU A 156 20.961 -9.600 -8.260 1.00 31.35 C ATOM 2279 CD GLU A 156 21.653 -10.842 -8.759 1.00 50.43 C ATOM 2280 OE1 GLU A 156 22.164 -11.618 -7.926 1.00 44.44 O ATOM 2281 OE2 GLU A 156 21.715 -11.051 -9.985 1.00 55.12 O ATOM 0 H GLU A 156 17.499 -10.364 -6.451 1.00 45.23 H new ATOM 0 HA GLU A 156 18.251 -9.592 -9.124 1.00 44.51 H new ATOM 0 HB2 GLU A 156 19.371 -8.956 -6.974 1.00 44.11 H new ATOM 0 HB3 GLU A 156 19.838 -10.630 -6.752 1.00 44.11 H new ATOM 0 HG2 GLU A 156 20.755 -8.947 -9.108 1.00 31.35 H new ATOM 0 HG3 GLU A 156 21.640 -9.060 -7.600 1.00 31.35 H new ATOM 2288 N GLY A 157 18.785 -11.662 -10.307 1.00 51.12 N ATOM 2289 CA GLY A 157 18.968 -12.884 -11.052 1.00 2.51 C ATOM 2290 C GLY A 157 17.684 -13.358 -11.683 1.00 4.13 C ATOM 2291 O GLY A 157 17.593 -14.487 -12.165 1.00 41.22 O ATOM 0 H GLY A 157 18.807 -10.812 -10.871 1.00 51.12 H new ATOM 0 HA2 GLY A 157 19.717 -12.727 -11.828 1.00 2.51 H new ATOM 0 HA3 GLY A 157 19.354 -13.658 -10.389 1.00 2.51 H new ATOM 2295 N THR A 158 16.682 -12.510 -11.678 1.00 44.54 N ATOM 2296 CA THR A 158 15.418 -12.853 -12.273 1.00 71.42 C ATOM 2297 C THR A 158 15.080 -11.797 -13.334 1.00 73.23 C ATOM 2298 O THR A 158 15.706 -10.727 -13.356 1.00 41.12 O ATOM 2299 CB THR A 158 14.276 -12.905 -11.210 1.00 21.52 C ATOM 2300 OG1 THR A 158 14.009 -11.598 -10.695 1.00 61.44 O ATOM 2301 CG2 THR A 158 14.636 -13.825 -10.047 1.00 52.00 C ATOM 0 H THR A 158 16.721 -11.577 -11.267 1.00 44.54 H new ATOM 0 HA THR A 158 15.499 -13.844 -12.720 1.00 71.42 H new ATOM 0 HB THR A 158 13.390 -13.296 -11.711 1.00 21.52 H new ATOM 0 HG1 THR A 158 14.711 -11.347 -10.059 1.00 61.44 H new ATOM 0 HG21 THR A 158 13.818 -13.837 -9.326 1.00 52.00 H new ATOM 0 HG22 THR A 158 14.805 -14.835 -10.421 1.00 52.00 H new ATOM 0 HG23 THR A 158 15.542 -13.461 -9.562 1.00 52.00 H new ATOM 2309 N PRO A 159 14.104 -12.052 -14.227 1.00 73.44 N ATOM 2310 CA PRO A 159 13.694 -11.080 -15.250 1.00 53.24 C ATOM 2311 C PRO A 159 12.817 -9.954 -14.669 1.00 23.03 C ATOM 2312 O PRO A 159 12.194 -9.192 -15.416 1.00 34.24 O ATOM 2313 CB PRO A 159 12.865 -11.921 -16.242 1.00 1.11 C ATOM 2314 CG PRO A 159 13.046 -13.341 -15.813 1.00 35.51 C ATOM 2315 CD PRO A 159 13.341 -13.296 -14.351 1.00 71.24 C ATOM 0 HA PRO A 159 14.556 -10.584 -15.698 1.00 53.24 H new ATOM 0 HB2 PRO A 159 11.814 -11.634 -16.216 1.00 1.11 H new ATOM 0 HB3 PRO A 159 13.210 -11.773 -17.265 1.00 1.11 H new ATOM 0 HG2 PRO A 159 12.148 -13.926 -16.012 1.00 35.51 H new ATOM 0 HG3 PRO A 159 13.861 -13.813 -16.361 1.00 35.51 H new ATOM 0 HD2 PRO A 159 12.430 -13.276 -13.752 1.00 71.24 H new ATOM 0 HD3 PRO A 159 13.918 -14.162 -14.025 1.00 71.24 H new ATOM 2323 N ALA A 160 12.772 -9.861 -13.353 1.00 20.51 N ATOM 2324 CA ALA A 160 11.987 -8.851 -12.684 1.00 74.22 C ATOM 2325 C ALA A 160 12.609 -7.478 -12.852 1.00 51.12 C