USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1129 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 28 MET CE :methyl -140:sc= -0.149 (180deg=-0.785) USER MOD Set 1.2: A 110 MET CE :methyl -171:sc= -1.76 (180deg=-2.42!) USER MOD Single : A 10 SER OG : rot 180:sc= -1.22 USER MOD Single : A 11 ASN : amide:sc= -0.804 K(o=-0.8,f=-3.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -1.35 K(o=-1.3,f=-3.5!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 167:sc= 0.113 (180deg=0.0912) USER MOD Single : A 29 SER OG : rot 82:sc= -0.123 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.252 K(o=-0.25,f=-0.87) USER MOD Single : A 40 TYR OH : rot 180:sc= -0.193 USER MOD Single : A 43 MET CE :methyl 149:sc= -0.0342 (180deg=-1.38) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 85:sc= 1.25 USER MOD Single : A 57 THR OG1 : rot -35:sc= -0.826 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -47:sc= 1.09 USER MOD Single : A 70 HIS : no HD1:sc= -4.09! X(o=-4.1!,f=-4.2) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.814 K(o=-0.81,f=-1.7) USER MOD Single : A 78 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0174) USER MOD Single : A 81 ASN : amide:sc= -0.0963 X(o=-0.096,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.123 K(o=-0.12,f=-2.2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 180:sc= -3.04 (180deg=-3.04) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -4.27! C(o=-4.3!,f=-6.9!) USER MOD Single : A 96 GLN : amide:sc= -0.0683 X(o=-0.068,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 177:sc= -0.396 (180deg=-0.464) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.234 USER MOD Single : A 101 SER OG : rot 63:sc= 0.085 USER MOD Single : A 103 GLN : amide:sc= -2.88 K(o=-2.9,f=-9.8!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 106 TYR OH : rot 98:sc= 1.54 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -0.161 K(o=-0.16,f=-1.2!) USER MOD Single : A 112 THR OG1 : rot 70:sc= 0.208 USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 122 LYS NZ :NH3+ 165:sc= 0.143 (180deg=-0.00185) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -159:sc= -0.085 (180deg=-0.582) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.482 7.026 -8.874 1.00 14.25 N ATOM 98 CA SER A 10 5.393 8.093 -9.270 1.00 64.10 C ATOM 99 C SER A 10 6.047 7.778 -10.612 1.00 61.11 C ATOM 100 O SER A 10 6.249 8.665 -11.440 1.00 13.20 O ATOM 101 CB SER A 10 6.469 8.297 -8.201 1.00 61.44 C ATOM 102 OG SER A 10 6.408 9.605 -7.659 1.00 62.53 O ATOM 0 HA SER A 10 4.815 9.011 -9.373 1.00 64.10 H new ATOM 0 HB2 SER A 10 6.339 7.564 -7.405 1.00 61.44 H new ATOM 0 HB3 SER A 10 7.454 8.125 -8.635 1.00 61.44 H new ATOM 0 HG SER A 10 7.105 9.710 -6.978 1.00 62.53 H new ATOM 108 N ASN A 11 6.376 6.507 -10.819 1.00 73.22 N ATOM 109 CA ASN A 11 7.007 6.073 -12.060 1.00 44.12 C ATOM 110 C ASN A 11 6.096 6.337 -13.255 1.00 64.23 C ATOM 111 O ASN A 11 6.555 6.757 -14.318 1.00 10.44 O ATOM 112 CB ASN A 11 7.354 4.585 -11.987 1.00 71.34 C ATOM 113 CG ASN A 11 7.662 3.995 -13.350 1.00 51.44 C ATOM 114 OD1 ASN A 11 8.427 4.567 -14.128 1.00 33.14 O ATOM 115 ND2 ASN A 11 7.066 2.846 -13.646 1.00 53.34 N ATOM 0 H ASN A 11 6.216 5.760 -10.143 1.00 73.22 H new ATOM 0 HA ASN A 11 7.924 6.647 -12.192 1.00 44.12 H new ATOM 0 HB2 ASN A 11 8.214 4.447 -11.332 1.00 71.34 H new ATOM 0 HB3 ASN A 11 6.522 4.042 -11.539 1.00 71.34 H new ATOM 0 HD21 ASN A 11 7.234 2.402 -14.549 1.00 53.34 H new ATOM 0 HD22 ASN A 11 6.440 2.408 -12.971 1.00 53.34 H new ATOM 122 N ASP A 12 4.804 6.087 -13.074 1.00 4.14 N ATOM 123 CA ASP A 12 3.828 6.299 -14.136 1.00 31.12 C ATOM 124 C ASP A 12 3.382 7.757 -14.181 1.00 42.24 C ATOM 125 O ASP A 12 2.989 8.265 -15.232 1.00 34.03 O ATOM 126 CB ASP A 12 2.616 5.388 -13.933 1.00 11.44 C ATOM 127 CG ASP A 12 2.211 4.670 -15.205 1.00 43.51 C ATOM 128 OD1 ASP A 12 1.505 5.283 -16.034 1.00 3.14 O ATOM 129 OD2 ASP A 12 2.601 3.496 -15.373 1.00 3.30 O ATOM 0 H ASP A 12 4.408 5.737 -12.201 1.00 4.14 H new ATOM 0 HA ASP A 12 4.302 6.053 -15.086 1.00 31.12 H new ATOM 0 HB2 ASP A 12 2.843 4.653 -13.161 1.00 11.44 H new ATOM 0 HB3 ASP A 12 1.776 5.981 -13.571 1.00 11.44 H new ATOM 134 N LYS A 13 3.446 8.426 -13.035 1.00 73.01 N ATOM 135 CA LYS A 13 3.049 9.826 -12.943 1.00 2.14 C ATOM 136 C LYS A 13 3.886 10.691 -13.879 1.00 40.53 C ATOM 137 O LYS A 13 3.349 11.415 -14.718 1.00 73.33 O ATOM 138 CB LYS A 13 3.196 10.325 -11.503 1.00 73.12 C ATOM 139 CG LYS A 13 3.011 11.826 -11.358 1.00 25.41 C ATOM 140 CD LYS A 13 3.201 12.274 -9.918 1.00 62.15 C ATOM 141 CE LYS A 13 2.394 13.526 -9.614 1.00 12.42 C ATOM 142 NZ LYS A 13 1.928 13.556 -8.200 1.00 23.35 N ATOM 0 H LYS A 13 3.769 8.021 -12.156 1.00 73.01 H new ATOM 0 HA LYS A 13 2.004 9.902 -13.243 1.00 2.14 H new ATOM 0 HB2 LYS A 13 2.466 9.815 -10.874 1.00 73.12 H new ATOM 0 HB3 LYS A 13 4.184 10.051 -11.131 1.00 73.12 H new ATOM 0 HG2 LYS A 13 3.724 12.345 -11.999 1.00 25.41 H new ATOM 0 HG3 LYS A 13 2.014 12.105 -11.699 1.00 25.41 H new ATOM 0 HD2 LYS A 13 2.899 11.473 -9.244 1.00 62.15 H new ATOM 0 HD3 LYS A 13 4.258 12.467 -9.732 1.00 62.15 H new ATOM 0 HE2 LYS A 13 3.002 14.408 -9.815 1.00 12.42 H new ATOM 0 HE3 LYS A 13 1.533 13.574 -10.281 1.00 12.42 H new ATOM 0 HZ1 LYS A 13 1.382 14.425 -8.033 1.00 23.35 H new ATOM 0 HZ2 LYS A 13 1.326 12.728 -8.015 1.00 23.35 H new ATOM 0 HZ3 LYS A 13 2.750 13.536 -7.563 1.00 23.35 H new ATOM 156 N VAL A 14 5.205 10.612 -13.732 1.00 33.44 N ATOM 157 CA VAL A 14 6.116 11.386 -14.566 1.00 73.43 C ATOM 158 C VAL A 14 5.861 11.124 -16.047 1.00 2.15 C ATOM 159 O VAL A 14 5.846 12.050 -16.858 1.00 12.34 O ATOM 160 CB VAL A 14 7.586 11.060 -14.244 1.00 62.51 C ATOM 161 CG1 VAL A 14 7.834 9.562 -14.337 1.00 71.32 C ATOM 162 CG2 VAL A 14 8.517 11.821 -15.176 1.00 12.23 C ATOM 0 H VAL A 14 5.666 10.019 -13.042 1.00 33.44 H new ATOM 0 HA VAL A 14 5.929 12.438 -14.348 1.00 73.43 H new ATOM 0 HB VAL A 14 7.794 11.376 -13.222 1.00 62.51 H new ATOM 0 HG11 VAL A 14 8.878 9.351 -14.106 1.00 71.32 H new ATOM 0 HG12 VAL A 14 7.193 9.042 -13.625 1.00 71.32 H new ATOM 0 HG13 VAL A 14 7.609 9.218 -15.346 1.00 71.32 H new ATOM 0 HG21 VAL A 14 9.552 11.579 -14.934 1.00 12.23 H new ATOM 0 HG22 VAL A 14 8.310 11.538 -16.208 1.00 12.23 H new ATOM 0 HG23 VAL A 14 8.357 12.892 -15.055 1.00 12.23 H new ATOM 172 N TYR A 15 5.661 9.857 -16.392 1.00 4.12 N ATOM 173 CA TYR A 15 5.409 9.473 -17.775 1.00 62.35 C ATOM 174 C TYR A 15 3.994 9.855 -18.198 1.00 32.13 C ATOM 175 O TYR A 15 3.673 9.875 -19.386 1.00 24.45 O ATOM 176 CB TYR A 15 5.618 7.968 -17.955 1.00 41.10 C ATOM 177 CG TYR A 15 5.318 7.478 -19.353 1.00 74.33 C ATOM 178 CD1 TYR A 15 5.761 8.179 -20.467 1.00 40.34 C ATOM 179 CD2 TYR A 15 4.591 6.312 -19.560 1.00 73.42 C ATOM 180 CE1 TYR A 15 5.488 7.735 -21.747 1.00 11.24 C ATOM 181 CE2 TYR A 15 4.314 5.859 -20.836 1.00 2.01 C ATOM 182 CZ TYR A 15 4.764 6.575 -21.926 1.00 25.53 C ATOM 183 OH TYR A 15 4.492 6.128 -23.198 1.00 74.04 O ATOM 0 H TYR A 15 5.669 9.079 -15.733 1.00 4.12 H new ATOM 0 HA TYR A 15 6.115 10.010 -18.408 1.00 62.35 H new ATOM 0 HB2 TYR A 15 6.650 7.721 -17.706 1.00 41.10 H new ATOM 0 HB3 TYR A 15 4.983 7.434 -17.248 1.00 41.10 H new ATOM 0 HD1 TYR A 15 6.329 9.087 -20.331 1.00 40.34 H new ATOM 0 HD2 TYR A 15 4.236 5.750 -18.709 1.00 73.42 H new ATOM 0 HE1 TYR A 15 5.840 8.293 -22.602 1.00 11.24 H new ATOM 0 HE2 TYR A 15 3.749 4.950 -20.979 1.00 2.01 H new ATOM 0 HH TYR A 15 3.974 5.298 -23.149 1.00 74.04 H new ATOM 193 N GLU A 16 3.152 10.158 -17.215 1.00 13.41 N ATOM 194 CA GLU A 16 1.770 10.540 -17.484 1.00 43.10 C ATOM 195 C GLU A 16 1.652 12.048 -17.685 1.00 52.13 C ATOM 196 O GLU A 16 1.263 12.513 -18.756 1.00 3.22 O ATOM 197 CB GLU A 16 0.862 10.095 -16.336 1.00 71.21 C ATOM 198 CG GLU A 16 -0.536 10.686 -16.402 1.00 75.52 C ATOM 199 CD GLU A 16 -1.621 9.634 -16.272 1.00 21.34 C ATOM 200 OE1 GLU A 16 -1.534 8.803 -15.344 1.00 24.23 O ATOM 201 OE2 GLU A 16 -2.557 9.642 -17.098 1.00 13.20 O ATOM 0 H GLU A 16 3.402 10.146 -16.226 1.00 13.41 H new ATOM 0 HA GLU A 16 1.454 10.043 -18.401 1.00 43.10 H new ATOM 0 HB2 GLU A 16 0.788 9.008 -16.343 1.00 71.21 H new ATOM 0 HB3 GLU A 16 1.322 10.377 -15.389 1.00 71.21 H new ATOM 0 HG2 GLU A 16 -0.653 11.423 -15.607 1.00 75.52 H new ATOM 0 HG3 GLU A 16 -0.659 11.214 -17.347 1.00 75.52 H new ATOM 208 N ASN A 17 1.989 12.806 -16.647 1.00 44.00 N ATOM 209 CA ASN A 17 1.920 14.262 -16.709 1.00 30.54 C ATOM 210 C ASN A 17 2.660 14.790 -17.934 1.00 15.01 C ATOM 211 O ASN A 17 2.221 15.747 -18.572 1.00 71.24 O ATOM 212 CB ASN A 17 2.511 14.875 -15.438 1.00 5.30 C ATOM 213 CG ASN A 17 1.775 14.437 -14.187 1.00 55.21 C ATOM 214 OD1 ASN A 17 2.075 13.392 -13.610 1.00 40.01 O ATOM 215 ND2 ASN A 17 0.803 15.237 -13.762 1.00 62.12 N ATOM 0 H ASN A 17 2.313 12.437 -15.753 1.00 44.00 H new ATOM 0 HA ASN A 17 0.871 14.549 -16.789 1.00 30.54 H new ATOM 0 HB2 ASN A 17 3.561 14.592 -15.356 1.00 5.30 H new ATOM 0 HB3 ASN A 17 2.478 15.962 -15.513 1.00 5.30 H new ATOM 0 HD21 ASN A 17 0.272 14.994 -12.926 1.00 62.12 H new ATOM 0 HD22 ASN A 17 0.588 16.094 -14.272 1.00 62.12 H new ATOM 222 N VAL A 18 3.784 14.160 -18.257 1.00 63.51 N ATOM 223 CA VAL A 18 4.584 14.564 -19.407 1.00 4.53 C ATOM 224 C VAL A 18 3.728 14.664 -20.664 1.00 44.43 C ATOM 225 O VAL A 18 4.020 15.450 -21.567 1.00 14.01 O ATOM 226 CB VAL A 18 5.739 13.578 -19.662 1.00 63.12 C ATOM 227 CG1 VAL A 18 5.200 12.229 -20.112 1.00 73.21 C ATOM 228 CG2 VAL A 18 6.706 14.145 -20.691 1.00 71.31 C ATOM 0 H VAL A 18 4.162 13.367 -17.738 1.00 63.51 H new ATOM 0 HA VAL A 18 4.999 15.545 -19.175 1.00 4.53 H new ATOM 0 HB VAL A 18 6.282 13.432 -18.728 1.00 63.12 H new ATOM 0 HG11 VAL A 18 6.031 11.545 -20.287 1.00 73.21 H new ATOM 0 HG12 VAL A 18 4.551 11.820 -19.338 1.00 73.21 H new ATOM 0 HG13 VAL A 18 4.632 12.353 -21.034 1.00 73.21 H new ATOM 0 HG21 VAL A 18 7.516 13.435 -20.859 1.00 71.31 H new ATOM 0 HG22 VAL A 18 6.178 14.321 -21.628 1.00 71.31 H new ATOM 0 HG23 VAL A 18 7.118 15.085 -20.324 1.00 71.31 H new ATOM 238 N THR A 19 2.669 13.863 -20.718 1.00 30.02 N ATOM 239 CA THR A 19 1.770 13.860 -21.865 1.00 10.12 C ATOM 240 C THR A 19 0.644 14.872 -21.684 1.00 4.03 C ATOM 241 O THR A 19 0.369 15.675 -22.574 1.00 5.40 O ATOM 242 CB THR A 19 1.159 12.465 -22.096 1.00 53.30 C ATOM 243 OG1 THR A 19 2.196 11.511 -22.348 1.00 4.25 O ATOM 244 CG2 THR A 19 0.188 12.487 -23.267 1.00 42.13 C ATOM 0 H THR A 19 2.413 13.207 -19.980 1.00 30.02 H new ATOM 0 HA THR A 19 2.366 14.136 -22.735 1.00 10.12 H new ATOM 0 HB THR A 19 0.613 12.178 -21.197 1.00 53.30 H new ATOM 0 HG1 THR A 19 1.799 10.627 -22.492 1.00 4.25 H new ATOM 0 HG21 THR A 19 -0.231 11.491 -23.411 1.00 42.13 H new ATOM 0 HG22 THR A 19 -0.617 13.192 -23.059 1.00 42.13 H new ATOM 0 HG23 THR A 19 0.715 12.793 -24.171 1.00 42.13 H new ATOM 252 N GLY A 20 -0.004 14.828 -20.524 1.00 32.12 N ATOM 253 CA GLY A 20 -1.093 15.747 -20.247 1.00 63.00 C ATOM 254 C GLY A 20 -0.706 17.193 -20.488 1.00 71.30 C ATOM 255 O GLY A 20 -1.390 17.913 -21.216 1.00 15.20 O ATOM 0 H GLY A 20 0.206 14.173 -19.771 1.00 32.12 H new ATOM 0 HA2 GLY A 20 -1.947 15.493 -20.875 1.00 63.00 H new ATOM 0 HA3 GLY A 20 -1.411 15.627 -19.211 1.00 63.00 H new ATOM 259 N LEU A 21 0.392 17.620 -19.875 1.00 22.20 N ATOM 260 CA LEU A 21 0.868 18.991 -20.025 1.00 64.51 C ATOM 261 C LEU A 21 0.982 19.369 -21.498 1.00 41.23 C ATOM 262 O LEU A 21 0.705 20.506 -21.881 1.00 44.11 O ATOM 263 CB LEU A 21 2.224 19.158 -19.337 1.00 45.45 C ATOM 264 CG LEU A 21 3.425 18.548 -20.062 1.00 53.23 C ATOM 265 CD1 LEU A 21 4.033 19.554 -21.027 1.00 64.11 C ATOM 266 CD2 LEU A 21 4.466 18.070 -19.061 1.00 33.32 C ATOM 0 H LEU A 21 0.970 17.037 -19.269 1.00 22.20 H new ATOM 0 HA LEU A 21 0.144 19.655 -19.554 1.00 64.51 H new ATOM 0 HB2 LEU A 21 2.411 20.223 -19.200 1.00 45.45 H new ATOM 0 HB3 LEU A 21 2.162 18.715 -18.343 1.00 45.45 H new ATOM 0 HG LEU A 21 3.080 17.688 -20.636 1.00 53.23 H new ATOM 0 HD11 LEU A 21 4.886 19.103 -21.534 1.00 64.11 H new ATOM 0 HD12 LEU A 21 3.286 19.847 -21.765 1.00 64.11 H new ATOM 0 HD13 LEU A 21 4.363 20.434 -20.475 1.00 64.11 H new ATOM 0 HD21 LEU A 21 5.313 17.639 -19.595 1.00 33.32 H new ATOM 0 HD22 LEU A 21 4.807 18.913 -18.460 1.00 33.32 H new ATOM 0 HD23 LEU A 21 4.025 17.315 -18.410 1.00 33.32 H new ATOM 278 N VAL A 22 1.389 18.408 -22.321 1.00 43.14 N ATOM 279 CA VAL A 22 1.536 18.639 -23.753 1.00 43.44 C ATOM 280 C VAL A 22 0.184 18.892 -24.411 1.00 22.40 C ATOM 281 O VAL A 22 0.067 19.714 -25.319 1.00 53.34 O ATOM 282 CB VAL A 22 2.218 17.445 -24.448 1.00 12.32 C ATOM 283 CG1 VAL A 22 2.321 17.687 -25.946 1.00 24.30 C ATOM 284 CG2 VAL A 22 3.591 17.191 -23.844 1.00 53.11 C ATOM 0 H VAL A 22 1.623 17.462 -22.020 1.00 43.14 H new ATOM 0 HA VAL A 22 2.163 19.523 -23.868 1.00 43.44 H new ATOM 0 HB VAL A 22 1.607 16.556 -24.290 1.00 12.32 H new ATOM 0 HG11 VAL A 22 2.805 16.833 -26.420 1.00 24.30 H new ATOM 0 HG12 VAL A 22 1.322 17.815 -26.363 1.00 24.30 H new ATOM 0 HG13 VAL A 22 2.909 18.586 -26.130 1.00 24.30 H new ATOM 0 HG21 VAL A 22 4.059 16.344 -24.347 1.00 53.11 H new ATOM 0 HG22 VAL A 22 4.213 18.077 -23.970 1.00 53.11 H new ATOM 0 HG23 VAL A 22 3.486 16.970 -22.782 1.00 53.11 H new ATOM 294 N LYS A 23 -0.836 18.178 -23.946 1.00 1.41 N ATOM 295 CA LYS A 23 -2.182 18.325 -24.487 1.00 30.04 C ATOM 296 C LYS A 23 -2.684 19.755 -24.315 1.00 54.04 C ATOM 297 O LYS A 23 -3.367 20.291 -25.188 1.00 11.55 O ATOM 298 CB LYS A 23 -3.140 17.351 -23.797 1.00 23.32 C ATOM 299 CG LYS A 23 -2.702 15.899 -23.889 1.00 43.31 C ATOM 300 CD LYS A 23 -3.007 15.311 -25.256 1.00 72.52 C ATOM 301 CE LYS A 23 -2.693 13.823 -25.305 1.00 44.35 C ATOM 302 NZ LYS A 23 -3.199 13.190 -26.554 1.00 55.14 N ATOM 0 H LYS A 23 -0.756 17.492 -23.196 1.00 1.41 H new ATOM 0 HA LYS A 23 -2.146 18.097 -25.552 1.00 30.04 H new ATOM 0 HB2 LYS A 23 -3.232 17.628 -22.747 1.00 23.32 H new ATOM 0 HB3 LYS A 23 -4.130 17.452 -24.242 1.00 23.32 H new ATOM 0 HG2 LYS A 23 -1.632 15.827 -23.691 1.00 43.31 H new ATOM 0 HG3 LYS A 23 -3.208 15.316 -23.120 1.00 43.31 H new ATOM 0 HD2 LYS A 23 -4.058 15.470 -25.495 1.00 72.52 H new ATOM 0 HD3 LYS A 23 -2.425 15.832 -26.016 1.00 72.52 H new ATOM 0 HE2 LYS A 23 -1.615 13.677 -25.235 1.00 44.35 H new ATOM 0 HE3 LYS A 23 -3.139 13.329 -24.441 1.00 44.35 H new ATOM 0 HZ1 LYS A 23 -2.782 12.243 -26.656 