USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 859 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 98 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 129 HIS : no HD1:sc= -1.72 X(o=-1.7,f=-1.3) USER MOD Set 2.1: A 80 SER OG : rot -175:sc= -1.59 USER MOD Set 2.2: A 81 GLN : amide:sc= -1.64 K(o=-3.2,f=1.4) USER MOD Set 3.1: A 55 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 68 THR OG1 : rot 131:sc= 1.89 USER MOD Set 4.1: A 47 LYS NZ :NH3+ 164:sc= -3.25! (180deg=-3.43!) USER MOD Set 4.2: A 91 GLN : amide:sc= 0.611 K(o=-2.6,f=-6) USER MOD Set 5.1: A 22 LYS NZ :NH3+ -140:sc= 0.0436 (180deg=0) USER MOD Set 5.2: A 102 TYR OH : rot -53:sc= 0.0577 USER MOD Single : A 8 ASN : amide:sc= -5.32! C(o=-5.3!,f=-9.5!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -164:sc= -0.012 (180deg=-0.275) USER MOD Single : A 17 THR OG1 : rot 100:sc= 0.863 USER MOD Single : A 19 ASN : amide:sc= -10.7! C(o=-11!,f=-22!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.567 K(o=0.57,f=-1.4) USER MOD Single : A 30 SER OG : rot 180:sc= 0.00478 USER MOD Single : A 33 GLN : amide:sc= -2.8 K(o=-2.8,f=-3.6!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 158:sc= 0.0399 (180deg=-0.626) USER MOD Single : A 38 ASN : amide:sc= -4.17! K(o=-4.2!,f=-0.68) USER MOD Single : A 39 SER OG : rot 2:sc= 0.735! USER MOD Single : A 41 ASN : amide:sc= -4.9! K(o=-4.9!,f=-0.72) USER MOD Single : A 44 LYS NZ :NH3+ 172:sc= -3.07! (180deg=-3.31!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.536 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 158:sc= -1.48 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 60:sc= 0.298 USER MOD Single : A 73 LYS NZ :NH3+ 137:sc= -0.0851 (180deg=-0.495) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -1.96! K(o=-2!,f=-0.075) USER MOD Single : A 87 THR OG1 : rot 59:sc= 0.153 USER MOD Single : A 93 MET CE :methyl -119:sc= -0.356 (180deg=-5.91!) USER MOD Single : A 97 SER OG : rot -12:sc= 0.571 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 137:sc= -5.66! USER MOD Single : A 121 ASN : amide:sc= -3.39! K(o=-3.4!,f=-0.86) USER MOD Single : A 123 THR OG1 : rot 160:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -136:sc= -0.0427 (180deg=-1.87!) USER MOD Single : A 132 SER OG : rot 180:sc= -0.168 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 103 N GLU A 7 98.558 20.902 10.226 1.00 1.00 N ATOM 104 CA GLU A 7 98.034 19.702 10.867 1.00 1.00 C ATOM 105 C GLU A 7 98.634 18.463 10.251 1.00 1.00 C ATOM 106 O GLU A 7 99.225 17.633 10.928 1.00 1.00 O ATOM 107 CB GLU A 7 96.529 19.647 10.698 1.00 1.00 C ATOM 108 CG GLU A 7 95.933 20.978 11.109 1.00 1.00 C ATOM 109 CD GLU A 7 94.417 20.869 11.207 1.00 1.00 C ATOM 110 OE1 GLU A 7 93.781 21.894 11.391 1.00 1.00 O ATOM 111 OE2 GLU A 7 93.913 19.763 11.102 1.00 1.00 O ATOM 0 HA GLU A 7 98.294 19.740 11.925 1.00 1.00 H new ATOM 0 HB2 GLU A 7 96.275 19.426 9.661 1.00 1.00 H new ATOM 0 HB3 GLU A 7 96.112 18.845 11.306 1.00 1.00 H new ATOM 0 HG2 GLU A 7 96.345 21.288 12.069 1.00 1.00 H new ATOM 0 HG3 GLU A 7 96.203 21.745 10.383 1.00 1.00 H new ATOM 118 N ASN A 8 98.504 18.360 8.958 1.00 1.00 N ATOM 119 CA ASN A 8 99.054 17.218 8.255 1.00 1.00 C ATOM 120 C ASN A 8 100.546 17.188 8.500 1.00 1.00 C ATOM 121 O ASN A 8 101.163 16.134 8.652 1.00 1.00 O ATOM 122 CB ASN A 8 98.779 17.374 6.775 1.00 1.00 C ATOM 123 CG ASN A 8 97.312 17.704 6.571 1.00 1.00 C ATOM 124 OD1 ASN A 8 96.549 17.756 7.533 1.00 1.00 O ATOM 125 ND2 ASN A 8 96.879 17.935 5.369 1.00 1.00 N ATOM 0 H ASN A 8 98.028 19.042 8.367 1.00 1.00 H new ATOM 0 HA ASN A 8 98.601 16.291 8.607 1.00 1.00 H new ATOM 0 HB2 ASN A 8 99.403 18.165 6.359 1.00 1.00 H new ATOM 0 HB3 ASN A 8 99.034 16.455 6.247 1.00 1.00 H new ATOM 0 HD21 ASN A 8 95.897 18.162 5.216 1.00 1.00 H new ATOM 0 HD22 ASN A 8 97.521 17.889 4.578 1.00 1.00 H new ATOM 132 N LYS A 9 101.099 18.377 8.541 1.00 1.00 N ATOM 133 CA LYS A 9 102.520 18.557 8.773 1.00 1.00 C ATOM 134 C LYS A 9 102.927 18.127 10.189 1.00 1.00 C ATOM 135 O LYS A 9 103.857 17.351 10.350 1.00 1.00 O ATOM 136 CB LYS A 9 102.840 20.029 8.526 1.00 1.00 C ATOM 137 CG LYS A 9 104.195 20.424 9.104 1.00 1.00 C ATOM 138 CD LYS A 9 104.723 21.719 8.440 1.00 1.00 C ATOM 139 CE LYS A 9 103.981 22.970 8.941 1.00 1.00 C ATOM 140 NZ LYS A 9 102.946 23.364 7.941 1.00 1.00 N ATOM 0 H LYS A 9 100.582 19.247 8.415 1.00 1.00 H new ATOM 0 HA LYS A 9 103.090 17.924 8.094 1.00 1.00 H new ATOM 0 HB2 LYS A 9 102.831 20.227 7.454 1.00 1.00 H new ATOM 0 HB3 LYS A 9 102.062 20.649 8.971 1.00 1.00 H new ATOM 0 HG2 LYS A 9 104.106 20.573 10.180 1.00 1.00 H new ATOM 0 HG3 LYS A 9 104.910 19.615 8.952 1.00 1.00 H new ATOM 0 HD2 LYS A 9 105.788 21.823 8.646 1.00 1.00 H new ATOM 0 HD3 LYS A 9 104.613 21.642 7.358 1.00 1.00 H new ATOM 0 HE2 LYS A 9 103.513 22.768 9.905 1.00 1.00 H new ATOM 0 HE3 LYS A 9 104.685 23.788 9.094 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 102.443 24.210 8.277 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 103.404 23.573 7.031 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 102.269 22.585 7.817 1.00 1.00 H new ATOM 154 N VAL A 10 102.232 18.607 11.216 1.00 1.00 N ATOM 155 CA VAL A 10 102.598 18.221 12.582 1.00 1.00 C ATOM 156 C VAL A 10 102.378 16.734 12.805 1.00 1.00 C ATOM 157 O VAL A 10 103.261 16.032 13.297 1.00 1.00 O ATOM 158 CB VAL A 10 101.791 19.029 13.606 1.00 1.00 C ATOM 159 CG1 VAL A 10 102.008 18.459 14.998 1.00 1.00 C ATOM 160 CG2 VAL A 10 102.231 20.496 13.574 1.00 1.00 C ATOM 0 H VAL A 10 101.438 19.243 11.139 1.00 1.00 H new ATOM 0 HA VAL A 10 103.658 18.438 12.717 1.00 1.00 H new ATOM 0 HB VAL A 10 100.732 18.967 13.354 1.00 1.00 H new ATOM 0 HG11 VAL A 10 101.433 19.037 15.721 1.00 1.00 H new ATOM 0 HG12 VAL A 10 101.681 17.420 15.021 1.00 1.00 H new ATOM 0 HG13 VAL A 10 103.067 18.511 15.252 1.00 1.00 H new ATOM 0 HG21 VAL A 10 101.654 21.065 14.303 1.00 1.00 H new ATOM 0 HG22 VAL A 10 103.291 20.563 13.818 1.00 1.00 H new ATOM 0 HG23 VAL A 10 102.061 20.905 12.578 1.00 1.00 H new ATOM 164 N LYS A 11 101.211 16.253 12.424 1.00 1.00 N ATOM 165 CA LYS A 11 100.918 14.849 12.576 1.00 1.00 C ATOM 166 C LYS A 11 101.874 14.074 11.701 1.00 1.00 C ATOM 167 O LYS A 11 102.361 13.017 12.082 1.00 1.00 O ATOM 168 CB LYS A 11 99.470 14.555 12.188 1.00 1.00 C ATOM 169 CG LYS A 11 98.500 15.011 13.307 1.00 1.00 C ATOM 170 CD LYS A 11 98.186 16.501 13.153 1.00 1.00 C ATOM 171 CE LYS A 11 97.448 17.023 14.382 1.00 1.00 C ATOM 172 NZ LYS A 11 96.231 16.202 14.641 1.00 1.00 N ATOM 0 H LYS A 11 100.461 16.809 12.012 1.00 1.00 H new ATOM 0 HA LYS A 11 101.042 14.552 13.617 1.00 1.00 H new ATOM 0 HB2 LYS A 11 99.226 15.068 11.257 1.00 1.00 H new ATOM 0 HB3 LYS A 11 99.347 13.487 12.006 1.00 1.00 H new ATOM 0 HG2 LYS A 11 97.579 14.430 13.260 1.00 1.00 H new ATOM 0 HG3 LYS A 11 98.945 14.824 14.284 1.00 1.00 H new ATOM 0 HD2 LYS A 11 99.111 17.061 13.012 1.00 1.00 H new ATOM 0 HD3 LYS A 11 97.578 16.660 12.262 1.00 1.00 H new ATOM 0 HE2 LYS A 11 98.107 16.994 15.250 1.00 1.00 H new ATOM 0 HE3 LYS A 11 97.167 18.065 14.231 1.00 1.00 H new ATOM 0 HZ1 LYS A 11 95.601 16.711 15.293 1.00 1.00 H new ATOM 0 HZ2 LYS A 11 95.733 16.026 13.745 1.00 1.00 H new ATOM 0 HZ3 LYS A 11 96.509 15.294 15.066 1.00 1.00 H new ATOM 186 N GLY A 12 102.142 14.633 10.527 1.00 1.00 N ATOM 187 CA GLY A 12 103.053 14.004 9.577 1.00 1.00 C ATOM 188 C GLY A 12 104.505 14.052 10.051 1.00 1.00 C ATOM 189 O GLY A 12 105.205 13.040 10.018 1.00 1.00 O ATOM 0 H GLY A 12 101.744 15.517 10.210 1.00 1.00 H new ATOM 0 HA2 GLY A 12 102.757 12.966 9.425 1.00 1.00 H new ATOM 0 HA3 GLY A 12 102.971 14.504 8.612 1.00 1.00 H new ATOM 193 N GLU A 13 104.961 15.213 10.509 1.00 1.00 N ATOM 194 CA GLU A 13 106.336 15.317 10.992 1.00 1.00 C ATOM 195 C GLU A 13 106.534 14.313 12.111 1.00 1.00 C ATOM 196 O GLU A 13 107.607 13.738 12.266 1.00 1.00 O ATOM 197 CB GLU A 13 106.634 16.723 11.534 1.00 1.00 C ATOM 198 CG GLU A 13 106.822 17.717 10.390 1.00 1.00 C ATOM 199 CD GLU A 13 107.046 19.114 10.955 1.00 1.00 C ATOM 200 OE1 GLU A 13 107.143 20.042 10.168 1.00 1.00 O ATOM 201 OE2 GLU A 13 107.119 19.235 12.166 1.00 1.00 O ATOM 0 H GLU A 13 104.417 16.075 10.557 1.00 1.00 H new ATOM 0 HA GLU A 13 107.011 15.118 10.160 1.00 1.00 H new ATOM 0 HB2 GLU A 13 105.816 17.051 12.176 1.00 1.00 H new ATOM 0 HB3 GLU A 13 107.533 16.697 12.150 1.00 1.00 H new ATOM 0 HG2 GLU A 13 107.673 17.422 9.775 1.00 1.00 H new ATOM 0 HG3 GLU A 13 105.945 17.712 9.743 1.00 1.00 H new ATOM 208 N ALA A 14 105.471 14.121 12.883 1.00 1.00 N ATOM 209 CA ALA A 14 105.487 13.201 13.998 1.00 1.00 C ATOM 210 C ALA A 14 105.324 11.775 13.508 1.00 1.00 C ATOM 211 O ALA A 14 105.826 10.828 14.112 1.00 1.00 O ATOM 212 CB ALA A 14 104.350 13.536 14.959 1.00 1.00 C ATOM 0 H ALA A 14 104.580 14.600 12.749 1.00 1.00 H new ATOM 0 HA ALA A 14 106.443 13.294 14.512 1.00 1.00 H new ATOM 0 HB1 ALA A 14 104.366 12.840 15.798 1.00 1.00 H new ATOM 0 HB2 ALA A 14 104.474 14.554 15.329 1.00 1.00 H new ATOM 0 HB3 ALA A 14 103.397 13.454 14.437 1.00 1.00 H new ATOM 218 N PHE A 15 104.597 11.642 12.410 1.00 1.00 N ATOM 219 CA PHE A 15 104.337 10.343 11.824 1.00 1.00 C ATOM 220 C PHE A 15 105.630 9.694 11.407 1.00 1.00 C ATOM 221 O PHE A 15 105.899 8.544 11.751 1.00 1.00 O ATOM 222 CB PHE A 15 103.432 10.540 10.618 1.00 1.00 C ATOM 223 CG PHE A 15 102.956 9.226 10.092 1.00 1.00 C ATOM 224 CD1 PHE A 15 103.518 8.702 8.931 1.00 1.00 C ATOM 225 CD2 PHE A 15 101.915 8.560 10.738 1.00 1.00 C ATOM 226 CE1 PHE A 15 103.036 7.499 8.414 1.00 1.00 C ATOM 227 CE2 PHE A 15 101.438 7.352 10.233 1.00 1.00 C ATOM 228 CZ PHE A 15 101.998 6.822 9.067 1.00 1.00 C ATOM 0 H PHE A 15 104.176 12.423 11.907 1.00 1.00 H new ATOM 0 HA PHE A 15 103.852 9.692 12.552 1.00 1.00 H new ATOM 0 HB2 PHE A 15 102.577 11.157 10.896 1.00 1.00 H new ATOM 0 HB3 PHE A 15 103.971 11.076 9.837 1.00 1.00 H new ATOM 0 HD1 PHE A 15 104.322 9.224 8.434 1.00 1.00 H new ATOM 0 HD2 PHE A 15 101.478 8.981 11.631 1.00 1.00 H new ATOM 0 HE1 PHE A 15 103.463 7.090 7.510 1.00 1.00 H new ATOM 0 HE2 PHE A 15 100.641 6.828 10.739 1.00 1.00 H new ATOM 0 HZ PHE A 15 101.629 5.888 8.669 1.00 1.00 H new ATOM 238 N LEU A 16 106.446 10.442 10.692 1.00 1.00 N ATOM 239 CA LEU A 16 107.729 9.911 10.278 1.00 1.00 C ATOM 240 C LEU A 16 108.598 9.696 11.497 1.00 1.00 C ATOM 241 O LEU A 16 109.323 8.708 11.587 1.00 1.00 O ATOM 242 CB LEU A 16 108.425 10.833 9.276 1.00 1.00 C ATOM 243 CG LEU A 16 107.732 10.755 7.890 1.00 1.00 C ATOM 244 CD1 LEU A 16 106.620 11.814 7.756 1.00 1.00 C ATOM 245 CD2 LEU A 16 108.788 10.951 6.804 1.00 1.00 C ATOM 0 H LEU A 16 106.251 11.397 10.391 1.00 1.00 H new ATOM 0 HA LEU A 16 107.563 8.958 9.775 1.00 1.00 H new ATOM 0 HB2 LEU A 16 108.403 11.859 9.642 1.00 1.00 H new ATOM 0 HB3 LEU A 16 109.473 10.550 9.181 1.00 1.00 H new ATOM 0 HG LEU A 16 107.262 9.778 7.782 1.00 1.00 H new ATOM 0 HD11 LEU A 16 106.155 11.731 6.773 1.00 1.00 H new ATOM 0 HD12 LEU A 16 105.868 11.651 8.528 1.00 1.00 H new ATOM 0 HD13 LEU A 16 107.049 12.809 7.872 1.00 1.00 H new ATOM 0 HD21 LEU A 16 108.315 10.899 5.823 1.00 1.00 H new ATOM 0 HD22 LEU A 16 109.260 11.925 6.928 1.00 1.00 H new ATOM 0 HD23 LEU A 16 109.543 10.169 6.885 1.00 1.00 H new ATOM 257 N THR A 17 108.501 10.619 12.444 1.00 1.00 N ATOM 258 CA THR A 17 109.268 10.513 13.675 1.00 1.00 C ATOM 259 C THR A 17 108.858 9.248 14.415 1.00 1.00 C ATOM 260 O THR A 17 109.688 8.523 14.957 1.00 1.00 O ATOM 261 CB THR A 17 109.010 11.718 14.575 1.00 1.00 C ATOM 262 OG1 THR A 17 109.156 12.918 13.833 1.00 1.00 O ATOM 263 CG2 THR A 17 109.997 11.703 15.729 1.00 1.00 C ATOM 0 H THR A 17 107.903 11.443 12.384 1.00 1.00 H new ATOM 0 HA THR A 17 110.328 10.479 13.423 1.00 1.00 H new ATOM 0 HB THR A 17 107.993 11.667 14.964 1.00 1.00 H new ATOM 0 HG1 THR A 17 108.272 13.249 13.570 1.00 1.00 H new ATOM 0 HG21 THR A 17 109.816 12.563 16.374 1.00 1.00 H new ATOM 0 HG22 THR A 17 109.871 10.785 16.303 1.00 1.00 H new ATOM 0 HG23 THR A 17 111.014 11.750 15.339 1.00 1.00 H new ATOM 271 N GLU A 18 107.557 9.009 14.450 1.00 1.00 N ATOM 272 CA GLU A 18 107.021 7.850 15.128 1.00 1.00 C ATOM 273 C GLU A 18 107.272 6.568 14.335 1.00 1.00 C ATOM 274 O GLU A 18 107.650 5.542 14.903 1.00 1.00 O ATOM 275 CB GLU A 18 105.526 8.055 15.378 1.00 1.00 C ATOM 276 CG GLU A 18 104.943 6.844 16.103 1.00 1.00 C ATOM 277 CD GLU A 18 103.480 7.090 16.453 1.00 1.00 C ATOM 278 OE1 GLU A 18 102.929 8.065 15.969 1.00 1.00 O ATOM 279 OE2 GLU A 18 102.929 6.295 17.196 1.00 1.00 O ATOM 0 H GLU A 18 106.855 9.607 14.014 1.00 1.00 H new ATOM 0 HA GLU A 18 107.534 7.738 16.083 1.00 1.00 H new ATOM 0 HB2 GLU A 18 105.369 8.955 15.973 1.00 1.00 H new ATOM 0 HB3 GLU A 18 105.008 8.205 14.431 1.00 1.00 H new ATOM 0 HG2 GLU A 18 105.029 5.958 15.473 1.00 1.00 H new ATOM 0 HG3 GLU A 18 105.513 6.646 17.011 1.00 1.00 H new ATOM 286 N ASN A 19 107.042 6.623 13.029 1.00 1.00 N ATOM 287 CA ASN A 19 107.226 5.446 12.176 1.00 1.00 C ATOM 288 C ASN A 19 108.624 4.893 12.276 1.00 1.00 C ATOM 289 O ASN A 19 108.821 3.693 12.454 1.00 1.00 O ATOM 290 CB ASN A 19 106.991 5.874 10.716 1.00 1.00 C ATOM 291 CG ASN A 19 107.920 5.152 9.738 1.00 1.00 C ATOM 292 OD1 ASN A 19 109.086 5.521 9.600 1.00 1.00 O ATOM 293 ND2 ASN A 19 107.477 4.162 9.056 1.00 1.00 N ATOM 0 H ASN A 19 106.730 7.460 12.537 1.00 1.00 H new ATOM 0 HA ASN A 19 106.526 4.676 12.499 1.00 1.00 H new ATOM 0 HB2 ASN A 19 105.955 5.673 10.444 1.00 1.00 H new ATOM 0 HB3 ASN A 19 107.141 6.950 10.627 1.00 1.00 H new ATOM 0 HD21 ASN A 19 108.091 3.680 8.399 1.00 1.00 H new ATOM 0 HD22 ASN A 19 106.511 3.856 9.170 1.00 1.00 H new ATOM 300 N LYS A 20 109.585 5.765 12.125 1.00 1.00 N ATOM 301 CA LYS A 20 110.957 5.315 12.158 1.00 1.00 C ATOM 302 C LYS A 20 111.247 4.663 13.503 1.00 1.00 C ATOM 303 O LYS A 20 112.091 3.775 13.615 1.00 1.00 O ATOM 304 CB LYS A 20 111.915 6.478 11.901 1.00 1.00 C ATOM 305 CG LYS A 20 111.786 7.491 13.025 1.00 1.00 C ATOM 306 CD LYS A 20 112.619 8.744 12.708 1.00 1.00 C ATOM 307 CE LYS A 20 114.130 8.442 12.786 