ATOM 2326 O ALA A 160 13.749 -7.242 -12.438 1.00 22.14 O ATOM 2327 CB ALA A 160 11.841 -9.177 -11.212 1.00 71.31 C ATOM 0 H ALA A 160 13.278 -10.483 -12.723 1.00 20.51 H new ATOM 0 HA ALA A 160 10.998 -8.840 -13.142 1.00 74.22 H new ATOM 0 HB1 ALA A 160 11.246 -8.404 -10.725 1.00 71.31 H new ATOM 0 HB2 ALA A 160 11.345 -10.141 -11.100 1.00 71.31 H new ATOM 0 HB3 ALA A 160 12.827 -9.221 -10.750 1.00 71.31 H new ATOM 2333 N THR A 161 11.873 -6.600 -13.467 1.00 64.22 N ATOM 2334 CA THR A 161 12.278 -5.237 -13.661 1.00 22.33 C ATOM 2335 C THR A 161 11.238 -4.382 -13.007 1.00 52.33 C ATOM 2336 O THR A 161 10.171 -4.881 -12.691 1.00 3.52 O ATOM 2337 CB THR A 161 12.390 -4.900 -15.161 1.00 73.44 C ATOM 2338 OG1 THR A 161 11.177 -5.270 -15.823 1.00 4.51 O ATOM 2339 CG2 THR A 161 13.562 -5.630 -15.801 1.00 64.43 C ATOM 0 H THR A 161 10.955 -6.815 -13.856 1.00 64.22 H new ATOM 0 HA THR A 161 13.262 -5.063 -13.225 1.00 22.33 H new ATOM 0 HB THR A 161 12.559 -3.828 -15.262 1.00 73.44 H new ATOM 0 HG1 THR A 161 11.246 -5.055 -16.777 1.00 4.51 H new ATOM 0 HG21 THR A 161 13.617 -5.373 -16.859 1.00 64.43 H new ATOM 0 HG22 THR A 161 14.488 -5.334 -15.308 1.00 64.43 H new ATOM 0 HG23 THR A 161 13.422 -6.706 -15.695 1.00 64.43 H new ATOM 2347 N TYR A 162 11.507 -3.138 -12.774 1.00 53.23 N ATOM 2348 CA TYR A 162 10.530 -2.318 -12.104 1.00 44.10 C ATOM 2349 C TYR A 162 10.344 -1.045 -12.887 1.00 31.43 C ATOM 2350 O TYR A 162 11.256 -0.603 -13.592 1.00 13.14 O ATOM 2351 CB TYR A 162 11.008 -1.949 -10.709 1.00 41.24 C ATOM 2352 CG TYR A 162 11.689 -3.068 -9.947 1.00 32.25 C ATOM 2353 CD1 TYR A 162 11.000 -4.187 -9.486 1.00 64.14 C ATOM 2354 CD2 TYR A 162 13.042 -2.988 -9.696 1.00 5.34 C ATOM 2355 CE1 TYR A 162 11.672 -5.191 -8.796 1.00 71.42 C ATOM 2356 CE2 TYR A 162 13.705 -3.966 -9.021 1.00 53.11 C ATOM 2357 CZ TYR A 162 13.030 -5.063 -8.573 1.00 1.33 C ATOM 2358 OH TYR A 162 13.713 -6.032 -7.886 1.00 1.12 O ATOM 0 H TYR A 162 12.375 -2.667 -13.029 1.00 53.23 H new ATOM 0 HA TYR A 162 9.596 -2.876 -12.032 1.00 44.10 H new ATOM 0 HB2 TYR A 162 11.700 -1.111 -10.789 1.00 41.24 H new ATOM 0 HB3 TYR A 162 10.153 -1.603 -10.128 1.00 41.24 H new ATOM 0 HD1 TYR A 162 9.939 -4.276 -9.665 1.00 64.14 H new ATOM 0 HD2 TYR A 162 13.591 -2.126 -10.045 1.00 5.34 H new ATOM 0 HE1 TYR A 162 11.139 -6.060 -8.439 1.00 71.42 H new ATOM 0 HE2 TYR A 162 14.766 -3.873 -8.840 1.00 53.11 H new ATOM 0 HH TYR A 162 14.676 -5.907 -8.015 1.00 1.12 H new ATOM 2368 N GLN A 163 9.182 -0.466 -12.787 1.00 24.12 N ATOM 2369 CA GLN A 163 8.925 0.800 -13.455 1.00 64.43 C ATOM 2370 C GLN A 163 8.973 1.961 -12.496 1.00 22.31 C ATOM 2371 O GLN A 163 8.217 2.025 -11.539 1.00 52.14 O ATOM 2372 CB GLN A 163 7.682 0.776 -14.402 1.00 74.32 C ATOM 2373 CG GLN A 163 6.372 0.197 -13.839 1.00 33.55 C ATOM 2374 CD GLN A 163 5.671 1.027 -12.793 