1.00 55.14 H new ATOM 0 HZ2 LYS A 23 -4.235 13.110 -26.507 1.00 55.14 H new ATOM 0 HZ3 LYS A 23 -2.934 13.775 -27.372 1.00 55.14 H new ATOM 316 N ALA A 24 -2.341 20.367 -23.187 1.00 3.10 N ATOM 317 CA ALA A 24 -2.754 21.736 -22.904 1.00 30.11 C ATOM 318 C ALA A 24 -1.923 22.736 -23.701 1.00 14.13 C ATOM 319 O ALA A 24 -2.462 23.663 -24.306 1.00 70.00 O ATOM 320 CB ALA A 24 -2.643 22.023 -21.414 1.00 10.22 C ATOM 0 H ALA A 24 -1.778 19.936 -22.454 1.00 3.10 H new ATOM 0 HA ALA A 24 -3.795 21.846 -23.207 1.00 30.11 H new ATOM 0 HB1 ALA A 24 -2.954 23.049 -21.217 1.00 10.22 H new ATOM 0 HB2 ALA A 24 -3.285 21.336 -20.862 1.00 10.22 H new ATOM 0 HB3 ALA A 24 -1.610 21.890 -21.094 1.00 10.22 H new ATOM 326 N VAL A 25 -0.608 22.543 -23.696 1.00 72.11 N ATOM 327 CA VAL A 25 0.297 23.428 -24.419 1.00 41.11 C ATOM 328 C VAL A 25 -0.138 23.593 -25.871 1.00 33.12 C ATOM 329 O VAL A 25 -0.106 24.696 -26.417 1.00 75.14 O ATOM 330 CB VAL A 25 1.744 22.901 -24.385 1.00 72.32 C ATOM 331 CG1 VAL A 25 2.668 23.827 -25.161 1.00 23.14 C ATOM 332 CG2 VAL A 25 2.218 22.740 -22.949 1.00 4.42 C ATOM 0 H VAL A 25 -0.146 21.782 -23.199 1.00 72.11 H new ATOM 0 HA VAL A 25 0.259 24.396 -23.919 1.00 41.11 H new ATOM 0 HB VAL A 25 1.767 21.921 -24.863 1.00 72.32 H new ATOM 0 HG11 VAL A 25 3.686 23.439 -25.126 1.00 23.14 H new ATOM 0 HG12 VAL A 25 2.338 23.885 -26.198 1.00 23.14 H new ATOM 0 HG13 VAL A 25 2.644 24.822 -24.716 1.00 23.14 H new ATOM 0 HG21 VAL A 25 3.242 22.367 -22.944 1.00 4.42 H new ATOM 0 HG22 VAL A 25 2.181 23.705 -22.443 1.00 4.42 H new ATOM 0 HG23 VAL A 25 1.571 22.033 -22.430 1.00 4.42 H new ATOM 342 N ILE A 26 -0.545 22.490 -26.489 1.00 71.35 N ATOM 343 CA ILE A 26 -0.989 22.512 -27.878 1.00 3.42 C ATOM 344 C ILE A 26 -2.408 23.058 -27.993 1.00 0.15 C ATOM 345 O ILE A 26 -2.685 23.925 -28.821 1.00 24.20 O ATOM 346 CB ILE A 26 -0.938 21.108 -28.508 1.00 12.00 C ATOM 347 CG1 ILE A 26 0.475 20.530 -28.405 1.00 73.25 C ATOM 348 CG2 ILE A 26 -1.390 21.162 -29.960 1.00 11.43 C ATOM 349 CD1 ILE A 26 0.567 19.081 -28.832 1.00 1.34 C ATOM 0 H ILE A 26 -0.577 21.570 -26.050 1.00 71.35 H new ATOM 0 HA ILE A 26 -0.305 23.168 -28.417 1.00 3.42 H new ATOM 0 HB ILE A 26 -1.618 20.455 -27.961 1.00 12.00 H new ATOM 0 HG12 ILE A 26 1.148 21.126 -29.021 1.00 73.25 H new ATOM 0 HG13 ILE A 26 0.822 20.620 -27.376 1.00 73.25 H new ATOM 0 HG21 ILE A 26 -1.348 20.162 -30.391 1.00 11.43 H new ATOM 0 HG22 ILE A 26 -2.413 21.536 -30.009 1.00 11.43 H new ATOM 0 HG23 ILE A 26 -0.733 21.827 -30.521 1.00 11.43 H new ATOM 0 HD11 ILE A 26 1.597 18.737 -28.733 1.00 1.34 H new ATOM 0 HD12 ILE A 26 -0.081 18.474 -28.200 1.00 1.34 H new ATOM 0 HD13 ILE A 26 0.251 18.987 -29.871 1.00 1.34 H new ATOM 361 N GLU A 27 -3.303 22.545 -27.154 1.00 10.31 N ATOM 362 CA GLU A 27 -4.694 22.983 -27.161 1.00 70.32 C ATOM 363 C GLU A 27 -4.787 24.503 -27.074 1.00 3.32 C ATOM 364 O GLU A 27 -5.497 25.138 -27.853 1.00 45.13 O ATOM 365 CB GLU A 27 -5.458 22.347 -25.998 1.00 60.50 C ATOM 366 CG GLU A 27 -6.915 22.771 -25.922 1.00 71.44 C ATOM 367 CD GLU A 27 -7.870 21.595 -25.999 1.00 64.14 C ATOM 368 OE1 GLU A 27 -8.055 21.054 -27.110 1.00 24.54 O ATOM 369 OE2 GLU A 27 -8.432 21.217 -24.951 1.00 24.55 O ATOM 0 H GLU A 27 -3.090 21.827 -26.462 1.00 10.31 H new ATOM 0 HA GLU A 27 -5.144 22.662 -28.101 1.00 70.32 H new ATOM 0 HB2 GLU A 27 -5.409 21.262 -26.092 1.00 60.50 H new ATOM 0 HB3 GLU A 27 -4.963 22.609 -25.063 1.00 60.50 H new ATOM 0 HG2 GLU A 27 -7.084 23.311 -24.990 1.00 71.44 H new ATOM 0 HG3 GLU A 27 -7.131 23.463 -26.736 1.00 71.44 H new ATOM 376 N MET A 28 -4.065 25.080 -26.119 1.00 5.31 N ATOM 377 CA MET A 28 -4.065 26.526 -25.930 1.00 4.35 C ATOM 378 C MET A 28 -3.640 27.242 -27.208 1.00 11.00 C ATOM 379 O MET A 28 -4.269 28.215 -27.624 1.00 1.24 O ATOM 380 CB MET A 28 -3.130 26.912 -24.781 1.00 72.21 C ATOM 381 CG MET A 28 -3.311 28.344 -24.305 1.00 42.14 C ATOM 382 SD MET A 28 -1.816 29.334 -24.498 1.00 22.45 S ATOM 383 CE MET A 28 -0.655 28.388 -23.514 1.00 14.45 C ATOM 0 H MET A 28 -3.473 24.569 -25.464 1.00 5.31 H new ATOM 0 HA MET A 28 -5.081 26.834 -25.682 1.00 4.35 H new ATOM 0 HB2 MET A 28 -3.299 26.235 -23.943 1.00 72.21 H new ATOM 0 HB3 MET A 28 -2.097 26.772 -25.101 1.00 72.21 H new ATOM 0 HG2 MET A 28 -4.124 28.808 -24.863 1.00 42.14 H new ATOM 0 HG3 MET A 28 -3.606 28.339 -23.256 1.00 42.14 H new ATOM 0 HE1 MET A 28 -0.018 29.068 -22.949 1.00 14.45 H new ATOM 0 HE2 MET A 28 -1.202 27.746 -22.823 1.00 14.45 H new ATOM 0 HE3 MET A 28 -0.038 27.773 -24.170 1.00 14.45 H new ATOM 393 N SER A 29 -2.570 26.754 -27.827 1.00 22.22 N ATOM 394 CA SER A 29 -2.059 27.350 -29.056 1.00 33.22 C ATOM 395 C SER A 29 -3.116 27.317 -30.155 1.00 73.04 C ATOM 396 O SER A 29 -3.050 28.080 -31.119 1.00 2.43 O ATOM 397 CB SER A 29 -0.801 26.614 -29.520 1.00 60.21 C ATOM 398 OG SER A 29 0.222 26.686 -28.542 1.00 70.51 O ATOM 0 H SER A 29 -2.040 25.947 -27.498 1.00 22.22 H new ATOM 0 HA SER A 29 -1.807 28.390 -28.849 1.00 33.22 H new ATOM 0 HB2 SER A 29 -1.041 25.570 -29.724 1.00 60.21 H new ATOM 0 HB3 SER A 29 -0.446 27.048 -30.455 1.00 60.21 H new ATOM 0 HG SER A 29 0.067 26.004 -27.855 1.00 70.51 H new ATOM 404 N SER A 30 -4.091 26.427 -30.004 1.00 35.53 N ATOM 405 CA SER A 30 -5.162 26.290 -30.985 1.00 4.21 C ATOM 406 C SER A 30 -6.145 27.452 -30.881 1.00 41.03 C ATOM 407 O SER A 30 -6.361 28.186 -31.846 1.00 13.02 O ATOM 408 CB SER A 30 -5.898 24.964 -30.786 1.00 54.22 C ATOM 409 OG SER A 30 -6.579 24.577 -31.967 1.00 51.13 O ATOM 0 H SER A 30 -4.162 25.789 -29.211 1.00 35.53 H new ATOM 0 HA SER A 30 -4.715 26.303 -31.979 1.00 4.21 H new ATOM 0 HB2 SER A 30 -5.187 24.189 -30.502 1.00 54.22 H new ATOM 0 HB3 SER A 30 -6.610 25.059 -29.966 1.00 54.22 H new ATOM 0 HG SER A 30 -7.040 23.726 -31.815 1.00 51.13 H new ATOM 415 N LYS A 31 -6.739 27.613 -29.704 1.00 4.04 N ATOM 416 CA LYS A 31 -7.699 28.685 -29.470 1.00 44.44 C ATOM 417 C LYS A 31 -7.018 29.899 -28.846 1.00 44.22 C ATOM 418 O LYS A 31 -7.665 30.716 -28.191 1.00 5.44 O ATOM 419 CB LYS A 31 -8.828 28.197 -28.561 1.00 15.42 C ATOM 420 CG LYS A 31 -10.199 28.245 -29.214 1.00 1.30 C ATOM 421 CD LYS A 31 -10.769 26.851 -29.418 1.00 4.45 C ATOM 422 CE LYS A 31 -11.799 26.828 -30.536 1.00 42.33 C ATOM 423 NZ LYS A 31 -13.004 26.038 -30.164 1.00 34.41 N ATOM 0 H LYS A 31 -6.572 27.014 -28.896 1.00 4.04 H new ATOM 0 HA LYS A 31 -8.118 28.980 -30.432 1.00 44.44 H new ATOM 0 HB2 LYS A 31 -8.618 27.173 -28.252 1.00 15.42 H new ATOM 0 HB3 LYS A 31 -8.844 28.806 -27.657 1.00 15.42 H new ATOM 0 HG2 LYS A 31 -10.878 28.830 -28.593 1.00 1.30 H new ATOM 0 HG3 LYS A 31 -10.128 28.754 -30.175 1.00 1.30 H new ATOM 0 HD2 LYS A 31 -9.961 26.157 -29.652 1.00 4.45 H new ATOM 0 HD3 LYS A 31 -11.228 26.505 -28.492 1.00 4.45 H new ATOM 0 HE2 LYS A 31 -12.095 27.849 -30.778 1.00 42.33 H new ATOM 0 HE3 LYS A 31 -11.350 26.404 -31.434 1.00 42.33 H new ATOM 0 HZ1 LYS A 31 -13.682 26.047 -30.953 1.00 34.41 H new ATOM 0 HZ2 LYS A 31 -12.726 25.057 -29.957 1.00 34.41 H new ATOM 0 HZ3 LYS A 31 -13.447 26.457 -29.322 1.00 34.41 H new ATOM 437 N ILE A 32 -5.710 30.011 -29.055 1.00 72.04 N ATOM 438 CA ILE A 32 -4.943 31.127 -28.515 1.00 73.42 C ATOM 439 C ILE A 32 -5.453 32.458 -29.057 1.00 34.32 C ATOM 440 O ILE A 32 -5.548 33.441 -28.323 1.00 54.22 O ATOM 441 CB ILE A 32 -3.445 30.992 -28.845 1.00 21.55 C ATOM 442 CG1 ILE A 32 -2.669 32.188 -28.291 1.00 2.23 C ATOM 443 CG2 ILE A 32 -3.242 30.871 -30.347 1.00 43.14 C ATOM 444 CD1 ILE A 32 -2.761 32.325 -26.787 1.00 73.11 C ATOM 0 H ILE A 32 -5.160 29.343 -29.594 1.00 72.04 H new ATOM 0 HA ILE A 32 -5.072 31.104 -27.433 1.00 73.42 H new ATOM 0 HB ILE A 32 -3.064 30.086 -28.373 1.00 21.55 H new ATOM 0 HG12 ILE A 32 -1.621 32.094 -28.576 1.00 2.23 H new ATOM 0 HG13 ILE A 32 -3.044 33.100 -28.754 1.00 2.23 H new ATOM 0 HG21 ILE A 32 -2.178 30.776 -30.564 1.00 43.14 H new ATOM 0 HG22 ILE A 32 -3.767 29.990 -30.715 1.00 43.14 H new ATOM 0 HG23 ILE A 32 -3.635 31.760 -30.840 1.00 43.14 H new ATOM 0 HD11 ILE A 32 -2.187 33.194 -26.465 1.00 73.11 H new ATOM 0 HD12 ILE A 32 -3.804 32.451 -26.496 1.00 73.11 H new ATOM 0 HD13 ILE A 32 -2.358 31.429 -26.315 1.00 73.11 H new ATOM 456 N GLN A 33 -5.782 32.480 -30.344 1.00 64.35 N ATOM 457 CA GLN A 33 -6.283 33.690 -30.984 1.00 15.21 C ATOM 458 C GLN A 33 -7.589 34.145 -30.340 1.00 73.41 C ATOM 459 O GLN A 33 -7.689 35.240 -29.787 1.00 50.24 O ATOM 460 CB GLN A 33 -6.494 33.452 -32.480 1.00 55.11 C ATOM 461 CG GLN A 33 -5.442 34.113 -33.356 1.00 22.34 C ATOM 462 CD GLN A 33 -5.894 35.453 -33.901 1.00 63.00 C ATOM 463 OE1 GLN A 33 -7.058 35.629 -34.262 1.00 63.34 O ATOM 464 NE2 GLN A 33 -4.973 36.408 -33.963 1.00 71.14 N ATOM 0 H GLN A 33 -5.711 31.673 -30.964 1.00 64.35 H new ATOM 0 HA GLN A 33 -5.540 34.476 -30.850 1.00 15.21 H new ATOM 0 HB2 GLN A 33 -6.493 32.379 -32.672 1.00 55.11 H new ATOM 0 HB3 GLN A 33 -7.478 33.826 -32.764 1.00 55.11 H new ATOM 0 HG2 GLN A 33 -4.528 34.250 -32.779 1.00 22.34 H new ATOM 0 HG3 GLN A 33 -5.198 33.451 -34.187 1.00 22.34 H new ATOM 0 HE21 GLN A 33 -4.020 36.218 -33.653 1.00 71.14 H new ATOM 0 HE22 GLN A 33 -5.219 37.331 -34.321 1.00 71.14 H new ATOM 473 N PRO A 34 -8.616 33.284 -30.412 1.00 41.33 N ATOM 474 CA PRO A 34 -9.934 33.576 -29.842 1.00 34.43 C ATOM 475 C PRO A 34 -9.918 33.580 -28.317 1.00 0.20 C ATOM 476 O PRO A 34 -10.906 33.938 -27.677 1.00 54.34 O ATOM 477 CB PRO A 34 -10.807 32.432 -30.364 1.00 33.44 C ATOM 478 CG PRO A 34 -9.855 31.315 -30.621 1.00 41.40 C ATOM 479 CD PRO A 34 -8.568 31.961 -31.056 1.00 74.21 C ATOM 0 HA PRO A 34 -10.290 34.566 -30.125 1.00 34.43 H new ATOM 0 HB2 PRO A 34 -11.564 32.147 -29.633 1.00 33.44 H new ATOM 0 HB3 PRO A 34 -11.334 32.720 -31.274 1.00 33.44 H new ATOM 0 HG2 PRO A 34 -9.707 30.714 -29.724 1.00 41.40 H new ATOM 0 HG3 PRO A 34 -10.237 30.646 -31.393 1.00 41.40 H new ATOM 0 HD2 PRO A 34 -7.700 31.387 -30.731 1.00 74.21 H new ATOM 0 HD3 PRO A 34 -8.507 32.044 -32.141 1.00 74.21 H new ATOM 487 N ALA A 35 -8.789 33.181 -27.741 1.00 30.43 N ATOM 488 CA ALA A 35 -8.644 33.141 -26.291 1.00 3.41 C ATOM 489 C ALA A 35 -9.132 34.439 -25.655 1.00 23.41 C ATOM 490 O ALA A 35 -8.489 35.484 -25.748 1.00 43.34 O ATOM 491 CB ALA A 35 -7.193 32.879 -25.913 1.00 35.12 C ATOM 0 H ALA A 35 -7.961 32.881 -28.256 1.00 30.43 H new ATOM 0 HA ALA A 35 -9.260 32.326 -25.911 1.00 3.41 H new ATOM 0 HB1 ALA A 35 -7.099 32.852 -24.827 1.00 35.12 H new ATOM 0 HB2 ALA A 35 -6.876 31.923 -26.329 1.00 35.12 H new ATOM 0 HB3 ALA A 35 -6.564 33.675 -26.312 1.00 35.12 H new ATOM 497 N PRO A 36 -10.296 34.372 -24.993 1.00 13.33 N ATOM 498 CA PRO A 36 -10.896 35.533 -24.328 1.00 53.24 C ATOM 499 C PRO A 36 -10.109 35.968 -23.097 1.00 64.13 C ATOM 500 O PRO A 36 -9.218 35.264 -22.620 1.00 14.12 O ATOM 501 CB PRO A 36 -12.285 35.032 -23.925 1.00 54.30 C ATOM 502 CG PRO A 36 -12.136 33.555 -23.809 1.00 32.51 C ATOM 503 CD PRO A 36 -11.117 33.159 -24.841 1.00 24.11 C ATOM 0 HA PRO A 36 -10.915 36.409 -24.976 1.00 53.24 H new ATOM 0 HB2 PRO A 36 -12.606 35.473 -22.981 1.00 54.30 H new ATOM 0 HB3 PRO A 36 -13.033 35.297 -24.672 1.00 54.30 H new ATOM 0 HG2 PRO A 36 -11.808 33.273 -22.808 1.00 32.51 H new ATOM 0 HG3 PRO A 36 -13.087 33.052 -23.986 1.00 32.51 H new ATOM 0 HD2 PRO A 36 -10.520 32.309 -24.511 1.00 24.11 H new ATOM 0 HD3 PRO A 36 -11.588 32.872 -25.781 1.00 24.11 H new ATOM 511 N PRO A 37 -10.442 37.155 -22.569 1.00 61.03 N ATOM 512 CA PRO A 37 -9.778 37.709 -21.386 1.00 2.52 C ATOM 513 C PRO A 37 -10.119 36.938 -20.115 1.00 44.32 C ATOM 514 O PRO A 37 -9.405 37.024 -19.117 1.00 1.34 O ATOM 515 CB PRO A 37 -10.325 39.137 -21.308 1.00 72.21 C ATOM 516 CG PRO A 37 -11.643 39.075 -22.000 1.00 13.34 C ATOM 517 CD PRO A 37 -11.493 38.047 -23.087 1.00 11.15 C ATOM 0 HA PRO A 37 -8.692 37.657 -21.467 1.00 2.52 H new ATOM 0 HB2 PRO A 37 -10.436 39.463 -20.274 1.00 72.21 H new ATOM 0 HB3 PRO A 37 -9.655 39.845 -21.795 1.00 72.21 H new ATOM 0 HG2 PRO A 37 -12.435 38.796 -21.306 1.00 13.34 H new ATOM 0 HG3 PRO A 37 -11.911 40.046 -22.416 1.00 13.34 H new ATOM 0 HD2 PRO A 37 -12.425 37.510 -23.264 1.00 11.15 H new ATOM 0 HD3 PRO A 37 -11.203 38.502 -24.034 1.00 11.15 H new ATOM 525 N GLU A 38 -11.213 36.185 -20.161 1.00 51.20 N ATOM 526 CA GLU A 38 -11.647 35.399 -19.012 1.00 54.31 C ATOM 527 C GLU A 38 -10.953 34.040 -18.989 1.00 13.53 C ATOM 528 O GLU A 38 -10.874 33.391 -17.947 1.00 2.15 O ATOM 529 CB GLU A 38 -13.165 35.209 -19.041 1.00 33.50 C ATOM 530 CG GLU A 38 -13.891 35.930 -17.918 1.00 1.21 C ATOM 531 CD GLU A 38 -14.926 36.913 -18.429 1.00 53.01 C ATOM 532 OE1 GLU A 38 -14.542 38.041 -18.801 1.00 4.33 O ATOM 533 OE2 GLU A 38 -16.122 36.553 -18.458 1.00 21.13 O ATOM 0 H GLU A 38 -11.815 36.103 -20.981 1.00 51.20 H new ATOM 0 HA GLU A 38 -11.373 35.942 -18.108 1.00 54.31 H new ATOM 0 HB2 GLU A 38 -13.549 35.564 -19.997 1.00 33.50 H new ATOM 0 HB3 GLU A 38 -13.390 34.144 -18.983 1.00 33.50 H new ATOM 0 HG2 GLU A 38 -14.378 35.196 -17.276 1.00 1.21 H new ATOM 0 HG3 GLU A 38 -13.164 36.460 -17.302 1.00 1.21 H new ATOM 540 N GLU A 39 -10.453 33.618 -20.146 1.00 34.23 N ATOM 541 CA GLU A 39 -9.768 32.336 -20.258 1.00 64.10 C ATOM 542 C GLU A 39 -8.254 32.525 -20.233 1.00 24.22 C ATOM 543 O GLU A 39 -7.502 31.574 -20.016 1.00 60.12 O ATOM 544 CB GLU A 39 -10.182 31.622 -21.546 1.00 71.32 C ATOM 545 CG GLU A 39 -11.596 31.067 -21.507 1.00 21.54 C ATOM 546 CD GLU A 39 -11.744 29.918 -20.528 1.00 73.31 C ATOM 547 OE1 GLU A 39 -11.367 28.782 -20.884 1.00 60.10 O ATOM 548 OE2 GLU A 39 -12.238 30.155 -19.406 1.00 1.23 O ATOM 0 H GLU A 39 -10.509 34.144 -21.018 1.00 34.23 H new ATOM 0 HA GLU A 39 -10.055 31.724 -19.403 1.00 64.10 H new ATOM 0 HB2 GLU A 39 -10.097 32.318 -22.381 1.00 71.32 H new ATOM 0 HB3 GLU A 39 -9.486 30.806 -21.739 1.00 71.32 H new ATOM 0 HG2 GLU A 39 -12.288 31.864 -21.234 1.00 21.54 H new ATOM 0 HG3 GLU A 39 -11.877 30.729 -22.504 1.00 21.54 H new ATOM 555 N TYR A 40 -7.814 33.758 -20.456 1.00 44.02 N ATOM 556 CA TYR A 40 -6.390 34.072 -20.462 1.00 42.14 C ATOM 557 C TYR A 40 -5.816 34.026 -19.050 1.00 24.33 C ATOM 558 O TYR A 40 -4.738 33.475 -18.822 1.00 52.15 O ATOM 559 CB TYR A 40 -6.153 35.453 -21.076 1.00 15.32 C ATOM 560 CG TYR A 40 -5.223 35.435 -22.267 1.00 44.51 C ATOM 561 CD1 TYR A 40 -5.425 34.550 -23.319 1.00 34.04 C ATOM 562 CD2 TYR A 40 -4.140 36.303 -22.341 