1.00 1.00 C ATOM 308 NZ LYS A 20 114.821 9.603 13.414 1.00 1.00 N ATOM 0 H LYS A 20 109.453 6.766 11.981 1.00 1.00 H new ATOM 0 HA LYS A 20 111.108 4.580 11.368 1.00 1.00 H new ATOM 0 HB2 LYS A 20 112.940 6.113 11.840 1.00 1.00 H new ATOM 0 HB3 LYS A 20 111.687 6.948 10.944 1.00 1.00 H new ATOM 0 HG2 LYS A 20 110.740 7.765 13.159 1.00 1.00 H new ATOM 0 HG3 LYS A 20 112.122 7.049 13.963 1.00 1.00 H new ATOM 0 HD2 LYS A 20 112.369 9.108 11.711 1.00 1.00 H new ATOM 0 HD3 LYS A 20 112.367 9.539 13.410 1.00 1.00 H new ATOM 0 HE2 LYS A 20 114.304 7.538 13.370 1.00 1.00 H new ATOM 0 HE3 LYS A 20 114.530 8.259 11.789 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 115.841 9.410 13.472 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 114.662 10.455 12.839 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 114.443 9.756 14.371 1.00 1.00 H new ATOM 322 N ASN A 21 110.527 5.117 14.521 1.00 1.00 N ATOM 323 CA ASN A 21 110.687 4.586 15.871 1.00 1.00 C ATOM 324 C ASN A 21 109.907 3.291 16.056 1.00 1.00 C ATOM 325 O ASN A 21 110.289 2.439 16.859 1.00 1.00 O ATOM 326 CB ASN A 21 110.238 5.639 16.894 1.00 1.00 C ATOM 327 CG ASN A 21 111.366 6.636 17.148 1.00 1.00 C ATOM 328 OD1 ASN A 21 112.289 6.345 17.910 1.00 1.00 O ATOM 329 ND2 ASN A 21 111.355 7.793 16.546 1.00 1.00 N ATOM 0 H ASN A 21 109.825 5.853 14.438 1.00 1.00 H new ATOM 0 HA ASN A 21 111.741 4.356 16.029 1.00 1.00 H new ATOM 0 HB2 ASN A 21 109.355 6.162 16.526 1.00 1.00 H new ATOM 0 HB3 ASN A 21 109.954 5.153 17.827 1.00 1.00 H new ATOM 0 HD21 ASN A 21 112.111 8.458 16.706 1.00 1.00 H new ATOM 0 HD22 ASN A 21 110.590 8.032 15.915 1.00 1.00 H new ATOM 336 N LYS A 22 108.808 3.147 15.331 1.00 1.00 N ATOM 337 CA LYS A 22 107.989 1.957 15.451 1.00 1.00 C ATOM 338 C LYS A 22 108.804 0.679 15.115 1.00 1.00 C ATOM 339 O LYS A 22 109.549 0.672 14.136 1.00 1.00 O ATOM 340 CB LYS A 22 106.786 2.087 14.507 1.00 1.00 C ATOM 341 CG LYS A 22 105.643 2.927 15.143 1.00 1.00 C ATOM 342 CD LYS A 22 104.274 2.374 14.717 1.00 1.00 C ATOM 343 CE LYS A 22 104.079 2.633 13.226 1.00 1.00 C ATOM 344 NZ LYS A 22 102.911 1.850 12.728 1.00 1.00 N ATOM 0 H LYS A 22 108.467 3.835 14.659 1.00 1.00 H new ATOM 0 HA LYS A 22 107.644 1.864 16.481 1.00 1.00 H new ATOM 0 HB2 LYS A 22 107.104 2.553 13.574 1.00 1.00 H new ATOM 0 HB3 LYS A 22 106.412 1.095 14.256 1.00 1.00 H new ATOM 0 HG2 LYS A 22 105.729 2.907 16.229 1.00 1.00 H new ATOM 0 HG3 LYS A 22 105.734 3.969 14.835 1.00 1.00 H new ATOM 0 HD2 LYS A 22 104.218 1.305 14.925 1.00 1.00 H new ATOM 0 HD3 LYS A 22 103.479 2.852 15.290 1.00 1.00 H new ATOM 0 HE2 LYS A 22 103.918 3.697 13.050 1.00 1.00 H new ATOM 0 HE3 LYS A 22 104.978 2.352 12.678 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 103.129 1.461 11.789 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 102.709 1.071 13.387 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 102.080 2.471 12.661 1.00 1.00 H new ATOM 358 N PRO A 23 108.679 -0.400 15.889 1.00 1.00 N ATOM 359 CA PRO A 23 109.432 -1.677 15.624 1.00 1.00 C ATOM 360 C PRO A 23 109.214 -2.256 14.217 1.00 1.00 C ATOM 361 O PRO A 23 108.140 -2.129 13.629 1.00 1.00 O ATOM 362 CB PRO A 23 108.901 -2.666 16.676 1.00 1.00 C ATOM 363 CG PRO A 23 108.330 -1.821 17.763 1.00 1.00 C ATOM 364 CD PRO A 23 107.835 -0.532 17.103 1.00 1.00 C ATOM 0 HA PRO A 23 110.504 -1.491 15.684 1.00 1.00 H new ATOM 0 HB2 PRO A 23 108.143 -3.323 16.250 1.00 1.00 H new ATOM 0 HB3 PRO A 23 109.700 -3.304 17.053 1.00 1.00 H new ATOM 0 HG2 PRO A 23 107.512 -2.337 18.266 1.00 1.00 H new ATOM 0 HG3 PRO A 23 109.083 -1.604 18.520 1.00 1.00 H new ATOM 0 HD2 PRO A 23 106.777 -0.595 16.848 1.00 1.00 H new ATOM 0 HD3 PRO A 23 107.952 0.326 17.765 1.00 1.00 H new ATOM 372 N GLY A 24 110.251 -2.915 13.712 1.00 1.00 N ATOM 373 CA GLY A 24 110.203 -3.551 12.396 1.00 1.00 C ATOM 374 C GLY A 24 110.458 -2.548 11.287 1.00 1.00 C ATOM 375 O GLY A 24 110.786 -2.919 10.163 1.00 1.00 O ATOM 0 H GLY A 24 111.142 -3.024 14.196 1.00 1.00 H new ATOM 0 HA2 GLY A 24 110.947 -4.346 12.347 1.00 1.00 H new ATOM 0 HA3 GLY A 24 109.228 -4.017 12.251 1.00 1.00 H new ATOM 379 N VAL A 25 110.297 -1.278 11.612 1.00 1.00 N ATOM 380 CA VAL A 25 110.496 -0.219 10.635 1.00 1.00 C ATOM 381 C VAL A 25 111.967 0.177 10.547 1.00 1.00 C ATOM 382 O VAL A 25 112.631 0.382 11.563 1.00 1.00 O ATOM 383 CB VAL A 25 109.703 1.029 11.046 1.00 1.00 C ATOM 384 CG1 VAL A 25 109.813 2.111 9.973 1.00 1.00 C ATOM 385 CG2 VAL A 25 108.236 0.692 11.274 1.00 1.00 C ATOM 0 H VAL A 25 110.030 -0.954 12.542 1.00 1.00 H new ATOM 0 HA VAL A 25 110.156 -0.596 9.670 1.00 1.00 H new ATOM 0 HB VAL A 25 110.129 1.400 11.978 1.00 1.00 H new ATOM 0 HG11 VAL A 25 109.245 2.988 10.281 1.00 1.00 H new ATOM 0 HG12 VAL A 25 110.859 2.385 9.839 1.00 1.00 H new ATOM 0 HG13 VAL A 25 109.414 1.732 9.032 1.00 1.00 H new ATOM 0 HG21 VAL A 25 107.696 1.594 11.564 1.00 1.00 H new ATOM 0 HG22 VAL A 25 107.807 0.293 10.355 1.00 1.00 H new ATOM 0 HG23 VAL A 25 108.152 -0.052 12.066 1.00 1.00 H new ATOM 389 N VAL A 26 112.443 0.347 9.320 1.00 1.00 N ATOM 390 CA VAL A 26 113.818 0.797 9.078 1.00 1.00 C ATOM 391 C VAL A 26 113.748 2.095 8.293 1.00 1.00 C ATOM 392 O VAL A 26 113.142 2.139 7.226 1.00 1.00 O ATOM 393 CB VAL A 26 114.609 -0.249 8.285 1.00 1.00 C ATOM 394 CG1 VAL A 26 115.964 0.322 7.898 1.00 1.00 C ATOM 395 CG2 VAL A 26 114.803 -1.494 9.134 1.00 1.00 C ATOM 0 H VAL A 26 111.900 0.181 8.472 1.00 1.00 H new ATOM 0 HA VAL A 26 114.329 0.944 10.029 1.00 1.00 H new ATOM 0 HB VAL A 26 114.057 -0.511 7.382 1.00 1.00 H new ATOM 0 HG11 VAL A 26 116.525 -0.423 7.334 1.00 1.00 H new ATOM 0 HG12 VAL A 26 115.822 1.211 7.283 1.00 1.00 H new ATOM 0 HG13 VAL A 26 116.517 0.588 8.799 1.00 1.00 H new ATOM 0 HG21 VAL A 26 115.366 -2.236 8.568 1.00 1.00 H new ATOM 0 HG22 VAL A 26 115.352 -1.235 10.039 1.00 1.00 H new ATOM 0 HG23 VAL A 26 113.830 -1.905 9.405 1.00 1.00 H new ATOM 399 N VAL A 27 114.345 3.161 8.838 1.00 1.00 N ATOM 400 CA VAL A 27 114.307 4.472 8.185 1.00 1.00 C ATOM 401 C VAL A 27 115.517 4.697 7.305 1.00 1.00 C ATOM 402 O VAL A 27 116.616 4.221 7.591 1.00 1.00 O ATOM 403 CB VAL A 27 114.186 5.597 9.227 1.00 1.00 C ATOM 404 CG1 VAL A 27 115.347 5.528 10.187 1.00 1.00 C ATOM 405 CG2 VAL A 27 114.143 6.988 8.566 1.00 1.00 C ATOM 0 H VAL A 27 114.855 3.142 9.721 1.00 1.00 H new ATOM 0 HA VAL A 27 113.425 4.489 7.545 1.00 1.00 H new ATOM 0 HB VAL A 27 113.248 5.453 9.764 1.00 1.00 H new ATOM 0 HG11 VAL A 27 115.258 6.326 10.924 1.00 1.00 H new ATOM 0 HG12 VAL A 27 115.342 4.564 10.695 1.00 1.00 H new ATOM 0 HG13 VAL A 27 116.281 5.644 9.637 1.00 1.00 H new ATOM 0 HG21 VAL A 27 114.057 7.754 9.336 1.00 1.00 H new ATOM 0 HG22 VAL A 27 115.058 7.148 7.995 1.00 1.00 H new ATOM 0 HG23 VAL A 27 113.284 7.047 7.898 1.00 1.00 H new ATOM 409 N LEU A 28 115.288 5.433 6.220 1.00 1.00 N ATOM 410 CA LEU A 28 116.351 5.743 5.262 1.00 1.00 C ATOM 411 C LEU A 28 116.626 7.245 5.225 1.00 1.00 C ATOM 412 O LEU A 28 115.811 8.030 5.709 1.00 1.00 O ATOM 413 CB LEU A 28 115.928 5.272 3.876 1.00 1.00 C ATOM 414 CG LEU A 28 115.661 3.766 3.893 1.00 1.00 C ATOM 415 CD1 LEU A 28 114.965 3.387 2.590 1.00 1.00 C ATOM 416 CD2 LEU A 28 116.983 2.996 4.003 1.00 1.00 C ATOM 0 H LEU A 28 114.378 5.826 5.981 1.00 1.00 H new ATOM 0 HA LEU A 28 117.262 5.231 5.571 1.00 1.00 H new ATOM 0 HB2 LEU A 28 115.031 5.805 3.560 1.00 1.00 H new ATOM 0 HB3 LEU A 28 116.708 5.503 3.151 1.00 1.00 H new ATOM 0 HG LEU A 28 115.035 3.514 4.749 1.00 1.00 H new ATOM 0 HD11 LEU A 28 114.766 2.315 2.582 1.00 1.00 H new ATOM 0 HD12 LEU A 28 114.024 3.932 2.508 1.00 1.00 H new ATOM 0 HD13 LEU A 28 115.607 3.643 1.747 1.00 1.00 H new ATOM 0 HD21 LEU A 28 116.780 1.925 4.014 1.00 1.00 H new ATOM 0 HD22 LEU A 28 117.616 3.237 3.149 1.00 1.00 H new ATOM 0 HD23 LEU A 28 117.493 3.278 4.924 1.00 1.00 H new ATOM 428 N PRO A 29 117.748 7.671 4.676 1.00 1.00 N ATOM 429 CA PRO A 29 118.084 9.117 4.614 1.00 1.00 C ATOM 430 C PRO A 29 117.047 9.910 3.829 1.00 1.00 C ATOM 431 O PRO A 29 116.794 11.079 4.121 1.00 1.00 O ATOM 432 CB PRO A 29 119.458 9.165 3.931 1.00 1.00 C ATOM 433 CG PRO A 29 120.013 7.793 4.098 1.00 1.00 C ATOM 434 CD PRO A 29 118.813 6.861 4.061 1.00 1.00 C ATOM 0 HA PRO A 29 118.097 9.571 5.605 1.00 1.00 H new ATOM 0 HB2 PRO A 29 119.367 9.430 2.878 1.00 1.00 H new ATOM 0 HB3 PRO A 29 120.104 9.912 4.393 1.00 1.00 H new ATOM 0 HG2 PRO A 29 120.719 7.556 3.302 1.00 1.00 H new ATOM 0 HG3 PRO A 29 120.553 7.700 5.040 1.00 1.00 H new ATOM 0 HD2 PRO A 29 118.560 6.568 3.042 1.00 1.00 H new ATOM 0 HD3 PRO A 29 118.997 5.944 4.620 1.00 1.00 H new ATOM 442 N SER A 30 116.449 9.266 2.831 1.00 1.00 N ATOM 443 CA SER A 30 115.442 9.932 2.018 1.00 1.00 C ATOM 444 C SER A 30 114.206 10.192 2.863 1.00 1.00 C ATOM 445 O SER A 30 113.311 10.941 2.474 1.00 1.00 O ATOM 446 CB SER A 30 115.086 9.070 0.805 1.00 1.00 C ATOM 447 OG SER A 30 116.274 8.497 0.277 1.00 1.00 O ATOM 0 H SER A 30 116.641 8.299 2.570 1.00 1.00 H new ATOM 0 HA SER A 30 115.838 10.882 1.658 1.00 1.00 H new ATOM 0 HB2 SER A 30 114.386 8.286 1.093 1.00 1.00 H new ATOM 0 HB3 SER A 30 114.591 9.675 0.046 1.00 1.00 H new ATOM 0 HG SER A 30 116.052 7.942 -0.500 1.00 1.00 H new ATOM 453 N GLY A 31 114.171 9.567 4.034 1.00 1.00 N ATOM 454 CA GLY A 31 113.051 9.721 4.942 1.00 1.00 C ATOM 455 C GLY A 31 112.059 8.603 4.709 1.00 1.00 C ATOM 456 O GLY A 31 111.042 8.507 5.394 1.00 1.00 O ATOM 0 H GLY A 31 114.908 8.949 4.373 1.00 1.00 H new ATOM 0 HA2 GLY A 31 113.400 9.703 5.974 1.00 1.00 H new ATOM 0 HA3 GLY A 31 112.571 10.687 4.785 1.00 1.00 H new ATOM 460 N LEU A 32 112.368 7.744 3.735 1.00 1.00 N ATOM 461 CA LEU A 32 111.489 6.630 3.429 1.00 1.00 C ATOM 462 C LEU A 32 111.739 5.532 4.439 1.00 1.00 C ATOM 463 O LEU A 32 112.885 5.197 4.737 1.00 1.00 O ATOM 464 CB LEU A 32 111.738 6.108 1.987 1.00 1.00 C ATOM 465 CG LEU A 32 110.757 4.975 1.543 1.00 1.00 C ATOM 466 CD1 LEU A 32 111.198 3.590 2.019 1.00 1.00 C ATOM 467 CD2 LEU A 32 109.331 5.261 2.005 1.00 1.00 C ATOM 0 H LEU A 32 113.207 7.802 3.158 1.00 1.00 H new ATOM 0 HA LEU A 32 110.451 6.958 3.484 1.00 1.00 H new ATOM 0 HB2 LEU A 32 111.653 6.942 1.290 1.00 1.00 H new ATOM 0 HB3 LEU A 32 112.761 5.737 1.917 1.00 1.00 H new ATOM 0 HG LEU A 32 110.779 4.967 0.453 1.00 1.00 H new ATOM 0 HD11 LEU A 32 110.479 2.843 1.682 1.00 1.00 H new ATOM 0 HD12 LEU A 32 112.181 3.360 1.607 1.00 1.00 H new ATOM 0 HD13 LEU A 32 111.249 3.579 3.108 1.00 1.00 H new ATOM 0 HD21 LEU A 32 108.674 4.454 1.680 1.00 1.00 H new ATOM 0 HD22 LEU A 32 109.308 5.332 3.092 1.00 1.00 H new ATOM 0 HD23 LEU A 32 108.990 6.202 1.573 1.00 1.00 H new ATOM 479 N GLN A 33 110.661 4.972 4.962 1.00 1.00 N ATOM 480 CA GLN A 33 110.750 3.905 5.941 1.00 1.00 C ATOM 481 C GLN A 33 109.973 2.694 5.490 1.00 1.00 C ATOM 482 O GLN A 33 108.925 2.821 4.861 1.00 1.00 O ATOM 483 CB GLN A 33 110.184 4.414 7.256 1.00 1.00 C ATOM 484 CG GLN A 33 110.979 5.651 7.697 1.00 1.00 C ATOM 485 CD GLN A 33 110.183 6.923 7.565 1.00 1.00 C ATOM 486 OE1 GLN A 33 109.194 6.981 6.833 1.00 1.00 O ATOM 487 NE2 GLN A 33 110.565 7.955 8.244 1.00 1.00 N ATOM 0 H GLN A 33 109.707 5.242 4.722 1.00 1.00 H new ATOM 0 HA GLN A 33 111.793 3.611 6.060 1.00 1.00 H new ATOM 0 HB2 GLN A 33 109.130 4.666 7.140 1.00 1.00 H new ATOM 0 HB3 GLN A 33 110.244 3.637 8.018 1.00 1.00 H new ATOM 0 HG2 GLN A 33 111.292 5.528 8.734 1.00 1.00 H new ATOM 0 HG3 GLN A 33 111.886 5.729 7.097 1.00 1.00 H new ATOM 0 HE21 GLN A 33 111.386 7.894 8.847 1.00 1.00 H new ATOM 0 HE22 GLN A 33 110.046 8.830 8.177 1.00 1.00 H new ATOM 496 N TYR A 34 110.481 1.511 5.829 1.00 1.00 N ATOM 497 CA TYR A 34 109.801 0.278 5.466 1.00 1.00 C ATOM 498 C TYR A 34 109.857 -0.712 6.594 1.00 1.00 C ATOM 499 O TYR A 34 110.798 -0.732 7.386 1.00 1.00 O ATOM 500 CB TYR A 34 110.400 -0.347 4.207 1.00 1.00 C ATOM 501 CG TYR A 34 111.846 -0.697 4.456 1.00 1.00 C ATOM 502 CD1 TYR A 34 112.157 -1.865 5.151 1.00 1.00 C ATOM 503 CD2 TYR A 34 112.871 0.139 3.997 1.00 1.00 C ATOM 504 CE1 TYR A 34 113.493 -2.206 5.393 1.00 1.00 C ATOM 505 CE2 TYR A 34 114.209 -0.201 4.237 1.00 1.00 C ATOM 506 CZ TYR A 34 114.520 -1.373 4.935 1.00 1.00 C ATOM 507 OH TYR A 34 115.837 -1.706 5.172 1.00 1.00 O ATOM 0 H TYR A 34 111.350 1.384 6.348 1.00 1.00 H new ATOM 0 HA TYR A 34 108.761 0.533 5.261 1.00 1.00 H new ATOM 0 HB2 TYR A 34 109.841 -1.241 3.931 1.00 1.00 H new ATOM 0 HB3 TYR A 34 110.322 0.348 3.371 1.00 1.00 H new ATOM 0 HD1 TYR A 34 111.365 -2.509 5.504 1.00 1.00 H new ATOM 0 HD2 TYR A 34 112.631 1.044 3.459 1.00 1.00 H new ATOM 0 HE1 TYR A 34 113.731 -3.111 5.933 1.00 1.00 H new ATOM 0 HE2 TYR A 34 115.001 0.442 3.883 1.00 1.00 H new ATOM 0 HH TYR A 34 116.422 -1.021 4.786 1.00 1.00 H new ATOM 517 N LYS A 35 108.827 -1.541 6.650 1.00 1.00 N ATOM 518 CA LYS A 35 108.716 -2.555 7.666 1.00 1.00 C ATOM 519 C LYS A 35 108.290 -3.846 7.028 1.00 1.00 C ATOM 520 O LYS A 35 107.400 -3.871 6.182 1.00 1.00 O ATOM 521 CB LYS A 35 107.699 -2.117 8.710 1.00 1.00 C ATOM 522 CG LYS A 35 107.651 -3.105 9.879 1.00 1.00 C ATOM 523 CD LYS A 35 106.419 -4.002 9.783 1.00 1.00 C ATOM 524 CE LYS A 35 106.361 -4.903 11.011 1.00 1.00 C ATOM 525 NZ LYS A 35 106.204 -4.062 12.232 1.00 1.00 N ATOM 0 H LYS A 35 108.050 -1.524 5.990 1.00 1.00 H new ATOM 0 HA LYS A 35 109.679 -2.701 8.155 1.00 1.00 H new ATOM 0 HB2 LYS A 35 107.956 -1.124 9.079 1.00 1.00 H new ATOM 0 HB3 LYS A 35 106.713 -2.041 8.252 1.00 1.00 H new ATOM 0 HG2 LYS A 35 108.553 -3.717 9.880 1.00 1.00 H new ATOM 0 HG3 LYS A 35 107.636 -2.559 10.822 1.00 1.00 H new ATOM 0 HD2 LYS A 35 105.516 -3.395 9.719 1.00 1.00 H new ATOM 0 HD3 LYS A 35 106.463 -4.605 8.876 1.00 1.00 H new ATOM 0 HE2 LYS A 35 105.527 -5.600 10.926 1.00 1.00 H new ATOM 0 HE3 LYS A 35 107.270 -5.500 11.081 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 105.799 -4.636 12.999 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 107.133 -3.699 12.525 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 105.570 -3.264 12.025 1.00 1.00 H new ATOM 539 N VAL A 36 108.947 -4.918 7.416 1.00 