1.00 31.12 C ATOM 2375 OE1 GLN A 163 5.734 2.258 -12.780 1.00 41.54 O ATOM 2376 NE2 GLN A 163 4.990 0.355 -11.922 1.00 40.25 N ATOM 0 H GLN A 163 8.395 -0.839 -12.256 1.00 24.12 H new ATOM 0 HA GLN A 163 9.752 0.963 -14.146 1.00 64.43 H new ATOM 0 HB2 GLN A 163 7.486 1.798 -14.726 1.00 74.32 H new ATOM 0 HB3 GLN A 163 7.948 0.205 -15.291 1.00 74.32 H new ATOM 0 HG2 GLN A 163 5.683 0.039 -14.669 1.00 33.55 H new ATOM 0 HG3 GLN A 163 6.586 -0.783 -13.412 1.00 33.55 H new ATOM 0 HE21 GLN A 163 4.965 -0.664 -11.970 1.00 40.25 H new ATOM 0 HE22 GLN A 163 4.478 0.844 -11.188 1.00 40.25 H new ATOM 2385 N GLY A 164 9.947 2.832 -12.705 1.00 71.55 N ATOM 2386 CA GLY A 164 10.133 3.982 -11.839 1.00 10.23 C ATOM 2387 C GLY A 164 10.742 3.580 -10.511 1.00 72.43 C ATOM 2388 O GLY A 164 10.955 4.418 -9.642 1.00 11.11 O ATOM 0 H GLY A 164 10.621 2.763 -13.468 1.00 71.55 H new ATOM 0 HA2 GLY A 164 10.778 4.710 -12.331 1.00 10.23 H new ATOM 0 HA3 GLY A 164 9.173 4.470 -11.668 1.00 10.23 H new ATOM 2392 N ASP A 165 11.022 2.270 -10.384 1.00 23.23 N ATOM 2393 CA ASP A 165 11.574 1.621 -9.176 1.00 20.42 C ATOM 2394 C ASP A 165 10.614 1.826 -7.995 1.00 52.14 C ATOM 2395 O ASP A 165 10.977 1.668 -6.830 1.00 44.52 O ATOM 2396 CB ASP A 165 12.985 2.167 -8.876 1.00 34.41 C ATOM 2397 CG ASP A 165 13.765 1.333 -7.872 1.00 54.40 C ATOM 2398 OD1 ASP A 165 14.103 0.186 -8.197 1.00 20.54 O ATOM 2399 OD2 ASP A 165 14.118 1.837 -6.785 1.00 12.10 O ATOM 0 H ASP A 165 10.865 1.609 -11.145 1.00 23.23 H new ATOM 0 HA ASP A 165 11.671 0.549 -9.345 1.00 20.42 H new ATOM 0 HB2 ASP A 165 13.550 2.220 -9.807 1.00 34.41 H new ATOM 0 HB3 ASP A 165 12.898 3.186 -8.498 1.00 34.41 H new ATOM 2404 N VAL A 166 9.359 2.122 -8.343 1.00 14.41 N ATOM 2405 CA VAL A 166 8.312 2.430 -7.387 1.00 13.32 C ATOM 2406 C VAL A 166 8.122 1.317 -6.370 1.00 74.32 C ATOM 2407 O VAL A 166 8.133 0.119 -6.705 1.00 52.41 O ATOM 2408 CB VAL A 166 6.946 2.724 -8.114 1.00 52.40 C ATOM 2409 CG1 VAL A 166 6.486 1.531 -8.941 1.00 53.42 C ATOM 2410 CG2 VAL A 166 5.857 3.128 -7.123 1.00 70.21 C ATOM 0 H VAL A 166 9.045 2.153 -9.313 1.00 14.41 H new ATOM 0 HA VAL A 166 8.632 3.325 -6.854 1.00 13.32 H new ATOM 0 HB VAL A 166 7.122 3.562 -8.788 1.00 52.40 H new ATOM 0 HG11 VAL A 166 5.541 1.769 -9.429 1.00 53.42 H new ATOM 0 HG12 VAL A 166 7.237 1.301 -9.697 1.00 53.42 H new ATOM 0 HG13 VAL A 166 6.351 0.667 -8.290 1.00 53.42 H new ATOM 0 HG21 VAL A 166 4.929 3.323 -7.661 1.00 70.21 H new ATOM 0 HG22 VAL A 166 5.699 2.321 -6.407 1.00 70.21 H new ATOM 0 HG23 VAL A 166 6.164 4.029 -6.592 1.00 70.21 H new ATOM 2420 N TYR A 167 7.939 1.715 -5.154 1.00 15.24 N ATOM 2421 CA TYR A 167 7.664 0.812 -4.106 1.00 14.44 C ATOM 2422 C TYR A 167 6.558 1.370 -3.271 1.00 40.02 C ATOM 2423 O TYR A 167 6.343 2.583 -3.238 1.00 62.21 O ATOM 2424 CB TYR A 167 8.923 0.445 -3.264 1.00 61.22 C ATOM 2425 CG TYR A 167 9.639 1.578 -2.542 1.00 3.04 C ATOM 2426 CD1 TYR A 167 10.440 2.475 -3.233 1.00 21.13 C ATOM 2427 CD2 TYR A 167 9.532 1.729 -1.161 1.00 61.41 C ATOM 2428 CE1 TYR A 167 11.109 3.491 -2.576 1.00 11.24 C ATOM 2429 CE2 TYR A 167 10.204 2.745 -0.498 1.00 43.22 C ATOM 2430 CZ TYR A 167 10.992 3.620 -1.217 1.00 20.41 C ATOM 2431 OH TYR A 167 11.661 4.633 -0.572 1.00 62.23 O ATOM 0 H TYR A 167 7.979 2.692 -4.865 1.00 15.24 H new ATOM 0 HA TYR A 167 7.344 -0.136 -4.540 1.00 14.44 H new ATOM 0 HB2 TYR A 167 8.626 -0.294 -2.520 1.00 61.22 H new ATOM 0 HB3 TYR A 167 9.641 -0.039 -3.926 1.00 61.22 H new ATOM 0 HD1 TYR A 167 10.543 2.378 -4.304 1.00 21.13 H new ATOM 0 HD2 TYR A 167 8.916 1.044 -0.598 1.00 61.41 H new ATOM 0 HE1 TYR A 167 11.723 4.182 -3.134 1.00 11.24 H new ATOM 0 HE2 TYR A 167 10.111 2.850 0.573 1.00 43.22 H new ATOM 0 HH TYR A 167 11.297 4.742 0.331 1.00 62.23 H new ATOM 2441 N TYR A 168 5.838 0.512 -2.657 1.00 54.33 N ATOM 2442 CA TYR A 168 4.752 0.902 -1.816 1.00 45.15 C ATOM 2443 C TYR A 168 5.077 0.503 -0.422 1.00 71.34 C ATOM 2444 O TYR A 168 5.647 -0.565 -0.202 1.00 52.34 O ATOM 2445 CB TYR A 168 3.456 0.212 -2.238 1.00 70.23 C ATOM 2446 CG TYR A 168 2.930 0.562 -3.621 1.00 55.14 C ATOM 2447 CD1 TYR A 168 3.622 0.205 -4.765 1.00 1.43 C ATOM 2448 CD2 TYR A 168 1.717 1.216 -3.771 1.00 30.13 C ATOM 2449 CE1 TYR A 168 3.128 0.495 -6.020 1.00 51.35 C ATOM 2450 CE2 TYR A 168 1.216 1.512 -5.026 1.00 3.33 C ATOM 2451 CZ TYR A 168 1.929 1.147 -6.145 1.00 42.44 C ATOM 2452 OH TYR A 168 1.437 1.439 -7.402 1.00 10.14 O ATOM 0 H TYR A 168 5.980 -0.496 -2.719 1.00 54.33 H new ATOM 0 HA TYR A 168 4.610 1.980 -1.895 1.00 45.15 H new ATOM 0 HB2 TYR A 168 3.611 -0.866 -2.193 1.00 70.23 H new ATOM 0 HB3 TYR A 168 2.685 0.454 -1.507 1.00 70.23 H new ATOM 0 HD1 TYR A 168 4.567 -0.310 -4.674 1.00 1.43 H new ATOM 0 HD2 TYR A 168 1.154 1.499 -2.894 1.00 30.13 H new ATOM 0 HE1 TYR A 168 3.684 0.209 -6.901 1.00 51.35 H new ATOM 0 HE2 TYR A 168 0.272 2.026 -5.127 1.00 3.33 H new ATOM 0 HH TYR A 168 0.577 1.902 -7.317 1.00 10.14 H new ATOM 2462 N CYS A 169 4.740 1.334 0.503 1.00 25.04 N ATOM 2463 CA CYS A 169 4.999 1.061 1.882 1.00 1.20 C ATOM 2464 C CYS A 169 3.679 0.895 2.604 1.00 74.31 C ATOM 2465 O CYS A 169 2.854 1.815 2.625 1.00 1.33 O ATOM 2466 CB CYS A 169 5.783 2.220 2.481 1.00 32.01 C ATOM 2467 SG CYS A 169 7.327 2.578 1.617 1.00 4.21 S ATOM 0 H CYS A 169 4.276 2.225 0.328 1.00 25.04 H new ATOM 0 HA CYS A 169 5.583 0.146 1.984 1.00 1.20 H new ATOM 0 HB2 CYS A 169 5.157 3.113 2.473 1.00 32.01 H new ATOM 0 HB3 CYS A 169 6.005 1.996 3.524 1.00 32.01 H new ATOM 0 HG CYS A 169 7.484 1.733 0.642 1.00 4.21 H new ATOM 2473 N ALA A 170 3.475 -0.263 3.173 1.00 73.22 N ATOM 2474 CA ALA A 170 2.250 -0.563 3.860 1.00 20.14 C ATOM 2475 C ALA A 170 