1.00 40.10 C ATOM 563 CE1 TYR A 40 -4.577 34.530 -24.409 1.00 32.51 C ATOM 564 CE2 TYR A 40 -3.288 36.291 -23.428 1.00 24.30 C ATOM 565 CZ TYR A 40 -3.510 35.402 -24.459 1.00 51.12 C ATOM 566 OH TYR A 40 -2.662 35.386 -25.543 1.00 34.40 O ATOM 0 H TYR A 40 -8.423 34.557 -20.635 1.00 44.02 H new ATOM 0 HA TYR A 40 -5.881 33.321 -21.066 1.00 42.14 H new ATOM 0 HB2 TYR A 40 -7.111 35.875 -21.380 1.00 15.32 H new ATOM 0 HB3 TYR A 40 -5.741 36.114 -20.314 1.00 15.32 H new ATOM 0 HD1 TYR A 40 -6.260 33.866 -23.284 1.00 34.04 H new ATOM 0 HD2 TYR A 40 -3.962 36.999 -21.535 1.00 40.10 H new ATOM 0 HE1 TYR A 40 -4.749 33.835 -25.218 1.00 32.51 H new ATOM 0 HE2 TYR A 40 -2.452 36.974 -23.470 1.00 24.30 H new ATOM 0 HH TYR A 40 -1.964 36.063 -25.422 1.00 34.40 H new ATOM 576 N VAL A 41 -6.544 34.608 -18.102 1.00 71.04 N ATOM 577 CA VAL A 41 -6.110 34.633 -16.711 1.00 22.42 C ATOM 578 C VAL A 41 -5.757 33.233 -16.220 1.00 63.15 C ATOM 579 O VAL A 41 -4.642 32.969 -15.770 1.00 22.22 O ATOM 580 CB VAL A 41 -7.196 35.227 -15.794 1.00 62.14 C ATOM 581 CG1 VAL A 41 -7.122 34.607 -14.407 1.00 43.51 C ATOM 582 CG2 VAL A 41 -7.060 36.740 -15.720 1.00 4.14 C ATOM 0 H VAL A 41 -7.438 35.069 -18.273 1.00 71.04 H new ATOM 0 HA VAL A 41 -5.223 35.265 -16.668 1.00 22.42 H new ATOM 0 HB VAL A 41 -8.173 34.993 -16.217 1.00 62.14 H new ATOM 0 HG11 VAL A 41 -7.897 35.039 -13.774 1.00 43.51 H new ATOM 0 HG12 VAL A 41 -7.273 33.530 -14.481 1.00 43.51 H new ATOM 0 HG13 VAL A 41 -6.143 34.807 -13.971 1.00 43.51 H new ATOM 0 HG21 VAL A 41 -7.835 37.144 -15.068 1.00 4.14 H new ATOM 0 HG22 VAL A 41 -6.079 36.998 -15.321 1.00 4.14 H new ATOM 0 HG23 VAL A 41 -7.168 37.164 -16.718 1.00 4.14 H new ATOM 592 N PRO A 42 -6.728 32.312 -16.310 1.00 11.23 N ATOM 593 CA PRO A 42 -6.543 30.923 -15.881 1.00 34.41 C ATOM 594 C PRO A 42 -5.596 30.154 -16.796 1.00 54.44 C ATOM 595 O PRO A 42 -4.919 29.223 -16.363 1.00 21.10 O ATOM 596 CB PRO A 42 -7.955 30.337 -15.959 1.00 74.41 C ATOM 597 CG PRO A 42 -8.658 31.174 -16.971 1.00 44.43 C ATOM 598 CD PRO A 42 -8.081 32.557 -16.837 1.00 32.34 C ATOM 0 HA PRO A 42 -6.094 30.859 -14.890 1.00 34.41 H new ATOM 0 HB2 PRO A 42 -7.933 29.289 -16.259 1.00 74.41 H new ATOM 0 HB3 PRO A 42 -8.456 30.381 -14.992 1.00 74.41 H new ATOM 0 HG2 PRO A 42 -8.504 30.782 -17.976 1.00 44.43 H new ATOM 0 HG3 PRO A 42 -9.733 31.181 -16.793 1.00 44.43 H new ATOM 0 HD2 PRO A 42 -8.051 33.075 -17.796 1.00 32.34 H new ATOM 0 HD3 PRO A 42 -8.671 33.175 -16.159 1.00 32.34 H new ATOM 606 N MET A 43 -5.554 30.551 -18.064 1.00 13.51 N ATOM 607 CA MET A 43 -4.688 29.900 -19.040 1.00 11.41 C ATOM 608 C MET A 43 -3.264 29.779 -18.507 1.00 61.23 C ATOM 609 O MET A 43 -2.640 28.722 -18.610 1.00 51.42 O ATOM 610 CB MET A 43 -4.688 30.682 -20.355 1.00 71.12 C ATOM 611 CG MET A 43 -5.410 29.968 -21.486 1.00 72.13 C ATOM 612 SD MET A 43 -5.913 31.089 -22.806 1.00 73.30 S ATOM 613 CE MET A 43 -7.248 30.156 -23.552 1.00 63.33 C ATOM 0 H MET A 43 -6.109 31.320 -18.439 1.00 13.51 H new ATOM 0 HA MET A 43 -5.076 28.898 -19.222 1.00 11.41 H new ATOM 0 HB2 MET A 43 -5.156 31.652 -20.191 1.00 71.12 H new ATOM 0 HB3 MET A 43 -3.658 30.872 -20.655 1.00 71.12 H new ATOM 0 HG2 MET A 43 -4.759 29.197 -21.898 1.00 72.13 H new ATOM 0 HG3 MET A 43 -6.290 29.463 -21.088 1.00 72.13 H new ATOM 0 HE1 MET A 43 -7.988 30.844 -23.962 1.00 63.33 H new ATOM 0 HE2 MET A 43 -6.852 29.530 -24.352 1.00 63.33 H new ATOM 0 HE3 MET A 43 -7.717 29.525 -22.797 1.00 63.33 H new ATOM 623 N VAL A 44 -2.755 30.867 -17.938 1.00 22.21 N ATOM 624 CA VAL A 44 -1.404 30.881 -17.388 1.00 54.34 C ATOM 625 C VAL A 44 -1.275 29.907 -16.223 1.00 64.44 C ATOM 626 O VAL A 44 -0.213 29.323 -16.003 1.00 11.14 O ATOM 627 CB VAL A 44 -1.008 32.291 -16.911 1.00 30.13 C ATOM 628 CG1 VAL A 44 -1.628 32.589 -15.554 1.00 53.22 C ATOM 629 CG2 VAL A 44 0.506 32.428 -16.856 1.00 0.23 C ATOM 0 H VAL A 44 -3.257 31.750 -17.846 1.00 22.21 H new ATOM 0 HA VAL A 44 -0.732 30.574 -18.190 1.00 54.34 H new ATOM 0 HB VAL A 44 -1.390 33.019 -17.626 1.00 30.13 H new ATOM 0 HG11 VAL A 44 -1.337 33.589 -15.233 1.00 53.22 H new ATOM 0 HG12 VAL A 44 -2.714 32.534 -15.630 1.00 53.22 H new ATOM 0 HG13 VAL A 44 -1.278 31.858 -14.825 1.00 53.22 H new ATOM 0 HG21 VAL A 44 0.769 33.430 -16.517 1.00 0.23 H new ATOM 0 HG22 VAL A 44 0.913 31.692 -16.162 1.00 0.23 H new ATOM 0 HG23 VAL A 44 0.923 32.260 -17.849 1.00 0.23 H new ATOM 639 N LYS A 45 -2.362 29.734 -15.480 1.00 31.21 N ATOM 640 CA LYS A 45 -2.372 28.828 -14.337 1.00 53.13 C ATOM 641 C LYS A 45 -2.070 27.398 -14.774 1.00 4.24 C ATOM 642 O LYS A 45 -1.269 26.705 -14.147 1.00 13.25 O ATOM 643 CB LYS A 45 -3.729 28.881 -13.631 1.00 21.41 C ATOM 644 CG LYS A 45 -4.191 30.290 -13.305 1.00 3.42 C ATOM 645 CD LYS A 45 -3.205 31.003 -12.394 1.00 52.42 C ATOM 646 CE LYS A 45 -3.848 32.196 -11.703 1.00 3.13 C ATOM 647 NZ LYS A 45 -4.689 31.780 -10.546 1.00 44.03 N ATOM 0 H LYS A 45 -3.249 30.209 -15.649 1.00 31.21 H new ATOM 0 HA LYS A 45 -1.595 29.149 -13.643 1.00 53.13 H new ATOM 0 HB2 LYS A 45 -4.476 28.400 -14.262 1.00 21.41 H new ATOM 0 HB3 LYS A 45 -3.672 28.304 -12.708 1.00 21.41 H new ATOM 0 HG2 LYS A 45 -4.311 30.857 -14.228 1.00 3.42 H new ATOM 0 HG3 LYS A 45 -5.169 30.251 -12.825 1.00 3.42 H new ATOM 0 HD2 LYS A 45 -2.830 30.306 -11.645 1.00 52.42 H new ATOM 0 HD3 LYS A 45 -2.346 31.337 -12.976 1.00 52.42 H new ATOM 0 HE2 LYS A 45 -3.071 32.879 -11.360 1.00 3.13 H new ATOM 0 HE3 LYS A 45 -4.461 32.744 -12.419 1.00 3.13 H new ATOM 0 HZ1 LYS A 45 -5.109 32.621 -10.102 1.00 44.03 H new ATOM 0 HZ2 LYS A 45 -5.446 31.148 -10.877 1.00 44.03 H new ATOM 0 HZ3 LYS A 45 -4.100 31.280 -9.850 1.00 44.03 H new ATOM 661 N GLU A 46 -2.714 26.965 -15.853 1.00 23.53 N ATOM 662 CA GLU A 46 -2.512 25.617 -16.372 1.00 45.11 C ATOM 663 C GLU A 46 -1.053 25.399 -16.766 1.00 35.21 C ATOM 664 O GLU A 46 -0.382 24.512 -16.238 1.00 72.03 O ATOM 665 CB GLU A 46 -3.420 25.370 -17.579 1.00 4.14 C ATOM 666 CG GLU A 46 -4.901 25.489 -17.260 1.00 65.23 C ATOM 667 CD GLU A 46 -5.758 24.589 -18.129 1.00 20.01 C ATOM 668 OE1 GLU A 46 -5.920 23.403 -17.774 1.00 73.50 O ATOM 669 OE2 GLU A 46 -6.266 25.070 -19.163 1.00 11.42 O ATOM 0 H GLU A 46 -3.379 27.527 -16.384 1.00 23.53 H new ATOM 0 HA GLU A 46 -2.767 24.909 -15.583 1.00 45.11 H new ATOM 0 HB2 GLU A 46 -3.168 26.082 -18.365 1.00 4.14 H new ATOM 0 HB3 GLU A 46 -3.221 24.374 -17.975 1.00 4.14 H new ATOM 0 HG2 GLU A 46 -5.064 25.239 -16.212 1.00 65.23 H new ATOM 0 HG3 GLU A 46 -5.216 26.524 -17.394 1.00 65.23 H new ATOM 676 N VAL A 47 -0.570 26.214 -17.698 1.00 1.23 N ATOM 677 CA VAL A 47 0.808 26.112 -18.163 1.00 22.31 C ATOM 678 C VAL A 47 1.791 26.262 -17.007 1.00 71.01 C ATOM 679 O VAL A 47 2.814 25.580 -16.955 1.00 53.24 O ATOM 680 CB VAL A 47 1.121 27.177 -19.230 1.00 40.31 C ATOM 681 CG1 VAL A 47 0.825 28.571 -18.697 1.00 34.43 C ATOM 682 CG2 VAL A 47 2.569 27.068 -19.683 1.00 61.22 C ATOM 0 H VAL A 47 -1.113 26.952 -18.146 1.00 1.23 H new ATOM 0 HA VAL A 47 0.920 25.122 -18.605 1.00 22.31 H new ATOM 0 HB VAL A 47 0.479 27.000 -20.093 1.00 40.31 H new ATOM 0 HG11 VAL A 47 1.052 29.310 -19.465 1.00 34.43 H new ATOM 0 HG12 VAL A 47 -0.229 28.641 -18.427 1.00 34.43 H new ATOM 0 HG13 VAL A 47 1.439 28.762 -17.817 1.00 34.43 H new ATOM 0 HG21 VAL A 47 2.773 27.828 -20.437 1.00 61.22 H new ATOM 0 HG22 VAL A 47 3.230 27.218 -18.829 1.00 61.22 H new ATOM 0 HG23 VAL A 47 2.744 26.080 -20.108 1.00 61.22 H new ATOM 692 N GLY A 48 1.473 27.160 -16.080 1.00 13.24 N ATOM 693 CA GLY A 48 2.338 27.384 -14.936 1.00 34.20 C ATOM 694 C GLY A 48 2.452 26.161 -14.048 1.00 30.14 C ATOM 695 O GLY A 48 3.492 25.928 -13.430 1.00 61.44 O ATOM 0 H GLY A 48 0.632 27.737 -16.101 1.00 13.24 H new ATOM 0 HA2 GLY A 48 3.330 27.670 -15.285 1.00 34.20 H new ATOM 0 HA3 GLY A 48 1.953 28.219 -14.351 1.00 34.20 H new ATOM 699 N LEU A 49 1.381 25.378 -13.980 1.00 54.43 N ATOM 700 CA LEU A 49 1.364 24.173 -13.159 1.00 61.21 C ATOM 701 C LEU A 49 2.209 23.071 -13.792 1.00 11.55 C ATOM 702 O LEU A 49 2.891 22.321 -13.094 1.00 44.44 O ATOM 703 CB LEU A 49 -0.072 23.683 -12.967 1.00 31.33 C ATOM 704 CG LEU A 49 -0.402 23.094 -11.595 1.00 32.14 C ATOM 705 CD1 LEU A 49 -1.279 24.050 -10.800 1.00 64.24 C ATOM 706 CD2 LEU A 49 -1.084 21.742 -11.745 1.00 32.24 C ATOM 0 H LEU A 49 0.512 25.556 -14.484 1.00 54.43 H new ATOM 0 HA LEU A 49 1.790 24.420 -12.187 1.00 61.21 H new ATOM 0 HB2 LEU A 49 -0.748 24.518 -13.154 1.00 31.33 H new ATOM 0 HB3 LEU A 49 -0.281 22.928 -13.724 1.00 31.33 H new ATOM 0 HG LEU A 49 0.530 22.950 -11.049 1.00 32.14 H new ATOM 0 HD11 LEU A 49 -1.503 23.614 -9.827 1.00 64.24 H new ATOM 0 HD12 LEU A 49 -0.754 24.995 -10.662 1.00 64.24 H new ATOM 0 HD13 LEU A 49 -2.208 24.227 -11.341 1.00 64.24 H new ATOM 0 HD21 LEU A 49 -1.311 21.338 -10.759 1.00 32.24 H new ATOM 0 HD22 LEU A 49 -2.008 21.861 -12.310 1.00 32.24 H new ATOM 0 HD23 LEU A 49 -0.421 21.057 -12.274 1.00 32.24 H new ATOM 718 N ALA A 50 2.159 22.982 -15.117 1.00 23.04 N ATOM 719 CA ALA A 50 2.923 21.976 -15.843 1.00 61.54 C ATOM 720 C ALA A 50 4.415 22.107 -15.558 1.00 44.13 C ATOM 721 O ALA A 50 5.101 21.114 -15.310 1.00 74.04 O ATOM 722 CB ALA A 50 2.657 22.088 -17.337 1.00 43.12 C ATOM 0 H ALA A 50 1.598 23.594 -15.709 1.00 23.04 H new ATOM 0 HA ALA A 50 2.600 20.993 -15.500 1.00 61.54 H new ATOM 0 HB1 ALA A 50 3.234 21.330 -17.867 1.00 43.12 H new ATOM 0 HB2 ALA A 50 1.595 21.936 -17.530 1.00 43.12 H new ATOM 0 HB3 ALA A 50 2.951 23.078 -17.686 1.00 43.12 H new ATOM 728 N LEU A 51 4.914 23.338 -15.596 1.00 33.02 N ATOM 729 CA LEU A 51 6.326 23.600 -15.342 1.00 22.41 C ATOM 730 C LEU A 51 6.698 23.237 -13.908 1.00 11.34 C ATOM 731 O LEU A 51 7.589 22.421 -13.674 1.00 63.12 O ATOM 732 CB LEU A 51 6.649 25.071 -15.608 1.00 55.02 C ATOM 733 CG LEU A 51 6.740 25.483 -17.078 1.00 30.30 C ATOM 734 CD1 LEU A 51 5.767 26.613 -17.377 1.00 64.13 C ATOM 735 CD2 LEU A 51 8.162 25.894 -17.429 1.00 65.32 C ATOM 0 H LEU A 51 4.361 24.170 -15.800 1.00 33.02 H new ATOM 0 HA LEU A 51 6.912 22.978 -16.019 1.00 22.41 H new ATOM 0 HB2 LEU A 51 5.886 25.683 -15.127 1.00 55.02 H new ATOM 0 HB3 LEU A 51 7.598 25.307 -15.126 1.00 55.02 H new ATOM 0 HG LEU A 51 6.468 24.625 -17.694 1.00 30.30 H new ATOM 0 HD11 LEU A 51 5.846 26.893 -18.428 1.00 64.13 H new ATOM 0 HD12 LEU A 51 4.750 26.283 -17.165 1.00 64.13 H new ATOM 0 HD13 LEU A 51 6.007 27.474 -16.753 1.00 64.13 H new ATOM 0 HD21 LEU A 51 8.208 26.184 -18.479 1.00 65.32 H new ATOM 0 HD22 LEU A 51 8.461 26.737 -16.806 1.00 65.32 H new ATOM 0 HD23 LEU A 51 8.837 25.056 -17.254 1.00 65.32 H new ATOM 747 N ARG A 52 6.007 23.848 -12.950 1.00 44.45 N ATOM 748 CA ARG A 52 6.264 23.589 -11.539 1.00 3.41 C ATOM 749 C ARG A 52 6.151 22.099 -11.230 1.00 53.51 C ATOM 750 O ARG A 52 6.923 21.557 -10.439 1.00 0.12 O ATOM 751 CB ARG A 52 5.285 24.378 -10.667 1.00 70.14 C ATOM 752 CG ARG A 52 5.566 24.263 -9.178 1.00 61.42 C ATOM 753 CD ARG A 52 6.832 25.010 -8.791 1.00 4.22 C ATOM 754 NE ARG A 52 7.864 24.112 -8.279 1.00 73.41 N ATOM 755 CZ ARG A 52 7.843 23.589 -7.058 1.00 71.52 C ATOM 756 NH1 ARG A 52 6.849 23.873 -6.228 1.00 74.25 N ATOM 757 NH2 ARG A 52 8.818 22.779 -6.665 1.00 71.24 N ATOM 0 H ARG A 52 5.265 24.526 -13.126 1.00 44.45 H new ATOM 0 HA ARG A 52 7.281 23.912 -11.315 1.00 3.41 H new ATOM 0 HB2 ARG A 52 5.321 25.429 -10.955 1.00 70.14 H new ATOM 0 HB3 ARG A 52 4.272 24.028 -10.865 1.00 70.14 H new ATOM 0 HG2 ARG A 52 4.721 24.661 -8.615 1.00 61.42 H new ATOM 0 HG3 ARG A 52 5.664 23.212 -8.905 1.00 61.42 H new ATOM 0 HD2 ARG A 52 7.216 25.546 -9.659 1.00 4.22 H new ATOM 0 HD3 ARG A 52 6.594 25.758 -8.034 1.00 4.22 H new ATOM 0 HE ARG A 52 8.643 23.873 -8.892 1.00 73.41 H new ATOM 0 HH11 ARG A 52 6.097 24.495 -6.526 1.00 74.25 H new ATOM 0 HH12 ARG A 52 6.836 23.470 -5.291 1.00 74.25 H new ATOM 0 HH21 ARG A 52 9.584 22.558 -7.301 1.00 71.24 H new ATOM 0 HH22 ARG A 52 8.801 22.378 -5.727 1.00 71.24 H new ATOM 771 N THR A 53 5.182 21.442 -11.860 1.00 32.14 N ATOM 772 CA THR A 53 4.966 20.016 -11.651 1.00 74.23 C ATOM 773 C THR A 53 6.070 19.191 -12.303 1.00 54.31 C ATOM 774 O THR A 53 6.520 18.188 -11.748 1.00 14.01 O ATOM 775 CB THR A 53 3.604 19.566 -12.214 1.00 61.21 C ATOM 776 OG1 THR A 53 2.545 20.263 -11.550 1.00 14.25 O ATOM 777 CG2 THR A 53 3.417 18.066 -12.043 1.00 33.03 C ATOM 0 H THR A 53 4.535 21.875 -12.519 1.00 32.14 H new ATOM 0 HA THR A 53 4.979 19.849 -10.574 1.00 74.23 H new ATOM 0 HB THR A 53 3.580 19.800 -13.278 1.00 61.21 H new ATOM 0 HG1 THR A 53 2.403 21.131 -11.982 1.00 14.25 H new ATOM 0 HG21 THR A 53 2.449 17.772 -12.448 1.00 33.03 H new ATOM 0 HG22 THR A 53 4.208 17.538 -12.575 1.00 33.03 H new ATOM 0 HG23 THR A 53 3.460 17.812 -10.984 1.00 33.03 H new ATOM 785 N LEU A 54 6.503 19.620 -13.483 1.00 62.04 N ATOM 786 CA LEU A 54 7.557 18.921 -14.211 1.00 53.14 C ATOM 787 C LEU A 54 8.792 18.735 -13.336 1.00 41.23 C ATOM 788 O LEU A 54 9.469 17.709 -13.409 1.00 62.23 O ATOM 789 CB LEU A 54 7.927 19.694 -15.479 1.00 32.33 C ATOM 790 CG LEU A 54 7.064 19.416 -16.710 1.00 63.43 C ATOM 791 CD1 LEU A 54 7.148 20.573 -17.693 1.00 43.11 C ATOM 792 CD2 LEU A 54 7.490 18.116 -17.377 1.00 31.41 C ATOM 0 H LEU A 54 6.141 20.448 -13.956 1.00 62.04 H new ATOM 0 HA LEU A 54 7.181 17.937 -14.490 1.00 53.14 H new ATOM 0 HB2 LEU A 54 7.877 20.760 -15.258 1.00 32.33 H new ATOM 0 HB3 LEU A 54 8.964 19.469 -15.728 1.00 32.33 H new ATOM 0 HG LEU A 54 6.028 19.314 -16.388 1.00 63.43 H new ATOM 0 HD11 LEU A 54 6.527 20.357 -18.563 1.00 43.11 H new ATOM 0 HD12 LEU A 54 6.795 21.485 -17.212 1.00 43.11 H new ATOM 0 HD13 LEU A 54 8.182 20.707 -18.010 1.00 43.11 H new ATOM 0 HD21 LEU A 54 6.865 17.934 -18.251 1.00 31.41 H new ATOM 0 HD22 LEU A 54 8.533 18.190 -17.685 1.00 31.41 H new ATOM 0 HD23 LEU A 54 7.378 17.292 -16.673 1.00 31.41 H new ATOM 804 N LEU A 55 9.079 19.733 -12.508 1.00 3.12 N ATOM 805 CA LEU A 55 10.232 19.679 -11.616 1.00 5.21 C ATOM 806 C LEU A 55 10.103 18.525 -10.627 1.00 54.11 C ATOM 807 O LEU A 55 11.056 17.782 -10.397 1.00 72.51 O ATOM 808 CB LEU A 55 10.379 21.000 -10.859 1.00 13.41 C ATOM 809 CG LEU A 55 11.778 21.616 -10.848 1.00 42.52 C ATOM 810 CD1 LEU A 55 11.698 23.120 -10.635 1.00 52.11 C ATOM 811 CD2 LEU A 55 12.638 20.969 -9.773 1.00 32.35 C ATOM 0 H LEU A 55 8.529 20.589 -12.436 1.00 3.12 H new ATOM 0 HA LEU A 55 11.122 19.514 -12.224 1.00 5.21 