1.00 N ATOM 540 CA VAL A 36 108.637 -6.225 6.838 1.00 1.00 C ATOM 541 C VAL A 36 107.596 -6.976 7.664 1.00 1.00 C ATOM 542 O VAL A 36 107.878 -7.536 8.720 1.00 1.00 O ATOM 543 CB VAL A 36 109.927 -7.038 6.675 1.00 1.00 C ATOM 544 CG1 VAL A 36 110.719 -7.056 7.978 1.00 1.00 C ATOM 545 CG2 VAL A 36 109.586 -8.473 6.250 1.00 1.00 C ATOM 0 H VAL A 36 109.688 -4.921 8.117 1.00 1.00 H new ATOM 0 HA VAL A 36 108.196 -6.073 5.853 1.00 1.00 H new ATOM 0 HB VAL A 36 110.540 -6.569 5.905 1.00 1.00 H new ATOM 0 HG11 VAL A 36 111.631 -7.638 7.842 1.00 1.00 H new ATOM 0 HG12 VAL A 36 110.979 -6.036 8.260 1.00 1.00 H new ATOM 0 HG13 VAL A 36 110.115 -7.507 8.765 1.00 1.00 H new ATOM 0 HG21 VAL A 36 110.506 -9.047 6.135 1.00 1.00 H new ATOM 0 HG22 VAL A 36 108.960 -8.939 7.011 1.00 1.00 H new ATOM 0 HG23 VAL A 36 109.050 -8.454 5.301 1.00 1.00 H new ATOM 549 N ILE A 37 106.379 -6.988 7.152 1.00 1.00 N ATOM 550 CA ILE A 37 105.289 -7.674 7.821 1.00 1.00 C ATOM 551 C ILE A 37 105.527 -9.171 7.756 1.00 1.00 C ATOM 552 O ILE A 37 105.291 -9.901 8.719 1.00 1.00 O ATOM 553 CB ILE A 37 103.955 -7.356 7.135 1.00 1.00 C ATOM 554 CG1 ILE A 37 103.842 -5.855 6.826 1.00 1.00 C ATOM 555 CG2 ILE A 37 102.826 -7.768 8.064 1.00 1.00 C ATOM 556 CD1 ILE A 37 103.784 -5.002 8.089 1.00 1.00 C ATOM 0 H ILE A 37 106.121 -6.532 6.277 1.00 1.00 H new ATOM 0 HA ILE A 37 105.248 -7.340 8.858 1.00 1.00 H new ATOM 0 HB ILE A 37 103.897 -7.903 6.194 1.00 1.00 H new ATOM 0 HG12 ILE A 37 104.695 -5.546 6.222 1.00 1.00 H new ATOM 0 HG13 ILE A 37 102.947 -5.676 6.229 1.00 1.00 H new ATOM 0 HG21 ILE A 37 101.868 -7.549 7.592 1.00 1.00 H new ATOM 0 HG22 ILE A 37 102.894 -8.837 8.268 1.00 1.00 H new ATOM 0 HG23 ILE A 37 102.904 -7.214 9.000 1.00 1.00 H new ATOM 0 HD11 ILE A 37 103.705 -3.950 7.814 1.00 1.00 H new ATOM 0 HD12 ILE A 37 102.916 -5.289 8.682 1.00 1.00 H new ATOM 0 HD13 ILE A 37 104.690 -5.157 8.674 1.00 1.00 H new ATOM 563 N ASN A 38 105.975 -9.620 6.590 1.00 1.00 N ATOM 564 CA ASN A 38 106.231 -11.029 6.354 1.00 1.00 C ATOM 565 C ASN A 38 107.472 -11.193 5.496 1.00 1.00 C ATOM 566 O ASN A 38 107.576 -10.592 4.434 1.00 1.00 O ATOM 567 CB ASN A 38 105.036 -11.638 5.621 1.00 1.00 C ATOM 568 CG ASN A 38 103.789 -11.571 6.493 1.00 1.00 C ATOM 569 OD1 ASN A 38 103.431 -12.551 7.147 1.00 1.00 O ATOM 570 ND2 ASN A 38 103.104 -10.464 6.549 1.00 1.00 N ATOM 0 H ASN A 38 106.169 -9.020 5.789 1.00 1.00 H new ATOM 0 HA ASN A 38 106.383 -11.532 7.309 1.00 1.00 H new ATOM 0 HB2 ASN A 38 104.863 -11.104 4.687 1.00 1.00 H new ATOM 0 HB3 ASN A 38 105.250 -12.675 5.361 1.00 1.00 H new ATOM 0 HD21 ASN A 38 102.271 -10.409 7.135 1.00 1.00 H new ATOM 0 HD22 ASN A 38 103.401 -9.653 6.007 1.00 1.00 H new ATOM 577 N SER A 39 108.406 -12.011 5.947 1.00 1.00 N ATOM 578 CA SER A 39 109.626 -12.251 5.186 1.00 1.00 C ATOM 579 C SER A 39 109.412 -13.389 4.201 1.00 1.00 C ATOM 580 O SER A 39 109.035 -14.496 4.587 1.00 1.00 O ATOM 581 CB SER A 39 110.772 -12.606 6.117 1.00 1.00 C ATOM 582 OG SER A 39 110.596 -13.933 6.597 1.00 1.00 O ATOM 0 H SER A 39 108.347 -12.519 6.830 1.00 1.00 H new ATOM 0 HA SER A 39 109.875 -11.339 4.643 1.00 1.00 H new ATOM 0 HB2 SER A 39 111.723 -12.521 5.591 1.00 1.00 H new ATOM 0 HB3 SER A 39 110.807 -11.907 6.952 1.00 1.00 H new ATOM 0 HG SER A 39 109.795 -14.324 6.190 1.00 1.00 H new ATOM 588 N GLY A 40 109.670 -13.110 2.927 1.00 1.00 N ATOM 589 CA GLY A 40 109.527 -14.105 1.873 1.00 1.00 C ATOM 590 C GLY A 40 110.892 -14.435 1.298 1.00 1.00 C ATOM 591 O GLY A 40 111.156 -15.566 0.889 1.00 1.00 O ATOM 0 H GLY A 40 109.981 -12.196 2.599 1.00 1.00 H new ATOM 0 HA2 GLY A 40 109.061 -15.006 2.270 1.00 1.00 H new ATOM 0 HA3 GLY A 40 108.872 -13.727 1.088 1.00 1.00 H new ATOM 595 N ASN A 41 111.760 -13.430 1.284 1.00 1.00 N ATOM 596 CA ASN A 41 113.108 -13.604 0.773 1.00 1.00 C ATOM 597 C ASN A 41 113.086 -14.117 -0.663 1.00 1.00 C ATOM 598 O ASN A 41 113.975 -14.856 -1.085 1.00 1.00 O ATOM 599 CB ASN A 41 113.858 -14.582 1.670 1.00 1.00 C ATOM 600 CG ASN A 41 113.824 -14.079 3.111 1.00 1.00 C ATOM 601 OD1 ASN A 41 114.413 -14.699 3.996 1.00 1.00 O ATOM 602 ND2 ASN A 41 113.153 -12.991 3.404 1.00 1.00 N ATOM 0 H ASN A 41 111.552 -12.490 1.620 1.00 1.00 H new ATOM 0 HA ASN A 41 113.615 -12.639 0.774 1.00 1.00 H new ATOM 0 HB2 ASN A 41 113.404 -15.571 1.608 1.00 1.00 H new ATOM 0 HB3 ASN A 41 114.890 -14.683 1.333 1.00 1.00 H new ATOM 0 HD21 ASN A 41 113.119 -12.657 4.367 1.00 1.00 H new ATOM 0 HD22 ASN A 41 112.666 -12.479 2.669 1.00 1.00 H new ATOM 609 N GLY A 42 112.066 -13.711 -1.412 1.00 1.00 N ATOM 610 CA GLY A 42 111.932 -14.119 -2.801 1.00 1.00 C ATOM 611 C GLY A 42 112.609 -13.139 -3.736 1.00 1.00 C ATOM 612 O GLY A 42 113.408 -12.295 -3.329 1.00 1.00 O ATOM 0 H GLY A 42 111.321 -13.100 -1.078 1.00 1.00 H new ATOM 0 HA2 GLY A 42 112.367 -15.110 -2.934 1.00 1.00 H new ATOM 0 HA3 GLY A 42 110.876 -14.198 -3.058 1.00 1.00 H new ATOM 616 N VAL A 43 112.233 -13.250 -4.991 1.00 1.00 N ATOM 617 CA VAL A 43 112.726 -12.377 -6.032 1.00 1.00 C ATOM 618 C VAL A 43 112.152 -10.991 -5.807 1.00 1.00 C ATOM 619 O VAL A 43 111.423 -10.783 -4.850 1.00 1.00 O ATOM 620 CB VAL A 43 112.348 -12.922 -7.415 1.00 1.00 C ATOM 621 CG1 VAL A 43 112.941 -14.316 -7.569 1.00 1.00 C ATOM 622 CG2 VAL A 43 110.833 -13.000 -7.584 1.00 1.00 C ATOM 0 H VAL A 43 111.572 -13.954 -5.320 1.00 1.00 H new ATOM 0 HA VAL A 43 113.814 -12.326 -5.995 1.00 1.00 H new ATOM 0 HB VAL A 43 112.741 -12.248 -8.176 1.00 1.00 H new ATOM 0 HG11 VAL A 43 112.680 -14.716 -8.549 1.00 1.00 H new ATOM 0 HG12 VAL A 43 114.026 -14.262 -7.476 1.00 1.00 H new ATOM 0 HG13 VAL A 43 112.542 -14.969 -6.792 1.00 1.00 H new ATOM 0 HG21 VAL A 43 110.597 -13.390 -8.574 1.00 1.00 H new ATOM 0 HG22 VAL A 43 110.416 -13.661 -6.825 1.00 1.00 H new ATOM 0 HG23 VAL A 43 110.403 -12.004 -7.474 1.00 1.00 H new ATOM 626 N LYS A 44 112.468 -10.073 -6.696 1.00 1.00 N ATOM 627 CA LYS A 44 111.979 -8.693 -6.611 1.00 1.00 C ATOM 628 C LYS A 44 112.603 -7.872 -7.736 1.00 1.00 C ATOM 629 O LYS A 44 113.640 -8.248 -8.285 1.00 1.00 O ATOM 630 CB LYS A 44 112.274 -8.044 -5.223 1.00 1.00 C ATOM 631 CG LYS A 44 113.772 -7.681 -5.019 1.00 1.00 C ATOM 632 CD LYS A 44 114.521 -8.828 -4.300 1.00 1.00 C ATOM 633 CE LYS A 44 114.492 -8.632 -2.774 1.00 1.00 C ATOM 634 NZ LYS A 44 114.812 -9.926 -2.119 1.00 1.00 N ATOM 0 H LYS A 44 113.069 -10.251 -7.500 1.00 1.00 H new ATOM 0 HA LYS A 44 110.895 -8.708 -6.721 1.00 1.00 H new ATOM 0 HB2 LYS A 44 111.671 -7.142 -5.116 1.00 1.00 H new ATOM 0 HB3 LYS A 44 111.963 -8.730 -4.435 1.00 1.00 H new ATOM 0 HG2 LYS A 44 114.238 -7.485 -5.985 1.00 1.00 H new ATOM 0 HG3 LYS A 44 113.853 -6.765 -4.434 1.00 1.00 H new ATOM 0 HD2 LYS A 44 114.063 -9.783 -4.557 1.00 1.00 H new ATOM 0 HD3 LYS A 44 115.554 -8.866 -4.646 1.00 1.00 H new ATOM 0 HE2 LYS A 44 115.213 -7.870 -2.478 1.00 1.00 H new ATOM 0 HE3 LYS A 44 113.510 -8.281 -2.457 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 114.929 -9.778 -1.096 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 114.038 -10.600 -2.285 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 115.694 -10.308 -2.517 1.00 1.00 H new ATOM 648 N PRO A 45 111.940 -6.815 -8.150 1.00 1.00 N ATOM 649 CA PRO A 45 112.383 -5.985 -9.306 1.00 1.00 C ATOM 650 C PRO A 45 113.348 -4.866 -8.967 1.00 1.00 C ATOM 651 O PRO A 45 113.307 -4.300 -7.882 1.00 1.00 O ATOM 652 CB PRO A 45 111.065 -5.409 -9.833 1.00 1.00 C ATOM 653 CG PRO A 45 110.150 -5.337 -8.646 1.00 1.00 C ATOM 654 CD PRO A 45 110.709 -6.260 -7.556 1.00 1.00 C ATOM 0 HA PRO A 45 112.948 -6.589 -10.016 1.00 1.00 H new ATOM 0 HB2 PRO A 45 111.216 -4.422 -10.271 1.00 1.00 H new ATOM 0 HB3 PRO A 45 110.645 -6.043 -10.613 1.00 1.00 H new ATOM 0 HG2 PRO A 45 110.082 -4.313 -8.279 1.00 1.00 H new ATOM 0 HG3 PRO A 45 109.142 -5.643 -8.924 1.00 1.00 H new ATOM 0 HD2 PRO A 45 110.922 -5.710 -6.639 1.00 1.00 H new ATOM 0 HD3 PRO A 45 110.001 -7.047 -7.299 1.00 1.00 H new ATOM 662 N GLY A 46 114.159 -4.507 -9.954 1.00 1.00 N ATOM 663 CA GLY A 46 115.081 -3.401 -9.810 1.00 1.00 C ATOM 664 C GLY A 46 114.349 -2.119 -10.127 1.00 1.00 C ATOM 665 O GLY A 46 113.167 -2.134 -10.466 1.00 1.00 O ATOM 0 H GLY A 46 114.193 -4.970 -10.862 1.00 1.00 H new ATOM 0 HA2 GLY A 46 115.478 -3.369 -8.795 1.00 1.00 H new ATOM 0 HA3 GLY A 46 115.931 -3.527 -10.481 1.00 1.00 H new ATOM 669 N LYS A 47 115.049 -1.022 -10.020 1.00 1.00 N ATOM 670 CA LYS A 47 114.445 0.261 -10.293 1.00 1.00 C ATOM 671 C LYS A 47 113.825 0.282 -11.676 1.00 1.00 C ATOM 672 O LYS A 47 112.973 1.119 -11.969 1.00 1.00 O ATOM 673 CB LYS A 47 115.486 1.388 -10.153 1.00 1.00 C ATOM 674 CG LYS A 47 116.505 1.404 -11.323 1.00 1.00 C ATOM 675 CD LYS A 47 117.928 1.027 -10.852 1.00 1.00 C ATOM 676 CE LYS A 47 118.066 -0.483 -10.621 1.00 1.00 C ATOM 677 NZ LYS A 47 117.824 -0.805 -9.187 1.00 1.00 N ATOM 0 H LYS A 47 116.031 -0.987 -9.748 1.00 1.00 H new ATOM 0 HA LYS A 47 113.653 0.426 -9.562 1.00 1.00 H new ATOM 0 HB2 LYS A 47 114.973 2.349 -10.109 1.00 1.00 H new ATOM 0 HB3 LYS A 47 116.021 1.269 -9.211 1.00 1.00 H new ATOM 0 HG2 LYS A 47 116.182 0.707 -12.096 1.00 1.00 H new ATOM 0 HG3 LYS A 47 116.523 2.395 -11.775 1.00 1.00 H new ATOM 0 HD2 LYS A 47 118.656 1.349 -11.597 1.00 1.00 H new ATOM 0 HD3 LYS A 47 118.159 1.559 -9.929 1.00 1.00 H new ATOM 0 HE2 LYS A 47 117.355 -1.021 -11.248 1.00 1.00 H new ATOM 0 HE3 LYS A 47 119.063 -0.814 -10.913 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 117.651 -1.825 -9.085 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 118.658 -0.538 -8.626 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 116.995 -0.277 -8.848 1.00 1.00 H new ATOM 691 N SER A 48 114.289 -0.619 -12.538 1.00 1.00 N ATOM 692 CA SER A 48 113.804 -0.658 -13.919 1.00 1.00 C ATOM 693 C SER A 48 112.892 -1.847 -14.213 1.00 1.00 C ATOM 694 O SER A 48 112.253 -1.872 -15.262 1.00 1.00 O ATOM 695 CB SER A 48 115.004 -0.690 -14.864 1.00 1.00 C ATOM 696 OG SER A 48 115.604 0.598 -14.894 1.00 1.00 O ATOM 0 H SER A 48 114.991 -1.324 -12.311 1.00 1.00 H new ATOM 0 HA SER A 48 113.202 0.238 -14.072 1.00 1.00 H new ATOM 0 HB2 SER A 48 115.727 -1.434 -14.530 1.00 1.00 H new ATOM 0 HB3 SER A 48 114.687 -0.981 -15.865 1.00 1.00 H new ATOM 0 HG SER A 48 116.376 0.585 -15.497 1.00 1.00 H new ATOM 702 N ASP A 49 112.808 -2.821 -13.306 1.00 1.00 N ATOM 703 CA ASP A 49 111.931 -3.977 -13.558 1.00 1.00 C ATOM 704 C ASP A 49 110.517 -3.645 -13.104 1.00 1.00 C ATOM 705 O ASP A 49 110.307 -2.655 -12.403 1.00 1.00 O ATOM 706 CB ASP A 49 112.436 -5.230 -12.844 1.00 1.00 C ATOM 707 CG ASP A 49 113.698 -5.760 -13.518 1.00 1.00 C ATOM 708 OD1 ASP A 49 114.038 -5.261 -14.578 1.00 1.00 O ATOM 709 OD2 ASP A 49 114.306 -6.660 -12.961 1.00 1.00 O ATOM 0 H ASP A 49 113.314 -2.841 -12.420 1.00 1.00 H new ATOM 0 HA ASP A 49 111.935 -4.186 -14.628 1.00 1.00 H new ATOM 0 HB2 ASP A 49 112.644 -5.001 -11.799 1.00 1.00 H new ATOM 0 HB3 ASP A 49 111.662 -5.998 -12.854 1.00 1.00 H new ATOM 714 N THR A 50 109.545 -4.464 -13.517 1.00 1.00 N ATOM 715 CA THR A 50 108.145 -4.230 -13.153 1.00 1.00 C ATOM 716 C THR A 50 107.714 -5.191 -12.061 1.00 1.00 C ATOM 717 O THR A 50 108.268 -6.279 -11.914 1.00 1.00 O ATOM 718 CB THR A 50 107.253 -4.335 -14.396 1.00 1.00 C ATOM 719 OG1 THR A 50 107.877 -3.668 -15.481 1.00 1.00 O ATOM 720 CG2 THR A 50 105.890 -3.712 -14.145 1.00 1.00 C ATOM 0 H THR A 50 109.700 -5.288 -14.098 1.00 1.00 H new ATOM 0 HA THR A 50 108.040 -3.220 -12.756 1.00 1.00 H new ATOM 0 HB THR A 50 107.114 -5.390 -14.630 1.00 1.00 H new ATOM 0 HG1 THR A 50 107.309 -3.736 -16.277 1.00 1.00 H new ATOM 0 HG21 THR A 50 105.279 -3.801 -15.043 1.00 1.00 H new ATOM 0 HG22 THR A 50 105.400 -4.229 -13.320 1.00 1.00 H new ATOM 0 HG23 THR A 50 106.012 -2.659 -13.892 1.00 1.00 H new ATOM 728 N VAL A 51 106.760 -4.739 -11.250 1.00 1.00 N ATOM 729 CA VAL A 51 106.294 -5.516 -10.102 1.00 1.00 C ATOM 730 C VAL A 51 104.788 -5.671 -10.085 1.00 1.00 C ATOM 731 O VAL A 51 104.079 -4.846 -10.640 1.00 1.00 O ATOM 732 CB VAL A 51 106.734 -4.793 -8.821 1.00 1.00 C ATOM 733 CG1 VAL A 51 105.874 -3.559 -8.521 1.00 1.00 C ATOM 734 CG2 VAL A 51 106.705 -5.775 -7.651 1.00 1.00 C ATOM 0 H VAL A 51 106.294 -3.839 -11.366 1.00 1.00 H new ATOM 0 HA VAL A 51 106.726 -6.514 -10.169 1.00 1.00 H new ATOM 0 HB VAL A 51 107.751 -4.430 -8.970 1.00 1.00 H new ATOM 0 HG11 VAL A 51 106.226 -3.084 -7.605 1.00 1.00 H new ATOM 0 HG12 VAL A 51 105.949 -2.853 -9.348 1.00 1.00 H new ATOM 0 HG13 VAL A 51 104.834 -3.862 -8.396 1.00 1.00 H new ATOM 0 HG21 VAL A 51 107.017 -5.265 -6.740 1.00 1.00 H new ATOM 0 HG22 VAL A 51 105.693 -6.159 -7.523 1.00 1.00 H new ATOM 0 HG23 VAL A 51 107.384 -6.603 -7.854 1.00 1.00 H new ATOM 738 N THR A 52 104.306 -6.708 -9.387 1.00 1.00 N ATOM 739 CA THR A 52 102.868 -6.934 -9.241 1.00 1.00 C ATOM 740 C THR A 52 102.550 -6.996 -7.743 1.00 1.00 C ATOM 741 O THR A 52 103.138 -7.802 -7.022 1.00 1.00 O ATOM 742 CB THR A 52 102.493 -8.242 -9.938 1.00 1.00 C ATOM 743 OG1 THR A 52 102.808 -8.141 -11.319 1.00 1.00 O ATOM 744 CG2 THR A 52 101.008 -8.502 -9.773 1.00 1.00 C ATOM 0 H THR A 52 104.891 -7.399 -8.918 1.00 1.00 H new ATOM 0 HA THR A 52 102.293 -6.129 -9.699 1.00 1.00 H new ATOM 0 HB THR A 52 103.051 -9.066 -9.493 1.00 1.00 H new ATOM 0 HG1 THR A 52 102.571 -8.978 -11.771 1.00 1.00 H new ATOM 0 HG21 THR A 52 100.744 -9.435 -10.271 1.00 1.00 H new ATOM 0 HG22 THR A 52 100.767 -8.576 -8.713 1.00 1.00 H new ATOM 0 HG23 THR A 52 100.444 -7.682 -10.217 1.00 1.00 H new ATOM 752 N VAL A 53 101.681 -6.101 -7.257 1.00 1.00 N ATOM 753 CA VAL A 53 101.400 -6.046 -5.810 1.00 1.00 C ATOM 754 C VAL A 53 99.978 -5.589 -5.449 1.00 1.00 C ATOM 755 O VAL A 53 99.321 -4.901 -6.228 1.00 1.00 O ATOM 756 CB VAL A 53 102.345 -4.997 -5.221 1.00 1.00 C ATOM 757 CG1 VAL A 53 103.791 -5.340 -5.575 1.00 1.00 C ATOM 758 CG2 VAL A 53 102.002 -3.594 -5.808 1.00 1.00 C ATOM 0 H VAL A 53 101.171 -5.422 -7.822 1.00 1.00 H new ATOM 0 HA VAL A 53 101.525 -7.058 -5.424 1.00 1.00 H new ATOM 0 HB VAL A 53 102.226 -4.986 -4.138 1.00 1.00 H new ATOM 0 HG11 