2.462 -0.713 5.340 1.00 22.52 C ATOM 2476 O ALA A 170 3.449 -1.290 5.783 1.00 62.05 O ATOM 2477 CB ALA A 170 1.600 -1.807 3.297 1.00 4.20 C ATOM 0 H ALA A 170 4.154 -1.024 3.173 1.00 73.22 H new ATOM 0 HA ALA A 170 1.581 0.283 3.701 1.00 20.14 H new ATOM 0 HB1 ALA A 170 0.675 -2.010 3.836 1.00 4.20 H new ATOM 0 HB2 ALA A 170 1.379 -1.655 2.241 1.00 4.20 H new ATOM 0 HB3 ALA A 170 2.278 -2.654 3.408 1.00 4.20 H new ATOM 2483 N GLY A 171 1.534 -0.188 6.073 1.00 25.12 N ATOM 2484 CA GLY A 171 1.533 -0.220 7.497 1.00 44.23 C ATOM 2485 C GLY A 171 0.202 0.281 7.950 1.00 33.21 C ATOM 2486 O GLY A 171 -0.526 0.852 7.149 1.00 45.11 O ATOM 0 H GLY A 171 0.725 0.293 5.679 1.00 25.12 H new ATOM 0 HA2 GLY A 171 1.706 -1.234 7.859 1.00 44.23 H new ATOM 0 HA3 GLY A 171 2.334 0.402 7.896 1.00 44.23 H new ATOM 2632 N ARG A 181 4.277 -2.745 13.352 1.00 23.42 N ATOM 2633 CA ARG A 181 4.920 -4.024 13.525 1.00 24.22 C ATOM 2634 C ARG A 181 4.733 -4.892 12.305 1.00 34.22 C ATOM 2635 O ARG A 181 5.558 -5.767 12.023 1.00 55.30 O ATOM 2636 CB ARG A 181 4.372 -4.732 14.753 1.00 73.23 C ATOM 2637 CG ARG A 181 4.488 -3.918 16.021 1.00 34.10 C ATOM 2638 CD ARG A 181 3.939 -4.671 17.204 1.00 43.11 C ATOM 2639 NE ARG A 181 3.913 -3.846 18.408 1.00 4.04 N ATOM 2640 CZ ARG A 181 3.942 -4.327 19.656 1.00 41.45 C ATOM 2641 NH1 ARG A 181 4.138 -5.633 19.874 1.00 51.43 N ATOM 2642 NH2 ARG A 181 3.796 -3.501 20.683 1.00 61.54 N ATOM 0 HA ARG A 181 5.987 -3.847 13.663 1.00 24.22 H new ATOM 0 HB2 ARG A 181 3.324 -4.978 14.583 1.00 73.23 H new ATOM 0 HB3 ARG A 181 4.903 -5.675 14.886 1.00 73.23 H new ATOM 0 HG2 ARG A 181 5.533 -3.666 16.200 1.00 34.10 H new ATOM 0 HG3 ARG A 181 3.949 -2.978 15.903 1.00 34.10 H new ATOM 0 HD2 ARG A 181 2.930 -5.016 16.978 1.00 43.11 H new ATOM 0 HD3 ARG A 181 4.547 -5.558 17.384 1.00 43.11 H new ATOM 0 HE ARG A 181 3.870 -2.834 18.290 1.00 4.04 H new ATOM 0 HH11 ARG A 181 4.266 -6.268 19.086 1.00 51.43 H new ATOM 0 HH12 ARG A 181 4.159 -5.993 20.828 1.00 51.43 H new ATOM 0 HH21 ARG A 181 3.662 -2.503 20.520 1.00 61.54 H new ATOM 0 HH22 ARG A 181 3.817 -3.864 21.636 1.00 61.54 H new ATOM 2656 N ARG A 182 3.640 -4.683 11.596 1.00 74.01 N ATOM 2657 CA ARG A 182 3.389 -5.434 10.384 1.00 63.25 C ATOM 2658 C ARG A 182 3.460 -4.477 9.236 1.00 71.51 C ATOM 2659 O ARG A 182 2.777 -3.442 9.245 1.00 65.32 O ATOM 2660 CB ARG A 182 1.998 -6.074 10.442 1.00 42.10 C ATOM 2661 CG ARG A 182 1.811 -7.028 11.602 1.00 45.23 C ATOM 2662 CD ARG A 182 0.414 -7.608 11.638 1.00 13.31 C ATOM 2663 NE ARG A 182 0.247 -8.542 12.756 1.00 60.30 N ATOM 2664 CZ ARG A 182 -0.777 -9.387 12.900 1.00 44.21 C ATOM 2665 NH1 ARG A 182 -1.764 -9.406 12.005 1.00 12.14 N ATOM 2666 NH2 ARG A 182 -0.828 -10.200 13.948 1.00 22.24 N ATOM 0 H ARG A 182 2.918 -4.004 11.837 1.00 74.01 H new ATOM 0 HA ARG A 182 4.126 -6.229 10.268 