H new ATOM 0 HB2 LEU A 55 9.689 21.723 -11.294 1.00 13.41 H new ATOM 0 HB3 LEU A 55 10.066 20.841 -9.827 1.00 13.41 H new ATOM 0 HG LEU A 55 12.242 21.431 -11.817 1.00 42.52 H new ATOM 0 HD11 LEU A 55 12.703 23.541 -10.630 1.00 52.11 H new ATOM 0 HD12 LEU A 55 11.120 23.571 -11.441 1.00 52.11 H new ATOM 0 HD13 LEU A 55 11.213 23.327 -9.681 1.00 52.11 H new ATOM 0 HD21 LEU A 55 13.630 21.420 -9.780 1.00 32.35 H new ATOM 0 HD22 LEU A 55 12.177 21.122 -8.797 1.00 32.35 H new ATOM 0 HD23 LEU A 55 12.724 19.900 -9.970 1.00 32.35 H new ATOM 823 N ALA A 56 8.916 18.381 -10.047 1.00 32.24 N ATOM 824 CA ALA A 56 8.660 17.315 -9.086 1.00 72.30 C ATOM 825 C ALA A 56 8.569 15.960 -9.780 1.00 42.25 C ATOM 826 O ALA A 56 9.126 14.969 -9.307 1.00 35.23 O ATOM 827 CB ALA A 56 7.382 17.599 -8.310 1.00 62.13 C ATOM 0 H ALA A 56 8.117 18.989 -10.226 1.00 32.24 H new ATOM 0 HA ALA A 56 9.496 17.281 -8.388 1.00 72.30 H new ATOM 0 HB1 ALA A 56 7.203 16.795 -7.596 1.00 62.13 H new ATOM 0 HB2 ALA A 56 7.483 18.543 -7.775 1.00 62.13 H new ATOM 0 HB3 ALA A 56 6.543 17.663 -9.002 1.00 62.13 H new ATOM 833 N THR A 57 7.864 15.924 -10.907 1.00 34.43 N ATOM 834 CA THR A 57 7.698 14.690 -11.665 1.00 44.24 C ATOM 835 C THR A 57 9.046 14.039 -11.956 1.00 34.33 C ATOM 836 O THR A 57 9.263 12.870 -11.635 1.00 43.14 O ATOM 837 CB THR A 57 6.966 14.943 -12.997 1.00 11.44 C ATOM 838 OG1 THR A 57 7.738 15.824 -13.821 1.00 31.32 O ATOM 839 CG2 THR A 57 5.591 15.546 -12.751 1.00 73.24 C ATOM 0 H THR A 57 7.399 16.735 -11.315 1.00 34.43 H new ATOM 0 HA THR A 57 7.098 14.019 -11.050 1.00 44.24 H new ATOM 0 HB THR A 57 6.841 13.987 -13.506 1.00 11.44 H new ATOM 0 HG1 THR A 57 8.201 16.478 -13.257 1.00 31.32 H new ATOM 0 HG21 THR A 57 5.092 15.716 -13.705 1.00 73.24 H new ATOM 0 HG22 THR A 57 4.996 14.861 -12.148 1.00 73.24 H new ATOM 0 HG23 THR A 57 5.698 16.494 -12.224 1.00 73.24 H new ATOM 847 N VAL A 58 9.948 14.802 -12.564 1.00 22.02 N ATOM 848 CA VAL A 58 11.276 14.299 -12.896 1.00 12.03 C ATOM 849 C VAL A 58 12.075 13.984 -11.636 1.00 72.22 C ATOM 850 O VAL A 58 12.911 13.080 -11.629 1.00 11.20 O ATOM 851 CB VAL A 58 12.062 15.311 -13.749 1.00 43.53 C ATOM 852 CG1 VAL A 58 12.368 16.565 -12.944 1.00 40.33 C ATOM 853 CG2 VAL A 58 13.342 14.682 -14.277 1.00 64.34 C ATOM 0 H VAL A 58 9.784 15.771 -12.837 1.00 22.02 H new ATOM 0 HA VAL A 58 11.133 13.384 -13.471 1.00 12.03 H new ATOM 0 HB VAL A 58 11.446 15.597 -14.601 1.00 43.53 H new ATOM 0 HG11 VAL A 58 12.924 17.269 -13.564 1.00 40.33 H new ATOM 0 HG12 VAL A 58 11.435 17.026 -12.620 1.00 40.33 H new ATOM 0 HG13 VAL A 58 12.965 16.300 -12.071 1.00 40.33 H new ATOM 0 HG21 VAL A 58 13.885 15.412 -14.878 1.00 64.34 H new ATOM 0 HG22 VAL A 58 13.964 14.366 -13.440 1.00 64.34 H new ATOM 0 HG23 VAL A 58 13.095 13.817 -14.892 1.00 64.34 H new ATOM 863 N ASP A 59 11.812 14.734 -10.572 1.00 54.21 N ATOM 864 CA ASP A 59 12.505 14.534 -9.305 1.00 10.11 C ATOM 865 C ASP A 59 12.429 13.074 -8.869 1.00 3.34 C ATOM 866 O ASP A 59 13.436 12.478 -8.489 1.00 63.53 O ATOM 867 CB ASP A 59 11.906 15.434 -8.223 1.00 54.34 C ATOM 868 CG ASP A 59 12.956 16.267 -7.515 1.00 42.04 C ATOM 869 OD1 ASP A 59 13.935 15.681 -7.008 1.00 23.14 O ATOM 870 OD2 ASP A 59 12.800 17.505 -7.470 1.00 71.00 O ATOM 0 H ASP A 59 11.123 15.486 -10.562 1.00 54.21 H new ATOM 0 HA ASP A 59 13.553 14.798 -9.447 1.00 10.11 H new ATOM 0 HB2 ASP A 59 11.165 16.095 -8.673 1.00 54.34 H new ATOM 0 HB3 ASP A 59 11.381 14.819 -7.492 1.00 54.34 H new ATOM 875 N GLU A 60 11.229 12.507 -8.925 1.00 35.44 N ATOM 876 CA GLU A 60 11.022 11.117 -8.533 1.00 42.21 C ATOM 877 C GLU A 60 11.463 10.168 -9.643 1.00 61.25 C ATOM 878 O GLU A 60 11.641 8.971 -9.417 1.00 73.03 O ATOM 879 CB GLU A 60 9.550 10.873 -8.193 1.00 5.11 C ATOM 880 CG GLU A 60 8.657 10.744 -9.415 1.00 33.32 C ATOM 881 CD GLU A 60 7.421 11.618 -9.329 1.00 41.41 C ATOM 882 OE1 GLU A 60 7.535 12.762 -8.840 1.00 25.40 O ATOM 883 OE2 GLU A 60 6.339 11.159 -9.752 1.00 3.11 O ATOM 0 H GLU A 60 10.385 12.988 -9.238 1.00 35.44 H new ATOM 0 HA GLU A 60 11.628 10.921 -7.649 1.00 42.21 H new ATOM 0 HB2 GLU A 60 9.469 9.964 -7.597 1.00 5.11 H new ATOM 0 HB3 GLU A 60 9.188 11.694 -7.574 1.00 5.11 H new ATOM 0 HG2 GLU A 60 9.225 11.012 -10.306 1.00 33.32 H new ATOM 0 HG3 GLU A 60 8.354 9.703 -9.531 1.00 33.32 H new ATOM 890 N SER A 61 11.637 10.711 -10.844 1.00 3.10 N ATOM 891 CA SER A 61 12.053 9.913 -11.991 1.00 71.23 C ATOM 892 C SER A 61 13.525 9.528 -11.880 1.00 60.43 C ATOM 893 O SER A 61 13.967 8.540 -12.470 1.00 13.24 O ATOM 894 CB SER A 61 11.812 10.684 -13.290 1.00 45.43 C ATOM 895 OG SER A 61 11.641 9.800 -14.384 1.00 51.23 O ATOM 0 H SER A 61 11.496 11.701 -11.048 1.00 3.10 H new ATOM 0 HA SER A 61 11.457 9.001 -12.003 1.00 71.23 H new ATOM 0 HB2 SER A 61 10.928 11.312 -13.185 1.00 45.43 H new ATOM 0 HB3 SER A 61 12.654 11.348 -13.484 1.00 45.43 H new ATOM 0 HG SER A 61 11.487 10.318 -15.202 1.00 51.23 H new ATOM 901 N LEU A 62 14.280 10.314 -11.121 1.00 70.20 N ATOM 902 CA LEU A 62 15.703 10.057 -10.931 1.00 64.44 C ATOM 903 C LEU A 62 15.943 8.616 -10.492 1.00 75.41 C ATOM 904 O LEU A 62 16.617 7.838 -11.168 1.00 52.43 O ATOM 905 CB LEU A 62 16.282 11.021 -9.894 1.00 62.34 C ATOM 906 CG LEU A 62 17.068 12.209 -10.448 1.00 44.53 C ATOM 907 CD1 LEU A 62 17.479 13.148 -9.324 1.00 42.15 C ATOM 908 CD2 LEU A 62 18.290 11.729 -11.218 1.00 21.02 C ATOM 0 H LEU A 62 13.930 11.135 -10.627 1.00 70.20 H new ATOM 0 HA LEU A 62 16.205 10.215 -11.885 1.00 64.44 H new ATOM 0 HB2 LEU A 62 15.462 11.405 -9.287 1.00 62.34 H new ATOM 0 HB3 LEU A 62 16.935 10.457 -9.228 1.00 62.34 H new ATOM 0 HG LEU A 62 16.423 12.757 -11.135 1.00 44.53 H new ATOM 0 HD11 LEU A 62 18.038 13.988 -9.737 1.00 42.15 H new ATOM 0 HD12 LEU A 62 16.589 13.519 -8.816 1.00 42.15 H new ATOM 0 HD13 LEU A 62 18.106 12.611 -8.612 1.00 42.15 H new ATOM 0 HD21 LEU A 62 18.837 12.589 -11.605 1.00 21.02 H new ATOM 0 HD22 LEU A 62 18.937 11.156 -10.553 1.00 21.02 H new ATOM 0 HD23 LEU A 62 17.972 11.098 -12.048 1.00 21.02 H new ATOM 920 N PRO A 63 15.376 8.248 -9.333 1.00 52.23 N ATOM 921 CA PRO A 63 15.511 6.898 -8.779 1.00 60.21 C ATOM 922 C PRO A 63 14.750 5.858 -9.594 1.00 71.21 C ATOM 923 O PRO A 63 15.238 4.749 -9.815 1.00 54.33 O ATOM 924 CB PRO A 63 14.906 7.027 -7.379 1.00 25.12 C ATOM 925 CG PRO A 63 13.956 8.170 -7.480 1.00 70.54 C ATOM 926 CD PRO A 63 14.559 9.123 -8.475 1.00 71.51 C ATOM 0 HA PRO A 63 16.547 6.558 -8.781 1.00 60.21 H new ATOM 0 HB2 PRO A 63 14.394 6.111 -7.083 1.00 25.12 H new ATOM 0 HB3 PRO A 63 15.676 7.217 -6.631 1.00 25.12 H new ATOM 0 HG2 PRO A 63 12.973 7.833 -7.809 1.00 70.54 H new ATOM 0 HG3 PRO A 63 13.820 8.651 -6.511 1.00 70.54 H new ATOM 0 HD2 PRO A 63 13.792 9.645 -9.047 1.00 71.51 H new ATOM 0 HD3 PRO A 63 15.165 9.885 -7.985 1.00 71.51 H new ATOM 934 N VAL A 64 13.552 6.223 -10.039 1.00 74.52 N ATOM 935 CA VAL A 64 12.723 5.321 -10.831 1.00 45.35 C ATOM 936 C VAL A 64 13.473 4.826 -12.063 1.00 25.53 C ATOM 937 O VAL A 64 13.166 3.763 -12.605 1.00 31.14 O ATOM 938 CB VAL A 64 11.419 6.006 -11.280 1.00 12.31 C ATOM 939 CG1 VAL A 64 10.629 5.096 -12.208 1.00 21.32 C ATOM 940 CG2 VAL A 64 10.584 6.404 -10.072 1.00 70.10 C ATOM 0 H VAL A 64 13.134 7.137 -9.865 1.00 74.52 H new ATOM 0 HA VAL A 64 12.478 4.473 -10.192 1.00 45.35 H new ATOM 0 HB VAL A 64 11.675 6.911 -11.831 1.00 12.31 H new ATOM 0 HG11 VAL A 64 9.711 5.597 -12.515 1.00 21.32 H new ATOM 0 HG12 VAL A 64 11.228 4.866 -13.089 1.00 21.32 H new ATOM 0 HG13 VAL A 64 10.381 4.172 -11.687 1.00 21.32 H new ATOM 0 HG21 VAL A 64 9.666 6.887 -10.407 1.00 70.10 H new ATOM 0 HG22 VAL A 64 10.336 5.515 -9.492 1.00 70.10 H new ATOM 0 HG23 VAL A 64 11.151 7.096 -9.450 1.00 70.10 H new ATOM 950 N LEU A 65 14.459 5.601 -12.500 1.00 43.11 N ATOM 951 CA LEU A 65 15.255 5.241 -13.668 1.00 63.13 C ATOM 952 C LEU A 65 16.704 4.968 -13.277 1.00 1.10 C ATOM 953 O LEU A 65 17.191 5.429 -12.245 1.00 4.14 O ATOM 954 CB LEU A 65 15.199 6.357 -14.712 1.00 53.44 C ATOM 955 CG LEU A 65 14.000 6.329 -15.661 1.00 52.01 C ATOM 956 CD1 LEU A 65 14.332 5.539 -16.917 1.00 72.33 C ATOM 957 CD2 LEU A 65 12.782 5.740 -14.964 1.00 61.32 C ATOM 0 H LEU A 65 14.727 6.483 -12.063 1.00 43.11 H new ATOM 0 HA LEU A 65 14.835 4.330 -14.095 1.00 63.13 H new ATOM 0 HB2 LEU A 65 15.203 7.315 -14.191 1.00 53.44 H new ATOM 0 HB3 LEU A 65 16.110 6.315 -15.309 1.00 53.44 H new ATOM 0 HG LEU A 65 13.767 7.353 -15.952 1.00 52.01 H new ATOM 0 HD11 LEU A 65 13.467 5.530 -17.580 1.00 72.33 H new ATOM 0 HD12 LEU A 65 15.176 6.004 -17.427 1.00 72.33 H new ATOM 0 HD13 LEU A 65 14.592 4.516 -16.645 1.00 72.33 H new ATOM 0 HD21 LEU A 65 11.938 5.728 -15.654 1.00 61.32 H new ATOM 0 HD22 LEU A 65 13.003 4.722 -14.643 1.00 61.32 H new ATOM 0 HD23 LEU A 65 12.531 6.348 -14.095 1.00 61.32 H new ATOM 969 N PRO A 66 17.411 4.202 -14.121 1.00 42.42 N ATOM 970 CA PRO A 66 18.815 3.853 -13.886 1.00 44.32 C ATOM 971 C PRO A 66 19.745 5.052 -14.041 1.00 14.44 C ATOM 972 O PRO A 66 19.627 5.822 -14.993 1.00 53.24 O ATOM 973 CB PRO A 66 19.107 2.808 -14.966 1.00 52.53 C ATOM 974 CG PRO A 66 18.132 3.105 -16.053 1.00 41.31 C ATOM 975 CD PRO A 66 16.895 3.619 -15.371 1.00 35.14 C ATOM 0 HA PRO A 66 18.980 3.494 -12.870 1.00 44.32 H new ATOM 0 HB2 PRO A 66 20.134 2.884 -15.323 1.00 52.53 H new ATOM 0 HB3 PRO A 66 18.977 1.796 -14.583 1.00 52.53 H new ATOM 0 HG2 PRO A 66 18.533 3.846 -16.745 1.00 41.31 H new ATOM 0 HG3 PRO A 66 17.913 2.210 -16.636 1.00 41.31 H new ATOM 0 HD2 PRO A 66 16.381 4.363 -15.979 1.00 35.14 H new ATOM 0 HD3 PRO A 66 16.181 2.818 -15.176 1.00 35.14 H new ATOM 983 N ALA A 67 20.669 5.205 -13.097 1.00 75.45 N ATOM 984 CA ALA A 67 21.619 6.309 -13.131 1.00 24.23 C ATOM 985 C ALA A 67 22.380 6.339 -14.452 1.00 22.41 C ATOM 986 O ALA A 67 23.139 5.421 -14.763 1.00 23.22 O ATOM 987 CB ALA A 67 22.589 6.205 -11.963 1.00 44.31 C ATOM 0 H ALA A 67 20.779 4.578 -12.300 1.00 75.45 H new ATOM 0 HA ALA A 67 21.060 7.240 -13.044 1.00 24.23 H new ATOM 0 HB1 ALA A 67 23.294 7.036 -12.000 1.00 44.31 H new ATOM 0 HB2 ALA A 67 22.035 6.241 -11.025 1.00 44.31 H new ATOM 0 HB3 ALA A 67 23.135 5.264 -12.026 1.00 44.31 H new ATOM 993 N SER A 68 22.171 7.399 -15.226 1.00 61.42 N ATOM 994 CA SER A 68 22.834 7.545 -16.517 1.00 2.34 C ATOM 995 C SER A 68 22.388 8.827 -17.214 1.00 21.11 C ATOM 996 O SER A 68 23.162 9.459 -17.934 1.00 24.24 O ATOM 997 CB SER A 68 22.537 6.337 -17.407 1.00 22.03 C ATOM 998 OG SER A 68 22.636 6.678 -18.779 1.00 21.33 O ATOM 0 H SER A 68 21.548 8.169 -14.982 1.00 61.42 H new ATOM 0 HA SER A 68 23.908 7.602 -16.342 1.00 2.34 H new ATOM 0 HB2 SER A 68 23.235 5.532 -17.178 1.00 22.03 H new ATOM 0 HB3 SER A 68 21.536 5.961 -17.194 1.00 22.03 H new ATOM 0 HG SER A 68 22.443 5.889 -19.327 1.00 21.33 H new ATOM 1004 N THR A 69 21.133 9.206 -16.996 1.00 34.24 N ATOM 1005 CA THR A 69 20.581 10.410 -17.603 1.00 2.52 C ATOM 1006 C THR A 69 20.309 11.481 -16.552 1.00 64.11 C ATOM 1007 O THR A 69 19.437 12.331 -16.729 1.00 15.40 O ATOM 1008 CB THR A 69 19.275 10.110 -18.362 1.00 63.44 C ATOM 1009 OG1 THR A 69 18.810 11.291 -19.024 1.00 41.12 O ATOM 1010 CG2 THR A 69 18.202 9.598 -17.413 1.00 5.43 C ATOM 0 H THR A 69 20.479 8.696 -16.403 1.00 34.24 H new ATOM 0 HA THR A 69 21.326 10.777 -18.309 1.00 2.52 H new ATOM 0 HB THR A 69 19.481 9.337 -19.102 1.00 63.44 H new ATOM 0 HG1 THR A 69 18.836 12.047 -18.401 1.00 41.12 H new ATOM 0 HG21 THR A 69 17.289 9.393 -17.972 1.00 5.43 H new ATOM 0 HG22 THR A 69 18.547 8.682 -16.934 1.00 5.43 H new ATOM 0 HG23 THR A 69 18.000 10.352 -16.652 1.00 5.43 H new ATOM 1018 N HIS A 70 21.063 11.434 -15.458 1.00 13.22 N ATOM 1019 CA HIS A 70 20.903 12.402 -14.378 1.00 64.02 C ATOM 1020 C HIS A 70 21.305 13.800 -14.838 1.00 51.23 C ATOM 1021 O HIS A 70 20.772 14.800 -14.356 1.00 21.42 O ATOM 1022 CB HIS A 70 21.742 11.990 -13.168 1.00 1.21 C ATOM 1023 CG HIS A 70 21.148 10.861 -12.384 1.00 62.51 C ATOM 1024 ND1 HIS A 70 21.353 10.694 -11.031 1.00 13.44 N ATOM 1025 CD2 HIS A 70 20.350 9.838 -12.771 1.00 22.12 C ATOM 1026 CE1 HIS A 70 20.708 9.617 -10.619 1.00 54.50 C ATOM 1027 NE2 HIS A 70 20.091 9.080 -11.656 1.00 33.33 N ATOM 0 H HIS A 70 21.790 10.737 -15.296 1.00 13.22 H new ATOM 0 HA HIS A 70 19.851 12.421 -14.092 1.00 64.02 H new ATOM 0 HB2 HIS A 70 22.737 11.702 -13.507 1.00 1.21 H new ATOM 0 HB3 HIS A 70 21.866 12.851 -12.512 1.00 1.21 H new ATOM 0 HD2 HIS A 70 19.985 9.653 -13.771 1.00 22.12 H new ATOM 0 HE1 HIS A 70 20.689 9.240 -9.607 1.00 54.50 H new ATOM 0 HE2 HIS A 70 19.515 8.238 -11.632 1.00 33.33 H new ATOM 1035 N ARG A 71 22.248 13.862 -15.773 1.00 14.31 N ATOM 1036 CA ARG A 71 22.722 15.138 -16.296 1.00 73.23 C ATOM 1037 C ARG A 71 21.553 16.008 -16.749 1.00 13.03 C ATOM 1038 O ARG A 71 21.335 17.096 -16.217 1.00 50.10 O ATOM 1039 CB ARG A 71 23.683 14.909 -17.464 1.00 73.42 C ATOM 1040 CG ARG A 71 24.932 14.131 -17.082 1.00 13.43 C ATOM 1041 CD ARG A 71 25.987 15.039 -16.469 1.00 33.02 C ATOM 1042 NE ARG A 71 25.751 15.270 -15.046 1.00 74.22 N ATOM 1043 CZ ARG A 71 26.470 16.108 -14.308 1.00 64.52 C ATOM 1044 NH1 ARG A 71 27.466 16.791 -14.856 1.00 22.43 N ATOM 1045 NH2 ARG A 71 26.194 16.264 -13.020 1.00 23.33 N ATOM 0 H ARG A 71 22.698 13.044 -16.184 1.00 14.31 H new ATOM 0 HA ARG A 71 23.250 15.657 -15.496 1.00 73.23 H new ATOM 0 HB2 ARG A 71 23.159 14.372 -18.255 1.00 73.42 H new ATOM 0 HB3 ARG A 71 23.978 15.874 -17.875 1.00 73.42 H new ATOM 0 HG2 ARG A 71 24.670 13.345 -16.373 1.00 13.43 H new ATOM 0 HG3 ARG A 71 25.341 13.640 -17.965 1.00 13.43 H new ATOM 0 HD2 ARG A 71 26.972 14.593 -16.605 1.00 33.02 H new ATOM 0 HD3 ARG A 71 25.993 15.994 -16.995 1.00 33.02 H new ATOM 0 HE ARG A 71 24.992 14.760 -14.594 1.00 74.22 H new ATOM 0 HH11 ARG A 71 27.681 16.673 -15.846 1.00 22.43 H new ATOM 0 HH12 ARG A 71 28.017 17.434 -14.287 1.00 22.43 H new ATOM 0 HH21 ARG A 71 25.429 15.740 -12.595 1.00 23.33 H new ATOM 0 HH22 ARG A 71 26.747 16.908 -12.454 1.00 23.33 H new ATOM 1059 N GLU A 72 20.805 15.520 -17.734 1.00 0.32 N ATOM 1060 CA GLU A 72 19.660 16.255 -18.258 1.00 74.20 C ATOM 1061 C GLU A 72 18.594 16.442 -17.182 1.00 3.05 C ATOM 1062 O GLU A 72 17.941 17.483 -17.115 1.00 54.40 O ATOM 1063 CB GLU A 72 19.062 15.521 -19.460 1.00 51.13 C ATOM 1064 CG GLU A 72 20.059 15.273 -20.579 1.00 64.52 C ATOM 1065 CD GLU A 72 19.398 14.777 -21.851 1.00 4.12 