VAL A 53 104.457 -4.588 -5.152 1.00 1.00 H new ATOM 0 HG12 VAL A 53 104.043 -6.319 -5.167 1.00 1.00 H new ATOM 0 HG13 VAL A 53 103.906 -5.358 -6.659 1.00 1.00 H new ATOM 0 HG21 VAL A 53 102.677 -2.849 -5.387 1.00 1.00 H new ATOM 0 HG22 VAL A 53 102.116 -3.615 -6.892 1.00 1.00 H new ATOM 0 HG23 VAL A 53 100.973 -3.336 -5.556 1.00 1.00 H new ATOM 762 N GLU A 54 99.574 -5.858 -4.192 1.00 1.00 N ATOM 763 CA GLU A 54 98.284 -5.363 -3.665 1.00 1.00 C ATOM 764 C GLU A 54 98.621 -4.455 -2.484 1.00 1.00 C ATOM 765 O GLU A 54 99.680 -4.623 -1.881 1.00 1.00 O ATOM 766 CB GLU A 54 97.342 -6.477 -3.158 1.00 1.00 C ATOM 767 CG GLU A 54 97.259 -7.669 -4.132 1.00 1.00 C ATOM 768 CD GLU A 54 96.967 -8.979 -3.390 1.00 1.00 C ATOM 769 OE1 GLU A 54 96.914 -10.005 -4.049 1.00 1.00 O ATOM 770 OE2 GLU A 54 96.798 -8.940 -2.183 1.00 1.00 O ATOM 0 H GLU A 54 100.116 -6.410 -3.527 1.00 1.00 H new ATOM 0 HA GLU A 54 97.758 -4.860 -4.477 1.00 1.00 H new ATOM 0 HB2 GLU A 54 97.691 -6.829 -2.187 1.00 1.00 H new ATOM 0 HB3 GLU A 54 96.344 -6.064 -3.008 1.00 1.00 H new ATOM 0 HG2 GLU A 54 96.477 -7.485 -4.869 1.00 1.00 H new ATOM 0 HG3 GLU A 54 98.198 -7.760 -4.679 1.00 1.00 H new ATOM 777 N TYR A 55 97.781 -3.463 -2.160 1.00 1.00 N ATOM 778 CA TYR A 55 98.142 -2.572 -1.065 1.00 1.00 C ATOM 779 C TYR A 55 96.983 -1.731 -0.521 1.00 1.00 C ATOM 780 O TYR A 55 95.996 -1.482 -1.211 1.00 1.00 O ATOM 781 CB TYR A 55 99.194 -1.617 -1.611 1.00 1.00 C ATOM 782 CG TYR A 55 98.609 -0.935 -2.837 1.00 1.00 C ATOM 783 CD1 TYR A 55 97.746 0.156 -2.683 1.00 1.00 C ATOM 784 CD2 TYR A 55 98.890 -1.418 -4.119 1.00 1.00 C ATOM 785 CE1 TYR A 55 97.166 0.769 -3.802 1.00 1.00 C ATOM 786 CE2 TYR A 55 98.316 -0.800 -5.241 1.00 1.00 C ATOM 787 CZ TYR A 55 97.454 0.292 -5.081 1.00 1.00 C ATOM 788 OH TYR A 55 96.885 0.888 -6.188 1.00 1.00 O ATOM 0 H TYR A 55 96.891 -3.267 -2.618 1.00 1.00 H new ATOM 0 HA TYR A 55 98.486 -3.192 -0.237 1.00 1.00 H new ATOM 0 HB2 TYR A 55 99.468 -0.879 -0.857 1.00 1.00 H new ATOM 0 HB3 TYR A 55 100.103 -2.159 -1.872 1.00 1.00 H new ATOM 0 HD1 TYR A 55 97.525 0.529 -1.694 1.00 1.00 H new ATOM 0 HD2 TYR A 55 99.548 -2.265 -4.246 1.00 1.00 H new ATOM 0 HE1 TYR A 55 96.498 1.608 -3.675 1.00 1.00 H new ATOM 0 HE2 TYR A 55 98.540 -1.168 -6.231 1.00 1.00 H new ATOM 0 HH TYR A 55 97.193 0.433 -6.999 1.00 1.00 H new ATOM 798 N THR A 56 97.165 -1.217 0.712 1.00 1.00 N ATOM 799 CA THR A 56 96.183 -0.311 1.330 1.00 1.00 C ATOM 800 C THR A 56 96.877 0.987 1.705 1.00 1.00 C ATOM 801 O THR A 56 97.912 0.975 2.352 1.00 1.00 O ATOM 802 CB THR A 56 95.456 -0.939 2.538 1.00 1.00 C ATOM 803 OG1 THR A 56 94.387 -1.745 2.070 1.00 1.00 O ATOM 804 CG2 THR A 56 94.860 0.148 3.443 1.00 1.00 C ATOM 0 H THR A 56 97.979 -1.414 1.295 1.00 1.00 H new ATOM 0 HA THR A 56 95.400 -0.110 0.599 1.00 1.00 H new ATOM 0 HB THR A 56 96.179 -1.528 3.102 1.00 1.00 H new ATOM 0 HG1 THR A 56 94.148 -2.402 2.757 1.00 1.00 H new ATOM 0 HG21 THR A 56 94.353 -0.319 4.287 1.00 1.00 H new ATOM 0 HG22 THR A 56 95.658 0.793 3.811 1.00 1.00 H new ATOM 0 HG23 THR A 56 94.145 0.743 2.875 1.00 1.00 H new ATOM 812 N GLY A 57 96.309 2.115 1.280 1.00 1.00 N ATOM 813 CA GLY A 57 96.917 3.419 1.565 1.00 1.00 C ATOM 814 C GLY A 57 96.084 4.239 2.531 1.00 1.00 C ATOM 815 O GLY A 57 94.859 4.297 2.418 1.00 1.00 O ATOM 0 H GLY A 57 95.442 2.156 0.745 1.00 1.00 H new ATOM 0 HA2 GLY A 57 97.913 3.270 1.982 1.00 1.00 H new ATOM 0 HA3 GLY A 57 97.040 3.972 0.634 1.00 1.00 H new ATOM 819 N ARG A 58 96.751 4.893 3.486 1.00 1.00 N ATOM 820 CA ARG A 58 96.044 5.714 4.450 1.00 1.00 C ATOM 821 C ARG A 58 96.848 6.941 4.877 1.00 1.00 C ATOM 822 O ARG A 58 98.057 7.029 4.663 1.00 1.00 O ATOM 823 CB ARG A 58 95.643 4.872 5.679 1.00 1.00 C ATOM 824 CG ARG A 58 96.791 4.759 6.712 1.00 1.00 C ATOM 825 CD ARG A 58 96.253 4.204 8.033 1.00 1.00 C ATOM 826 NE ARG A 58 96.166 2.750 7.973 1.00 1.00 N ATOM 827 CZ ARG A 58 95.556 2.058 8.927 1.00 1.00 C ATOM 828 NH1 ARG A 58 94.877 2.672 9.857 1.00 1.00 N ATOM 829 NH2 ARG A 58 95.607 0.753 8.919 1.00 1.00 N ATOM 0 H ARG A 58 97.764 4.866 3.605 1.00 1.00 H new ATOM 0 HA ARG A 58 95.144 6.083 3.959 1.00 1.00 H new ATOM 0 HB2 ARG A 58 94.771 5.320 6.155 1.00 1.00 H new ATOM 0 HB3 ARG A 58 95.350 3.874 5.353 1.00 1.00 H new ATOM 0 HG2 ARG A 58 97.575 4.107 6.327 1.00 1.00 H new ATOM 0 HG3 ARG A 58 97.242 5.738 6.876 1.00 1.00 H new ATOM 0 HD2 ARG A 58 96.906 4.502 8.853 1.00 1.00 H new ATOM 0 HD3 ARG A 58 95.269 4.626 8.239 1.00 1.00 H new ATOM 0 HE ARG A 58 96.582 2.256 7.183 1.00 1.00 H new ATOM 0 HH11 ARG A 58 94.813 3.690 9.854 1.00 1.00 H new ATOM 0 HH12 ARG A 58 94.411 2.134 10.587 1.00 1.00 H new ATOM 0 HH21 ARG A 58 96.115 0.267 8.180 1.00 1.00 H new ATOM 0 HH22 ARG A 58 95.139 0.220 9.652 1.00 1.00 H new ATOM 843 N LEU A 59 96.139 7.862 5.518 1.00 1.00 N ATOM 844 CA LEU A 59 96.730 9.090 6.042 1.00 1.00 C ATOM 845 C LEU A 59 97.366 8.825 7.404 1.00 1.00 C ATOM 846 O LEU A 59 97.064 7.834 8.069 1.00 1.00 O ATOM 847 CB LEU A 59 95.627 10.158 6.214 1.00 1.00 C ATOM 848 CG LEU A 59 95.596 11.161 5.040 1.00 1.00 C ATOM 849 CD1 LEU A 59 94.891 10.552 3.839 1.00 1.00 C ATOM 850 CD2 LEU A 59 94.845 12.437 5.444 1.00 1.00 C ATOM 0 H LEU A 59 95.137 7.780 5.690 1.00 1.00 H new ATOM 0 HA LEU A 59 97.490 9.440 5.344 1.00 1.00 H new ATOM 0 HB2 LEU A 59 94.658 9.666 6.295 1.00 1.00 H new ATOM 0 HB3 LEU A 59 95.789 10.698 7.147 1.00 1.00 H new ATOM 0 HG LEU A 59 96.627 11.403 4.782 1.00 1.00 H new ATOM 0 HD11 LEU A 59 94.878 11.272 3.021 1.00 1.00 H new ATOM 0 HD12 LEU A 59 95.421 9.653 3.523 1.00 1.00 H new ATOM 0 HD13 LEU A 59 93.868 10.293 4.111 1.00 1.00 H new ATOM 0 HD21 LEU A 59 94.833 13.133 4.605 1.00 1.00 H new ATOM 0 HD22 LEU A 59 93.822 12.184 5.721 1.00 1.00 H new ATOM 0 HD23 LEU A 59 95.347 12.901 6.293 1.00 1.00 H new ATOM 862 N ILE A 60 98.218 9.749 7.816 1.00 1.00 N ATOM 863 CA ILE A 60 98.874 9.657 9.114 1.00 1.00 C ATOM 864 C ILE A 60 97.840 9.648 10.227 1.00 1.00 C ATOM 865 O ILE A 60 98.085 9.169 11.334 1.00 1.00 O ATOM 866 CB ILE A 60 99.814 10.857 9.336 1.00 1.00 C ATOM 867 CG1 ILE A 60 99.051 12.182 9.622 1.00 1.00 C ATOM 868 CG2 ILE A 60 100.713 11.056 8.123 1.00 1.00 C ATOM 869 CD1 ILE A 60 98.231 12.638 8.420 1.00 1.00 C ATOM 0 H ILE A 60 98.473 10.573 7.271 1.00 1.00 H new ATOM 0 HA ILE A 60 99.450 8.732 9.129 1.00 1.00 H new ATOM 0 HB ILE A 60 100.409 10.620 10.218 1.00 1.00 H new ATOM 0 HG12 ILE A 60 98.392 12.044 10.479 1.00 1.00 H new ATOM 0 HG13 ILE A 60 99.765 12.961 9.891 1.00 1.00 H new ATOM 0 HG21 ILE A 60 101.372 11.907 8.294 1.00 1.00 H new ATOM 0 HG22 ILE A 60 101.312 10.160 7.963 1.00 1.00 H new ATOM 0 HG23 ILE A 60 100.099 11.244 7.242 1.00 1.00 H new ATOM 0 HD11 ILE A 60 97.715 13.567 8.663 1.00 1.00 H new ATOM 0 HD12 ILE A 60 98.893 12.803 7.570 1.00 1.00 H new ATOM 0 HD13 ILE A 60 97.499 11.871 8.167 1.00 1.00 H new ATOM 876 N ASP A 61 96.705 10.244 9.920 1.00 1.00 N ATOM 877 CA ASP A 61 95.614 10.392 10.879 1.00 1.00 C ATOM 878 C ASP A 61 94.605 9.258 10.766 1.00 1.00 C ATOM 879 O ASP A 61 93.565 9.277 11.423 1.00 1.00 O ATOM 880 CB ASP A 61 94.928 11.738 10.646 1.00 1.00 C ATOM 881 CG ASP A 61 94.064 12.103 11.850 1.00 1.00 C ATOM 882 OD1 ASP A 61 93.493 13.181 11.842 1.00 1.00 O ATOM 883 OD2 ASP A 61 93.990 11.299 12.765 1.00 1.00 O ATOM 0 H ASP A 61 96.507 10.641 9.001 1.00 1.00 H new ATOM 0 HA ASP A 61 96.029 10.353 11.886 1.00 1.00 H new ATOM 0 HB2 ASP A 61 95.677 12.512 10.478 1.00 1.00 H new ATOM 0 HB3 ASP A 61 94.312 11.690 9.748 1.00 1.00 H new ATOM 888 N GLY A 62 94.933 8.256 9.963 1.00 1.00 N ATOM 889 CA GLY A 62 94.063 7.094 9.808 1.00 1.00 C ATOM 890 C GLY A 62 93.058 7.240 8.670 1.00 1.00 C ATOM 891 O GLY A 62 92.353 6.283 8.347 1.00 1.00 O ATOM 0 H GLY A 62 95.790 8.222 9.411 1.00 1.00 H new ATOM 0 HA2 GLY A 62 94.676 6.211 9.631 1.00 1.00 H new ATOM 0 HA3 GLY A 62 93.524 6.926 10.740 1.00 1.00 H new ATOM 895 N THR A 63 92.976 8.419 8.060 1.00 1.00 N ATOM 896 CA THR A 63 92.019 8.599 6.970 1.00 1.00 C ATOM 897 C THR A 63 92.430 7.775 5.755 1.00 1.00 C ATOM 898 O THR A 63 93.371 8.123 5.043 1.00 1.00 O ATOM 899 CB THR A 63 91.898 10.077 6.575 1.00 1.00 C ATOM 900 OG1 THR A 63 91.846 10.880 7.743 1.00 1.00 O ATOM 901 CG2 THR A 63 90.626 10.279 5.754 1.00 1.00 C ATOM 0 H THR A 63 93.538 9.238 8.290 1.00 1.00 H new ATOM 0 HA THR A 63 91.047 8.255 7.325 1.00 1.00 H new ATOM 0 HB THR A 63 92.764 10.367 5.980 1.00 1.00 H new ATOM 0 HG1 THR A 63 91.771 11.823 7.488 1.00 1.00 H new ATOM 0 HG21 THR A 63 90.538 11.328 5.472 1.00 1.00 H new ATOM 0 HG22 THR A 63 90.672 9.664 4.855 1.00 1.00 H new ATOM 0 HG23 THR A 63 89.760 9.989 6.348 1.00 1.00 H new ATOM 909 N VAL A 64 91.710 6.680 5.523 1.00 1.00 N ATOM 910 CA VAL A 64 92.002 5.817 4.384 1.00 1.00 C ATOM 911 C VAL A 64 91.480 6.444 3.123 1.00 1.00 C ATOM 912 O VAL A 64 90.286 6.709 2.989 1.00 1.00 O ATOM 913 CB VAL A 64 91.409 4.424 4.598 1.00 1.00 C ATOM 914 CG1 VAL A 64 91.682 3.527 3.385 1.00 1.00 C ATOM 915 CG2 VAL A 64 92.043 3.826 5.842 1.00 1.00 C ATOM 0 H VAL A 64 90.929 6.372 6.102 1.00 1.00 H new ATOM 0 HA VAL A 64 93.082 5.704 4.290 1.00 1.00 H new ATOM 0 HB VAL A 64 90.329 4.498 4.721 1.00 1.00 H new ATOM 0 HG11 VAL A 64 91.252 2.541 3.558 1.00 1.00 H new ATOM 0 HG12 VAL A 64 91.231 3.969 2.497 1.00 1.00 H new ATOM 0 HG13 VAL A 64 92.758 3.433 3.237 1.00 1.00 H new ATOM 0 HG21 VAL A 64 91.635 2.830 6.016 1.00 1.00 H new ATOM 0 HG22 VAL A 64 93.122 3.757 5.703 1.00 1.00 H new ATOM 0 HG23 VAL A 64 91.828 4.461 6.701 1.00 1.00 H new ATOM 919 N PHE A 65 92.407 6.717 2.203 1.00 1.00 N ATOM 920 CA PHE A 65 92.056 7.363 0.946 1.00 1.00 C ATOM 921 C PHE A 65 92.095 6.395 -0.216 1.00 1.00 C ATOM 922 O PHE A 65 91.477 6.637 -1.252 1.00 1.00 O ATOM 923 CB PHE A 65 92.984 8.556 0.707 1.00 1.00 C ATOM 924 CG PHE A 65 94.421 8.138 0.479 1.00 1.00 C ATOM 925 CD1 PHE A 65 95.205 7.765 1.569 1.00 1.00 C ATOM 926 CD2 PHE A 65 94.990 8.193 -0.802 1.00 1.00 C ATOM 927 CE1 PHE A 65 96.558 7.450 1.389 1.00 1.00 C ATOM 928 CE2 PHE A 65 96.340 7.869 -0.975 1.00 1.00 C ATOM 929 CZ PHE A 65 97.119 7.508 0.119 1.00 1.00 C ATOM 0 H PHE A 65 93.398 6.501 2.307 1.00 1.00 H new ATOM 0 HA PHE A 65 91.029 7.720 1.018 1.00 1.00 H new ATOM 0 HB2 PHE A 65 92.631 9.119 -0.157 1.00 1.00 H new ATOM 0 HB3 PHE A 65 92.936 9.227 1.565 1.00 1.00 H new ATOM 0 HD1 PHE A 65 94.768 7.719 2.556 1.00 1.00 H new ATOM 0 HD2 PHE A 65 94.389 8.484 -1.651 1.00 1.00 H new ATOM 0 HE1 PHE A 65 97.164 7.163 2.236 1.00 1.00 H new ATOM 0 HE2 PHE A 65 96.779 7.899 -1.961 1.00 1.00 H new ATOM 0 HZ PHE A 65 98.164 7.272 -0.019 1.00 1.00 H new ATOM 939 N ASP A 66 92.804 5.292 -0.042 1.00 1.00 N ATOM 940 CA ASP A 66 92.888 4.297 -1.099 1.00 1.00 C ATOM 941 C ASP A 66 93.185 2.917 -0.555 1.00 1.00 C ATOM 942 O ASP A 66 93.781 2.766 0.512 1.00 1.00 O ATOM 943 CB ASP A 66 93.977 4.689 -2.084 1.00 1.00 C ATOM 944 CG ASP A 66 93.840 3.871 -3.364 1.00 1.00 C ATOM 945 OD1 ASP A 66 93.448 4.440 -4.368 1.00 1.00 O ATOM 946 OD2 ASP A 66 94.132 2.687 -3.319 1.00 1.00 O ATOM 0 H ASP A 66 93.322 5.064 0.807 1.00 1.00 H new ATOM 0 HA ASP A 66 91.919 4.263 -1.596 1.00 1.00 H new ATOM 0 HB2 ASP A 66 93.907 5.752 -2.313 1.00 1.00 H new ATOM 0 HB3 ASP A 66 94.958 4.523 -1.639 1.00 1.00 H new ATOM 951 N SER A 67 92.788 1.906 -1.321 1.00 1.00 N ATOM 952 CA SER A 67 93.038 0.534 -0.930 1.00 1.00 C ATOM 953 C SER A 67 93.021 -0.404 -2.133 1.00 1.00 C ATOM 954 O SER A 67 92.481 -0.075 -3.189 1.00 1.00 O ATOM 955 CB SER A 67 92.034 0.087 0.128 1.00 1.00 C ATOM 956 OG SER A 67 90.735 0.028 -0.442 1.00 1.00 O ATOM 0 H SER A 67 92.296 2.015 -2.208 1.00 1.00 H new ATOM 0 HA SER A 67 94.037 0.487 -0.497 1.00 1.00 H new ATOM 0 HB2 SER A 67 92.315 -0.891 0.520 1.00 1.00 H new ATOM 0 HB3 SER A 67 92.042 0.782 0.968 1.00 1.00 H new ATOM 0 HG SER A 67 90.092 -0.261 0.239 1.00 1.00 H new ATOM 962 N THR A 68 93.638 -1.576 -1.959 1.00 1.00 N ATOM 963 CA THR A 68 93.714 -2.570 -3.033 1.00 1.00 C ATOM 964 C THR A 68 93.889 -3.957 -2.445 1.00 1.00 C ATOM 965 O THR A 68 93.302 -4.926 -2.919 1.00 1.00 O ATOM 966 CB THR A 68 94.894 -2.263 -3.950 1.00 1.00 C ATOM 967 OG1 THR A 68 94.749 -0.951 -4.478 1.00 1.00 O ATOM 968 CG2 THR A 68 94.952 -3.276 -5.090 1.00 1.00 C ATOM 0 H THR A 68 94.090 -1.859 -1.089 1.00 1.00 H new ATOM 0 HA THR A 68 92.789 -2.531 -3.608 1.00 1.00 H new ATOM 0 HB THR A 68 95.820 -2.327 -3.378 1.00 1.00 H new ATOM 0 HG1 THR A 68 95.586 -0.456 -4.359 1.00 1.00 H new ATOM 0 HG21 THR A 68 95.798 -3.047 -5.738 1.00 1.00 H new ATOM 0 HG22 THR A 68 95.070 -4.279 -4.680 1.00 1.00 H new ATOM 0 HG23 THR A 68 94.029 -3.227 -5.668 1.00 1.00 H new ATOM 976 N GLU A 69 94.680 -4.043 -1.386 1.00 1.00 N ATOM 977 CA GLU A 69 94.887 -5.310 -0.725 1.00 1.00 C ATOM 978 C GLU A 69 93.566 -5.737 -0.130 1.00 1.00 C ATOM 979 O GLU A 69 93.289 -6.926 0.032 1.00 1.00 O ATOM 980 CB GLU A 69 96.003 -5.217 0.295 1.00 1.00 C ATOM 981 CG GLU A 69 95.696 -4.162 1.333 1.00 1.00 C ATOM 982 CD GLU A 69 94.692 -4.689 2.354 1.00 1.00 C ATOM 983 OE1 GLU A 69 94.557 -5.898 2.456 1.00 1.00 O ATOM 984 OE2 GLU A 69 94.079 -3.878 3.024 1.00 1.00 O ATOM 0 H GLU A 69 95.182 -3.256 -0.974 1.00 1.00 H new ATOM 0 HA GLU A 69 95.214 -6.072 -1.433 1.00 1.00 H new ATOM 0 HB2 GLU A 69 96.139 -6.183 0.781 1.00 1.00 H new ATOM 0 HB3 GLU A 69 96.941 -4.978 -0.206 1.00 1.00 H new ATOM 0 HG2 GLU A 69 96.614 -3.864 1.839 1.00 1.00 H new ATOM 0 HG3 GLU A 69 95.296 -3.272 0.847 1.00 1.00 H new ATOM 991 N LYS A 70 92.728 -4.741 0.141 1.00 1.00 N ATOM 992 CA LYS A 70 91.406 -5.006 0.648 1.00 1.00 C ATOM 993 C LYS A 70 90.686 -5.859 -0.374 1.00 1.00 C ATOM 994 O LYS A 70 90.076 -6.879 -0.051 1.00 1.00 O ATOM 995 CB LYS A 70 90.652 -3.692 0.838 1.00 1.00 C ATOM 996 CG LYS A 70 91.243 -2.912 2.007 1.00 1.00 C ATOM 997 CD LYS A 70 90.894 -3.606 3.345 1.00 1.00 C ATOM 998 CE LYS A 70 91.053 -2.641 4.538 1.00 1.00 C ATOM 999 NZ LYS A 70 89.986 -2.921 5.538 1.00 1.00 N ATOM 0 H LYS A 70 92.948 -3.753 0.016 1.00 1.00 H new ATOM 0 HA LYS A 70 91.461 -5.518 1.609 1.00 1.00 H new ATOM 0 HB2 LYS A 70 90.709 -3.096 -0.073 1.00 1.00 H new ATOM 0 HB3 LYS A 70 89.596 -3.893 1.021 1.00 1.00 H new ATOM 0 HG2 LYS A 70 92.325 -2.842 1.897 1.00 1.00 H new ATOM 0 HG3 LYS A 70 90.856 -1.893 2.006 1.00 1.00 H new ATOM 0 HD2 LYS A 70 89.869 -3.976 3.308 1.00 1.00 H new ATOM 0 HD3 LYS A 70 91.541 -4.472 3.487 1.00 1.00 H new ATOM 0 HE2 LYS A 70 92.036 -2.764 4.993 1.00 1.00 H new ATOM 0 HE3 LYS A 70 90.987 -1.608 4.197 1.00 1.00 H new ATOM 0 HZ1 LYS A 70 90.088 -2.273 6.345 1.00 1.00 H new ATOM 0 HZ2 LYS A 70 89.054 -2.783 5.099 1.00 1.00 H new ATOM 0 HZ3 LYS A 70 90.070 -3.903 5.870 1.00 1.00 H new ATOM 1013 N THR A 71 90.817 -5.446 -1.623 1.00 1.00 N ATOM 1014 CA THR A 71 90.239 -6.176 -2.735 1.00 1.00 C ATOM 1015 C THR A 71 91.065 -7.446 -2.954 1.00 1.00 C ATOM 1016 O THR A 71 90.534 -8.492 -3.326 1.00 1.00 O ATOM 1017 CB THR A 71 90.236 -5.290 -4.000 1.00 1.00 C ATOM 1018 OG1 THR A 71 91.336 -4.402 -3.958 1.00 1.00 O ATOM 1019 CG2 THR A 71 88.930 -4.490 -4.094 1.00 1.00 C ATOM 0 H THR A 71 91.323 -4.602 -1.892 1.00 1.00 H new ATOM 0 HA THR A 71 89.206 -6.449 -2.519 1.00 1.00 H new ATOM 0 HB THR A 71 90.316 -5.931 -4.878 1.00 1.00 H new ATOM 0 HG1 THR A 71 92.170 -4.916 -3.924 1.00 1.00 H new ATOM 0 HG21 THR A 71 88.946 -3.872 -4.991 1.00 1.00 H new ATOM 0 HG22 THR A 71 88.085 -5.177 -4.142 1.00 1.00 H new ATOM 0 HG23 THR A 71 88.830 -3.852 -3.216 1.00 1.00 H new ATOM 1027 N GLY A 72 92.373 -7.344 -2.693 1.00 1.00 N ATOM 1028 CA GLY A 72 93.264 -8.487 -2.836 1.00 1.00 C ATOM 1029 C GLY A 72 93.682 -8.689 -4.281 1.00 1.00 C ATOM 1030 O GLY A 72 94.116 -9.776 -4.663 1.00 1.00 O ATOM 0 H GLY A 72 92.830 -6.486 -2.384 1.00 1.00 H new ATOM 0 HA2 GLY A 72 94.149 -8.339 -2.217 1.00 1.00 H new ATOM 0 HA3 GLY A 72 92.766 -9.385 -2.471 1.00 1.00 H new ATOM 1034 N LYS A 73 93.531 -7.645 -5.092 1.00 1.00 N ATOM 1035 CA LYS A 73 93.884 -7.737 -6.516 1.00 1.00 C ATOM 1036 C LYS A 73 95.168 -6.970 -6.809 1.00 1.00 C ATOM 1037 O LYS A 73 95.205 -5.749 -6.659 1.00 1.00 O ATOM 1038 CB LYS A 73 92.730 -7.167 -7.370 1.00 1.00 C ATOM 1039 CG LYS A 73 91.623 -8.229 -7.620 1.00 1.00 C ATOM 1040 CD LYS A 73 90.435 -7.985 -6.686 1.00 1.00 C ATOM 1041 CE LYS A 73 89.347 -9.020 -6.938 1.00 1.00 C ATOM 1042 NZ LYS A 73 89.873 -10.389 -6.676 1.00 1.00 N ATOM 0 H LYS A 73 93.173 -6.736 -4.799 1.00 1.00 H new ATOM 0 HA LYS A 73 94.046 -8.785 -6.767 1.00 1.00 H new ATOM 0 HB2 LYS A 73 92.298 -6.302 -6.867 1.00 1.00 H new ATOM 0 HB3 LYS A 73 93.122 -6.818 -8.325 1.00 1.00 H new ATOM 0 HG2 LYS A 73 91.294 -8.184 -8.658 1.00 1.00 H new ATOM 0 HG3 LYS A 73 92.025 -9.229 -7.456 1.00 1.00 H new ATOM 0 HD2 LYS A 73 90.763 -8.037 -5.648 1.00 1.00 H new ATOM 0 HD3 LYS A 73 90.038 -6.983 -6.845 1.00 1.00 H new ATOM 0 HE2 LYS A 73 88.490 -8.822 -6.295 1.00 1.00 H new ATOM 0 HE3 LYS A 73 88.996 -8.947 -7.968 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 89.164 -10.938 -6.149 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 90.076 -10.862 -7.580 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 90.747 -10.324 -6.116 1.00 1.00 H new ATOM 1056 N PRO A 74 96.232 -7.647 -7.216 1.00 1.00 N ATOM 1057 CA PRO A 74 97.520 -6.977 -7.505 1.00 1.00 C ATOM 1058 C PRO A 74 97.443 -5.924 -8.602 1.00 1.00 C ATOM 1059 O PRO A 74 96.644 -6.011 -9.535 1.00 1.00 O ATOM 1060 CB PRO A 74 98.463 -8.119 -7.908 1.00 1.00 C ATOM 1061 CG PRO A 74 97.841 -9.347 -7.365 1.00 1.00 C ATOM 1062 CD PRO A 74 96.360 -9.109 -7.436 1.00 1.00 C ATOM 0 HA PRO A 74 97.859 -6.418 -6.633 1.00 1.00 H new ATOM 0 HB2 PRO A 74 98.570 -8.178 -8.991 1.00 1.00 H new ATOM 0 HB3 PRO A 74 99.461 -7.969 -7.497 1.00 1.00 H new ATOM 0 HG2 PRO A 74 98.127 -10.223 -7.948 1.00 1.00 H new ATOM 0 HG3 PRO A 74 98.161 -9.529 -6.339 1.00 1.00 H new ATOM 0 HD2 PRO A 74 95.952 -9.407 -8.402 1.00 1.00 H new ATOM 0 HD3 PRO A 74 95.825 -9.678 -6.675 1.00 1.00 H new ATOM 1070 N ALA A 75 98.330 -4.950 -8.474 1.00 1.00 N ATOM 1071 CA ALA A 75 98.457 -3.858 -9.435 1.00 1.00 C ATOM 1072 C ALA A 75 99.876 -3.895 -9.985 1.00 1.00 C ATOM 1073 O ALA A 75 100.787 -4.324 -9.278 1.00 1.00 O ATOM 1074 CB ALA A 75 98.191 -2.510 -8.756 1.00 1.00 C ATOM 0 H ALA A 75 98.988 -4.892 -7.697 1.00 1.00 H new ATOM 0 HA ALA A 75 97.729 -3.974 -10.237 1.00 1.00 H new ATOM 0 HB1 ALA A 75 98.290 -1.708 -9.488 1.00 1.00 H new ATOM 0 HB2 ALA A 75 97.182 -2.503 -8.344 1.00 1.00 H new ATOM 0 HB3 ALA A 75 98.912 -2.359 -7.952 1.00 1.00 H new ATOM 1080 N THR A 76 100.071 -3.487 -11.243 1.00 1.00 N ATOM 1081 CA THR A 76 101.398 -3.531 -11.848 1.00 1.00 C ATOM 1082 C THR A 76 102.011 -2.150 -11.998 1.00 1.00 C ATOM 1083 O THR A 76 101.441 -1.262 -12.632 1.00 1.00 O ATOM 1084 CB THR A 76 101.293 -4.193 -13.214 1.00 1.00 C ATOM 1085 OG1 THR A 76 102.417 -3.842 -14.006 1.00 1.00 O ATOM 1086 CG2 THR A 76 100.008 -3.723 -13.899 1.00 1.00 C ATOM 0 H THR A 76 99.336 -3.128 -11.852 1.00 1.00 H new ATOM 0 HA THR A 76 102.050 -4.103 -11.188 1.00 1.00 H new ATOM 0 HB THR A 76 101.270 -5.276 -13.096 1.00 1.00 H new ATOM 0 HG1 THR A 76 102.346 -4.272 -14.884 1.00 1.00 H new ATOM 0 HG21 THR A 76 99.925 -4.193 -14.879 1.00 1.00 H new ATOM 0 HG22 THR A 76 99.148 -4.001 -13.289 1.00 1.00 H new ATOM 0 HG23 THR A 76 100.034 -2.640 -14.017 1.00 1.00 H new ATOM 1094 N PHE A 77 103.206 -1.994 -11.433 1.00 1.00 N ATOM 1095 CA PHE A 77 103.931 -0.737 -11.519 1.00 1.00 C ATOM 1096 C PHE A 77 105.352 -1.000 -11.895 1.00 1.00 C ATOM 1097 O PHE A 77 105.947 -1.991 -11.479 1.00 1.00 O ATOM 1098 CB PHE A 77 103.986 -0.021 -10.173 1.00 1.00 C ATOM 1099 CG PHE A 77 102.596 0.210 -9.661 1.00 1.00 C ATOM 1100 CD1 PHE A 77 102.223 -0.357 -8.445 1.00 1.00 C ATOM 1101 CD2 PHE A 77 101.672 0.952 -10.412 1.00 1.00 C ATOM 1102 CE1 PHE A 77 100.921 -0.193 -7.971 1.00 1.00 C ATOM 1103 CE2 PHE A 77 100.377 1.125 -9.935 1.00 1.00 C ATOM 1104 CZ PHE A 77 99.994 0.552 -8.715 1.00 1.00 C ATOM 0 H PHE A 77 103.690 -2.725 -10.911 1.00 1.00 H new ATOM 0 HA PHE A 77 103.409 -0.127 -12.256 1.00 1.00 H new ATOM 0 HB2 PHE A 77 104.552 -0.617 -9.457 1.00 1.00 H new ATOM 0 HB3 PHE A 77 104.507 0.931 -10.278 1.00 1.00 H new ATOM 0 HD1 PHE A 77 102.941 -0.923 -7.870 1.00 1.00 H new ATOM 0 HD2 PHE A 77 101.965 1.387 -11.356 1.00 1.00 H new ATOM 0 HE1 PHE A 77 100.627 -0.639 -7.032 1.00 1.00 H new ATOM 0 HE2 PHE A 77 99.665 1.702 -10.506 1.00 1.00 H new ATOM 0 HZ PHE A 77 98.987 0.684 -8.348 1.00 1.00 H new ATOM 1114 N GLN A 78 105.927 -0.058 -12.589 1.00 1.00 N ATOM 1115 CA GLN A 78 107.326 -0.144 -12.910 1.00 1.00 C ATOM 1116 C GLN A 78 108.030 0.554 -11.781 1.00 1.00 C ATOM 1117 O GLN A 78 107.621 1.642 -11.375 1.00 1.00 O ATOM 1118 CB GLN A 78 107.650 0.511 -14.249 1.00 1.00 C ATOM 1119 CG GLN A 78 107.156 -0.379 -15.396 1.00 1.00 C ATOM 1120 CD GLN A 78 107.849 0.001 -16.695 1.00 1.00 C ATOM 1121 OE1 GLN A 78 107.663 -0.654 -17.722 1.00 1.00 O ATOM 1122 NE2 GLN A 78 108.646 1.021 -16.697 1.00 1.00 N ATOM 0 H GLN A 78 105.453 0.774 -12.942 1.00 1.00 H new ATOM 0 HA GLN A 78 107.644 -1.181 -13.015 1.00 1.00 H new ATOM 0 HB2 GLN A 78 107.178 1.492 -14.308 1.00 1.00 H new ATOM 0 HB3 GLN A 78 108.725 0.669 -14.336 1.00 1.00 H new ATOM 0 HG2 GLN A 78 107.353 -1.426 -15.164 1.00 1.00 H new ATOM 0 HG3 GLN A 78 106.077 -0.274 -15.508 1.00 1.00 H new ATOM 0 HE21 GLN A 78 108.792 1.556 -15.841 1.00 1.00 H new ATOM 0 HE22 GLN A 78 109.128 1.290 -17.555 1.00 1.00 H new ATOM 1131 N VAL A 79 109.032 -0.081 -11.217 1.00 1.00 N ATOM 1132 CA VAL A 79 109.687 0.513 -10.085 1.00 1.00 C ATOM 1133 C VAL A 79 110.214 1.891 -10.450 1.00 1.00 C ATOM 1134 O VAL A 79 110.288 2.766 -9.600 1.00 1.00 O ATOM 1135 CB VAL A 79 110.860 -0.357 -9.607 1.00 1.00 C ATOM 1136 CG1 VAL A 79 111.437 0.233 -8.334 1.00 1.00 C ATOM 1137 CG2 VAL A 79 110.395 -1.771 -9.310 1.00 1.00 C ATOM 0 H VAL A 79 109.400 -0.984 -11.516 1.00 1.00 H new ATOM 0 HA VAL A 79 108.955 0.595 -9.282 1.00 1.00 H new ATOM 0 HB VAL A 79 111.612 -0.383 -10.396 1.00 1.00 H new ATOM 0 HG11 VAL A 79 112.269 -0.382 -7.993 1.00 1.00 H new ATOM 0 HG12 VAL A 79 111.790 1.245 -8.530 1.00 1.00 H new ATOM 0 HG13 VAL A 79 110.666 0.260 -7.564 1.00 1.00 H new ATOM 0 HG21 VAL A 79 111.242 -2.369 -8.973 1.00 1.00 H new ATOM 0 HG22 VAL A 79 109.634 -1.747 -8.530 1.00 1.00 H new ATOM 0 HG23 VAL A 79 109.975 -2.213 -10.213 1.00 1.00 H new ATOM 1141 N SER A 80 110.601 2.080 -11.709 1.00 1.00 N ATOM 1142 CA SER A 80 111.153 3.363 -12.127 1.00 1.00 C ATOM 1143 C SER A 80 110.078 4.439 -12.240 1.00 1.00 C ATOM 1144 O SER A 80 110.371 5.632 -12.156 1.00 1.00 O ATOM 1145 CB SER A 80 111.843 3.209 -13.489 1.00 1.00 C ATOM 1146 OG SER A 80 111.726 4.422 -14.222 1.00 1.00 O ATOM 0 H SER A 80 110.544 1.375 -12.444 1.00 1.00 H new ATOM 0 HA SER A 80 111.868 3.673 -11.365 1.00 1.00 H new ATOM 0 HB2 SER A 80 112.894 2.957 -13.349 1.00 1.00 H new ATOM 0 HB3 SER A 80 111.390 2.390 -14.047 1.00 1.00 H new ATOM 0 HG SER A 80 112.097 4.298 -15.121 1.00 1.00 H new ATOM 1152 N GLN A 81 108.844 4.016 -12.484 1.00 1.00 N ATOM 1153 CA GLN A 81 107.736 4.955 -12.663 1.00 1.00 C ATOM 1154 C GLN A 81 106.840 5.068 -11.421 1.00 1.00 C ATOM 1155 O GLN A 81 105.927 5.891 -11.398 1.00 1.00 O ATOM 1156 CB GLN A 81 106.896 4.508 -13.853 1.00 1.00 C ATOM 1157 CG GLN A 81 107.787 4.126 -15.020 1.00 1.00 C ATOM 1158 CD GLN A 81 108.664 5.306 -15.418 1.00 1.00 C ATOM 1159 OE1 GLN A 81 108.231 6.457 -15.342 1.00 1.00 O ATOM 1160 NE2 GLN A 81 109.878 5.090 -15.845 1.00 1.00 N ATOM 0 H GLN A 81 108.582 3.033 -12.563 1.00 1.00 H new ATOM 0 HA GLN A 81 108.168 5.941 -12.835 1.00 1.00 H new ATOM 0 HB2 GLN A 81 106.275 3.658 -13.569 1.00 1.00 H new ATOM 0 HB3 GLN A 81 106.221 5.310 -14.151 1.00 1.00 H new ATOM 0 HG2 GLN A 81 108.411 3.275 -14.748 1.00 1.00 H new ATOM 0 HG3 GLN A 81 107.176 3.815 -15.867 1.00 1.00 H new ATOM 0 HE21 GLN A 81 110.235 4.136 -15.907 1.00 1.00 H new ATOM 0 HE22 GLN A 81 110.470 5.875 -16.117 1.00 1.00 H new ATOM 1169 N VAL A 82 107.074 4.232 -10.409 1.00 1.00 N ATOM 1170 CA VAL A 82 106.237 4.249 -9.205 1.00 1.00 C ATOM 1171 C VAL A 82 106.625 5.400 -8.277 1.00 1.00 C ATOM 1172 O VAL A 82 107.647 6.052 -8.490 1.00 1.00 O ATOM 1173 CB VAL A 82 106.351 2.868 -8.536 1.00 1.00 C ATOM 1174 CG1 VAL A 82 107.544 2.836 -7.629 1.00 1.00 C ATOM 1175 CG2 VAL A 82 105.123 2.533 -7.717 1.00 1.00 C ATOM 0 H VAL A 82 107.825 3.542 -10.396 1.00 1.00 H new ATOM 0 HA VAL A 82 105.193 4.430 -9.461 1.00 1.00 H new ATOM 0 HB VAL A 82 106.451 2.133 -9.335 1.00 1.00 H new ATOM 0 HG11 VAL A 82 107.618 1.855 -7.159 1.00 1.00 H new ATOM 0 HG12 VAL A 82 108.447 3.030 -8.208 1.00 1.00 H new ATOM 0 HG13 VAL A 82 107.436 3.600 -6.859 1.00 1.00 H new ATOM 0 HG21 VAL A 82 105.246 1.550 -7.263 1.00 1.00 H new ATOM 0 HG22 VAL A 82 104.992 3.281 -6.935 1.00 1.00 H new ATOM 0 HG23 VAL A 82 104.245 2.527 -8.363 1.00 1.00 H new ATOM 1179 N ILE A 83 105.793 5.671 -7.263 1.00 1.00 N ATOM 1180 CA ILE A 83 106.075 6.785 -6.355 1.00 1.00 C ATOM 1181 C ILE A 83 107.509 6.617 -5.833 1.00 1.00 C ATOM 1182 O ILE A 83 107.975 5.486 -5.705 1.00 1.00 O ATOM 1183 CB ILE A 83 105.033 6.836 -5.181 1.00 1.00 C ATOM 1184 CG1 ILE A 83 103.946 5.800 -5.432 1.00 1.00 C ATOM 1185 CG2 ILE A 83 104.360 8.220 -5.098 1.00 1.00 C ATOM 1186 CD1 ILE A 83 102.823 5.929 -4.394 1.00 1.00 C ATOM 0 H ILE A 83 104.942 5.149 -7.055 1.00 1.00 H new ATOM 0 HA ILE A 83 105.987 7.734 -6.885 1.00 1.00 H new ATOM 0 HB ILE A 83 105.562 6.635 -4.249 1.00 1.00 H new ATOM 0 HG12 ILE A 83 103.538 5.929 -6.434 1.00 1.00 H new ATOM 0 HG13 ILE A 83 104.374 4.799 -5.389 1.00 1.00 H new ATOM 0 HG21 ILE A 83 103.643 8.227 -4.277 1.00 1.00 H new ATOM 0 HG22 ILE A 83 105.118 8.984 -4.925 1.00 1.00 H new ATOM 0 HG23 ILE A 83 103.842 8.429 -6.034 1.00 1.00 H new ATOM 0 HD11 ILE A 83 102.057 5.179 -4.592 1.00 1.00 H new ATOM 0 HD12 ILE A 83 103.231 5.776 -3.395 1.00 1.00 H new ATOM 0 HD13 ILE A 83 102.382 6.924 -4.457 1.00 1.00 H new ATOM 1193 N PRO A 84 108.238 7.686 -5.574 1.00 1.00 N ATOM 1194 CA PRO A 84 109.655 7.570 -5.110 1.00 1.00 C ATOM 1195 C PRO A 84 109.810 6.619 -3.938 1.00 1.00 C ATOM 1196 O PRO A 84 110.749 5.824 -3.886 1.00 1.00 O ATOM 1197 CB PRO A 84 110.010 8.993 -4.672 1.00 1.00 C ATOM 1198 CG PRO A 84 109.122 9.883 -5.469 1.00 1.00 C ATOM 1199 CD PRO A 84 107.827 9.107 -5.674 1.00 1.00 C ATOM 0 HA PRO A 84 110.298 7.171 -5.895 1.00 1.00 H new ATOM 0 HB2 PRO A 84 109.845 9.128 -3.603 1.00 1.00 H new ATOM 0 HB3 PRO A 84 111.060 9.213 -4.863 1.00 1.00 H new ATOM 0 HG2 PRO A 84 108.937 10.821 -4.945 1.00 1.00 H new ATOM 0 HG3 PRO A 84 109.580 10.137 -6.425 1.00 1.00 H new ATOM 0 HD2 PRO A 84 107.085 9.362 -4.917 1.00 1.00 H new ATOM 0 HD3 PRO A 84 107.380 9.326 -6.644 1.00 1.00 H new ATOM 1207 N GLY A 85 108.902 6.721 -2.989 1.00 1.00 N ATOM 1208 CA GLY A 85 108.986 5.870 -1.819 1.00 1.00 C ATOM 1209 C GLY A 85 108.939 4.407 -2.209 1.00 1.00 C ATOM 1210 O GLY A 85 109.732 3.585 -1.750 1.00 1.00 O ATOM 0 H GLY A 85 108.114 7.369 -3.002 1.00 1.00 H new ATOM 0 HA2 GLY A 85 109.910 6.077 -1.280 1.00 1.00 H new ATOM 0 HA3 GLY A 85 108.164 6.096 -1.140 1.00 1.00 H new ATOM 1214 N TRP A 86 107.983 4.112 -3.059 1.00 1.00 N ATOM 1215 CA TRP A 86 107.764 2.764 -3.555 1.00 1.00 C ATOM 1216 C TRP A 86 108.941 2.309 -4.434 1.00 1.00 C ATOM 1217 O TRP A 86 109.265 1.131 -4.488 1.00 1.00 O ATOM 1218 CB TRP A 86 106.462 2.777 -4.366 1.00 1.00 C ATOM 1219 CG TRP A 86 105.257 2.497 -3.523 1.00 1.00 C ATOM 1220 CD1 TRP A 86 104.751 3.278 -2.553 1.00 1.00 C ATOM 1221 CD2 TRP A 86 104.362 1.388 -3.642 1.00 1.00 C ATOM 1222 NE1 TRP A 86 103.621 2.685 -2.037 1.00 1.00 N ATOM 1223 CE2 TRP A 86 103.337 1.510 -2.685 1.00 1.00 C ATOM 1224 CE3 TRP A 86 104.364 0.293 -4.479 1.00 1.00 C ATOM 1225 CZ2 TRP A 86 102.338 0.558 -2.571 1.00 1.00 C ATOM 1226 CZ3 TRP A 86 103.362 -0.659 -4.385 1.00 1.00 C ATOM 1227 CH2 TRP A 86 102.345 -0.535 -3.430 1.00 1.00 C ATOM 0 H TRP A 86 107.329 4.801 -3.431 1.00 1.00 H new ATOM 0 HA TRP A 86 107.690 2.063 -2.724 1.00 1.00 H new ATOM 0 HB2 TRP A 86 106.347 3.749 -4.847 1.00 1.00 H new ATOM 0 HB3 TRP A 86 106.526 2.034 -5.161 1.00 1.00 H new ATOM 0 HD1 TRP A 86 