1.00 63.25 H new ATOM 0 HB2 ARG A 182 1.248 -5.286 10.508 1.00 42.10 H new ATOM 0 HB3 ARG A 182 1.816 -6.610 9.510 1.00 42.10 H new ATOM 0 HG2 ARG A 182 2.538 -7.837 11.527 1.00 45.23 H new ATOM 0 HG3 ARG A 182 2.011 -6.505 12.537 1.00 45.23 H new ATOM 0 HD2 ARG A 182 -0.314 -6.801 11.725 1.00 13.31 H new ATOM 0 HD3 ARG A 182 0.209 -8.122 10.699 1.00 13.31 H new ATOM 0 HE ARG A 182 0.967 -8.547 13.478 1.00 60.30 H new ATOM 0 HH11 ARG A 182 -1.740 -8.773 11.205 1.00 12.14 H new ATOM 0 HH12 ARG A 182 -2.544 -10.053 12.120 1.00 12.14 H new ATOM 0 HH21 ARG A 182 -0.084 -10.180 14.646 1.00 22.24 H new ATOM 0 HH22 ARG A 182 -1.611 -10.845 14.056 1.00 22.24 H new ATOM 2680 N ASN A 183 4.251 -4.804 8.246 1.00 3.24 N ATOM 2681 CA ASN A 183 4.469 -3.904 7.145 1.00 71.21 C ATOM 2682 C ASN A 183 4.599 -4.689 5.863 1.00 15.35 C ATOM 2683 O ASN A 183 4.918 -5.888 5.887 1.00 73.23 O ATOM 2684 CB ASN A 183 5.775 -3.126 7.364 1.00 1.03 C ATOM 2685 CG ASN A 183 5.897 -2.508 8.740 1.00 2.22 C ATOM 2686 OD1 ASN A 183 5.459 -1.301 8.898 1.00 33.12 O flip ATOM 2687 ND2 ASN A 183 6.403 -3.134 9.660 1.00 3.20 N flip ATOM 0 H ASN A 183 4.755 -5.688 8.181 1.00 3.24 H new ATOM 0 HA ASN A 183 3.625 -3.217 7.082 1.00 71.21 H new ATOM 0 HB2 ASN A 183 6.618 -3.798 7.202 1.00 1.03 H new ATOM 0 HB3 ASN A 183 5.847 -2.338 6.615 1.00 1.03 H new ATOM 0 HD21 ASN A 183 6.740 -4.084 9.506 1.00 3.20 H new ATOM 0 HD22 ASN A 183 6.489 -2.706 10.582 1.00 3.20 H new ATOM 2694 N GLU A 184 4.372 -4.026 4.753 1.00 61.34 N ATOM 2695 CA GLU A 184 4.562 -4.626 3.445 1.00 53.51 C ATOM 2696 C GLU A 184 5.252 -3.628 2.540 1.00 41.34 C ATOM 2697 O GLU A 184 5.032 -2.425 2.655 1.00 0.24 O ATOM 2698 CB GLU A 184 3.233 -5.026 2.773 1.00 25.41 C ATOM 2699 CG GLU A 184 2.370 -6.032 3.506 1.00 24.31 C ATOM 2700 CD GLU A 184 1.107 -6.335 2.725 1.00 31.24 C ATOM 2701 OE1 GLU A 184 1.179 -7.102 1.728 1.00 3.04 O ATOM 2702 OE2 GLU A 184 0.037 -5.820 3.073 1.00 64.45 O ATOM 0 H GLU A 184 4.051 -3.058 4.727 1.00 61.34 H new ATOM 0 HA GLU A 184 5.157 -5.527 3.592 1.00 53.51 H new ATOM 0 HB2 GLU A 184 2.644 -4.121 2.620 1.00 25.41 H new ATOM 0 HB3 GLU A 184 3.460 -5.429 1.786 1.00 25.41 H new ATOM 0 HG2 GLU A 184 2.933 -6.952 3.665 1.00 24.31 H new ATOM 0 HG3 GLU A 184 2.109 -5.644 4.490 1.00 24.31 H new ATOM 2709 N VAL A 185 6.088 -4.117 1.676 1.00 42.30 N ATOM 2710 CA VAL A 185 6.704 -3.298 0.648 1.00 63.42 C ATOM 2711 C VAL A 185 6.426 -3.947 -0.687 1.00 62.33 C ATOM 2712 O VAL A 185 6.758 -5.121 -0.893 1.00 74.31 O ATOM 2713 CB VAL A 185 8.244 -3.096 0.855 1.00 21.01 C ATOM 2714 CG1 VAL A 185 8.855 -2.341 -0.323 1.00 71.32 C ATOM 2715 CG2 VAL A 185 8.509 -2.320 2.134 1.00 73.11 C ATOM 0 H VAL A 185 6.371 -5.097 1.654 1.00 42.30 H new ATOM 0 HA VAL A 185 6.272 -2.299 0.698 1.00 63.42 H new ATOM 0 HB VAL A 185 8.703 -4.082 0.925 1.00 