C ATOM 1066 OE1 GLU A 72 18.151 14.788 -21.915 1.00 45.21 O ATOM 1067 OE2 GLU A 72 20.129 14.379 -22.782 1.00 21.40 O ATOM 0 H GLU A 72 20.971 14.620 -18.184 1.00 0.32 H new ATOM 0 HA GLU A 72 20.007 17.238 -18.576 1.00 74.20 H new ATOM 0 HB2 GLU A 72 18.657 14.565 -19.127 1.00 51.13 H new ATOM 0 HB3 GLU A 72 18.227 16.102 -19.851 1.00 51.13 H new ATOM 0 HG2 GLU A 72 20.599 16.196 -20.791 1.00 64.52 H new ATOM 0 HG3 GLU A 72 20.796 14.541 -20.248 1.00 64.52 H new ATOM 1074 N ILE A 73 18.426 15.426 -16.342 1.00 14.44 N ATOM 1075 CA ILE A 73 17.441 15.479 -15.268 1.00 72.23 C ATOM 1076 C ILE A 73 17.694 16.668 -14.348 1.00 14.11 C ATOM 1077 O ILE A 73 16.791 17.461 -14.081 1.00 22.23 O ATOM 1078 CB ILE A 73 17.450 14.186 -14.432 1.00 21.30 C ATOM 1079 CG1 ILE A 73 16.921 13.013 -15.260 1.00 63.12 C ATOM 1080 CG2 ILE A 73 16.621 14.366 -13.169 1.00 62.30 C ATOM 1081 CD1 ILE A 73 17.292 11.659 -14.696 1.00 51.13 C ATOM 0 H ILE A 73 18.958 14.557 -16.384 1.00 14.44 H new ATOM 0 HA ILE A 73 16.465 15.590 -15.740 1.00 72.23 H new ATOM 0 HB ILE A 73 18.477 13.967 -14.141 1.00 21.30 H new ATOM 0 HG12 ILE A 73 15.835 13.085 -15.325 1.00 63.12 H new ATOM 0 HG13 ILE A 73 17.307 13.093 -16.276 1.00 63.12 H new ATOM 0 HG21 ILE A 73 16.637 13.443 -12.589 1.00 62.30 H new ATOM 0 HG22 ILE A 73 17.038 15.177 -12.572 1.00 62.30 H new ATOM 0 HG23 ILE A 73 15.593 14.606 -13.440 1.00 62.30 H new ATOM 0 HD11 ILE A 73 16.884 10.875 -15.334 1.00 51.13 H new ATOM 0 HD12 ILE A 73 18.377 11.566 -14.656 1.00 51.13 H new ATOM 0 HD13 ILE A 73 16.882 11.559 -13.691 1.00 51.13 H new ATOM 1093 N GLU A 74 18.928 16.786 -13.868 1.00 14.21 N ATOM 1094 CA GLU A 74 19.299 17.880 -12.978 1.00 50.00 C ATOM 1095 C GLU A 74 19.094 19.230 -13.660 1.00 31.30 C ATOM 1096 O GLU A 74 18.442 20.120 -13.115 1.00 31.42 O ATOM 1097 CB GLU A 74 20.757 17.735 -12.537 1.00 11.52 C ATOM 1098 CG GLU A 74 20.978 18.023 -11.061 1.00 54.12 C ATOM 1099 CD GLU A 74 21.765 19.298 -10.827 1.00 33.34 C ATOM 1100 OE1 GLU A 74 22.824 19.467 -11.465 1.00 42.52 O ATOM 1101 OE2 GLU A 74 21.320 20.126 -10.004 1.00 23.30 O ATOM 0 H GLU A 74 19.687 16.138 -14.080 1.00 14.21 H new ATOM 0 HA GLU A 74 18.655 17.835 -12.100 1.00 50.00 H new ATOM 0 HB2 GLU A 74 21.095 16.722 -12.755 1.00 11.52 H new ATOM 0 HB3 GLU A 74 21.375 18.411 -13.127 1.00 11.52 H new ATOM 0 HG2 GLU A 74 20.012 18.099 -10.561 1.00 54.12 H new ATOM 0 HG3 GLU A 74 21.507 17.185 -10.606 1.00 54.12 H new ATOM 1108 N MET A 75 19.656 19.373 -14.856 1.00 3.45 N ATOM 1109 CA MET A 75 19.535 20.614 -15.613 1.00 31.14 C ATOM 1110 C MET A 75 18.074 20.918 -15.927 1.00 14.34 C ATOM 1111 O MET A 75 17.701 22.073 -16.133 1.00 60.22 O ATOM 1112 CB MET A 75 20.340 20.525 -16.911 1.00 12.14 C ATOM 1113 CG MET A 75 21.308 21.681 -17.106 1.00 31.44 C ATOM 1114 SD MET A 75 22.803 21.509 -16.113 1.00 1.23 S ATOM 1115 CE MET A 75 23.938 20.834 -17.323 1.00 53.01 C ATOM 0 H MET A 75 20.199 18.646 -15.321 1.00 3.45 H new ATOM 0 HA MET A 75 19.933 21.424 -15.002 1.00 31.14 H new ATOM 0 HB2 MET A 75 20.898 19.589 -16.919 1.00 12.14 H new ATOM 0 HB3 MET A 75 19.651 20.493 -17.755 1.00 12.14 H new ATOM 0 HG2 MET A 75 21.581 21.747 -18.159 1.00 31.44 H new ATOM 0 HG3 MET A 75 20.810 22.615 -16.847 1.00 31.44 H new ATOM 0 HE1 MET A 75 24.911 20.672 -16.859 1.00 53.01 H new ATOM 0 HE2 MET A 75 23.551 19.886 -17.696 1.00 53.01 H new ATOM 0 HE3 MET A 75 24.044 21.533 -18.152 1.00 53.01 H new ATOM 1125 N ALA A 76 17.251 19.875 -15.961 1.00 54.31 N ATOM 1126 CA ALA A 76 15.830 20.032 -16.248 1.00 42.23 C ATOM 1127 C ALA A 76 15.102 20.684 -15.078 1.00 2.14 C ATOM 1128 O ALA A 76 14.138 21.424 -15.270 1.00 1.30 O ATOM 1129 CB ALA A 76 15.206 18.684 -16.576 1.00 31.24 C ATOM 0 H ALA A 76 17.544 18.912 -15.793 1.00 54.31 H new ATOM 0 HA ALA A 76 15.730 20.687 -17.114 1.00 42.23 H new ATOM 0 HB1 ALA A 76 14.145 18.816 -16.788 1.00 31.24 H new ATOM 0 HB2 ALA A 76 15.700 18.257 -17.449 1.00 31.24 H new ATOM 0 HB3 ALA A 76 15.325 18.012 -15.726 1.00 31.24 H new ATOM 1135 N GLN A 77 15.570 20.403 -13.866 1.00 12.24 N ATOM 1136 CA GLN A 77 14.961 20.962 -12.664 1.00 41.02 C ATOM 1137 C GLN A 77 15.036 22.485 -12.674 1.00 54.33 C ATOM 1138 O GLN A 77 14.011 23.168 -12.681 1.00 71.21 O ATOM 1139 CB GLN A 77 15.653 20.414 -11.415 1.00 14.04 C ATOM 1140 CG GLN A 77 15.252 18.988 -11.074 1.00 21.33 C ATOM 1141 CD GLN A 77 15.501 18.644 -9.618 1.00 62.45 C ATOM 1142 OE1 GLN A 77 16.014 19.461 -8.854 1.00 45.32 O ATOM 1143 NE2 GLN A 77 15.138 17.428 -9.227 1.00 32.12 N ATOM 0 H GLN A 77 16.368 19.792 -13.690 1.00 12.24 H new ATOM 0 HA GLN A 77 13.911 20.668 -12.648 1.00 41.02 H new ATOM 0 HB2 GLN A 77 16.732 20.454 -11.561 1.00 14.04 H new ATOM 0 HB3 GLN A 77 15.421 21.060 -10.568 1.00 14.04 H new ATOM 0 HG2 GLN A 77 14.195 18.848 -11.301 1.00 21.33 H new ATOM 0 HG3 GLN A 77 15.808 18.297 -11.707 1.00 21.33 H new ATOM 0 HE21 GLN A 77 14.716 16.782 -9.894 1.00 32.12 H new ATOM 0 HE22 GLN A 77 15.281 17.140 -8.259 1.00 32.12 H new ATOM 1152 N LYS A 78 16.255 23.013 -12.675 1.00 10.13 N ATOM 1153 CA LYS A 78 16.465 24.456 -12.685 1.00 33.12 C ATOM 1154 C LYS A 78 15.881 25.082 -13.947 1.00 74.23 C ATOM 1155 O LYS A 78 15.227 26.124 -13.890 1.00 41.45 O ATOM 1156 CB LYS A 78 17.958 24.776 -12.588 1.00 62.44 C ATOM 1157 CG LYS A 78 18.319 25.641 -11.393 1.00 61.23 C ATOM 1158 CD LYS A 78 19.625 25.196 -10.757 1.00 22.00 C ATOM 1159 CE LYS A 78 20.827 25.730 -11.520 1.00 44.15 C ATOM 1160 NZ LYS A 78 21.076 27.169 -11.227 1.00 61.23 N ATOM 0 H LYS A 78 17.114 22.463 -12.669 1.00 10.13 H new ATOM 0 HA LYS A 78 15.953 24.878 -11.821 1.00 33.12 H new ATOM 0 HB2 LYS A 78 18.518 23.843 -12.532 1.00 62.44 H new ATOM 0 HB3 LYS A 78 18.272 25.282 -13.501 1.00 62.44 H new ATOM 0 HG2 LYS A 78 18.402 26.681 -11.708 1.00 61.23 H new ATOM 0 HG3 LYS A 78 17.519 25.595 -10.654 1.00 61.23 H new ATOM 0 HD2 LYS A 78 19.665 25.543 -9.724 1.00 22.00 H new ATOM 0 HD3 LYS A 78 19.665 24.107 -10.729 1.00 22.00 H new ATOM 0 HE2 LYS A 78 21.711 25.148 -11.259 1.00 44.15 H new ATOM 0 HE3 LYS A 78 20.665 25.600 -12.590 1.00 44.15 H new ATOM 0 HZ1 LYS A 78 21.951 27.473 -11.699 1.00 61.23 H new ATOM 0 HZ2 LYS A 78 20.279 27.738 -11.577 1.00 61.23 H new ATOM 0 HZ3 LYS A 78 21.172 27.303 -10.200 1.00 61.23 H new ATOM 1174 N LEU A 79 16.119 24.439 -15.085 1.00 54.12 N ATOM 1175 CA LEU A 79 15.614 24.932 -16.362 1.00 44.13 C ATOM 1176 C LEU A 79 14.109 25.168 -16.299 1.00 73.40 C ATOM 1177 O LEU A 79 13.623 26.246 -16.643 1.00 41.02 O ATOM 1178 CB LEU A 79 15.940 23.939 -17.479 1.00 44.23 C ATOM 1179 CG LEU A 79 15.354 24.260 -18.855 1.00 32.34 C ATOM 1180 CD1 LEU A 79 16.449 24.282 -19.910 1.00 13.42 C ATOM 1181 CD2 LEU A 79 14.276 23.250 -19.223 1.00 41.51 C ATOM 0 H LEU A 79 16.658 23.576 -15.150 1.00 54.12 H new ATOM 0 HA LEU A 79 16.103 25.883 -16.575 1.00 44.13 H new ATOM 0 HB2 LEU A 79 17.024 23.873 -17.574 1.00 44.23 H new ATOM 0 HB3 LEU A 79 15.586 22.953 -17.176 1.00 44.23 H new ATOM 0 HG LEU A 79 14.899 25.250 -18.814 1.00 32.34 H new ATOM 0 HD11 LEU A 79 16.013 24.512 -20.882 1.00 13.42 H new ATOM 0 HD12 LEU A 79 17.186 25.043 -19.654 1.00 13.42 H new ATOM 0 HD13 LEU A 79 16.934 23.307 -19.951 1.00 13.42 H new ATOM 0 HD21 LEU A 79 13.870 23.493 -20.205 1.00 41.51 H new ATOM 0 HD22 LEU A 79 14.708 22.249 -19.246 1.00 41.51 H new ATOM 0 HD23 LEU A 79 13.478 23.283 -18.482 1.00 41.51 H new ATOM 1193 N LEU A 80 13.375 24.153 -15.855 1.00 52.23 N ATOM 1194 CA LEU A 80 11.923 24.250 -15.744 1.00 64.12 C ATOM 1195 C LEU A 80 11.519 25.493 -14.957 1.00 62.53 C ATOM 1196 O LEU A 80 10.611 26.222 -15.353 1.00 61.25 O ATOM 1197 CB LEU A 80 11.359 22.999 -15.069 1.00 24.33 C ATOM 1198 CG LEU A 80 11.269 21.747 -15.943 1.00 11.25 C ATOM 1199 CD1 LEU A 80 11.242 20.495 -15.080 1.00 64.22 C ATOM 1200 CD2 LEU A 80 10.038 21.808 -16.836 1.00 3.14 C ATOM 0 H LEU A 80 13.761 23.254 -15.566 1.00 52.23 H new ATOM 0 HA LEU A 80 11.511 24.330 -16.750 1.00 64.12 H new ATOM 0 HB2 LEU A 80 11.978 22.768 -14.202 1.00 24.33 H new ATOM 0 HB3 LEU A 80 10.361 23.230 -14.697 1.00 24.33 H new ATOM 0 HG LEU A 80 12.153 21.706 -16.579 1.00 11.25 H new ATOM 0 HD11 LEU A 80 11.178 19.614 -15.719 1.00 64.22 H new ATOM 0 HD12 LEU A 80 12.153 20.445 -14.483 1.00 64.22 H new ATOM 0 HD13 LEU A 80 10.376 20.528 -14.419 1.00 64.22 H new ATOM 0 HD21 LEU A 80 9.990 20.909 -17.451 1.00 3.14 H new ATOM 0 HD22 LEU A 80 9.143 21.873 -16.218 1.00 3.14 H new ATOM 0 HD23 LEU A 80 10.099 22.685 -17.480 1.00 3.14 H new ATOM 1212 N ASN A 81 12.202 25.728 -13.841 1.00 53.04 N ATOM 1213 CA ASN A 81 11.915 26.884 -12.999 1.00 73.25 C ATOM 1214 C ASN A 81 12.027 28.179 -13.797 1.00 40.33 C ATOM 1215 O ASN A 81 11.077 28.958 -13.872 1.00 40.54 O ATOM 1216 CB ASN A 81 12.872 26.922 -11.806 1.00 72.13 C ATOM 1217 CG ASN A 81 12.307 27.704 -10.637 1.00 14.34 C ATOM 1218 OD1 ASN A 81 12.883 28.704 -10.208 1.00 54.41 O ATOM 1219 ND2 ASN A 81 11.173 27.251 -10.114 1.00 22.40 N ATOM 0 H ASN A 81 12.957 25.134 -13.499 1.00 53.04 H new ATOM 0 HA ASN A 81 10.893 26.791 -12.633 1.00 73.25 H new ATOM 0 HB2 ASN A 81 13.091 25.903 -11.486 1.00 72.13 H new ATOM 0 HB3 ASN A 81 13.817 27.369 -12.116 1.00 72.13 H new ATOM 0 HD21 ASN A 81 10.746 27.736 -9.325 1.00 22.40 H new ATOM 0 HD22 ASN A 81 10.730 26.418 -10.501 1.00 22.40 H new ATOM 1226 N SER A 82 13.195 28.402 -14.392 1.00 54.32 N ATOM 1227 CA SER A 82 13.433 29.605 -15.182 1.00 73.41 C ATOM 1228 C SER A 82 12.346 29.785 -16.238 1.00 1.12 C ATOM 1229 O SER A 82 11.702 30.832 -16.309 1.00 20.12 O ATOM 1230 CB SER A 82 14.806 29.536 -15.854 1.00 34.43 C ATOM 1231 OG SER A 82 15.263 30.828 -16.213 1.00 23.32 O ATOM 0 H SER A 82 13.991 27.766 -14.342 1.00 54.32 H new ATOM 0 HA SER A 82 13.408 30.463 -14.510 1.00 73.41 H new ATOM 0 HB2 SER A 82 15.522 29.068 -15.178 1.00 34.43 H new ATOM 0 HB3 SER A 82 14.748 28.907 -16.742 1.00 34.43 H new ATOM 0 HG SER A 82 16.143 30.757 -16.639 1.00 23.32 H new ATOM 1237 N ASP A 83 12.149 28.757 -17.056 1.00 14.31 N ATOM 1238 CA ASP A 83 11.140 28.800 -18.108 1.00 13.40 C ATOM 1239 C ASP A 83 9.762 29.104 -17.528 1.00 31.15 C ATOM 1240 O ASP A 83 8.953 29.795 -18.148 1.00 44.34 O ATOM 1241 CB ASP A 83 11.106 27.473 -18.866 1.00 60.34 C ATOM 1242 CG ASP A 83 12.494 26.946 -19.174 1.00 1.13 C ATOM 1243 OD1 ASP A 83 13.407 27.770 -19.392 1.00 10.44 O ATOM 1244 OD2 ASP A 83 12.668 25.710 -19.195 1.00 72.15 O ATOM 0 H ASP A 83 12.674 27.884 -17.011 1.00 14.31 H new ATOM 0 HA ASP A 83 11.407 29.598 -18.800 1.00 13.40 H new ATOM 0 HB2 ASP A 83 10.563 26.735 -18.276 1.00 60.34 H new ATOM 0 HB3 ASP A 83 10.555 27.604 -19.798 1.00 60.34 H new ATOM 1249 N LEU A 84 9.500 28.582 -16.334 1.00 64.03 N ATOM 1250 CA LEU A 84 8.220 28.796 -15.670 1.00 15.04 C ATOM 1251 C LEU A 84 7.878 30.281 -15.611 1.00 2.53 C ATOM 1252 O LEU A 84 6.926 30.735 -16.245 1.00 11.24 O ATOM 1253 CB LEU A 84 8.252 28.212 -14.256 1.00 42.12 C ATOM 1254 CG LEU A 84 6.893 27.948 -13.607 1.00 51.43 C ATOM 1255 CD1 LEU A 84 6.964 26.734 -12.695 1.00 74.52 C ATOM 1256 CD2 LEU A 84 6.425 29.172 -12.833 1.00 51.24 C ATOM 0 H LEU A 84 10.158 28.008 -15.807 1.00 64.03 H new ATOM 0 HA LEU A 84 7.449 28.287 -16.249 1.00 15.04 H new ATOM 0 HB2 LEU A 84 8.807 27.274 -14.285 1.00 42.12 H new ATOM 0 HB3 LEU A 84 8.811 28.894 -13.616 1.00 42.12 H new ATOM 0 HG LEU A 84 6.169 27.743 -14.396 1.00 51.43 H new ATOM 0 HD11 LEU A 84 5.988 26.562 -12.242 1.00 74.52 H new ATOM 0 HD12 LEU A 84 7.254 25.859 -13.276 1.00 74.52 H new ATOM 0 HD13 LEU A 84 7.701 26.910 -11.912 1.00 74.52 H new ATOM 0 HD21 LEU A 84 5.456 28.966 -12.378 1.00 51.24 H new ATOM 0 HD22 LEU A 84 7.149 29.408 -12.054 1.00 51.24 H new ATOM 0 HD23 LEU A 84 6.334 30.019 -13.513 1.00 51.24 H new ATOM 1268 N ALA A 85 8.663 31.034 -14.847 1.00 24.01 N ATOM 1269 CA ALA A 85 8.447 32.469 -14.709 1.00 30.22 C ATOM 1270 C ALA A 85 8.388 33.149 -16.072 1.00 61.14 C ATOM 1271 O ALA A 85 7.625 34.094 -16.272 1.00 23.51 O ATOM 1272 CB ALA A 85 9.543 33.088 -13.855 1.00 4.12 C ATOM 0 H ALA A 85 9.455 30.674 -14.314 1.00 24.01 H new ATOM 0 HA ALA A 85 7.487 32.621 -14.215 1.00 30.22 H new ATOM 0 HB1 ALA A 85 9.369 34.160 -13.760 1.00 4.12 H new ATOM 0 HB2 ALA A 85 9.535 32.630 -12.866 1.00 4.12 H new ATOM 0 HB3 ALA A 85 10.511 32.918 -14.326 1.00 4.12 H new ATOM 1278 N GLU A 86 9.199 32.662 -17.007 1.00 10.42 N ATOM 1279 CA GLU A 86 9.239 33.226 -18.351 1.00 70.32 C ATOM 1280 C GLU A 86 7.866 33.153 -19.012 1.00 54.54 C ATOM 1281 O GLU A 86 7.404 34.121 -19.619 1.00 1.22 O ATOM 1282 CB GLU A 86 10.269 32.486 -19.208 1.00 1.25 C ATOM 1283 CG GLU A 86 11.206 33.411 -19.967 1.00 75.10 C ATOM 1284 CD GLU A 86 11.966 32.696 -21.067 1.00 24.34 C ATOM 1285 OE1 GLU A 86 12.822 31.847 -20.739 1.00 61.25 O ATOM 1286 OE2 GLU A 86 11.707 32.985 -22.253 1.00 72.32 O ATOM 0 H GLU A 86 9.836 31.879 -16.858 1.00 10.42 H new ATOM 0 HA GLU A 86 9.529 34.273 -18.270 1.00 70.32 H new ATOM 0 HB2 GLU A 86 10.859 31.831 -18.567 1.00 1.25 H new ATOM 0 HB3 GLU A 86 9.746 31.848 -19.920 1.00 1.25 H new ATOM 0 HG2 GLU A 86 10.631 34.229 -20.400 1.00 75.10 H new ATOM 0 HG3 GLU A 86 11.916 33.855 -19.269 1.00 75.10 H new ATOM 1293 N LEU A 87 7.218 32.000 -18.892 1.00 14.12 N ATOM 1294 CA LEU A 87 5.897 31.800 -19.478 1.00 33.22 C ATOM 1295 C LEU A 87 4.864 32.705 -18.815 1.00 13.14 C ATOM 1296 O LEU A 87 4.050 33.334 -19.491 1.00 74.14 O ATOM 1297 CB LEU A 87 5.473 30.337 -19.340 1.00 34.51 C ATOM 1298 CG LEU A 87 5.241 29.579 -20.648 1.00 24.33 C ATOM 1299 CD1 LEU A 87 5.654 28.122 -20.501 1.00 13.23 C ATOM 1300 CD2 LEU A 87 3.784 29.682 -21.073 1.00 60.04 C ATOM 0 H LEU A 87 7.586 31.189 -18.394 1.00 14.12 H new ATOM 0 HA LEU A 87 5.953 32.058 -20.536 1.00 33.22 H new ATOM 0 HB2 LEU A 87 6.238 29.810 -18.769 1.00 34.51 H new ATOM 0 HB3 LEU A 87 4.555 30.299 -18.754 1.00 34.51 H new ATOM 0 HG LEU A 87 5.858 30.034 -21.423 1.00 24.33 H new ATOM 0 HD11 LEU A 87 5.482 27.598 -21.441 1.00 13.23 H new ATOM 0 HD12 LEU A 87 6.712 28.068 -20.244 1.00 13.23 H new ATOM 0 HD13 LEU A 87 5.065 27.655 -19.712 1.00 13.23 H new ATOM 0 HD21 LEU A 87 3.638 29.137 -22.005 1.00 60.04 H new ATOM 0 HD22 LEU A 87 3.148 29.254 -20.298 1.00 60.04 H new ATOM 0 HD23 LEU A 87 3.521 30.730 -21.220 1.00 60.04 H new ATOM 1312 N ILE A 88 4.904 32.768 -17.488 1.00 24.20 N ATOM 1313 CA ILE A 88 3.974 33.599 -16.734 1.00 61.01 