105.165 4.221 -2.230 1.00 1.00 H new ATOM 0 HE1 TRP A 86 103.067 3.070 -1.272 1.00 1.00 H new ATOM 0 HE3 TRP A 86 105.150 0.177 -5.211 1.00 1.00 H new ATOM 0 HZ2 TRP A 86 101.564 0.663 -1.825 1.00 1.00 H new ATOM 0 HZ3 TRP A 86 103.365 -1.506 -5.055 1.00 1.00 H new ATOM 0 HH2 TRP A 86 101.570 -1.284 -3.361 1.00 1.00 H new ATOM 1238 N THR A 87 109.562 3.240 -5.138 1.00 1.00 N ATOM 1239 CA THR A 87 110.670 2.902 -6.025 1.00 1.00 C ATOM 1240 C THR A 87 111.739 2.069 -5.309 1.00 1.00 C ATOM 1241 O THR A 87 112.118 0.995 -5.778 1.00 1.00 O ATOM 1242 CB THR A 87 111.304 4.206 -6.526 1.00 1.00 C ATOM 1243 OG1 THR A 87 110.290 5.034 -7.078 1.00 1.00 O ATOM 1244 CG2 THR A 87 112.367 3.927 -7.598 1.00 1.00 C ATOM 0 H THR A 87 109.322 4.231 -5.116 1.00 1.00 H new ATOM 0 HA THR A 87 110.282 2.307 -6.852 1.00 1.00 H new ATOM 0 HB THR A 87 111.785 4.703 -5.684 1.00 1.00 H new ATOM 0 HG1 THR A 87 109.609 5.215 -6.397 1.00 1.00 H new ATOM 0 HG21 THR A 87 112.800 4.869 -7.935 1.00 1.00 H new ATOM 0 HG22 THR A 87 113.151 3.297 -7.178 1.00 1.00 H new ATOM 0 HG23 THR A 87 111.906 3.416 -8.443 1.00 1.00 H new ATOM 1252 N GLU A 88 112.236 2.578 -4.193 1.00 1.00 N ATOM 1253 CA GLU A 88 113.285 1.894 -3.440 1.00 1.00 C ATOM 1254 C GLU A 88 112.792 0.653 -2.696 1.00 1.00 C ATOM 1255 O GLU A 88 113.507 -0.342 -2.609 1.00 1.00 O ATOM 1256 CB GLU A 88 113.910 2.875 -2.444 1.00 1.00 C ATOM 1257 CG GLU A 88 115.138 2.234 -1.790 1.00 1.00 C ATOM 1258 CD GLU A 88 115.784 3.213 -0.814 1.00 1.00 C ATOM 1259 OE1 GLU A 88 116.864 2.912 -0.334 1.00 1.00 O ATOM 1260 OE2 GLU A 88 115.195 4.252 -0.569 1.00 1.00 O ATOM 0 H GLU A 88 111.932 3.462 -3.785 1.00 1.00 H new ATOM 0 HA GLU A 88 114.022 1.548 -4.165 1.00 1.00 H new ATOM 0 HB2 GLU A 88 114.196 3.794 -2.955 1.00 1.00 H new ATOM 0 HB3 GLU A 88 113.181 3.148 -1.681 1.00 1.00 H new ATOM 0 HG2 GLU A 88 114.847 1.324 -1.265 1.00 1.00 H new ATOM 0 HG3 GLU A 88 115.857 1.944 -2.556 1.00 1.00 H new ATOM 1267 N ALA A 89 111.606 0.738 -2.108 1.00 1.00 N ATOM 1268 CA ALA A 89 111.072 -0.364 -1.307 1.00 1.00 C ATOM 1269 C ALA A 89 110.878 -1.674 -2.080 1.00 1.00 C ATOM 1270 O ALA A 89 111.188 -2.747 -1.565 1.00 1.00 O ATOM 1271 CB ALA A 89 109.732 0.046 -0.719 1.00 1.00 C ATOM 0 H ALA A 89 110.995 1.553 -2.168 1.00 1.00 H new ATOM 0 HA ALA A 89 111.818 -0.559 -0.537 1.00 1.00 H new ATOM 0 HB1 ALA A 89 109.331 -0.773 -0.121 1.00 1.00 H new ATOM 0 HB2 ALA A 89 109.865 0.925 -0.088 1.00 1.00 H new ATOM 0 HB3 ALA A 89 109.037 0.281 -1.525 1.00 1.00 H new ATOM 1277 N LEU A 90 110.330 -1.596 -3.283 1.00 1.00 N ATOM 1278 CA LEU A 90 110.067 -2.807 -4.062 1.00 1.00 C ATOM 1279 C LEU A 90 111.358 -3.578 -4.292 1.00 1.00 C ATOM 1280 O LEU A 90 111.390 -4.805 -4.208 1.00 1.00 O ATOM 1281 CB LEU A 90 109.482 -2.419 -5.417 1.00 1.00 C ATOM 1282 CG LEU A 90 108.178 -1.641 -5.224 1.00 1.00 C ATOM 1283 CD1 LEU A 90 107.839 -0.937 -6.531 1.00 1.00 C ATOM 1284 CD2 LEU A 90 107.043 -2.582 -4.841 1.00 1.00 C ATOM 0 H LEU A 90 110.061 -0.725 -3.740 1.00 1.00 H new ATOM 0 HA LEU A 90 109.365 -3.432 -3.510 1.00 1.00 H new ATOM 0 HB2 LEU A 90 110.198 -1.812 -5.971 1.00 1.00 H new ATOM 0 HB3 LEU A 90 109.296 -3.314 -6.011 1.00 1.00 H new ATOM 0 HG LEU A 90 108.305 -0.914 -4.422 1.00 1.00 H new ATOM 0 HD11 LEU A 90 106.912 -0.377 -6.413 1.00 1.00 H new ATOM 0 HD12 LEU A 90 108.645 -0.253 -6.795 1.00 1.00 H new ATOM 0 HD13 LEU A 90 107.717 -1.677 -7.322 1.00 1.00 H new ATOM 0 HD21 LEU A 90 106.125 -2.010 -4.708 1.00 1.00 H new ATOM 0 HD22 LEU A 90 106.900 -3.320 -5.631 1.00 1.00 H new ATOM 0 HD23 LEU A 90 107.291 -3.091 -3.910 1.00 1.00 H new ATOM 1296 N GLN A 91 112.414 -2.839 -4.591 1.00 1.00 N ATOM 1297 CA GLN A 91 113.715 -3.430 -4.846 1.00 1.00 C ATOM 1298 C GLN A 91 114.243 -4.108 -3.594 1.00 1.00 C ATOM 1299 O GLN A 91 115.094 -4.994 -3.659 1.00 1.00 O ATOM 1300 CB GLN A 91 114.692 -2.336 -5.258 1.00 1.00 C ATOM 1301 CG GLN A 91 114.098 -1.521 -6.407 1.00 1.00 C ATOM 1302 CD GLN A 91 115.037 -0.373 -6.767 1.00 1.00 C ATOM 1303 OE1 GLN A 91 116.254 -0.554 -6.801 1.00 1.00 O ATOM 1304 NE2 GLN A 91 114.539 0.799 -7.053 1.00 1.00 N ATOM 0 H GLN A 91 112.393 -1.822 -4.663 1.00 1.00 H new ATOM 0 HA GLN A 91 113.614 -4.169 -5.641 1.00 1.00 H new ATOM 0 HB2 GLN A 91 114.904 -1.686 -4.409 1.00 1.00 H new ATOM 0 HB3 GLN A 91 115.640 -2.778 -5.565 1.00 1.00 H new ATOM 0 HG2 GLN A 91 113.941 -2.161 -7.276 1.00 1.00 H new ATOM 0 HG3 GLN A 91 113.122 -1.129 -6.120 1.00 1.00 H new ATOM 0 HE21 GLN A 91 113.530 0.945 -7.024 1.00 1.00 H new ATOM 0 HE22 GLN A 91 115.159 1.569 -7.306 1.00 1.00 H new ATOM 1313 N LEU A 92 113.756 -3.662 -2.442 1.00 1.00 N ATOM 1314 CA LEU A 92 114.206 -4.214 -1.164 1.00 1.00 C ATOM 1315 C LEU A 92 113.228 -5.231 -0.618 1.00 1.00 C ATOM 1316 O LEU A 92 113.573 -5.973 0.292 1.00 1.00 O ATOM 1317 CB LEU A 92 114.376 -3.095 -0.137 1.00 1.00 C ATOM 1318 CG LEU A 92 115.407 -2.068 -0.614 1.00 1.00 C ATOM 1319 CD1 LEU A 92 115.460 -0.933 0.391 1.00 1.00 C ATOM 1320 CD2 LEU A 92 116.790 -2.709 -0.746 1.00 1.00 C ATOM 0 H LEU A 92 113.055 -2.925 -2.363 1.00 1.00 H new ATOM 0 HA LEU A 92 115.160 -4.709 -1.344 1.00 1.00 H new ATOM 0 HB2 LEU A 92 113.418 -2.603 0.033 1.00 1.00 H new ATOM 0 HB3 LEU A 92 114.691 -3.517 0.817 1.00 1.00 H new ATOM 0 HG LEU A 92 115.114 -1.691 -1.594 1.00 1.00 H new ATOM 0 HD11 LEU A 92 116.191 -0.192 0.065 1.00 1.00 H new ATOM 0 HD12 LEU A 92 114.478 -0.466 0.465 1.00 1.00 H new ATOM 0 HD13 LEU A 92 115.750 -1.324 1.366 1.00 1.00 H new ATOM 0 HD21 LEU A 92 117.507 -1.961 -1.086 1.00 1.00 H new ATOM 0 HD22 LEU A 92 117.104 -3.099 0.222 1.00 1.00 H new ATOM 0 HD23 LEU A 92 116.746 -3.524 -1.468 1.00 1.00 H new ATOM 1332 N MET A 93 112.014 -5.261 -1.163 1.00 1.00 N ATOM 1333 CA MET A 93 110.999 -6.204 -0.693 1.00 1.00 C ATOM 1334 C MET A 93 111.035 -7.532 -1.488 1.00 1.00 C ATOM 1335 O MET A 93 110.616 -7.556 -2.646 1.00 1.00 O ATOM 1336 CB MET A 93 109.618 -5.563 -0.851 1.00 1.00 C ATOM 1337 CG MET A 93 108.540 -6.593 -0.519 1.00 1.00 C ATOM 1338 SD MET A 93 106.951 -5.756 -0.269 1.00 1.00 S ATOM 1339 CE MET A 93 106.567 -5.395 -2.003 1.00 1.00 C ATOM 0 H MET A 93 111.710 -4.651 -1.922 1.00 1.00 H new ATOM 0 HA MET A 93 111.205 -6.433 0.352 1.00 1.00 H new ATOM 0 HB2 MET A 93 109.528 -4.700 -0.191 1.00 1.00 H new ATOM 0 HB3 MET A 93 109.488 -5.200 -1.870 1.00 1.00 H new ATOM 0 HG2 MET A 93 108.456 -7.319 -1.327 1.00 1.00 H new ATOM 0 HG3 MET A 93 108.816 -7.146 0.379 1.00 1.00 H new ATOM 0 HE1 MET A 93 106.490 -4.317 -2.142 1.00 1.00 H new ATOM 0 HE2 MET A 93 107.359 -5.788 -2.640 1.00 1.00 H new ATOM 0 HE3 MET A 93 105.620 -5.863 -2.271 1.00 1.00 H new ATOM 1349 N PRO A 94 111.485 -8.639 -0.905 1.00 1.00 N ATOM 1350 CA PRO A 94 111.509 -9.968 -1.603 1.00 1.00 C ATOM 1351 C PRO A 94 110.108 -10.484 -1.962 1.00 1.00 C ATOM 1352 O PRO A 94 109.134 -10.206 -1.272 1.00 1.00 O ATOM 1353 CB PRO A 94 112.192 -10.906 -0.597 1.00 1.00 C ATOM 1354 CG PRO A 94 112.876 -10.022 0.386 1.00 1.00 C ATOM 1355 CD PRO A 94 112.028 -8.773 0.461 1.00 1.00 C ATOM 0 HA PRO A 94 112.030 -9.902 -2.558 1.00 1.00 H new ATOM 0 HB2 PRO A 94 111.462 -11.548 -0.103 1.00 1.00 H new ATOM 0 HB3 PRO A 94 112.906 -11.561 -1.096 1.00 1.00 H new ATOM 0 HG2 PRO A 94 112.953 -10.504 1.361 1.00 1.00 H new ATOM 0 HG3 PRO A 94 113.891 -9.789 0.065 1.00 1.00 H new ATOM 0 HD2 PRO A 94 111.233 -8.872 1.200 1.00 1.00 H new ATOM 0 HD3 PRO A 94 112.620 -7.903 0.744 1.00 1.00 H new ATOM 1363 N ALA A 95 110.012 -11.232 -3.049 1.00 1.00 N ATOM 1364 CA ALA A 95 108.721 -11.764 -3.460 1.00 1.00 C ATOM 1365 C ALA A 95 108.173 -12.709 -2.414 1.00 1.00 C ATOM 1366 O ALA A 95 108.883 -13.566 -1.888 1.00 1.00 O ATOM 1367 CB ALA A 95 108.812 -12.461 -4.808 1.00 1.00 C ATOM 0 H ALA A 95 110.795 -11.482 -3.653 1.00 1.00 H new ATOM 0 HA ALA A 95 108.036 -10.922 -3.562 1.00 1.00 H new ATOM 0 HB1 ALA A 95 107.831 -12.847 -5.085 1.00 1.00 H new ATOM 0 HB2 ALA A 95 109.149 -11.751 -5.563 1.00 1.00 H new ATOM 0 HB3 ALA A 95 109.521 -13.286 -4.744 1.00 1.00 H new ATOM 1373 N GLY A 96 106.899 -12.516 -2.100 1.00 1.00 N ATOM 1374 CA GLY A 96 106.237 -13.317 -1.092 1.00 1.00 C ATOM 1375 C GLY A 96 106.350 -12.609 0.245 1.00 1.00 C ATOM 1376 O GLY A 96 105.661 -12.942 1.208 1.00 1.00 O ATOM 0 H GLY A 96 106.306 -11.808 -2.533 1.00 1.00 H new ATOM 0 HA2 GLY A 96 105.189 -13.464 -1.354 1.00 1.00 H new ATOM 0 HA3 GLY A 96 106.693 -14.305 -1.036 1.00 1.00 H new ATOM 1380 N SER A 97 107.234 -11.611 0.290 1.00 1.00 N ATOM 1381 CA SER A 97 107.440 -10.840 1.505 1.00 1.00 C ATOM 1382 C SER A 97 106.511 -9.636 1.516 1.00 1.00 C ATOM 1383 O SER A 97 106.528 -8.814 0.601 1.00 1.00 O ATOM 1384 CB SER A 97 108.900 -10.385 1.583 1.00 1.00 C ATOM 1385 OG SER A 97 109.201 -9.961 2.906 1.00 1.00 O ATOM 0 H SER A 97 107.813 -11.323 -0.499 1.00 1.00 H new ATOM 0 HA SER A 97 107.216 -11.462 2.371 1.00 1.00 H new ATOM 0 HB2 SER A 97 109.561 -11.202 1.294 1.00 1.00 H new ATOM 0 HB3 SER A 97 109.075 -9.570 0.881 1.00 1.00 H new ATOM 0 HG SER A 97 108.371 -9.878 3.420 1.00 1.00 H new ATOM 1391 N THR A 98 105.689 -9.545 2.563 1.00 1.00 N ATOM 1392 CA THR A 98 104.738 -8.445 2.695 1.00 1.00 C ATOM 1393 C THR A 98 105.302 -7.367 3.583 1.00 1.00 C ATOM 1394 O THR A 98 105.560 -7.590 4.764 1.00 1.00 O ATOM 1395 CB THR A 98 103.416 -8.939 3.276 1.00 1.00 C ATOM 1396 OG1 THR A 98 102.902 -9.982 2.458 1.00 1.00 O ATOM 1397 CG2 THR A 98 102.430 -7.784 3.292 1.00 1.00 C ATOM 0 H THR A 98 105.664 -10.219 3.329 1.00 1.00 H new ATOM 0 HA THR A 98 104.558 -8.037 1.701 1.00 1.00 H new ATOM 0 HB THR A 98 103.571 -9.314 4.288 1.00 1.00 H new ATOM 0 HG1 THR A 98 102.054 -10.302 2.830 1.00 1.00 H new ATOM 0 HG21 THR A 98 101.480 -8.122 3.705 1.00 1.00 H new ATOM 0 HG22 THR A 98 102.826 -6.976 3.907 1.00 1.00 H new ATOM 0 HG23 THR A 98 102.276 -7.423 2.275 1.00 1.00 H new ATOM 1405 N TRP A 99 105.534 -6.199 2.997 1.00 1.00 N ATOM 1406 CA TRP A 99 106.107 -5.079 3.732 1.00 1.00 C ATOM 1407 C TRP A 99 105.125 -3.922 3.814 1.00 1.00 C ATOM 1408 O TRP A 99 104.140 -3.857 3.078 1.00 1.00 O ATOM 1409 CB TRP A 99 107.363 -4.546 3.027 1.00 1.00 C ATOM 1410 CG TRP A 99 108.528 -5.495 3.104 1.00 1.00 C ATOM 1411 CD1 TRP A 99 108.494 -6.825 3.384 1.00 1.00 C ATOM 1412 CD2 TRP A 99 109.923 -5.165 2.898 1.00 1.00 C ATOM 1413 NE1 TRP A 99 109.775 -7.329 3.354 1.00 1.00 N ATOM 1414 CE2 TRP A 99 110.700 -6.339 3.061 1.00 1.00 C ATOM 1415 CE3 TRP A 99 110.580 -3.961 2.587 1.00 1.00 C ATOM 1416 CZ2 TRP A 99 112.084 -6.317 2.916 1.00 1.00 C ATOM 1417 CZ3 TRP A 99 111.975 -3.935 2.445 1.00 1.00 C ATOM 1418 CH2 TRP A 99 112.726 -5.110 2.610 1.00 1.00 C ATOM 0 H TRP A 99 105.334 -6.003 2.016 1.00 1.00 H new ATOM 0 HA TRP A 99 106.350 -5.451 4.728 1.00 1.00 H new ATOM 0 HB2 TRP A 99 107.130 -4.350 1.980 1.00 1.00 H new ATOM 0 HB3 TRP A 99 107.647 -3.593 3.474 1.00 1.00 H new ATOM 0 HD1 TRP A 99 107.602 -7.396 3.597 1.00 1.00 H new ATOM 0 HE1 TRP A 99 110.013 -8.306 3.525 1.00 1.00 H new ATOM 0 HE3 TRP A 99 110.009 -3.054 2.457 1.00 1.00 H new ATOM 0 HZ2 TRP A 99 112.659 -7.223 3.038 1.00 1.00 H new ATOM 0 HZ3 TRP A 99 112.474 -3.007 2.208 1.00 1.00 H new ATOM 0 HH2 TRP A 99 113.800 -5.083 2.501 1.00 1.00 H new ATOM 1429 N GLU A 100 105.471 -2.974 4.672 1.00 1.00 N ATOM 1430 CA GLU A 100 104.719 -1.741 4.839 1.00 1.00 C ATOM 1431 C GLU A 100 105.711 -0.617 4.716 1.00 1.00 C ATOM 1432 O GLU A 100 106.785 -0.693 5.306 1.00 1.00 O ATOM 1433 CB GLU A 100 104.039 -1.655 6.211 1.00 1.00 C ATOM 1434 CG GLU A 100 102.753 -2.475 6.203 1.00 1.00 C ATOM 1435 CD GLU A 100 102.139 -2.508 7.598 1.00 1.00 C ATOM 1436 OE1 GLU A 100 101.135 -3.181 7.765 1.00 1.00 O ATOM 1437 OE2 GLU A 100 102.680 -1.861 8.478 1.00 1.00 O ATOM 0 H GLU A 100 106.289 -3.040 5.277 1.00 1.00 H new ATOM 0 HA GLU A 100 103.930 -1.693 4.088 1.00 1.00 H new ATOM 0 HB2 GLU A 100 104.712 -2.025 6.984 1.00 1.00 H new ATOM 0 HB3 GLU A 100 103.817 -0.616 6.452 1.00 1.00 H new ATOM 0 HG2 GLU A 100 102.044 -2.045 5.496 1.00 1.00 H new ATOM 0 HG3 GLU A 100 102.963 -3.490 5.866 1.00 1.00 H new ATOM 1444 N ILE A 101 105.377 0.424 3.961 1.00 1.00 N ATOM 1445 CA ILE A 101 106.289 1.541 3.802 1.00 1.00 C ATOM 1446 C ILE A 101 105.553 2.834 4.048 1.00 1.00 C ATOM 1447 O ILE A 101 104.396 3.002 3.667 1.00 1.00 O ATOM 1448 CB ILE A 101 106.997 1.483 2.440 1.00 1.00 C ATOM 1449 CG1 ILE A 101 106.163 2.101 1.311 1.00 1.00 C ATOM 1450 CG2 ILE A 101 107.253 0.007 2.125 1.00 1.00 C ATOM 1451 CD1 ILE A 101 106.994 2.094 0.033 1.00 1.00 C ATOM 0 H ILE A 101 104.494 0.514 3.458 1.00 1.00 H new ATOM 0 HA ILE A 101 107.084 1.481 4.546 1.00 1.00 H new ATOM 0 HB ILE A 101 107.920 2.060 2.501 1.00 1.00 H new ATOM 0 HG12 ILE A 101 105.243 1.535 1.167 1.00 1.00 H new ATOM 0 HG13 ILE A 101 105.874 3.120 1.569 1.00 1.00 H new ATOM 0 HG21 ILE A 101 107.756 -0.078 1.162 1.00 1.00 H new ATOM 0 HG22 ILE A 101 107.882 -0.427 2.902 1.00 1.00 H new ATOM 0 HG23 ILE A 101 106.303 -0.527 2.086 1.00 1.00 H new ATOM 0 HD11 ILE A 101 106.414 2.531 -0.780 1.00 1.00 H new ATOM 0 HD12 ILE A 101 107.902 2.678 0.186 1.00 1.00 H new ATOM 0 HD13 ILE A 101 107.261 1.068 -0.222 1.00 1.00 H new ATOM 1458 N TYR A 102 106.234 3.723 4.743 1.00 1.00 N ATOM 1459 CA TYR A 102 105.680 4.999 5.127 1.00 1.00 C ATOM 1460 C TYR A 102 106.400 6.033 4.294 1.00 1.00 C ATOM 1461 O TYR A 102 107.577 6.317 4.516 1.00 1.00 O ATOM 1462 CB TYR A 102 105.938 5.220 6.628 1.00 1.00 C ATOM 1463 CG TYR A 102 105.410 4.044 7.461 1.00 1.00 C ATOM 1464 CD1 TYR A 102 105.825 2.726 7.196 1.00 1.00 C ATOM 1465 CD2 TYR A 102 104.517 4.269 8.520 1.00 1.00 C ATOM 1466 CE1 TYR A 102 105.360 1.664 7.964 1.00 1.00 C ATOM 1467 CE2 TYR A 102 104.048 3.196 9.293 1.00 1.00 C ATOM 1468 CZ TYR A 102 104.470 1.893 9.014 1.00 1.00 C ATOM 1469 OH TYR A 102 104.017 0.837 9.778 1.00 1.00 O ATOM 0 H TYR A 102 107.193 3.576 5.058 1.00 1.00 H new ATOM 0 HA TYR A 102 104.604 5.058 4.962 1.00 1.00 H new ATOM 0 HB2 TYR A 102 107.007 5.341 6.802 1.00 1.00 H new ATOM 0 HB3 TYR A 102 105.456 6.143 6.951 1.00 1.00 H new ATOM 0 HD1 TYR A 102 106.514 2.537 6.386 1.00 