21.01 H new ATOM 0 HG11 VAL A 185 9.925 -2.212 -0.157 1.00 71.32 H new ATOM 0 HG12 VAL A 185 8.695 -2.908 -1.240 1.00 71.32 H new ATOM 0 HG13 VAL A 185 8.382 -1.363 -0.413 1.00 71.32 H new ATOM 0 HG21 VAL A 185 9.583 -2.188 2.264 1.00 73.11 H new ATOM 0 HG22 VAL A 185 8.028 -1.344 2.073 1.00 73.11 H new ATOM 0 HG23 VAL A 185 8.106 -2.871 2.984 1.00 73.11 H new ATOM 2725 N TRP A 186 5.775 -3.213 -1.567 1.00 54.35 N ATOM 2726 CA TRP A 186 5.392 -3.743 -2.863 1.00 74.12 C ATOM 2727 C TRP A 186 6.209 -3.090 -3.973 1.00 53.20 C ATOM 2728 O TRP A 186 6.206 -1.876 -4.103 1.00 20.44 O ATOM 2729 CB TRP A 186 3.894 -3.481 -3.166 1.00 71.41 C ATOM 2730 CG TRP A 186 2.873 -4.025 -2.179 1.00 3.34 C ATOM 2731 CD1 TRP A 186 3.096 -4.652 -0.981 1.00 22.12 C ATOM 2732 CD2 TRP A 186 1.446 -3.962 -2.329 1.00 32.43 C ATOM 2733 NE1 TRP A 186 1.896 -4.988 -0.393 1.00 33.41 N ATOM 2734 CE2 TRP A 186 0.874 -4.572 -1.196 1.00 44.14 C ATOM 2735 CE3 TRP A 186 0.598 -3.450 -3.319 1.00 72.45 C ATOM 2736 CZ2 TRP A 186 -0.504 -4.683 -1.024 1.00 50.11 C ATOM 2737 CZ3 TRP A 186 -0.769 -3.560 -3.143 1.00 52.14 C ATOM 2738 CH2 TRP A 186 -1.306 -4.172 -2.003 1.00 55.24 C ATOM 0 H TRP A 186 5.499 -2.244 -1.409 1.00 54.35 H new ATOM 0 HA TRP A 186 5.578 -4.817 -2.829 1.00 74.12 H new ATOM 0 HB2 TRP A 186 3.749 -2.403 -3.240 1.00 71.41 H new ATOM 0 HB3 TRP A 186 3.671 -3.901 -4.147 1.00 71.41 H new ATOM 0 HD1 TRP A 186 4.070 -4.853 -0.559 1.00 22.12 H new ATOM 0 HE1 TRP A 186 1.789 -5.470 0.499 1.00 33.41 H new ATOM 0 HE3 TRP A 186 1.004 -2.979 -4.202 1.00 72.45 H new ATOM 0 HZ2 TRP A 186 -0.922 -5.156 -0.148 1.00 50.11 H new ATOM 0 HZ3 TRP A 186 -1.434 -3.167 -3.898 1.00 52.14 H new ATOM 0 HH2 TRP A 186 -2.379 -4.241 -1.896 1.00 55.24 H new ATOM 2749 N LEU A 187 6.907 -3.889 -4.735 1.00 2.10 N ATOM 2750 CA LEU A 187 7.591 -3.423 -5.938 1.00 1.41 C ATOM 2751 C LEU A 187 6.765 -3.839 -7.127 1.00 21.53 C ATOM 2752 O LEU A 187 6.235 -4.940 -7.142 1.00 71.32 O ATOM 2753 CB LEU A 187 9.008 -4.018 -6.066 1.00 4.32 C ATOM 2754 CG LEU A 187 10.055 -3.547 -5.057 1.00 22.15 C ATOM 2755 CD1 LEU A 187 11.348 -4.312 -5.257 1.00 42.51 C ATOM 2756 CD2 LEU A 187 10.319 -2.071 -5.237 1.00 41.24 C ATOM 0 H LEU A 187 7.025 -4.885 -4.549 1.00 2.10 H new ATOM 0 HA LEU A 187 7.699 -2.340 -5.884 1.00 1.41 H new ATOM 0 HB2 LEU A 187 8.928 -5.102 -5.989 1.00 4.32 H new ATOM 0 HB3 LEU A 187 9.379 -3.796 -7.067 1.00 4.32 H new ATOM 0 HG LEU A 187 9.676 -3.729 -4.051 1.00 22.15 H new ATOM 0 HD11 LEU A 187 12.089 -3.970 -4.534 1.00 42.51 H new ATOM 0 HD12 LEU A 187 11.166 -5.377 -5.114 1.00 42.51 H new ATOM 0 HD13 LEU A 187 11.720 -4.140 -6.267 1.00 42.51 H new ATOM 0 HD21 LEU A 187 11.066 -1.744 -4.514 1.00 41.24 H new ATOM 0 HD22 LEU A 187 10.687 -1.888 -6.247 1.00 41.24 H new ATOM 0 HD23 LEU A 187 9.395 -1.514 -5.081 1.00 41.24 H new