C ATOM 1314 C ILE A 88 4.071 35.060 -17.162 1.00 22.53 C ATOM 1315 O ILE A 88 3.058 35.740 -17.315 1.00 42.35 O ATOM 1316 CB ILE A 88 4.232 33.501 -15.219 1.00 3.10 C ATOM 1317 CG1 ILE A 88 4.211 32.039 -14.769 1.00 62.34 C ATOM 1318 CG2 ILE A 88 3.198 34.312 -14.452 1.00 23.30 C ATOM 1319 CD1 ILE A 88 2.882 31.355 -15.000 1.00 33.12 C ATOM 0 H ILE A 88 5.571 32.253 -16.913 1.00 24.20 H new ATOM 0 HA ILE A 88 2.973 33.226 -16.948 1.00 61.01 H new ATOM 0 HB ILE A 88 5.219 33.913 -15.006 1.00 3.10 H new ATOM 0 HG12 ILE A 88 4.989 31.492 -15.301 1.00 62.34 H new ATOM 0 HG13 ILE A 88 4.456 31.990 -13.708 1.00 62.34 H new ATOM 0 HG21 ILE A 88 3.394 34.233 -13.383 1.00 23.30 H new ATOM 0 HG22 ILE A 88 3.257 35.357 -14.755 1.00 23.30 H new ATOM 0 HG23 ILE A 88 2.201 33.928 -14.668 1.00 23.30 H new ATOM 0 HD11 ILE A 88 2.940 30.322 -14.658 1.00 33.12 H new ATOM 0 HD12 ILE A 88 2.103 31.878 -14.446 1.00 33.12 H new ATOM 0 HD13 ILE A 88 2.644 31.372 -16.064 1.00 33.12 H new ATOM 1331 N ASN A 89 5.298 35.534 -17.354 1.00 31.23 N ATOM 1332 CA ASN A 89 5.528 36.914 -17.765 1.00 71.13 C ATOM 1333 C ASN A 89 4.916 37.182 -19.137 1.00 34.13 C ATOM 1334 O ASN A 89 4.109 38.098 -19.301 1.00 63.31 O ATOM 1335 CB ASN A 89 7.028 37.216 -17.796 1.00 75.41 C ATOM 1336 CG ASN A 89 7.328 38.680 -17.539 1.00 62.41 C ATOM 1337 OD1 ASN A 89 6.466 39.431 -17.082 1.00 65.21 O ATOM 1338 ND2 ASN A 89 8.556 39.092 -17.833 1.00 31.23 N ATOM 0 H ASN A 89 6.148 34.983 -17.232 1.00 31.23 H new ATOM 0 HA ASN A 89 5.047 37.568 -17.038 1.00 71.13 H new ATOM 0 HB2 ASN A 89 7.534 36.607 -17.047 1.00 75.41 H new ATOM 0 HB3 ASN A 89 7.434 36.930 -18.766 1.00 75.41 H new ATOM 0 HD21 ASN A 89 8.817 40.066 -17.682 1.00 31.23 H new ATOM 0 HD22 ASN A 89 9.238 38.434 -18.210 1.00 31.23 H new ATOM 1345 N LYS A 90 5.303 36.376 -20.119 1.00 45.04 N ATOM 1346 CA LYS A 90 4.793 36.523 -21.477 1.00 55.20 C ATOM 1347 C LYS A 90 3.268 36.482 -21.492 1.00 12.41 C ATOM 1348 O LYS A 90 2.618 37.407 -21.978 1.00 52.30 O ATOM 1349 CB LYS A 90 5.352 35.419 -22.377 1.00 34.21 C ATOM 1350 CG LYS A 90 6.860 35.477 -22.545 1.00 61.31 C ATOM 1351 CD LYS A 90 7.308 36.819 -23.097 1.00 44.45 C ATOM 1352 CE LYS A 90 8.334 36.651 -24.208 1.00 23.13 C ATOM 1353 NZ LYS A 90 9.061 37.920 -24.489 1.00 30.12 N ATOM 0 H LYS A 90 5.969 35.613 -20.000 1.00 45.04 H new ATOM 0 HA LYS A 90 5.117 37.492 -21.857 1.00 55.20 H new ATOM 0 HB2 LYS A 90 5.078 34.449 -21.961 1.00 34.21 H new ATOM 0 HB3 LYS A 90 4.883 35.489 -23.358 1.00 34.21 H new ATOM 0 HG2 LYS A 90 7.341 35.299 -21.583 1.00 61.31 H new ATOM 0 HG3 LYS A 90 7.183 34.681 -23.215 1.00 61.31 H new ATOM 0 HD2 LYS A 90 6.444 37.364 -23.478 1.00 44.45 H new ATOM 0 HD3 LYS A 90 7.735 37.420 -22.294 1.00 44.45 H new ATOM 0 HE2 LYS A 90 9.049 35.877 -23.928 1.00 23.13 H new ATOM 0 HE3 LYS A 90 7.835 36.310 -25.115 1.00 23.13 H new ATOM 0 HZ1 LYS A 90 9.751 37.763 -25.252 1.00 30.12 H new ATOM 0 HZ2 LYS A 90 8.382 38.652 -24.781 1.00 30.12 H new ATOM 0 HZ3 LYS A 90 9.559 38.232 -23.631 1.00 30.12 H new ATOM 1367 N MET A 91 2.704 35.405 -20.955 1.00 51.22 N ATOM 1368 CA MET A 91 1.255 35.246 -20.905 1.00 1.31 C ATOM 1369 C MET A 91 0.602 36.434 -20.205 1.00 51.13 C ATOM 1370 O MET A 91 -0.381 36.992 -20.694 1.00 2.11 O ATOM 1371 CB MET A 91 0.888 33.949 -20.182 1.00 72.24 C ATOM 1372 CG MET A 91 -0.008 33.031 -20.999 1.00 4.10 C ATOM 1373 SD MET A 91 -1.549 33.825 -21.494 1.00 31.22 S ATOM 1374 CE MET A 91 -2.190 34.340 -19.903 1.00 13.41 C ATOM 0 H MET A 91 3.228 34.630 -20.549 1.00 51.22 H new ATOM 0 HA MET A 91 0.884 35.201 -21.929 1.00 1.31 H new ATOM 0 HB2 MET A 91 1.803 33.415 -19.924 1.00 72.24 H new ATOM 0 HB3 MET A 91 0.387 34.194 -19.246 1.00 72.24 H new ATOM 0 HG2 MET A 91 0.529 32.703 -21.889 1.00 4.10 H new ATOM 0 HG3 MET A 91 -0.235 32.138 -20.416 1.00 4.10 H new ATOM 0 HE1 MET A 91 -3.144 34.849 -20.042 1.00 13.41 H new ATOM 0 HE2 MET A 91 -2.334 33.466 -19.269 1.00 13.41 H new ATOM 0 HE3 MET A 91 -1.482 35.020 -19.428 1.00 13.41 H new ATOM 1384 N LYS A 92 1.154 36.816 -19.058 1.00 75.04 N ATOM 1385 CA LYS A 92 0.626 37.938 -18.291 1.00 52.13 C ATOM 1386 C LYS A 92 0.703 39.232 -19.096 1.00 21.40 C ATOM 1387 O LYS A 92 -0.160 40.102 -18.976 1.00 74.21 O ATOM 1388 CB LYS A 92 1.398 38.094 -16.980 1.00 5.15 C ATOM 1389 CG LYS A 92 0.811 39.141 -16.049 1.00 23.45 C ATOM 1390 CD LYS A 92 1.888 39.805 -15.207 1.00 51.51 C ATOM 1391 CE LYS A 92 1.450 39.955 -13.758 1.00 53.33 C ATOM 1392 NZ LYS A 92 0.488 41.078 -13.583 1.00 53.42 N ATOM 0 H LYS A 92 1.967 36.365 -18.639 1.00 75.04 H new ATOM 0 HA LYS A 92 -0.421 37.732 -18.067 1.00 52.13 H new ATOM 0 HB2 LYS A 92 1.420 37.134 -16.465 1.00 5.15 H new ATOM 0 HB3 LYS A 92 2.431 38.359 -17.206 1.00 5.15 H new ATOM 0 HG2 LYS A 92 0.288 39.897 -16.634 1.00 23.45 H new ATOM 0 HG3 LYS A 92 0.073 38.676 -15.396 1.00 23.45 H new ATOM 0 HD2 LYS A 92 2.803 39.214 -15.252 1.00 51.51 H new ATOM 0 HD3 LYS A 92 2.122 40.786 -15.621 1.00 51.51 H new ATOM 0 HE2 LYS A 92 0.990 39.027 -13.420 1.00 53.33 H new ATOM 0 HE3 LYS A 92 2.325 40.125 -13.130 1.00 53.33 H new ATOM 0 HZ1 LYS A 92 0.214 41.147 -12.582 1.00 53.42 H new ATOM 0 HZ2 LYS A 92 0.935 41.968 -13.882 1.00 53.42 H new ATOM 0 HZ3 LYS A 92 -0.358 40.904 -14.163 1.00 53.42 H new ATOM 1406 N LEU A 93 1.741 39.351 -19.917 1.00 13.13 N ATOM 1407 CA LEU A 93 1.930 40.538 -20.743 1.00 53.41 C ATOM 1408 C LEU A 93 0.835 40.646 -21.800 1.00 64.12 C ATOM 1409 O LEU A 93 0.150 41.664 -21.897 1.00 63.52 O ATOM 1410 CB LEU A 93 3.303 40.502 -21.416 1.00 51.11 C ATOM 1411 CG LEU A 93 4.434 41.214 -20.672 1.00 71.54 C ATOM 1412 CD1 LEU A 93 5.779 40.869 -21.292 1.00 25.04 C ATOM 1413 CD2 LEU A 93 4.212 42.719 -20.678 1.00 72.03 C ATOM 0 H LEU A 93 2.464 38.640 -20.028 1.00 13.13 H new ATOM 0 HA LEU A 93 1.872 41.413 -20.096 1.00 53.41 H new ATOM 0 HB2 LEU A 93 3.588 39.460 -21.558 1.00 51.11 H new ATOM 0 HB3 LEU A 93 3.211 40.946 -22.407 1.00 51.11 H new ATOM 0 HG LEU A 93 4.435 40.872 -19.637 1.00 71.54 H new ATOM 0 HD11 LEU A 93 6.572 41.384 -20.750 1.00 25.04 H new ATOM 0 HD12 LEU A 93 5.941 39.793 -21.235 1.00 25.04 H new ATOM 0 HD13 LEU A 93 5.790 41.183 -22.336 1.00 25.04 H new ATOM 0 HD21 LEU A 93 5.026 43.209 -20.144 1.00 72.03 H new ATOM 0 HD22 LEU A 93 4.184 43.079 -21.707 1.00 72.03 H new ATOM 0 HD23 LEU A 93 3.266 42.949 -20.187 1.00 72.03 H new ATOM 1425 N ALA A 94 0.676 39.588 -22.589 1.00 12.30 N ATOM 1426 CA ALA A 94 -0.338 39.562 -23.636 1.00 10.11 C ATOM 1427 C ALA A 94 -1.721 39.866 -23.069 1.00 45.40 C ATOM 1428 O ALA A 94 -2.575 40.422 -23.759 1.00 2.33 O ATOM 1429 CB ALA A 94 -0.338 38.212 -24.337 1.00 33.43 C ATOM 0 H ALA A 94 1.236 38.738 -22.523 1.00 12.30 H new ATOM 0 HA ALA A 94 -0.094 40.337 -24.363 1.00 10.11 H new ATOM 0 HB1 ALA A 94 -1.100 38.207 -25.116 1.00 33.43 H new ATOM 0 HB2 ALA A 94 0.640 38.034 -24.784 1.00 33.43 H new ATOM 0 HB3 ALA A 94 -0.554 37.426 -23.613 1.00 33.43 H new ATOM 1435 N GLN A 95 -1.933 39.498 -21.810 1.00 30.31 N ATOM 1436 CA GLN A 95 -3.213 39.731 -21.152 1.00 32.41 C ATOM 1437 C GLN A 95 -3.464 41.223 -20.962 1.00 31.12 C ATOM 1438 O GLN A 95 -4.611 41.665 -20.895 1.00 23.20 O ATOM 1439 CB GLN A 95 -3.252 39.018 -19.799 1.00 11.43 C ATOM 1440 CG GLN A 95 -4.552 39.227 -19.038 1.00 43.33 C ATOM 1441 CD GLN A 95 -5.191 37.923 -18.605 1.00 25.40 C ATOM 1442 OE1 GLN A 95 -4.502 36.985 -18.200 1.00 51.33 O ATOM 1443 NE2 GLN A 95 -6.514 37.855 -18.687 1.00 52.23 N ATOM 0 H GLN A 95 -1.235 39.038 -21.225 1.00 30.31 H new ATOM 0 HA GLN A 95 -4.000 39.328 -21.790 1.00 32.41 H new ATOM 0 HB2 GLN A 95 -3.100 37.950 -19.956 1.00 11.43 H new ATOM 0 HB3 GLN A 95 -2.422 39.371 -19.187 1.00 11.43 H new ATOM 0 HG2 GLN A 95 -4.359 39.842 -18.159 1.00 43.33 H new ATOM 0 HG3 GLN A 95 -5.251 39.779 -19.666 1.00 43.33 H new ATOM 0 HE21 GLN A 95 -7.046 38.656 -19.028 1.00 52.23 H new ATOM 0 HE22 GLN A 95 -6.999 37.002 -18.409 1.00 52.23 H new ATOM 1452 N GLN A 96 -2.384 41.993 -20.875 1.00 54.13 N ATOM 1453 CA GLN A 96 -2.489 43.436 -20.692 1.00 24.23 C ATOM 1454 C GLN A 96 -2.292 44.169 -22.015 1.00 21.52 C ATOM 1455 O GLN A 96 -2.777 45.286 -22.195 1.00 72.44 O ATOM 1456 CB GLN A 96 -1.457 43.917 -19.670 1.00 44.13 C ATOM 1457 CG GLN A 96 -1.975 45.012 -18.752 1.00 24.13 C ATOM 1458 CD GLN A 96 -1.945 46.381 -19.401 1.00 51.33 C ATOM 1459 OE1 GLN A 96 -2.980 47.031 -19.554 1.00 62.04 O ATOM 1460 NE2 GLN A 96 -0.756 46.828 -19.788 1.00 3.15 N ATOM 0 H GLN A 96 -1.428 41.642 -20.928 1.00 54.13 H new ATOM 0 HA GLN A 96 -3.489 43.658 -20.321 1.00 24.23 H new ATOM 0 HB2 GLN A 96 -1.135 43.070 -19.065 1.00 44.13 H new ATOM 0 HB3 GLN A 96 -0.577 44.284 -20.199 1.00 44.13 H new ATOM 0 HG2 GLN A 96 -2.997 44.778 -18.454 1.00 24.13 H new ATOM 0 HG3 GLN A 96 -1.375 45.032 -17.842 1.00 24.13 H new ATOM 0 HE21 GLN A 96 0.076 46.256 -19.642 1.00 3.15 H new ATOM 0 HE22 GLN A 96 -0.675 47.743 -20.231 1.00 3.15 H new ATOM 1469 N TYR A 97 -1.577 43.533 -22.937 1.00 32.04 N ATOM 1470 CA TYR A 97 -1.314 44.126 -24.242 1.00 61.35 C ATOM 1471 C TYR A 97 -2.323 43.635 -25.277 1.00 4.33 C ATOM 1472 O TYR A 97 -2.037 43.604 -26.474 1.00 22.12 O ATOM 1473 CB TYR A 97 0.107 43.791 -24.701 1.00 14.14 C ATOM 1474 CG TYR A 97 1.158 44.722 -24.141 1.00 4.11 C ATOM 1475 CD1 TYR A 97 1.507 45.889 -24.809 1.00 45.32 C ATOM 1476 CD2 TYR A 97 1.804 44.434 -22.945 1.00 12.33 C ATOM 1477 CE1 TYR A 97 2.468 46.743 -24.302 1.00 63.41 C ATOM 1478 CE2 TYR A 97 2.765 45.282 -22.429 1.00 54.44 C ATOM 1479 CZ TYR A 97 3.094 46.435 -23.112 1.00 14.13 C ATOM 1480 OH TYR A 97 4.051 47.282 -22.602 1.00 63.15 O ATOM 0 H TYR A 97 -1.170 42.607 -22.804 1.00 32.04 H new ATOM 0 HA TYR A 97 -1.413 45.207 -24.148 1.00 61.35 H new ATOM 0 HB2 TYR A 97 0.344 42.769 -24.405 1.00 14.14 H new ATOM 0 HB3 TYR A 97 0.146 43.825 -25.790 1.00 14.14 H new ATOM 0 HD1 TYR A 97 1.019 46.133 -25.741 1.00 45.32 H new ATOM 0 HD2 TYR A 97 1.550 43.531 -22.409 1.00 12.33 H new ATOM 0 HE1 TYR A 97 2.727 47.646 -24.834 1.00 63.41 H new ATOM 0 HE2 TYR A 97 3.256 45.044 -21.497 1.00 54.44 H new ATOM 0 HH TYR A 97 4.392 46.920 -21.758 1.00 63.15 H new ATOM 1490 N VAL A 98 -3.505 43.254 -24.805 1.00 74.44 N ATOM 1491 CA VAL A 98 -4.559 42.766 -25.688 1.00 1.23 C ATOM 1492 C VAL A 98 -5.744 43.725 -25.711 1.00 2.11 C ATOM 1493 O VAL A 98 -6.422 43.866 -26.728 1.00 64.53 O ATOM 1494 CB VAL A 98 -5.050 41.371 -25.258 1.00 61.11 C ATOM 1495 CG1 VAL A 98 -5.508 41.389 -23.808 1.00 13.21 C ATOM 1496 CG2 VAL A 98 -6.168 40.895 -26.173 1.00 60.03 C ATOM 0 H VAL A 98 -3.758 43.273 -23.817 1.00 74.44 H new ATOM 0 HA VAL A 98 -4.129 42.700 -26.688 1.00 1.23 H new ATOM 0 HB VAL A 98 -4.219 40.671 -25.342 1.00 61.11 H new ATOM 0 HG11 VAL A 98 -5.851 40.395 -23.523 1.00 13.21 H new ATOM 0 HG12 VAL A 98 -4.677 41.684 -23.167 1.00 13.21 H new ATOM 0 HG13 VAL A 98 -6.325 42.102 -23.693 1.00 13.21 H new ATOM 0 HG21 VAL A 98 -6.503 39.908 -25.855 1.00 60.03 H new ATOM 0 HG22 VAL A 98 -7.002 41.595 -26.123 1.00 60.03 H new ATOM 0 HG23 VAL A 98 -5.801 40.841 -27.198 1.00 60.03 H new ATOM 1506 N MET A 99 -5.987 44.383 -24.582 1.00 53.44 N ATOM 1507 CA MET A 99 -7.090 45.331 -24.474 1.00 12.42 C ATOM 1508 C MET A 99 -6.861 46.538 -25.379 1.00 31.23 C ATOM 1509 O MET A 99 -7.808 47.216 -25.779 1.00 10.01 O ATOM 1510 CB MET A 99 -7.255 45.791 -23.024 1.00 32.31 C ATOM 1511 CG MET A 99 -8.474 46.672 -22.800 1.00 63.45 C ATOM 1512 SD MET A 99 -8.065 48.229 -21.989 1.00 53.21 S ATOM 1513 CE MET A 99 -7.100 49.033 -23.266 1.00 25.24 C ATOM 0 H MET A 99 -5.436 44.277 -23.730 1.00 53.44 H new ATOM 0 HA MET A 99 -8.002 44.827 -24.794 1.00 12.42 H new ATOM 0 HB2 MET A 99 -7.327 44.915 -22.380 1.00 32.31 H new ATOM 0 HB3 MET A 99 -6.362 46.337 -22.721 1.00 32.31 H new ATOM 0 HG2 MET A 99 -8.948 46.880 -23.759 1.00 63.45 H new ATOM 0 HG3 MET A 99 -9.202 46.132 -22.195 1.00 63.45 H new ATOM 0 HE1 MET A 99 -6.818 50.032 -22.934 1.00 25.24 H new ATOM 0 HE2 MET A 99 -6.201 48.449 -23.464 1.00 25.24 H new ATOM 0 HE3 MET A 99 -7.693 49.107 -24.178 1.00 25.24 H new ATOM 1523 N THR A 100 -5.598 46.801 -25.698 1.00 43.22 N ATOM 1524 CA THR A 100 -5.244 47.927 -26.554 1.00 75.53 C ATOM 1525 C THR A 100 -5.516 47.608 -28.020 1.00 43.52 C ATOM 1526 O THR A 100 -6.479 48.104 -28.605 1.00 3.40 O ATOM 1527 CB THR A 100 -3.763 48.314 -26.390 1.00 64.44 C ATOM 1528 OG1 THR A 100 -2.949 47.136 -26.362 1.00 62.34 O ATOM 1529 CG2 THR A 100 -3.550 49.113 -25.114 1.00 12.41 C ATOM 0 H THR A 100 -4.803 46.249 -25.376 1.00 43.22 H new ATOM 0 HA THR A 100 -5.866 48.767 -26.246 1.00 75.53 H new ATOM 0 HB THR A 100 -3.477 48.934 -27.240 1.00 64.44 H new ATOM 0 HG1 THR A 100 -2.008 47.391 -26.259 1.00 62.34 H new ATOM 0 HG21 THR A 100 -2.496 49.375 -25.020 1.00 12.41 H new ATOM 0 HG22 THR A 100 -4.148 50.023 -25.151 1.00 12.41 H new ATOM 0 HG23 THR A 100 -3.853 48.514 -24.255 1.00 12.41 H new ATOM 1537 N SER A 101 -4.661 46.778 -28.609 1.00 31.22 N ATOM 1538 CA SER A 101 -4.807 46.396 -30.008 1.00 73.14 C ATOM 1539 C SER A 101 -3.704 45.428 -30.425 1.00 73.24 C ATOM 1540 O SER A 101 -3.927 44.525 -31.233 1.00 32.31 O ATOM 1541 CB SER A 101 -4.778 47.636 -30.903 1.00 42.53 C ATOM 1542 OG SER A 101 -6.035 47.849 -31.522 1.00 63.34 O ATOM 0 H SER A 101 -3.860 46.357 -28.139 1.00 31.22 H new ATOM 0 HA SER A 101 -5.768 45.896 -30.124 1.00 73.14 H new ATOM 0 HB2 SER A 101 -4.509 48.510 -30.310 1.00 42.53 H new ATOM 0 HB3 SER A 101 -4.009 47.519 -31.666 1.00 42.53 H new ATOM 0 HG SER A 101 -6.713 48.021 -30.835 1.00 63.34 H new ATOM 1548 N LEU A 102 -2.514 45.623 -29.869 1.00 63.44 N ATOM 1549 CA LEU A 102 -1.374 44.767 -30.182 1.00 40.54 C ATOM 1550 C LEU A 102 -1.481 43.431 -29.456 1.00 25.43 C ATOM 1551 O LEU A 102 -0.646 43.104 -28.612 1.00 50.32 O ATOM 1552 CB LEU A 102 -0.067 45.466 -29.801 1.00 35.43 C ATOM 1553 CG LEU A 102 0.000 46.966 -30.086 1.00 52.32 C ATOM 1554 CD1 LEU A 102 1.377 47.514 -29.744 1.00 32.52 C ATOM 1555 CD2 LEU A 102 -0.341 47.248 -31.542 1.00 52.12 C ATOM 0 H LEU A 102 -2.313 46.366 -29.199 1.00 63.44 H new ATOM 0 HA LEU A 102 -1.377 44.577 -31.255 1.00 40.54 H new ATOM 0 HB2 LEU A 102 0.108 45.311 -28.736 1.00 35.43 H new ATOM 0 HB3 LEU A 102 0.750 44.979 -30.332 1.00 35.43 H new ATOM 0 HG LEU A 102 -0.735 47.469 -29.457 1.00 52.32 H new ATOM 0 HD11 LEU A 102 1.405 48.583 -29.954 1.00 32.52 H new ATOM 0 HD12 LEU