1.00 H new ATOM 0 HD2 TYR A 102 104.189 5.274 8.741 1.00 1.00 H new ATOM 0 HE1 TYR A 102 105.689 0.658 7.747 1.00 1.00 H new ATOM 0 HE2 TYR A 102 103.360 3.377 10.105 1.00 1.00 H new ATOM 0 HH TYR A 102 103.642 0.147 9.192 1.00 1.00 H new ATOM 1479 N VAL A 103 105.711 6.514 3.262 1.00 1.00 N ATOM 1480 CA VAL A 103 106.314 7.427 2.306 1.00 1.00 C ATOM 1481 C VAL A 103 106.172 8.901 2.645 1.00 1.00 C ATOM 1482 O VAL A 103 105.068 9.441 2.618 1.00 1.00 O ATOM 1483 CB VAL A 103 105.709 7.230 0.927 1.00 1.00 C ATOM 1484 CG1 VAL A 103 106.555 7.988 -0.096 1.00 1.00 C ATOM 1485 CG2 VAL A 103 105.694 5.748 0.580 1.00 1.00 C ATOM 0 H VAL A 103 104.736 6.284 3.070 1.00 1.00 H new ATOM 0 HA VAL A 103 107.375 7.179 2.337 1.00 1.00 H new ATOM 0 HB VAL A 103 104.687 7.608 0.915 1.00 1.00 H new ATOM 0 HG11 VAL A 103 106.130 7.854 -1.091 1.00 1.00 H new ATOM 0 HG12 VAL A 103 106.565 9.049 0.154 1.00 1.00 H new ATOM 0 HG13 VAL A 103 107.575 7.603 -0.082 1.00 1.00 H new ATOM 0 HG21 VAL A 103 105.259 5.611 -0.410 1.00 1.00 H new ATOM 0 HG22 VAL A 103 106.714 5.363 0.585 1.00 1.00 H new ATOM 0 HG23 VAL A 103 105.098 5.208 1.316 1.00 1.00 H new ATOM 1489 N PRO A 104 107.267 9.583 2.886 1.00 1.00 N ATOM 1490 CA PRO A 104 107.230 11.042 3.145 1.00 1.00 C ATOM 1491 C PRO A 104 106.420 11.737 2.050 1.00 1.00 C ATOM 1492 O PRO A 104 106.458 11.327 0.890 1.00 1.00 O ATOM 1493 CB PRO A 104 108.708 11.458 3.075 1.00 1.00 C ATOM 1494 CG PRO A 104 109.499 10.218 3.377 1.00 1.00 C ATOM 1495 CD PRO A 104 108.637 9.040 2.964 1.00 1.00 C ATOM 0 HA PRO A 104 106.766 11.305 4.096 1.00 1.00 H new ATOM 0 HB2 PRO A 104 108.957 11.850 2.089 1.00 1.00 H new ATOM 0 HB3 PRO A 104 108.927 12.246 3.796 1.00 1.00 H new ATOM 0 HG2 PRO A 104 110.442 10.218 2.831 1.00 1.00 H new ATOM 0 HG3 PRO A 104 109.745 10.165 4.438 1.00 1.00 H new ATOM 0 HD2 PRO A 104 108.956 8.634 2.004 1.00 1.00 H new ATOM 0 HD3 PRO A 104 108.700 8.230 3.690 1.00 1.00 H new ATOM 1503 N SER A 105 105.673 12.765 2.417 1.00 1.00 N ATOM 1504 CA SER A 105 104.852 13.463 1.442 1.00 1.00 C ATOM 1505 C SER A 105 105.691 13.917 0.246 1.00 1.00 C ATOM 1506 O SER A 105 105.177 14.032 -0.867 1.00 1.00 O ATOM 1507 CB SER A 105 104.181 14.673 2.092 1.00 1.00 C ATOM 1508 OG SER A 105 105.123 15.730 2.209 1.00 1.00 O ATOM 0 H SER A 105 105.618 13.130 3.368 1.00 1.00 H new ATOM 0 HA SER A 105 104.087 12.773 1.085 1.00 1.00 H new ATOM 0 HB2 SER A 105 103.329 14.995 1.493 1.00 1.00 H new ATOM 0 HB3 SER A 105 103.796 14.404 3.076 1.00 1.00 H new ATOM 0 HG SER A 105 104.693 16.507 2.624 1.00 1.00 H new ATOM 1514 N GLY A 106 106.983 14.159 0.471 1.00 1.00 N ATOM 1515 CA GLY A 106 107.863 14.580 -0.609 1.00 1.00 C ATOM 1516 C GLY A 106 108.143 13.418 -1.538 1.00 1.00 C ATOM 1517 O GLY A 106 108.398 13.598 -2.729 1.00 1.00 O ATOM 0 H GLY A 106 107.435 14.071 1.381 1.00 1.00 H new ATOM 0 HA2 GLY A 106 107.403 15.397 -1.165 1.00 1.00 H new ATOM 0 HA3 GLY A 106 108.798 14.960 -0.198 1.00 1.00 H new ATOM 1521 N LEU A 107 108.116 12.216 -0.969 1.00 1.00 N ATOM 1522 CA LEU A 107 108.385 11.003 -1.727 1.00 1.00 C ATOM 1523 C LEU A 107 107.088 10.281 -2.092 1.00 1.00 C ATOM 1524 O LEU A 107 107.132 9.195 -2.657 1.00 1.00 O ATOM 1525 CB LEU A 107 109.252 10.044 -0.895 1.00 1.00 C ATOM 1526 CG LEU A 107 110.575 10.698 -0.458 1.00 1.00 C ATOM 1527 CD1 LEU A 107 111.483 9.620 0.123 1.00 1.00 C ATOM 1528 CD2 LEU A 107 111.282 11.374 -1.637 1.00 1.00 C ATOM 0 H LEU A 107 107.910 12.058 0.017 1.00 1.00 H new ATOM 0 HA LEU A 107 108.905 11.294 -2.639 1.00 1.00 H new ATOM 0 HB2 LEU A 107 108.696 9.725 -0.013 1.00 1.00 H new ATOM 0 HB3 LEU A 107 109.465 9.149 -1.479 1.00 1.00 H new ATOM 0 HG LEU A 107 110.356 11.463 0.287 1.00 1.00 H new ATOM 0 HD11 LEU A 107 112.425 10.069 0.437 1.00 1.00 H new ATOM 0 HD12 LEU A 107 110.996 9.159 0.982 1.00 1.00 H new ATOM 0 HD13 LEU A 107 111.678 8.861 -0.635 1.00 1.00 H new ATOM 0 HD21 LEU A 107 112.213 11.826 -1.293 1.00 1.00 H new ATOM 0 HD22 LEU A 107 111.501 10.631 -2.404 1.00 1.00 H new ATOM 0 HD23 LEU A 107 110.636 12.147 -2.054 1.00 1.00 H new ATOM 1540 N ALA A 108 105.934 10.855 -1.728 1.00 1.00 N ATOM 1541 CA ALA A 108 104.645 10.216 -2.004 1.00 1.00 C ATOM 1542 C ALA A 108 103.851 10.973 -3.069 1.00 1.00 C ATOM 1543 O ALA A 108 104.185 10.923 -4.247 1.00 1.00 O ATOM 1544 CB ALA A 108 103.809 10.140 -0.727 1.00 1.00 C ATOM 0 H ALA A 108 105.868 11.752 -1.247 1.00 1.00 H new ATOM 0 HA ALA A 108 104.857 9.214 -2.376 1.00 1.00 H new ATOM 0 HB1 ALA A 108 102.854 9.663 -0.945 1.00 1.00 H new ATOM 0 HB2 ALA A 108 104.343 9.556 0.023 1.00 1.00 H new ATOM 0 HB3 ALA A 108 103.634 11.146 -0.346 1.00 1.00 H new ATOM 1550 N TYR A 109 102.774 11.650 -2.652 1.00 1.00 N ATOM 1551 CA TYR A 109 101.913 12.377 -3.582 1.00 1.00 C ATOM 1552 C TYR A 109 102.225 13.869 -3.607 1.00 1.00 C ATOM 1553 O TYR A 109 101.572 14.631 -4.318 1.00 1.00 O ATOM 1554 CB TYR A 109 100.445 12.109 -3.220 1.00 1.00 C ATOM 1555 CG TYR A 109 100.098 10.750 -3.792 1.00 1.00 C ATOM 1556 CD1 TYR A 109 100.108 9.641 -2.958 1.00 1.00 C ATOM 1557 CD2 TYR A 109 99.851 10.594 -5.168 1.00 1.00 C ATOM 1558 CE1 TYR A 109 99.882 8.377 -3.474 1.00 1.00 C ATOM 1559 CE2 TYR A 109 99.609 9.323 -5.696 1.00 1.00 C ATOM 1560 CZ TYR A 109 99.635 8.205 -4.844 1.00 1.00 C ATOM 1561 OH TYR A 109 99.434 6.938 -5.347 1.00 1.00 O ATOM 0 H TYR A 109 102.481 11.707 -1.677 1.00 1.00 H new ATOM 0 HA TYR A 109 102.104 12.015 -4.592 1.00 1.00 H new ATOM 0 HB2 TYR A 109 100.304 12.122 -2.139 1.00 1.00 H new ATOM 0 HB3 TYR A 109 99.797 12.881 -3.635 1.00 1.00 H new ATOM 0 HD1 TYR A 109 100.293 9.765 -1.901 1.00 1.00 H new ATOM 0 HD2 TYR A 109 99.848 11.457 -5.817 1.00 1.00 H new ATOM 0 HE1 TYR A 109 99.896 7.519 -2.819 1.00 1.00 H new ATOM 0 HE2 TYR A 109 99.404 9.201 -6.749 1.00 1.00 H new ATOM 0 HH TYR A 109 99.275 6.991 -6.313 1.00 1.00 H new ATOM 1571 N GLY A 110 103.250 14.279 -2.859 1.00 1.00 N ATOM 1572 CA GLY A 110 103.663 15.685 -2.841 1.00 1.00 C ATOM 1573 C GLY A 110 103.285 16.385 -1.540 1.00 1.00 C ATOM 1574 O GLY A 110 102.459 15.891 -0.772 1.00 1.00 O ATOM 0 H GLY A 110 103.805 13.665 -2.263 1.00 1.00 H new ATOM 0 HA2 GLY A 110 104.742 15.746 -2.983 1.00 1.00 H new ATOM 0 HA3 GLY A 110 103.201 16.207 -3.679 1.00 1.00 H new ATOM 1578 N PRO A 111 103.883 17.529 -1.289 1.00 1.00 N ATOM 1579 CA PRO A 111 103.622 18.341 -0.065 1.00 1.00 C ATOM 1580 C PRO A 111 102.292 19.081 -0.145 1.00 1.00 C ATOM 1581 O PRO A 111 101.819 19.635 0.843 1.00 1.00 O ATOM 1582 CB PRO A 111 104.796 19.313 -0.042 1.00 1.00 C ATOM 1583 CG PRO A 111 105.120 19.528 -1.479 1.00 1.00 C ATOM 1584 CD PRO A 111 104.884 18.181 -2.155 1.00 1.00 C ATOM 0 HA PRO A 111 103.546 17.733 0.836 1.00 1.00 H new ATOM 0 HB2 PRO A 111 104.529 20.248 0.450 1.00 1.00 H new ATOM 0 HB3 PRO A 111 105.646 18.898 0.500 1.00 1.00 H new ATOM 0 HG2 PRO A 111 104.486 20.301 -1.913 1.00 1.00 H new ATOM 0 HG3 PRO A 111 106.152 19.855 -1.604 1.00 1.00 H new ATOM 0 HD2 PRO A 111 104.515 18.303 -3.173 1.00 1.00 H new ATOM 0 HD3 PRO A 111 105.802 17.597 -2.217 1.00 1.00 H new ATOM 1592 N ARG A 112 101.702 19.094 -1.335 1.00 1.00 N ATOM 1593 CA ARG A 112 100.424 19.771 -1.549 1.00 1.00 C ATOM 1594 C ARG A 112 99.292 18.757 -1.503 1.00 1.00 C ATOM 1595 O ARG A 112 99.527 17.552 -1.560 1.00 1.00 O ATOM 1596 CB ARG A 112 100.403 20.439 -2.925 1.00 1.00 C ATOM 1597 CG ARG A 112 101.425 21.577 -2.987 1.00 1.00 C ATOM 1598 CD ARG A 112 101.326 22.249 -4.358 1.00 1.00 C ATOM 1599 NE ARG A 112 102.258 23.371 -4.449 1.00 1.00 N ATOM 1600 CZ ARG A 112 103.506 23.208 -4.884 1.00 1.00 C ATOM 1601 NH1 ARG A 112 103.932 22.025 -5.236 1.00 1.00 N ATOM 1602 NH2 ARG A 112 104.307 24.235 -4.961 1.00 1.00 N ATOM 0 H ARG A 112 102.086 18.645 -2.166 1.00 1.00 H new ATOM 0 HA ARG A 112 100.299 20.520 -0.768 1.00 1.00 H new ATOM 0 HB2 ARG A 112 100.624 19.702 -3.697 1.00 1.00 H new ATOM 0 HB3 ARG A 112 99.406 20.827 -3.132 1.00 1.00 H new ATOM 0 HG2 ARG A 112 101.232 22.302 -2.196 1.00 1.00 H new ATOM 0 HG3 ARG A 112 102.432 21.190 -2.827 1.00 1.00 H new ATOM 0 HD2 ARG A 112 101.544 21.523 -5.141 1.00 1.00 H new ATOM 0 HD3 ARG A 112 100.308 22.601 -4.524 1.00 1.00 H new ATOM 0 HE ARG A 112 101.945 24.302 -4.173 1.00 1.00 H new ATOM 0 HH11 ARG A 112 103.308 21.220 -5.178 1.00 1.00 H new ATOM 0 HH12 ARG A 112 104.889 21.906 -5.569 1.00 1.00 H new ATOM 0 HH21 ARG A 112 103.977 25.161 -4.688 1.00 1.00 H new ATOM 0 HH22 ARG A 112 105.263 24.112 -5.294 1.00 1.00 H new ATOM 1616 N SER A 113 98.062 19.242 -1.418 1.00 1.00 N ATOM 1617 CA SER A 113 96.922 18.346 -1.398 1.00 1.00 C ATOM 1618 C SER A 113 96.687 17.778 -2.790 1.00 1.00 C ATOM 1619 O SER A 113 95.794 18.223 -3.510 1.00 1.00 O ATOM 1620 CB SER A 113 95.673 19.088 -0.949 1.00 1.00 C ATOM 1621 OG SER A 113 95.984 19.886 0.176 1.00 1.00 O ATOM 0 H SER A 113 97.832 20.234 -1.363 1.00 1.00 H new ATOM 0 HA SER A 113 97.132 17.537 -0.698 1.00 1.00 H new ATOM 0 HB2 SER A 113 95.296 19.712 -1.759 1.00 1.00 H new ATOM 0 HB3 SER A 113 94.884 18.378 -0.699 1.00 1.00 H new ATOM 0 HG SER A 113 95.565 20.767 0.078 1.00 1.00 H new ATOM 1627 N VAL A 114 97.494 16.794 -3.162 1.00 1.00 N ATOM 1628 CA VAL A 114 97.369 16.164 -4.476 1.00 1.00 C ATOM 1629 C VAL A 114 96.479 14.926 -4.378 1.00 1.00 C ATOM 1630 O VAL A 114 96.921 13.813 -4.658 1.00 1.00 O ATOM 1631 CB VAL A 114 98.756 15.755 -4.985 1.00 1.00 C ATOM 1632 CG1 VAL A 114 98.677 15.363 -6.462 1.00 1.00 C ATOM 1633 CG2 VAL A 114 99.741 16.921 -4.826 1.00 1.00 C ATOM 0 H VAL A 114 98.239 16.414 -2.579 1.00 1.00 H new ATOM 0 HA VAL A 114 96.920 16.875 -5.170 1.00 1.00 H new ATOM 0 HB VAL A 114 99.104 14.904 -4.400 1.00 1.00 H new ATOM 0 HG11 VAL A 114 99.667 15.074 -6.815 1.00 1.00 H new ATOM 0 HG12 VAL A 114 97.991 14.525 -6.580 1.00 1.00 H new ATOM 0 HG13 VAL A 114 98.317 16.211 -7.045 1.00 1.00 H new ATOM 0 HG21 VAL A 114 100.723 16.620 -5.190 1.00 1.00 H new ATOM 0 HG22 VAL A 114 99.387 17.777 -5.401 1.00 1.00 H new ATOM 0 HG23 VAL A 114 99.813 17.195 -3.774 1.00 1.00 H new ATOM 1637 N GLY A 115 95.225 15.114 -3.965 1.00 1.00 N ATOM 1638 CA GLY A 115 94.317 13.979 -3.833 1.00 1.00 C ATOM 1639 C GLY A 115 93.008 14.360 -3.133 1.00 1.00 C ATOM 1640 O GLY A 115 92.828 15.499 -2.700 1.00 1.00 O ATOM 0 H GLY A 115 94.824 16.020 -3.722 1.00 1.00 H new ATOM 0 HA2 GLY A 115 94.094 13.578 -4.822 1.00 1.00 H new ATOM 0 HA3 GLY A 115 94.810 13.186 -3.271 1.00 1.00 H new ATOM 1644 N GLY A 116 92.100 13.390 -3.028 1.00 1.00 N ATOM 1645 CA GLY A 116 90.802 13.613 -2.379 1.00 1.00 C ATOM 1646 C GLY A 116 90.977 14.041 -0.914 1.00 1.00 C ATOM 1647 O GLY A 116 91.369 15.179 -0.654 1.00 1.00 O ATOM 0 H GLY A 116 92.236 12.443 -3.382 1.00 1.00 H new ATOM 0 HA2 GLY A 116 90.249 14.380 -2.921 1.00 1.00 H new ATOM 0 HA3 GLY A 116 90.208 12.700 -2.425 1.00 1.00 H new ATOM 1651 N PRO A 117 90.696 13.183 0.052 1.00 1.00 N ATOM 1652 CA PRO A 117 90.832 13.545 1.491 1.00 1.00 C ATOM 1653 C PRO A 117 92.254 13.970 1.800 1.00 1.00 C ATOM 1654 O PRO A 117 92.527 14.569 2.842 1.00 1.00 O ATOM 1655 CB PRO A 117 90.422 12.285 2.259 1.00 1.00 C ATOM 1656 CG PRO A 117 90.525 11.182 1.264 1.00 1.00 C ATOM 1657 CD PRO A 117 90.241 11.795 -0.098 1.00 1.00 C ATOM 0 HA PRO A 117 90.207 14.393 1.772 1.00 1.00 H new ATOM 0 HB2 PRO A 117 91.078 12.111 3.112 1.00 1.00 H new ATOM 0 HB3 PRO A 117 89.408 12.372 2.649 1.00 1.00 H new ATOM 0 HG2 PRO A 117 91.517 10.732 1.287 1.00 1.00 H new ATOM 0 HG3 PRO A 117 89.811 10.390 1.489 1.00 1.00 H new ATOM 0 HD2 PRO A 117 90.781 11.279 -0.892 1.00 1.00 H new ATOM 0 HD3 PRO A 117 89.181 11.744 -0.348 1.00 1.00 H new ATOM 1665 N ILE A 118 93.153 13.685 0.874 1.00 1.00 N ATOM 1666 CA ILE A 118 94.531 14.079 1.066 1.00 1.00 C ATOM 1667 C ILE A 118 94.580 15.601 1.019 1.00 1.00 C ATOM 1668 O ILE A 118 94.352 16.206 -0.028 1.00 1.00 O ATOM 1669 CB ILE A 118 95.427 13.529 -0.054 1.00 1.00 C ATOM 1670 CG1 ILE A 118 95.314 12.005 -0.122 1.00 1.00 C ATOM 1671 CG2 ILE A 118 96.890 13.877 0.236 1.00 1.00 C ATOM 1672 CD1 ILE A 118 93.995 11.574 -0.766 1.00 1.00 C ATOM 0 H ILE A 118 92.957 13.193 0.002 1.00 1.00 H new ATOM 0 HA ILE A 118 94.891 13.686 2.017 1.00 1.00 H new ATOM 0 HB ILE A 118 95.106 13.972 -0.997 1.00 1.00 H new ATOM 0 HG12 ILE A 118 96.149 11.601 -0.694 1.00 1.00 H new ATOM 0 HG13 ILE A 118 95.384 11.588 0.883 1.00 1.00 H new ATOM 0 HG21 ILE A 118 97.522 13.485 -0.561 1.00 1.00 H new ATOM 0 HG22 ILE A 118 97.003 14.960 0.289 1.00 1.00 H new ATOM 0 HG23 ILE A 118 97.188 13.434 1.186 1.00 1.00 H new ATOM 0 HD11 ILE A 118 93.945 10.486 -0.800 1.00 1.00 H new ATOM 0 HD12 ILE A 118 93.161 11.958 -0.178 1.00 1.00 H new ATOM 0 HD13 ILE A 118 93.938 11.971 -1.779 1.00 1.00 H new ATOM 1679 N GLY A 119 94.873 16.204 2.159 1.00 1.00 N ATOM 1680 CA GLY A 119 94.954 17.648 2.274 1.00 1.00 C ATOM 1681 C GLY A 119 96.385 18.119 2.064 1.00 1.00 C ATOM 1682 O GLY A 119 97.236 17.351 1.614 1.00 1.00 O ATOM 0 H GLY A 119 95.061 15.706 3.029 1.00 1.00 H new ATOM 0 HA2 GLY A 119 94.299 18.115 1.538 1.00 1.00 H new ATOM 0 HA3 GLY A 119 94.602 17.961 3.257 1.00 1.00 H new ATOM 1686 N PRO A 120 96.671 19.351 2.387 1.00 1.00 N ATOM 1687 CA PRO A 120 98.045 19.916 2.234 1.00 1.00 C ATOM 1688 C PRO A 120 99.080 19.202 3.113 1.00 1.00 C ATOM 1689 O PRO A 120 98.784 18.811 4.235 1.00 1.00 O ATOM 1690 CB PRO A 120 97.890 21.383 2.666 1.00 1.00 C ATOM 1691 CG PRO A 120 96.649 21.411 3.501 1.00 1.00 C ATOM 1692 CD PRO A 120 95.726 20.352 2.927 1.00 1.00 C ATOM 0 HA PRO A 120 98.414 19.798 1.215 1.00 1.00 H new ATOM 0 HB2 PRO A 120 98.756 21.721 3.235 1.00 1.00 H new ATOM 0 HB3 PRO A 120 97.800 22.042 1.802 1.00 1.00 H new ATOM 0 HG2 PRO A 120 96.879 21.202 4.546 1.00 1.00 H new ATOM 0 HG3 PRO A 120 96.180 22.395 3.468 1.00 1.00 H new ATOM 0 HD2 PRO A 120 95.077 19.924 3.691 1.00 1.00 H new ATOM 0 HD3 PRO A 120 95.079 20.758 2.149 1.00 1.00 H new ATOM 1700 N ASN A 121 100.301 19.076 2.602 1.00 1.00 N ATOM 1701 CA ASN A 121 101.393 18.454 3.353 1.00 1.00 C ATOM 1702 C ASN A 121 100.973 17.136 3.997 1.00 1.00 C ATOM 1703 O ASN A 121 101.084 16.970 5.211 