ATOM 2768 N VAL A 188 6.626 -2.985 -8.095 1.00 41.14 N ATOM 2769 CA VAL A 188 5.837 -3.325 -9.264 1.00 63.34 C ATOM 2770 C VAL A 188 6.758 -3.657 -10.414 1.00 64.41 C ATOM 2771 O VAL A 188 7.691 -2.890 -10.701 1.00 2.41 O ATOM 2772 CB VAL A 188 4.916 -2.159 -9.704 1.00 63.54 C ATOM 2773 CG1 VAL A 188 3.986 -2.592 -10.834 1.00 73.44 C ATOM 2774 CG2 VAL A 188 4.124 -1.612 -8.538 1.00 25.01 C ATOM 0 H VAL A 188 7.040 -2.053 -8.110 1.00 41.14 H new ATOM 0 HA VAL A 188 5.214 -4.179 -8.997 1.00 63.34 H new ATOM 0 HB VAL A 188 5.555 -1.359 -10.077 1.00 63.54 H new ATOM 0 HG11 VAL A 188 3.351 -1.755 -11.123 1.00 73.44 H new ATOM 0 HG12 VAL A 188 4.579 -2.911 -11.691 1.00 73.44 H new ATOM 0 HG13 VAL A 188 3.363 -3.420 -10.496 1.00 73.44 H new ATOM 0 HG21 VAL A 188 3.488 -0.796 -8.881 1.00 25.01 H new ATOM 0 HG22 VAL A 188 3.503 -2.403 -8.117 1.00 25.01 H new ATOM 0 HG23 VAL A 188 4.809 -1.243 -7.774 1.00 25.01 H new ATOM 2784 N LYS A 189 6.515 -4.783 -11.071 1.00 14.11 N ATOM 2785 CA LYS A 189 7.309 -5.141 -12.226 1.00 70.21 C ATOM 2786 C LYS A 189 6.988 -4.193 -13.348 1.00 40.30 C ATOM 2787 O LYS A 189 5.813 -3.914 -13.594 1.00 45.02 O ATOM 2788 CB LYS A 189 7.079 -6.603 -12.675 1.00 2.23 C ATOM 2789 CG LYS A 189 7.885 -7.004 -13.920 1.00 63.04 C ATOM 2790 CD LYS A 189 7.685 -8.469 -14.304 1.00 55.14 C ATOM 2791 CE LYS A 189 6.237 -8.790 -14.655 1.00 63.24 C ATOM 2792 NZ LYS A 189 6.072 -10.213 -15.025 1.00 2.04 N ATOM 0 H LYS A 189 5.785 -5.452 -10.825 1.00 14.11 H new ATOM 0 HA LYS A 189 8.361 -5.063 -11.951 1.00 70.21 H new ATOM 0 HB2 LYS A 189 7.340 -7.271 -11.854 1.00 2.23 H new ATOM 0 HB3 LYS A 189 6.018 -6.748 -12.878 1.00 2.23 H new ATOM 0 HG2 LYS A 189 7.593 -6.370 -14.757 1.00 63.04 H new ATOM 0 HG3 LYS A 189 8.944 -6.822 -13.737 1.00 63.04 H new ATOM 0 HD2 LYS A 189 8.323 -8.708 -15.155 1.00 55.14 H new ATOM 0 HD3 LYS A 189 8.004 -9.104 -13.478 1.00 55.14 H new ATOM 0 HE2 LYS A 189 5.595 -8.557 -13.805 1.00 63.24 H new ATOM 0 HE3 LYS A 189 5.913 -8.158 -15.482 1.00 63.24 H new ATOM 0 HZ1 LYS A 189 5.075 -10.398 -15.258 1.00 2.04 H new ATOM 0 HZ2 LYS A 189 6.666 -10.428 -15.851 1.00 2.04 H new ATOM 0 HZ3 LYS A 189 6.358 -10.815 -14.226 1.00 2.04 H new ATOM 2806 N ALA A 190 8.028 -3.676 -13.980 1.00 61.03 N ATOM 2807 CA ALA A 190 7.900 -2.749 -15.111 1.00 42.02 C ATOM 2808 C ALA A 190 6.872 -3.227 -16.129 1.00 1.45 C ATOM 2809 O ALA A 190 7.160 -4.189 -16.870 1.00 37.79 O ATOM 2810 CB ALA A 190 9.242 -2.529 -15.787 1.00 11.03 C ATOM 2811 OXT ALA A 190 5.781 -2.622 -16.208 1.00 37.79 O ATOM 0 H ALA A 190 8.994 -3.884 -13.728 1.00 61.03 H new ATOM 0 HA ALA A 190 7.549 -1.800 -14.705 1.00 42.02 H new ATOM 0 HB1 ALA A 190 9.120 -1.839 -16.622 1.00 11.03 H new ATOM 0 HB2 ALA A 190 9.947 -2.110 -15.069 1.00 11.03 H new ATOM 0 HB3 ALA A 190 9.624 -3.481 -16.156 1.00 11.03 H new