A 102 1.583 47.346 -28.687 1.00 32.52 H new ATOM 0 HD13 LEU A 102 2.131 47.006 -30.346 1.00 32.52 H new ATOM 0 HD21 LEU A 102 -0.288 48.321 -31.727 1.00 52.12 H new ATOM 0 HD22 LEU A 102 0.370 46.733 -32.188 1.00 52.12 H new ATOM 0 HD23 LEU A 102 -1.349 46.892 -31.755 1.00 52.12 H new ATOM 1567 N GLN A 103 -2.511 42.661 -29.791 1.00 12.20 N ATOM 1568 CA GLN A 103 -2.725 41.359 -29.171 1.00 32.00 C ATOM 1569 C GLN A 103 -1.947 40.272 -29.905 1.00 52.03 C ATOM 1570 O GLN A 103 -1.165 39.540 -29.300 1.00 32.32 O ATOM 1571 CB GLN A 103 -4.216 41.016 -29.158 1.00 63.51 C ATOM 1572 CG GLN A 103 -4.507 39.587 -28.727 1.00 12.22 C ATOM 1573 CD GLN A 103 -4.441 38.605 -29.879 1.00 63.43 C ATOM 1574 OE1 GLN A 103 -3.543 37.764 -29.943 1.00 1.23 O ATOM 1575 NE2 GLN A 103 -5.394 38.705 -30.799 1.00 24.33 N ATOM 0 H GLN A 103 -3.210 42.916 -30.488 1.00 12.20 H new ATOM 0 HA GLN A 103 -2.362 41.409 -28.144 1.00 32.00 H new ATOM 0 HB2 GLN A 103 -4.732 41.702 -28.486 1.00 63.51 H new ATOM 0 HB3 GLN A 103 -4.626 41.177 -30.155 1.00 63.51 H new ATOM 0 HG2 GLN A 103 -3.792 39.290 -27.960 1.00 12.22 H new ATOM 0 HG3 GLN A 103 -5.497 39.543 -28.273 1.00 12.22 H new ATOM 0 HE21 GLN A 103 -6.119 39.416 -30.707 1.00 24.33 H new ATOM 0 HE22 GLN A 103 -5.401 38.070 -31.597 1.00 24.33 H new ATOM 1584 N GLN A 104 -2.168 40.174 -31.212 1.00 61.52 N ATOM 1585 CA GLN A 104 -1.488 39.175 -32.028 1.00 63.32 C ATOM 1586 C GLN A 104 0.022 39.236 -31.817 1.00 74.43 C ATOM 1587 O GLN A 104 0.694 38.206 -31.779 1.00 71.22 O ATOM 1588 CB GLN A 104 -1.817 39.384 -33.507 1.00 62.23 C ATOM 1589 CG GLN A 104 -3.308 39.444 -33.796 1.00 70.53 C ATOM 1590 CD GLN A 104 -3.732 40.766 -34.404 1.00 72.00 C ATOM 1591 OE1 GLN A 104 -3.180 41.204 -35.414 1.00 32.30 O ATOM 1592 NE2 GLN A 104 -4.718 41.411 -33.791 1.00 22.43 N ATOM 0 H GLN A 104 -2.812 40.774 -31.728 1.00 61.52 H new ATOM 0 HA GLN A 104 -1.840 38.190 -31.721 1.00 63.32 H new ATOM 0 HB2 GLN A 104 -1.352 40.309 -33.847 1.00 62.23 H new ATOM 0 HB3 GLN A 104 -1.375 38.574 -34.087 1.00 62.23 H new ATOM 0 HG2 GLN A 104 -3.576 38.634 -34.475 1.00 70.53 H new ATOM 0 HG3 GLN A 104 -3.860 39.280 -32.871 1.00 70.53 H new ATOM 0 HE21 GLN A 104 -5.147 41.012 -32.956 1.00 22.43 H new ATOM 0 HE22 GLN A 104 -5.046 42.306 -34.155 1.00 22.43 H new ATOM 1601 N GLU A 105 0.547 40.449 -31.681 1.00 53.34 N ATOM 1602 CA GLU A 105 1.977 40.643 -31.476 1.00 3.23 C ATOM 1603 C GLU A 105 2.455 39.893 -30.236 1.00 23.02 C ATOM 1604 O GLU A 105 3.129 38.868 -30.339 1.00 30.52 O ATOM 1605 CB GLU A 105 2.298 42.133 -31.339 1.00 0.10 C ATOM 1606 CG GLU A 105 3.730 42.411 -30.913 1.00 71.22 C ATOM 1607 CD GLU A 105 4.124 43.863 -31.103 1.00 33.22 C ATOM 1608 OE1 GLU A 105 4.147 44.326 -32.262 1.00 75.53 O ATOM 1609 OE2 GLU A 105 4.409 44.536 -30.090 1.00 51.54 O ATOM 0 H GLU A 105 0.004 41.312 -31.709 1.00 53.34 H new ATOM 0 HA GLU A 105 2.500 40.244 -32.345 1.00 3.23 H new ATOM 0 HB2 GLU A 105 2.110 42.626 -32.293 1.00 0.10 H new ATOM 0 HB3 GLU A 105 1.619 42.577 -30.611 1.00 0.10 H new ATOM 0 HG2 GLU A 105 3.852 42.140 -29.864 1.00 71.22 H new ATOM 0 HG3 GLU A 105 4.406 41.777 -31.487 1.00 71.22 H new ATOM 1616 N TYR A 106 2.102 40.412 -29.065 1.00 64.11 N ATOM 1617 CA TYR A 106 2.497 39.794 -27.805 1.00 22.20 C ATOM 1618 C TYR A 106 2.087 38.325 -27.766 1.00 73.04 C ATOM 1619 O TYR A 106 2.720 37.508 -27.097 1.00 72.15 O ATOM 1620 CB TYR A 106 1.869 40.541 -26.627 1.00 45.44 C ATOM 1621 CG TYR A 106 2.738 41.654 -26.084 1.00 74.22 C ATOM 1622 CD1 TYR A 106 2.795 42.889 -26.718 1.00 65.14 C ATOM 1623 CD2 TYR A 106 3.501 41.470 -24.938 1.00 33.21 C ATOM 1624 CE1 TYR A 106 3.588 43.908 -26.226 1.00 53.13 C ATOM 1625 CE2 TYR A 106 4.295 42.484 -24.438 1.00 35.31 C ATOM 1626 CZ TYR A 106 4.335 43.701 -25.086 1.00 31.24 C ATOM 1627 OH TYR A 106 5.126 44.713 -24.591 1.00 74.25 O ATOM 0 H TYR A 106 1.543 41.259 -28.962 1.00 64.11 H new ATOM 0 HA TYR A 106 3.583 39.852 -27.727 1.00 22.20 H new ATOM 0 HB2 TYR A 106 0.912 40.958 -26.941 1.00 45.44 H new ATOM 0 HB3 TYR A 106 1.660 39.831 -25.827 1.00 45.44 H new ATOM 0 HD1 TYR A 106 2.210 43.055 -27.610 1.00 65.14 H new ATOM 0 HD2 TYR A 106 3.473 40.518 -24.429 1.00 33.21 H new ATOM 0 HE1 TYR A 106 3.622 44.862 -26.732 1.00 53.13 H new ATOM 0 HE2 TYR A 106 4.881 42.325 -23.545 1.00 35.31 H new ATOM 0 HH TYR A 106 4.653 45.174 -23.867 1.00 74.25 H new ATOM 1637 N LYS A 107 1.022 37.996 -28.490 1.00 31.01 N ATOM 1638 CA LYS A 107 0.525 36.626 -28.542 1.00 43.11 C ATOM 1639 C LYS A 107 1.545 35.702 -29.201 1.00 51.50 C ATOM 1640 O LYS A 107 1.890 34.653 -28.658 1.00 33.23 O ATOM 1641 CB LYS A 107 -0.799 36.571 -29.308 1.00 24.53 C ATOM 1642 CG LYS A 107 -1.458 35.203 -29.284 1.00 33.45 C ATOM 1643 CD LYS A 107 -2.370 35.002 -30.483 1.00 24.33 C ATOM 1644 CE LYS A 107 -1.765 34.032 -31.486 1.00 62.22 C ATOM 1645 NZ LYS A 107 -0.838 34.716 -32.430 1.00 11.22 N ATOM 0 H LYS A 107 0.486 38.660 -29.049 1.00 31.01 H new ATOM 0 HA LYS A 107 0.361 36.286 -27.519 1.00 43.11 H new ATOM 0 HB2 LYS A 107 -1.486 37.303 -28.883 1.00 24.53 H new ATOM 0 HB3 LYS A 107 -0.623 36.862 -30.343 1.00 24.53 H new ATOM 0 HG2 LYS A 107 -0.691 34.429 -29.275 1.00 33.45 H new ATOM 0 HG3 LYS A 107 -2.034 35.092 -28.365 1.00 33.45 H new ATOM 0 HD2 LYS A 107 -3.336 34.625 -30.148 1.00 24.33 H new ATOM 0 HD3 LYS A 107 -2.553 35.961 -30.967 1.00 24.33 H new ATOM 0 HE2 LYS A 107 -1.227 33.248 -30.954 1.00 62.22 H new ATOM 0 HE3 LYS A 107 -2.563 33.547 -32.048 1.00 62.22 H new ATOM 0 HZ1 LYS A 107 -0.447 34.021 -33.097 1.00 11.22 H new ATOM 0 HZ2 LYS A 107 -1.356 35.448 -32.957 1.00 11.22 H new ATOM 0 HZ3 LYS A 107 -0.063 35.158 -31.896 1.00 11.22 H new ATOM 1659 N LYS A 108 2.025 36.100 -30.374 1.00 44.32 N ATOM 1660 CA LYS A 108 3.008 35.310 -31.107 1.00 11.43 C ATOM 1661 C LYS A 108 4.203 34.972 -30.222 1.00 3.14 C ATOM 1662 O LYS A 108 4.648 33.825 -30.176 1.00 53.41 O ATOM 1663 CB LYS A 108 3.479 36.069 -32.350 1.00 14.24 C ATOM 1664 CG LYS A 108 3.560 35.205 -33.596 1.00 33.53 C ATOM 1665 CD LYS A 108 4.346 35.891 -34.700 1.00 74.34 C ATOM 1666 CE LYS A 108 3.578 35.890 -36.014 1.00 21.15 C ATOM 1667 NZ LYS A 108 3.990 34.763 -36.896 1.00 41.41 N ATOM 0 H LYS A 108 1.749 36.965 -30.838 1.00 44.32 H new ATOM 0 HA LYS A 108 2.532 34.379 -31.416 1.00 11.43 H new ATOM 0 HB2 LYS A 108 2.799 36.900 -32.538 1.00 14.24 H new ATOM 0 HB3 LYS A 108 4.461 36.500 -32.152 1.00 14.24 H new ATOM 0 HG2 LYS A 108 4.031 34.253 -33.350 1.00 33.53 H new ATOM 0 HG3 LYS A 108 2.554 34.980 -33.950 1.00 33.53 H new ATOM 0 HD2 LYS A 108 4.567 36.917 -34.407 1.00 74.34 H new ATOM 0 HD3 LYS A 108 5.302 35.385 -34.836 1.00 74.34 H new ATOM 0 HE2 LYS A 108 2.510 35.820 -35.810 1.00 21.15 H new ATOM 0 HE3 LYS A 108 3.742 36.835 -36.532 1.00 21.15 H new ATOM 0 HZ1 LYS A 108 3.444 34.797 -37.781 1.00 41.41 H new ATOM 0 HZ2 LYS A 108 5.004 34.844 -37.111 1.00 41.41 H new ATOM 0 HZ3 LYS A 108 3.810 33.860 -36.413 1.00 41.41 H new ATOM 1681 N GLN A 109 4.717 35.977 -29.520 1.00 23.13 N ATOM 1682 CA GLN A 109 5.861 35.784 -28.636 1.00 14.25 C ATOM 1683 C GLN A 109 5.583 34.681 -27.619 1.00 50.52 C ATOM 1684 O GLN A 109 6.427 33.818 -27.379 1.00 51.55 O ATOM 1685 CB GLN A 109 6.198 37.089 -27.911 1.00 75.32 C ATOM 1686 CG GLN A 109 7.432 37.787 -28.459 1.00 13.24 C ATOM 1687 CD GLN A 109 7.227 39.279 -28.638 1.00 72.52 C ATOM 1688 OE1 GLN A 109 6.131 39.730 -28.973 1.00 3.54 O ATOM 1689 NE2 GLN A 109 8.283 40.052 -28.416 1.00 52.42 N ATOM 0 H GLN A 109 4.360 36.932 -29.546 1.00 23.13 H new ATOM 0 HA GLN A 109 6.713 35.485 -29.246 1.00 14.25 H new ATOM 0 HB2 GLN A 109 5.346 37.765 -27.983 1.00 75.32 H new ATOM 0 HB3 GLN A 109 6.350 36.878 -26.852 1.00 75.32 H new ATOM 0 HG2 GLN A 109 8.271 37.618 -27.784 1.00 13.24 H new ATOM 0 HG3 GLN A 109 7.700 37.343 -29.418 1.00 13.24 H new ATOM 0 HE21 GLN A 109 9.172 39.634 -28.140 1.00 52.42 H new ATOM 0 HE22 GLN A 109 8.206 41.064 -28.521 1.00 52.42 H new ATOM 1698 N MET A 110 4.395 34.717 -27.025 1.00 11.04 N ATOM 1699 CA MET A 110 4.006 33.720 -26.034 1.00 63.53 C ATOM 1700 C MET A 110 4.116 32.311 -26.609 1.00 71.05 C ATOM 1701 O MET A 110 4.749 31.435 -26.018 1.00 14.33 O ATOM 1702 CB MET A 110 2.577 33.977 -25.554 1.00 32.13 C ATOM 1703 CG MET A 110 2.018 32.862 -24.685 1.00 74.43 C ATOM 1704 SD MET A 110 0.743 31.901 -25.524 1.00 62.22 S ATOM 1705 CE MET A 110 1.487 30.272 -25.516 1.00 63.43 C ATOM 0 H MET A 110 3.685 35.425 -27.212 1.00 11.04 H new ATOM 0 HA MET A 110 4.686 33.802 -25.186 1.00 63.53 H new ATOM 0 HB2 MET A 110 2.554 34.911 -24.992 1.00 32.13 H new ATOM 0 HB3 MET A 110 1.930 34.110 -26.421 1.00 32.13 H new ATOM 0 HG2 MET A 110 2.829 32.199 -24.385 1.00 74.43 H new ATOM 0 HG3 MET A 110 1.603 33.291 -23.773 1.00 74.43 H new ATOM 0 HE1 MET A 110 0.896 29.599 -26.138 1.00 63.43 H new ATOM 0 HE2 MET A 110 2.501 30.333 -25.910 1.00 63.43 H new ATOM 0 HE3 MET A 110 1.517 29.891 -24.495 1.00 63.43 H new ATOM 1715 N LEU A 111 3.496 32.099 -27.765 1.00 63.12 N ATOM 1716 CA LEU A 111 3.524 30.796 -28.420 1.00 62.25 C ATOM 1717 C LEU A 111 4.958 30.310 -28.605 1.00 61.22 C ATOM 1718 O LEU A 111 5.260 29.135 -28.392 1.00 10.01 O ATOM 1719 CB LEU A 111 2.820 30.870 -29.776 1.00 71.34 C ATOM 1720 CG LEU A 111 2.105 29.597 -30.232 1.00 24.22 C ATOM 1721 CD1 LEU A 111 1.661 29.724 -31.681 1.00 32.44 C ATOM 1722 CD2 LEU A 111 3.009 28.385 -30.053 1.00 53.23 C ATOM 0 H LEU A 111 2.968 32.812 -28.268 1.00 63.12 H new ATOM 0 HA LEU A 111 2.998 30.085 -27.783 1.00 62.25 H new ATOM 0 HB2 LEU A 111 2.091 31.679 -29.741 1.00 71.34 H new ATOM 0 HB3 LEU A 111 3.558 31.139 -30.532 1.00 71.34 H new ATOM 0 HG LEU A 111 1.218 29.459 -29.613 1.00 24.22 H new ATOM 0 HD11 LEU A 111 1.154 28.809 -31.988 1.00 32.44 H new ATOM 0 HD12 LEU A 111 0.978 30.568 -31.780 1.00 32.44 H new ATOM 0 HD13 LEU A 111 2.532 29.887 -32.316 1.00 32.44 H new ATOM 0 HD21 LEU A 111 2.484 27.488 -30.382 1.00 53.23 H new ATOM 0 HD22 LEU A 111 3.914 28.515 -30.647 1.00 53.23 H new ATOM 0 HD23 LEU A 111 3.277 28.283 -29.001 1.00 53.23 H new ATOM 1734 N THR A 112 5.840 31.222 -29.002 1.00 4.05 N ATOM 1735 CA THR A 112 7.243 30.887 -29.214 1.00 11.21 C ATOM 1736 C THR A 112 7.824 30.160 -28.006 1.00 54.43 C ATOM 1737 O THR A 112 8.391 29.076 -28.136 1.00 75.03 O ATOM 1738 CB THR A 112 8.085 32.146 -29.495 1.00 13.33 C ATOM 1739 OG1 THR A 112 7.533 32.867 -30.602 1.00 44.22 O ATOM 1740 CG2 THR A 112 9.530 31.776 -29.793 1.00 34.31 C ATOM 0 H THR A 112 5.608 32.198 -29.183 1.00 4.05 H new ATOM 0 HA THR A 112 7.283 30.231 -30.083 1.00 11.21 H new ATOM 0 HB THR A 112 8.065 32.776 -28.606 1.00 13.33 H new ATOM 0 HG1 THR A 112 6.681 33.272 -30.336 1.00 44.22 H new ATOM 0 HG21 THR A 112 10.105 32.681 -29.988 1.00 34.31 H new ATOM 0 HG22 THR A 112 9.956 31.254 -28.936 1.00 34.31 H new ATOM 0 HG23 THR A 112 9.566 31.127 -30.668 1.00 34.31 H new ATOM 1748 N ALA A 113 7.678 30.764 -26.832 1.00 11.55 N ATOM 1749 CA ALA A 113 8.186 30.173 -25.600 1.00 72.31 C ATOM 1750 C ALA A 113 7.533 28.821 -25.330 1.00 41.24 C ATOM 1751 O ALA A 113 8.218 27.814 -25.156 1.00 44.12 O ATOM 1752 CB ALA A 113 7.956 31.115 -24.428 1.00 3.22 C ATOM 0 H ALA A 113 7.212 31.663 -26.708 1.00 11.55 H new ATOM 0 HA ALA A 113 9.258 30.013 -25.718 1.00 72.31 H new ATOM 0 HB1 ALA A 113 8.340 30.660 -23.515 1.00 3.22 H new ATOM 0 HB2 ALA A 113 8.474 32.056 -24.611 1.00 3.22 H new ATOM 0 HB3 ALA A 113 6.888 31.304 -24.317 1.00 3.22 H new ATOM 1758 N ALA A 114 6.205 28.807 -25.297 1.00 14.22 N ATOM 1759 CA ALA A 114 5.460 27.579 -25.050 1.00 34.14 C ATOM 1760 C ALA A 114 5.856 26.488 -26.039 1.00 13.12 C ATOM 1761 O ALA A 114 5.769 25.298 -25.734 1.00 13.11 O ATOM 1762 CB ALA A 114 3.963 27.845 -25.125 1.00 65.22 C ATOM 0 H ALA A 114 5.623 29.632 -25.438 1.00 14.22 H new ATOM 0 HA ALA A 114 5.706 27.230 -24.047 1.00 34.14 H new ATOM 0 HB1 ALA A 114 3.419 26.919 -24.939 1.00 65.22 H new ATOM 0 HB2 ALA A 114 3.687 28.585 -24.374 1.00 65.22 H new ATOM 0 HB3 ALA A 114 3.710 28.221 -26.116 1.00 65.22 H new ATOM 1768 N HIS A 115 6.290 26.901 -27.225 1.00 65.12 N ATOM 1769 CA HIS A 115 6.700 25.958 -28.260 1.00 30.12 C ATOM 1770 C HIS A 115 7.912 25.148 -27.808 1.00 54.11 C ATOM 1771 O HIS A 115 7.872 23.919 -27.779 1.00 24.54 O ATOM 1772 CB HIS A 115 7.023 26.700 -29.557 1.00 52.01 C ATOM 1773 CG HIS A 115 7.154 25.799 -30.746 1.00 73.31 C ATOM 1774 ND1 HIS A 115 8.313 25.692 -31.485 1.00 73.34 N ATOM 1775 CD2 HIS A 115 6.263 24.958 -31.322 1.00 52.11 C ATOM 1776 CE1 HIS A 115 8.129 24.826 -32.466 1.00 35.32 C ATOM 1777 NE2 HIS A 115 6.893 24.366 -32.389 1.00 32.43 N ATOM 0 H HIS A 115 6.367 27.882 -27.494 1.00 65.12 H new ATOM 0 HA HIS A 115 5.873 25.272 -28.440 1.00 30.12 H new ATOM 0 HB2 HIS A 115 6.240 27.433 -29.751 1.00 52.01 H new ATOM 0 HB3 HIS A 115 7.953 27.254 -29.427 1.00 52.01 H new ATOM 0 HD2 HIS A 115 5.246 24.785 -31.002 1.00 52.11 H new ATOM 0 HE1 HIS A 115 8.864 24.543 -33.205 1.00 35.32 H new ATOM 0 HE2 HIS A 115 6.475 23.682 -33.020 1.00 32.43 H new ATOM 1785 N ALA A 116 8.987 25.846 -27.458 1.00 12.41 N ATOM 1786 CA ALA A 116 10.209 25.192 -27.007 1.00 12.42 C ATOM 1787 C ALA A 116 9.991 24.479 -25.677 1.00 11.24 C ATOM 1788 O ALA A 116 10.608 23.449 -25.405 1.00 22.54 O ATOM 1789 CB ALA A 116 11.336 26.207 -26.885 1.00 64.35 C ATOM 0 H ALA A 116 9.036 26.865 -27.478 1.00 12.41 H new ATOM 0 HA ALA A 116 10.487 24.444 -27.749 1.00 12.42 H new ATOM 0 HB1 ALA A 116 12.243 25.705 -26.547 1.00 64.35 H new ATOM 0 HB2 ALA A 116 11.517 26.668 -27.856 1.00 64.35 H new ATOM 0 HB3 ALA A 116 11.057 26.976 -26.164 1.00 64.35 H new ATOM 1795 N LEU A 117 9.111 25.034 -24.851 1.00 35.22 N ATOM 1796 CA LEU A 117 8.811 24.451 -23.547 1.00 64.34 C ATOM 1797 C LEU A 117 8.122 23.099 -23.701 1.00 30.30 C ATOM 1798 O LEU A 117 8.540 22.106 -23.105 1.00 42.43 O ATOM 1799 CB LEU A 117 7.927 25.397 -22.734 1.00 2.40 C ATOM 1800 CG LEU A 117 8.015 25.258 -21.214 1.00 3.02 C ATOM 1801 CD1 LEU A 117 7.507 23.895 -20.772 1.00 74.54 C ATOM 1802 CD2 LEU A 117 9.445 25.475 -20.740 1.00 62.33 C ATOM 0 H LEU A 117 8.592 25.887 -25.061 1.00 35.22 H new ATOM 0 HA LEU A 117 9.752 24.301 -23.019 1.00 64.34 H new ATOM 0 HB2 LEU A 117 8.185 26.422 -23.001 1.00 2.40 H new ATOM 0 HB3 LEU A 117 6.891 25.241 -23.034 1.00 2.40 H new ATOM 0 HG LEU A 117 7.383 26.023 -20.762 1.00 3.02 H new ATOM 0 HD11 LEU A 117 