1.00 1.00 O ATOM 1704 CB ASN A 121 101.895 19.418 4.433 1.00 1.00 C ATOM 1705 CG ASN A 121 103.294 19.015 4.887 1.00 1.00 C ATOM 1706 OD1 ASN A 121 104.081 19.864 5.305 1.00 1.00 O ATOM 1707 ND2 ASN A 121 103.645 17.760 4.840 1.00 1.00 N ATOM 0 H ASN A 121 100.562 19.396 1.669 1.00 1.00 H new ATOM 0 HA ASN A 121 102.192 18.235 2.645 1.00 1.00 H new ATOM 0 HB2 ASN A 121 101.910 20.436 4.044 1.00 1.00 H new ATOM 0 HB3 ASN A 121 101.213 19.411 5.283 1.00 1.00 H new ATOM 0 HD21 ASN A 121 104.575 17.479 5.150 1.00 1.00 H new ATOM 0 HD22 ASN A 121 102.990 17.060 4.493 1.00 1.00 H new ATOM 1714 N GLU A 122 100.495 16.201 3.185 1.00 1.00 N ATOM 1715 CA GLU A 122 100.060 14.899 3.694 1.00 1.00 C ATOM 1716 C GLU A 122 101.076 13.805 3.421 1.00 1.00 C ATOM 1717 O GLU A 122 101.475 13.580 2.279 1.00 1.00 O ATOM 1718 CB GLU A 122 98.748 14.492 3.024 1.00 1.00 C ATOM 1719 CG GLU A 122 97.580 15.245 3.636 1.00 1.00 C ATOM 1720 CD GLU A 122 97.348 14.773 5.071 1.00 1.00 C ATOM 1721 OE1 GLU A 122 96.545 15.383 5.756 1.00 1.00 O ATOM 1722 OE2 GLU A 122 97.974 13.802 5.461 1.00 1.00 O ATOM 0 H GLU A 122 100.398 16.315 2.176 1.00 1.00 H new ATOM 0 HA GLU A 122 99.939 15.008 4.772 1.00 1.00 H new ATOM 0 HB2 GLU A 122 98.800 14.698 1.955 1.00 1.00 H new ATOM 0 HB3 GLU A 122 98.594 13.419 3.135 1.00 1.00 H new ATOM 0 HG2 GLU A 122 97.781 16.316 3.625 1.00 1.00 H new ATOM 0 HG3 GLU A 122 96.681 15.083 3.041 1.00 1.00 H new ATOM 1729 N THR A 123 101.431 13.078 4.476 1.00 1.00 N ATOM 1730 CA THR A 123 102.331 11.949 4.339 1.00 1.00 C ATOM 1731 C THR A 123 101.470 10.705 4.172 1.00 1.00 C ATOM 1732 O THR A 123 100.554 10.469 4.959 1.00 1.00 O ATOM 1733 CB THR A 123 103.216 11.811 5.579 1.00 1.00 C ATOM 1734 OG1 THR A 123 104.045 12.959 5.695 1.00 1.00 O ATOM 1735 CG2 THR A 123 104.084 10.564 5.435 1.00 1.00 C ATOM 0 H THR A 123 101.109 13.253 5.428 1.00 1.00 H new ATOM 0 HA THR A 123 102.987 12.088 3.480 1.00 1.00 H new ATOM 0 HB THR A 123 102.595 11.723 6.470 1.00 1.00 H new ATOM 0 HG1 THR A 123 104.367 13.038 6.617 1.00 1.00 H new ATOM 0 HG21 THR A 123 104.718 10.458 6.315 1.00 1.00 H new ATOM 0 HG22 THR A 123 103.446 9.685 5.340 1.00 1.00 H new ATOM 0 HG23 THR A 123 104.709 10.656 4.547 1.00 1.00 H new ATOM 1743 N LEU A 124 101.744 9.918 3.138 1.00 1.00 N ATOM 1744 CA LEU A 124 100.957 8.708 2.879 1.00 1.00 C ATOM 1745 C LEU A 124 101.773 7.446 3.168 1.00 1.00 C ATOM 1746 O LEU A 124 102.990 7.408 2.975 1.00 1.00 O ATOM 1747 CB LEU A 124 100.497 8.653 1.406 1.00 1.00 C ATOM 1748 CG LEU A 124 99.590 9.850 0.994 1.00 1.00 C ATOM 1749 CD1 LEU A 124 98.651 10.265 2.113 1.00 1.00 C ATOM 1750 CD2 LEU A 124 100.442 11.051 0.606 1.00 1.00 C ATOM 0 H LEU A 124 102.495 10.089 2.470 1.00 1.00 H new ATOM 0 HA LEU A 124 100.091 8.747 3.539 1.00 1.00 H new ATOM 0 HB2 LEU A 124 101.375 8.633 0.760 1.00 1.00 H new ATOM 0 HB3 LEU A 124 99.956 7.722 1.237 1.00 1.00 H new ATOM 0 HG LEU A 124 98.994 9.516 0.144 1.00 1.00 H new ATOM 0 HD11 LEU A 124 98.038 11.103 1.781 1.00 1.00 H new ATOM 0 HD12 LEU A 124 98.007 9.426 2.378 1.00 1.00 H new ATOM 0 HD13 LEU A 124 99.233 10.564 2.984 1.00 1.00 H new ATOM 0 HD21 LEU A 124 99.794 11.880 0.320 1.00 1.00 H new ATOM 0 HD22 LEU A 124 101.059 11.348 1.454 1.00 1.00 H new ATOM 0 HD23 LEU A 124 101.083 10.786 -0.234 1.00 1.00 H new ATOM 1762 N ILE A 125 101.071 6.409 3.611 1.00 1.00 N ATOM 1763 CA ILE A 125 101.669 5.117 3.911 1.00 1.00 C ATOM 1764 C ILE A 125 100.912 4.053 3.156 1.00 1.00 C ATOM 1765 O ILE A 125 99.698 4.135 3.034 1.00 1.00 O ATOM 1766 CB ILE A 125 101.564 4.825 5.421 1.00 1.00 C ATOM 1767 CG1 ILE A 125 101.763 3.312 5.686 1.00 1.00 C ATOM 1768 CG2 ILE A 125 100.178 5.241 5.915 1.00 1.00 C ATOM 1769 CD1 ILE A 125 101.804 3.015 7.174 1.00 1.00 C ATOM 0 H ILE A 125 100.064 6.443 3.773 1.00 1.00 H new ATOM 0 HA ILE A 125 102.719 5.124 3.619 1.00 1.00 H new ATOM 0 HB ILE A 125 102.336 5.385 5.949 1.00 1.00 H new ATOM 0 HG12 ILE A 125 100.952 2.749 5.223 1.00 1.00 H new ATOM 0 HG13 ILE A 125 102.690 2.978 5.220 1.00 1.00 H new ATOM 0 HG21 ILE A 125 100.096 5.037 6.983 1.00 1.00 H new ATOM 0 HG22 ILE A 125 100.033 6.306 5.737 1.00 1.00 H new ATOM 0 HG23 ILE A 125 99.416 4.676 5.378 1.00 1.00 H new ATOM 0 HD11 ILE A 125 101.945 1.945 7.328 1.00 1.00 H new ATOM 0 HD12 ILE A 125 102.631 3.559 7.631 1.00 1.00 H new ATOM 0 HD13 ILE A 125 100.866 3.327 7.633 1.00 1.00 H new ATOM 1776 N PHE A 126 101.621 3.029 2.687 1.00 1.00 N ATOM 1777 CA PHE A 126 100.964 1.934 1.988 1.00 1.00 C ATOM 1778 C PHE A 126 101.478 0.588 2.465 1.00 1.00 C ATOM 1779 O PHE A 126 102.638 0.455 2.856 1.00 1.00 O ATOM 1780 CB PHE A 126 101.198 2.041 0.483 1.00 1.00 C ATOM 1781 CG PHE A 126 101.166 3.486 0.077 1.00 1.00 C ATOM 1782 CD1 PHE A 126 100.038 4.021 -0.559 1.00 1.00 C ATOM 1783 CD2 PHE A 126 102.273 4.293 0.334 1.00 1.00 C ATOM 1784 CE1 PHE A 126 100.025 5.366 -0.936 1.00 1.00 C ATOM 1785 CE2 PHE A 126 102.257 5.632 -0.040 1.00 1.00 C ATOM 1786 CZ PHE A 126 101.139 6.170 -0.675 1.00 1.00 C ATOM 0 H PHE A 126 102.633 2.937 2.777 1.00 1.00 H new ATOM 0 HA PHE A 126 99.898 2.007 2.204 1.00 1.00 H new ATOM 0 HB2 PHE A 126 102.159 1.599 0.221 1.00 1.00 H new ATOM 0 HB3 PHE A 126 100.433 1.483 -0.056 1.00 1.00 H new ATOM 0 HD1 PHE A 126 99.181 3.395 -0.757 1.00 1.00 H new ATOM 0 HD2 PHE A 126 103.142 3.879 0.823 1.00 1.00 H new ATOM 0 HE1 PHE A 126 99.158 5.783 -1.427 1.00 1.00 H new ATOM 0 HE2 PHE A 126 103.114 6.257 0.162 1.00 1.00 H new ATOM 0 HZ PHE A 126 101.133 7.210 -0.966 1.00 1.00 H new ATOM 1796 N LYS A 127 100.624 -0.429 2.370 1.00 1.00 N ATOM 1797 CA LYS A 127 101.015 -1.767 2.728 1.00 1.00 C ATOM 1798 C LYS A 127 101.314 -2.447 1.425 1.00 1.00 C ATOM 1799 O LYS A 127 100.492 -2.401 0.525 1.00 1.00 O ATOM 1800 CB LYS A 127 99.894 -2.521 3.488 1.00 1.00 C ATOM 1801 CG LYS A 127 98.788 -1.577 3.958 1.00 1.00 C ATOM 1802 CD LYS A 127 99.333 -0.595 5.015 1.00 1.00 C ATOM 1803 CE LYS A 127 98.178 0.190 5.638 1.00 1.00 C ATOM 1804 NZ LYS A 127 98.699 1.038 6.747 1.00 1.00 N ATOM 0 H LYS A 127 99.661 -0.340 2.047 1.00 1.00 H new ATOM 0 HA LYS A 127 101.871 -1.756 3.403 1.00 1.00 H new ATOM 0 HB2 LYS A 127 99.467 -3.286 2.839 1.00 1.00 H new ATOM 0 HB3 LYS A 127 100.322 -3.036 4.348 1.00 1.00 H new ATOM 0 HG2 LYS A 127 98.389 -1.023 3.109 1.00 1.00 H new ATOM 0 HG3 LYS A 127 97.964 -2.153 4.378 1.00 1.00 H new ATOM 0 HD2 LYS A 127 99.872 -1.142 5.789 1.00 1.00 H new ATOM 0 HD3 LYS A 127 100.044 0.091 4.555 1.00 1.00 H new ATOM 0 HE2 LYS A 127 97.698 0.813 4.883 1.00 1.00 H new ATOM 0 HE3 LYS A 127 97.419 -0.496 6.015 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 98.061 0.970 7.565 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 99.647 0.709 7.019 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 98.753 2.028 6.432 1.00 1.00 H new ATOM 1818 N ILE A 128 102.502 -3.012 1.275 1.00 1.00 N ATOM 1819 CA ILE A 128 102.845 -3.621 -0.012 1.00 1.00 C ATOM 1820 C ILE A 128 103.120 -5.108 0.109 1.00 1.00 C ATOM 1821 O ILE A 128 104.047 -5.546 0.790 1.00 1.00 O ATOM 1822 CB ILE A 128 104.044 -2.884 -0.634 1.00 1.00 C ATOM 1823 CG1 ILE A 128 103.905 -1.382 -0.306 1.00 1.00 C ATOM 1824 CG2 ILE A 128 104.023 -3.094 -2.150 1.00 1.00 C ATOM 1825 CD1 ILE A 128 105.016 -0.549 -0.956 1.00 1.00 C ATOM 0 H ILE A 128 103.224 -3.065 1.994 1.00 1.00 H new ATOM 0 HA ILE A 128 101.982 -3.520 -0.670 1.00 1.00 H new ATOM 0 HB ILE A 128 104.985 -3.264 -0.236 1.00 1.00 H new ATOM 0 HG12 ILE A 128 102.935 -1.024 -0.650 1.00 1.00 H new ATOM 0 HG13 ILE A 128 103.932 -1.243 0.775 1.00 1.00 H new ATOM 0 HG21 ILE A 128 104.869 -2.575 -2.601 1.00 1.00 H new ATOM 0 HG22 ILE A 128 104.091 -4.159 -2.371 1.00 1.00 H new ATOM 0 HG23 ILE A 128 103.094 -2.697 -2.559 1.00 1.00 H new ATOM 0 HD11 ILE A 128 104.880 0.502 -0.700 1.00 1.00 H new ATOM 0 HD12 ILE A 128 105.986 -0.889 -0.592 1.00 1.00 H new ATOM 0 HD13 ILE A 128 104.973 -0.667 -2.039 1.00 1.00 H new ATOM 1832 N HIS A 129 102.285 -5.862 -0.598 1.00 1.00 N ATOM 1833 CA HIS A 129 102.363 -7.310 -0.659 1.00 1.00 C ATOM 1834 C HIS A 129 102.829 -7.702 -2.048 1.00 1.00 C ATOM 1835 O HIS A 129 102.193 -7.332 -3.034 1.00 1.00 O ATOM 1836 CB HIS A 129 100.972 -7.894 -0.406 1.00 1.00 C ATOM 1837 CG HIS A 129 100.982 -9.370 -0.681 1.00 1.00 C ATOM 1838 ND1 HIS A 129 99.916 -9.994 -1.297 1.00 1.00 N ATOM 1839 CD2 HIS A 129 101.938 -10.343 -0.493 1.00 1.00 C ATOM 1840 CE1 HIS A 129 100.243 -11.281 -1.473 1.00 1.00 C ATOM 1841 NE2 HIS A 129 101.465 -11.552 -1.011 1.00 1.00 N ATOM 0 H HIS A 129 101.523 -5.473 -1.153 1.00 1.00 H new ATOM 0 HA HIS A 129 103.057 -7.688 0.091 1.00 1.00 H new ATOM 0 HB2 HIS A 129 100.672 -7.709 0.625 1.00 1.00 H new ATOM 0 HB3 HIS A 129 100.239 -7.401 -1.044 1.00 1.00 H new ATOM 0 HD2 HIS A 129 102.898 -10.196 -0.021 1.00 1.00 H new ATOM 0 HE1 HIS A 129 99.595 -12.012 -1.934 1.00 1.00 H new ATOM 0 HE2 HIS A 129 101.950 -12.449 -1.031 1.00 1.00 H new ATOM 1849 N LEU A 130 103.946 -8.422 -2.144 1.00 1.00 N ATOM 1850 CA LEU A 130 104.465 -8.804 -3.456 1.00 1.00 C ATOM 1851 C LEU A 130 103.967 -10.187 -3.892 1.00 1.00 C ATOM 1852 O LEU A 130 104.336 -11.206 -3.309 1.00 1.00 O ATOM 1853 CB LEU A 130 106.005 -8.758 -3.432 1.00 1.00 C ATOM 1854 CG LEU A 130 106.548 -8.078 -4.697 1.00 1.00 C ATOM 1855 CD1 LEU A 130 108.081 -7.992 -4.637 1.00 1.00 C ATOM 1856 CD2 LEU A 130 106.134 -8.867 -5.943 1.00 1.00 C ATOM 0 H LEU A 130 104.498 -8.746 -1.350 1.00 1.00 H new ATOM 0 HA LEU A 130 104.092 -8.090 -4.191 1.00 1.00 H new ATOM 0 HB2 LEU A 130 106.344 -8.217 -2.548 1.00 1.00 H new ATOM 0 HB3 LEU A 130 106.403 -9.770 -3.358 1.00 1.00 H new ATOM 0 HG LEU A 130 106.131 -7.072 -4.752 1.00 1.00 H new ATOM 0 HD11 LEU A 130 108.454 -7.508 -5.540 1.00 1.00 H new ATOM 0 HD12 LEU A 130 108.379 -7.411 -3.764 1.00 1.00 H new ATOM 0 HD13 LEU A 130 108.499 -8.996 -4.565 1.00 1.00 H new ATOM 0 HD21 LEU A 130 106.526 -8.374 -6.833 1.00 1.00 H new ATOM 0 HD22 LEU A 130 106.535 -9.879 -5.883 1.00 1.00 H new ATOM 0 HD23 LEU A 130 105.046 -8.911 -6.001 1.00 1.00 H new ATOM 1868 N ILE A 131 103.127 -10.199 -4.933 1.00 1.00 N ATOM 1869 CA ILE A 131 102.579 -11.441 -5.467 1.00 1.00 C ATOM 1870 C ILE A 131 103.464 -11.993 -6.590 1.00 1.00 C ATOM 1871 O ILE A 131 103.771 -13.185 -6.613 1.00 1.00 O ATOM 1872 CB ILE A 131 101.164 -11.190 -6.009 1.00 1.00 C ATOM 1873 CG1 ILE A 131 100.199 -10.877 -4.855 1.00 1.00 C ATOM 1874 CG2 ILE A 131 100.656 -12.447 -6.714 1.00 1.00 C ATOM 1875 CD1 ILE A 131 100.243 -9.412 -4.478 1.00 1.00 C ATOM 0 H ILE A 131 102.814 -9.359 -5.420 1.00 1.00 H new ATOM 0 HA ILE A 131 102.543 -12.174 -4.661 1.00 1.00 H new ATOM 0 HB ILE A 131 101.206 -10.348 -6.700 1.00 1.00 H new ATOM 0 HG12 ILE A 131 99.184 -11.149 -5.144 1.00 1.00 H new ATOM 0 HG13 ILE A 131 100.457 -11.485 -3.988 1.00 1.00 H new ATOM 0 HG21 ILE A 131 99.652 -12.268 -7.098 1.00 1.00 H new ATOM 0 HG22 ILE A 131 101.322 -12.695 -7.541 1.00 1.00 H new ATOM 0 HG23 ILE A 131 100.631 -13.276 -6.007 1.00 1.00 H new ATOM 0 HD11 ILE A 131 99.548 -9.226 -3.659 1.00 1.00 H new ATOM 0 HD12 ILE A 131 101.253 -9.147 -4.165 1.00 1.00 H new ATOM 0 HD13 ILE A 131 99.959 -8.806 -5.339 1.00 1.00 H new ATOM 1882 N SER A 132 103.859 -11.125 -7.530 1.00 1.00 N ATOM 1883 CA SER A 132 104.697 -11.547 -8.657 1.00 1.00 C ATOM 1884 C SER A 132 105.589 -10.405 -9.133 1.00 1.00 C ATOM 1885 O SER A 132 105.315 -9.236 -8.863 1.00 1.00 O ATOM 1886 CB SER A 132 103.827 -12.034 -9.808 1.00 1.00 C ATOM 1887 OG SER A 132 104.527 -11.863 -11.032 1.00 1.00 O ATOM 0 H SER A 132 103.614 -10.135 -7.532 1.00 1.00 H new ATOM 0 HA SER A 132 105.333 -12.364 -8.316 1.00 1.00 H new ATOM 0 HB2 SER A 132 103.571 -13.084 -9.666 1.00 1.00 H new ATOM 0 HB3 SER A 132 102.890 -11.478 -9.831 1.00 1.00 H new ATOM 0 HG SER A 132 103.970 -12.177 -11.774 1.00 1.00 H new ATOM 1893 N VAL A 133 106.686 -10.757 -9.816 1.00 1.00 N ATOM 1894 CA VAL A 133 107.650 -9.762 -10.299 1.00 1.00 C ATOM 1895 C VAL A 133 107.977 -9.967 -11.771 1.00 1.00 C ATOM 1896 O VAL A 133 108.203 -11.092 -12.215 1.00 1.00 O ATOM 1897 CB VAL A 133 108.942 -9.880 -9.498 1.00 1.00 C ATOM 1898 CG1 VAL A 133 109.928 -8.804 -9.952 1.00 1.00 C ATOM 1899 CG2 VAL A 133 108.612 -9.688 -8.034 1.00 1.00 C ATOM 0 H VAL A 133 106.927 -11.721 -10.046 1.00 1.00 H new ATOM 0 HA VAL A 133 107.201 -8.776 -10.174 1.00 1.00 H new ATOM 0 HB VAL A 133 109.395 -10.859 -9.655 1.00 1.00 H new ATOM 0 HG11 VAL A 133 110.851 -8.890 -9.378 1.00 1.00 H new ATOM 0 HG12 VAL A 133 110.146 -8.935 -11.012 1.00 1.00 H new ATOM 0 HG13 VAL A 133 109.491 -7.819 -9.790 1.00 1.00 H new ATOM 0 HG21 VAL A 133 109.524 -9.769 -7.442 1.00 1.00 H new ATOM 0 HG22 VAL A 133 108.170 -8.703 -7.887 1.00 1.00 H new ATOM 0 HG23 VAL A 133 107.905 -10.454 -7.717 1.00 1.00 H new ATOM 1903 N LYS A 134 108.031 -8.870 -12.520 1.00 1.00 N ATOM 1904 CA LYS A 134 108.366 -8.936 -13.932 1.00 1.00 C ATOM 1905 C LYS A 134 109.874 -8.737 -14.125 1.00 1.00 C ATOM 1906 O LYS A 134 110.685 -9.081 -13.268 1.00 1.00 O ATOM 1907 CB LYS A 134 107.638 -7.833 -14.699 1.00 1.00 C ATOM 1908 CG LYS A 134 107.449 -8.247 -16.172 1.00 1.00 C ATOM 1909 CD LYS A 134 106.151 -9.036 -16.323 1.00 1.00 C ATOM 1910 CE LYS A 134 106.152 -9.737 -17.679 1.00 1.00 C ATOM 1911 NZ LYS A 134 104.808 -10.327 -17.940 1.00 1.00 N ATOM 0 H LYS A 134 107.847 -7.929 -12.171 1.00 1.00 H new ATOM 0 HA LYS A 134 108.065 -9.914 -14.307 1.00 1.00 H new ATOM 0 HB2 LYS A 134 106.668 -7.640 -14.240 1.00 1.00 H new ATOM 0 HB3 LYS A 134 108.207 -6.905 -14.644 1.00 1.00 H new ATOM 0 HG2 LYS A 134 107.424 -7.362 -16.808 1.00 1.00 H new ATOM 0 HG3 LYS A 134 108.294 -8.852 -16.501 1.00 1.00 H new ATOM 0 HD2 LYS A 134 106.060 -9.768 -15.521 1.00 1.00 H new ATOM 0 HD3 LYS A 134 105.293 -8.368 -16.245 1.00 1.00 H new ATOM 0 HE2 LYS A 134 106.407 -9.027 -18.466 1.00 1.00 H new ATOM 0 HE3 LYS A 134 106.912 -10.518 -17.695 1.00 1.00 H new ATOM 0 HZ1 LYS A 134 104.812 -10.804 -18.864 1.00 1.00 H new ATOM 0 HZ2 LYS A 134 104.581 -11.017 -17.195 1.00 1.00 H new ATOM 0 HZ3 LYS A 134 104.092 -9.573 -17.943 1.00 1.00 H new