7.577 23.815 -19.687 1.00 74.54 H new ATOM 0 HD12 LEU A 117 6.467 23.777 -21.078 1.00 74.54 H new ATOM 0 HD13 LEU A 117 8.111 23.114 -21.234 1.00 74.54 H new ATOM 0 HD21 LEU A 117 9.488 25.372 -19.656 1.00 62.33 H new ATOM 0 HD22 LEU A 117 10.098 24.734 -21.201 1.00 62.33 H new ATOM 0 HD23 LEU A 117 9.774 26.475 -21.023 1.00 62.33 H new ATOM 1814 N ALA A 118 7.065 23.068 -24.505 1.00 74.55 N ATOM 1815 CA ALA A 118 6.320 21.837 -24.741 1.00 31.21 C ATOM 1816 C ALA A 118 7.252 20.701 -25.150 1.00 54.22 C ATOM 1817 O ALA A 118 7.245 19.630 -24.543 1.00 43.12 O ATOM 1818 CB ALA A 118 5.256 22.059 -25.806 1.00 1.22 C ATOM 0 H ALA A 118 6.705 23.881 -25.004 1.00 74.55 H new ATOM 0 HA ALA A 118 5.831 21.553 -23.809 1.00 31.21 H new ATOM 0 HB1 ALA A 118 4.708 21.131 -25.972 1.00 1.22 H new ATOM 0 HB2 ALA A 118 4.565 22.834 -25.474 1.00 1.22 H new ATOM 0 HB3 ALA A 118 5.732 22.370 -26.736 1.00 1.22 H new ATOM 1824 N VAL A 119 8.052 20.942 -26.184 1.00 31.20 N ATOM 1825 CA VAL A 119 8.990 19.939 -26.674 1.00 51.02 C ATOM 1826 C VAL A 119 9.929 19.477 -25.566 1.00 22.30 C ATOM 1827 O VAL A 119 10.287 18.301 -25.491 1.00 73.04 O ATOM 1828 CB VAL A 119 9.827 20.480 -27.849 1.00 34.11 C ATOM 1829 CG1 VAL A 119 10.729 19.391 -28.408 1.00 23.32 C ATOM 1830 CG2 VAL A 119 8.920 21.042 -28.934 1.00 23.51 C ATOM 0 H VAL A 119 8.069 21.823 -26.698 1.00 31.20 H new ATOM 0 HA VAL A 119 8.396 19.093 -27.020 1.00 51.02 H new ATOM 0 HB VAL A 119 10.459 21.288 -27.481 1.00 34.11 H new ATOM 0 HG11 VAL A 119 11.312 19.792 -29.237 1.00 23.32 H new ATOM 0 HG12 VAL A 119 11.403 19.040 -27.626 1.00 23.32 H new ATOM 0 HG13 VAL A 119 10.119 18.560 -28.762 1.00 23.32 H new ATOM 0 HG21 VAL A 119 9.527 21.420 -29.756 1.00 23.51 H new ATOM 0 HG22 VAL A 119 8.261 20.255 -29.301 1.00 23.51 H new ATOM 0 HG23 VAL A 119 8.321 21.854 -28.523 1.00 23.51 H new ATOM 1840 N ASP A 120 10.325 20.409 -24.706 1.00 40.15 N ATOM 1841 CA ASP A 120 11.222 20.097 -23.600 1.00 2.42 C ATOM 1842 C ASP A 120 10.578 19.099 -22.643 1.00 63.20 C ATOM 1843 O ASP A 120 11.194 18.103 -22.263 1.00 55.11 O ATOM 1844 CB ASP A 120 11.600 21.374 -22.846 1.00 71.25 C ATOM 1845 CG ASP A 120 13.074 21.424 -22.495 1.00 52.13 C ATOM 1846 OD1 ASP A 120 13.454 20.861 -21.447 1.00 61.45 O ATOM 1847 OD2 ASP A 120 13.847 22.026 -23.269 1.00 3.33 O ATOM 0 H ASP A 120 10.039 21.387 -24.754 1.00 40.15 H new ATOM 0 HA ASP A 120 12.125 19.647 -24.013 1.00 2.42 H new ATOM 0 HB2 ASP A 120 11.345 22.241 -23.455 1.00 71.25 H new ATOM 0 HB3 ASP A 120 11.009 21.441 -21.932 1.00 71.25 H new ATOM 1852 N ALA A 121 9.337 19.373 -22.257 1.00 13.32 N ATOM 1853 CA ALA A 121 8.609 18.499 -21.345 1.00 63.12 C ATOM 1854 C ALA A 121 8.635 17.054 -21.833 1.00 55.30 C ATOM 1855 O ALA A 121 8.792 16.124 -21.043 1.00 20.44 O ATOM 1856 CB ALA A 121 7.174 18.979 -21.186 1.00 4.14 C ATOM 0 H ALA A 121 8.814 20.194 -22.562 1.00 13.32 H new ATOM 0 HA ALA A 121 9.102 18.536 -20.374 1.00 63.12 H new ATOM 0 HB1 ALA A 121 6.643 18.317 -20.502 1.00 4.14 H new ATOM 0 HB2 ALA A 121 7.172 19.993 -20.785 1.00 4.14 H new ATOM 0 HB3 ALA A 121 6.678 18.972 -22.157 1.00 4.14 H new ATOM 1862 N LYS A 122 8.478 16.873 -23.140 1.00 14.30 N ATOM 1863 CA LYS A 122 8.483 15.542 -23.735 1.00 32.15 C ATOM 1864 C LYS A 122 9.907 15.013 -23.872 1.00 31.13 C ATOM 1865 O LYS A 122 10.178 13.850 -23.576 1.00 72.24 O ATOM 1866 CB LYS A 122 7.804 15.571 -25.106 1.00 32.43 C ATOM 1867 CG LYS A 122 7.656 14.199 -25.740 1.00 62.52 C ATOM 1868 CD LYS A 122 8.891 13.818 -26.539 1.00 63.04 C ATOM 1869 CE LYS A 122 8.597 12.691 -27.518 1.00 13.32 C ATOM 1870 NZ LYS A 122 7.925 11.540 -26.853 1.00 4.44 N ATOM 0 H LYS A 122 8.346 17.632 -23.808 1.00 14.30 H new ATOM 0 HA LYS A 122 7.928 14.874 -23.076 1.00 32.15 H new ATOM 0 HB2 LYS A 122 6.818 16.023 -25.004 1.00 32.43 H new ATOM 0 HB3 LYS A 122 8.381 16.211 -25.774 1.00 32.43 H new ATOM 0 HG2 LYS A 122 7.480 13.455 -24.963 1.00 62.52 H new ATOM 0 HG3 LYS A 122 6.783 14.191 -26.392 1.00 62.52 H new ATOM 0 HD2 LYS A 122 9.256 14.689 -27.084 1.00 63.04 H new ATOM 0 HD3 LYS A 122 9.686 13.512 -25.859 1.00 63.04 H new ATOM 0 HE2 LYS A 122 7.965 13.065 -28.323 1.00 13.32 H new ATOM 0 HE3 LYS A 122 9.528 12.354 -27.974 1.00 13.32 H new ATOM 0 HZ1 LYS A 122 7.516 10.912 -27.575 1.00 4.44 H new ATOM 0 HZ2 LYS A 122 8.620 11.011 -26.288 1.00 4.44 H new ATOM 0 HZ3 LYS A 122 7.169 11.891 -26.231 1.00 4.44 H new ATOM 1884 N ASN A 123 10.813 15.875 -24.320 1.00 42.43 N ATOM 1885 CA ASN A 123 12.210 15.494 -24.495 1.00 50.44 C ATOM 1886 C ASN A 123 12.803 14.983 -23.186 1.00 34.11 C ATOM 1887 O ASN A 123 13.779 14.232 -23.185 1.00 33.41 O ATOM 1888 CB ASN A 123 13.025 16.684 -25.006 1.00 53.44 C ATOM 1889 CG ASN A 123 14.425 16.287 -25.431 1.00 22.22 C ATOM 1890 OD1 ASN A 123 14.609 15.593 -26.431 1.00 22.42 O ATOM 1891 ND2 ASN A 123 15.421 16.726 -24.670 1.00 50.20 N ATOM 0 H ASN A 123 10.605 16.842 -24.569 1.00 42.43 H new ATOM 0 HA ASN A 123 12.252 14.691 -25.230 1.00 50.44 H new ATOM 0 HB2 ASN A 123 12.507 17.139 -25.850 1.00 53.44 H new ATOM 0 HB3 ASN A 123 13.087 17.441 -24.224 1.00 53.44 H new ATOM 0 HD21 ASN A 123 16.385 16.490 -24.906 1.00 50.20 H new ATOM 0 HD22 ASN A 123 15.222 17.299 -23.850 1.00 50.20 H new ATOM 1898 N LEU A 124 12.206 15.394 -22.073 1.00 11.14 N ATOM 1899 CA LEU A 124 12.674 14.977 -20.755 1.00 54.31 C ATOM 1900 C LEU A 124 12.658 13.457 -20.627 1.00 53.43 C ATOM 1901 O LEU A 124 13.697 12.830 -20.420 1.00 3.12 O ATOM 1902 CB LEU A 124 11.804 15.602 -19.662 1.00 71.54 C ATOM 1903 CG LEU A 124 11.814 14.891 -18.309 1.00 23.15 C ATOM 1904 CD1 LEU A 124 13.240 14.720 -17.806 1.00 75.34 C ATOM 1905 CD2 LEU A 124 10.979 15.660 -17.296 1.00 11.51 C ATOM 0 H LEU A 124 11.397 16.015 -22.056 1.00 11.14 H new ATOM 0 HA LEU A 124 13.701 15.322 -20.635 1.00 54.31 H new ATOM 0 HB2 LEU A 124 12.129 16.632 -19.511 1.00 71.54 H new ATOM 0 HB3 LEU A 124 10.776 15.641 -20.022 1.00 71.54 H new ATOM 0 HG LEU A 124 11.374 13.902 -18.437 1.00 23.15 H new ATOM 0 HD11 LEU A 124 13.227 14.212 -16.842 1.00 75.34 H new ATOM 0 HD12 LEU A 124 13.809 14.127 -18.521 1.00 75.34 H new ATOM 0 HD13 LEU A 124 13.706 15.699 -17.694 1.00 75.34 H new ATOM 0 HD21 LEU A 124 10.998 15.139 -16.339 1.00 11.51 H new ATOM 0 HD22 LEU A 124 11.390 16.662 -17.172 1.00 11.51 H new ATOM 0 HD23 LEU A 124 9.951 15.731 -17.651 1.00 11.51 H new ATOM 1917 N LEU A 125 11.473 12.871 -20.755 1.00 33.35 N ATOM 1918 CA LEU A 125 11.321 11.423 -20.656 1.00 1.23 C ATOM 1919 C LEU A 125 11.882 10.731 -21.894 1.00 10.12 C ATOM 1920 O LEU A 125 12.437 9.636 -21.807 1.00 73.51 O ATOM 1921 CB LEU A 125 9.847 11.056 -20.476 1.00 10.10 C ATOM 1922 CG LEU A 125 9.536 10.054 -19.364 1.00 34.11 C ATOM 1923 CD1 LEU A 125 8.620 10.679 -18.323 1.00 3.23 C ATOM 1924 CD2 LEU A 125 8.907 8.794 -19.942 1.00 10.32 C ATOM 0 H LEU A 125 10.603 13.376 -20.927 1.00 33.35 H new ATOM 0 HA LEU A 125 11.882 11.082 -19.786 1.00 1.23 H new ATOM 0 HB2 LEU A 125 9.287 11.970 -20.281 1.00 10.10 H new ATOM 0 HB3 LEU A 125 9.477 10.650 -21.417 1.00 10.10 H new ATOM 0 HG LEU A 125 10.472 9.779 -18.877 1.00 34.11 H new ATOM 0 HD11 LEU A 125 8.410 9.951 -17.539 1.00 3.23 H new ATOM 0 HD12 LEU A 125 9.107 11.551 -17.887 1.00 3.23 H new ATOM 0 HD13 LEU A 125 7.686 10.983 -18.796 1.00 3.23 H new ATOM 0 HD21 LEU A 125 8.692 8.092 -19.136 1.00 10.32 H new ATOM 0 HD22 LEU A 125 7.980 9.052 -20.455 1.00 10.32 H new ATOM 0 HD23 LEU A 125 9.597 8.334 -20.649 1.00 10.32 H new ATOM 1936 N ASP A 126 11.735 11.379 -23.044 1.00 64.44 N ATOM 1937 CA ASP A 126 12.230 10.827 -24.301 1.00 3.35 C ATOM 1938 C ASP A 126 13.696 10.422 -24.176 1.00 73.31 C ATOM 1939 O ASP A 126 14.069 9.295 -24.502 1.00 34.42 O ATOM 1940 CB ASP A 126 12.064 11.845 -25.430 1.00 2.43 C ATOM 1941 CG ASP A 126 11.376 11.255 -26.645 1.00 3.11 C ATOM 1942 OD1 ASP A 126 10.477 10.408 -26.464 1.00 40.00 O ATOM 1943 OD2 ASP A 126 11.738 11.640 -27.777 1.00 71.40 O ATOM 0 H ASP A 126 11.278 12.286 -23.133 1.00 64.44 H new ATOM 0 HA ASP A 126 11.644 9.938 -24.535 1.00 3.35 H new ATOM 0 HB2 ASP A 126 11.487 12.695 -25.067 1.00 2.43 H new ATOM 0 HB3 ASP A 126 13.044 12.225 -25.720 1.00 2.43 H new ATOM 1948 N VAL A 127 14.523 11.349 -23.703 1.00 71.34 N ATOM 1949 CA VAL A 127 15.948 11.088 -23.536 1.00 14.11 C ATOM 1950 C VAL A 127 16.190 10.016 -22.479 1.00 53.04 C ATOM 1951 O VAL A 127 16.954 9.076 -22.699 1.00 32.33 O ATOM 1952 CB VAL A 127 16.709 12.367 -23.138 1.00 20.40 C ATOM 1953 CG1 VAL A 127 18.187 12.067 -22.936 1.00 15.14 C ATOM 1954 CG2 VAL A 127 16.515 13.450 -24.188 1.00 2.21 C ATOM 0 H VAL A 127 14.231 12.287 -23.429 1.00 71.34 H new ATOM 0 HA VAL A 127 16.321 10.736 -24.498 1.00 14.11 H new ATOM 0 HB VAL A 127 16.304 12.732 -22.194 1.00 20.40 H new ATOM 0 HG11 VAL A 127 18.709 12.982 -22.655 1.00 15.14 H new ATOM 0 HG12 VAL A 127 18.303 11.326 -22.145 1.00 15.14 H new ATOM 0 HG13 VAL A 127 18.609 11.678 -23.863 1.00 15.14 H new ATOM 0 HG21 VAL A 127 17.059 14.346 -23.891 1.00 2.21 H new ATOM 0 HG22 VAL A 127 16.892 13.098 -25.148 1.00 2.21 H new ATOM 0 HG23 VAL A 127 15.454 13.683 -24.279 1.00 2.21 H new ATOM 1964 N ILE A 128 15.534 10.164 -21.333 1.00 73.24 N ATOM 1965 CA ILE A 128 15.676 9.207 -20.243 1.00 65.12 C ATOM 1966 C ILE A 128 15.328 7.795 -20.702 1.00 22.11 C ATOM 1967 O ILE A 128 15.781 6.811 -20.116 1.00 42.41 O ATOM 1968 CB ILE A 128 14.783 9.580 -19.046 1.00 1.54 C ATOM 1969 CG1 ILE A 128 15.140 10.977 -18.531 1.00 73.34 C ATOM 1970 CG2 ILE A 128 14.926 8.549 -17.936 1.00 52.13 C ATOM 1971 CD1 ILE A 128 14.041 11.618 -17.713 1.00 40.21 C ATOM 0 H ILE A 128 14.899 10.937 -21.135 1.00 73.24 H new ATOM 0 HA ILE A 128 16.720 9.238 -19.930 1.00 65.12 H new ATOM 0 HB ILE A 128 13.744 9.589 -19.376 1.00 1.54 H new ATOM 0 HG12 ILE A 128 16.043 10.912 -17.924 1.00 73.34 H new ATOM 0 HG13 ILE A 128 15.372 11.620 -19.380 1.00 73.34 H new ATOM 0 HG21 ILE A 128 14.288 8.827 -17.097 1.00 52.13 H new ATOM 0 HG22 ILE A 128 14.628 7.569 -18.309 1.00 52.13 H new ATOM 0 HG23 ILE A 128 15.964 8.511 -17.606 1.00 52.13 H new ATOM 0 HD11 ILE A 128 14.363 12.605 -17.381 1.00 40.21 H new ATOM 0 HD12 ILE A 128 13.143 11.715 -18.323 1.00 40.21 H new ATOM 0 HD13 ILE A 128 13.824 10.996 -16.844 1.00 40.21 H new ATOM 1983 N ASP A 129 14.522 7.703 -21.754 1.00 23.41 N ATOM 1984 CA ASP A 129 14.115 6.411 -22.294 1.00 61.31 C ATOM 1985 C ASP A 129 15.332 5.549 -22.616 1.00 73.44 C ATOM 1986 O ASP A 129 15.344 4.349 -22.341 1.00 52.15 O ATOM 1987 CB ASP A 129 13.265 6.604 -23.550 1.00 55.44 C ATOM 1988 CG ASP A 129 12.639 5.310 -24.031 1.00 62.25 C ATOM 1989 OD1 ASP A 129 12.568 4.352 -23.233 1.00 11.22 O ATOM 1990 OD2 ASP A 129 12.220 5.255 -25.206 1.00 63.54 O ATOM 0 H ASP A 129 14.138 8.507 -22.250 1.00 23.41 H new ATOM 0 HA ASP A 129 13.520 5.900 -21.537 1.00 61.31 H new ATOM 0 HB2 ASP A 129 12.478 7.330 -23.345 1.00 55.44 H new ATOM 0 HB3 ASP A 129 13.885 7.021 -24.344 1.00 55.44 H new ATOM 1995 N GLN A 130 16.352 6.168 -23.201 1.00 54.43 N ATOM 1996 CA GLN A 130 17.572 5.457 -23.562 1.00 72.44 C ATOM 1997 C GLN A 130 18.221 4.831 -22.333 1.00 5.05 C ATOM 1998 O GLN A 130 18.903 3.811 -22.430 1.00 33.24 O ATOM 1999 CB GLN A 130 18.557 6.405 -24.247 1.00 41.33 C ATOM 2000 CG GLN A 130 17.999 7.062 -25.500 1.00 31.23 C ATOM 2001 CD GLN A 130 19.080 7.669 -26.372 1.00 1.24 C ATOM 2002 OE1 GLN A 130 19.722 6.974 -27.160 1.00 34.01 O ATOM 2003 NE2 GLN A 130 19.288 8.974 -26.235 1.00 21.53 N ATOM 0 H GLN A 130 16.358 7.161 -23.435 1.00 54.43 H new ATOM 0 HA GLN A 130 17.306 4.659 -24.255 1.00 72.44 H new ATOM 0 HB2 GLN A 130 18.852 7.181 -23.541 1.00 41.33 H new ATOM 0 HB3 GLN A 130 19.459 5.852 -24.508 1.00 41.33 H new ATOM 0 HG2 GLN A 130 17.445 6.322 -26.077 1.00 31.23 H new ATOM 0 HG3 GLN A 130 17.290 7.839 -25.213 1.00 31.23 H new ATOM 0 HE21 GLN A 130 18.733 9.512 -25.570 1.00 21.53 H new ATOM 0 HE22 GLN A 130 20.003 9.438 -26.795 1.00 21.53 H new ATOM 2012 N ALA A 131 18.006 5.450 -21.176 1.00 61.13 N ATOM 2013 CA ALA A 131 18.569 4.953 -19.927 1.00 62.22 C ATOM 2014 C ALA A 131 17.843 3.696 -19.460 1.00 24.14 C ATOM 2015 O ALA A 131 18.474 2.710 -19.077 1.00 75.23 O ATOM 2016 CB ALA A 131 18.507 6.030 -18.855 1.00 3.24 C ATOM 0 H ALA A 131 17.446 6.297 -21.078 1.00 61.13 H new ATOM 0 HA ALA A 131 19.613 4.693 -20.105 1.00 62.22 H new ATOM 0 HB1 ALA A 131 18.931 5.645 -17.928 1.00 3.24 H new ATOM 0 HB2 ALA A 131 19.077 6.900 -19.180 1.00 3.24 H new ATOM 0 HB3 ALA A 131 17.469 6.318 -18.688 1.00 3.24 H new ATOM 2022 N ARG A 132 16.515 3.738 -19.492 1.00 44.31 N ATOM 2023 CA ARG A 132 15.704 2.603 -19.070 1.00 2.14 C ATOM 2024 C ARG A 132 16.065 1.351 -19.864 1.00 1.30 C ATOM 2025 O ARG A 132 16.239 0.272 -19.297 1.00 22.31 O ATOM 2026 CB ARG A 132 14.217 2.919 -19.243 1.00 24.13 C ATOM 2027 CG ARG A 132 13.322 2.200 -18.247 1.00 70.32 C ATOM 2028 CD ARG A 132 12.060 1.672 -18.912 1.00 43.44 C ATOM 2029 NE ARG A 132 11.626 0.404 -18.334 1.00 33.22 N ATOM 2030 CZ ARG A 132 10.540 -0.251 -18.730 1.00 10.00 C ATOM 2031 NH1 ARG A 132 9.783 0.240 -19.701 1.00 51.33 N ATOM 2032 NH2 ARG A 132 10.210 -1.400 -18.155 1.00 31.24 N ATOM 0 H ARG A 132 15.978 4.546 -19.806 1.00 44.31 H new ATOM 0 HA ARG A 132 15.908 2.415 -18.016 1.00 2.14 H new ATOM 0 HB2 ARG A 132 14.069 3.994 -19.142 1.00 24.13 H new ATOM 0 HB3 ARG A 132 13.912 2.649 -20.254 1.00 24.13 H new ATOM 0 HG2 ARG A 132 13.870 1.373 -17.795 1.00 70.32 H new ATOM 0 HG3 ARG A 132 13.052 2.882 -17.441 1.00 70.32 H new ATOM 0 HD2 ARG A 132 11.262 2.408 -18.811 1.00 43.44 H new ATOM 0 HD3 ARG A 132 12.240 1.541 -19.979 1.00 43.44 H new ATOM 0 HE ARG A 132 12.187 -0.002 -17.585 1.00 33.22 H new ATOM 0 HH11 ARG A 132 10.034 1.123 -20.146 1.00 51.33 H new ATOM 0 HH12 ARG A 132 8.950 -0.265 -20.003 1.00 51.33 H new ATOM 0 HH21 ARG A 132 10.790 -1.782 -17.408 1.00 31.24 H new ATOM 0 HH22 ARG A 132 9.376 -1.902 -18.460 1.00 31.24 H new ATOM 2046 N LEU A 133 16.175 1.503 -21.179 1.00 63.01 N ATOM 2047 CA LEU A 133 16.515 0.385 -22.052 1.00 61.14 C ATOM 2048 C LEU A 133 17.989 0.015 -21.915 1.00 54.13 C ATOM 2049 O LEU A 133 18.363 -1.150 -22.051 1.00 11.03 O ATOM 2050 CB LEU A 133 16.198 0.734 -23.508 1.00 5.34 C ATOM 2051 CG LEU A 133 15.136 -0.128 -24.189 1.00 73.30 C ATOM 2052 CD1 LEU A 133 14.540 0.602 -25.383 1.00 23.03 C ATOM 2053 CD2 LEU A 133 15.727 -1.463 -24.619 1.00 2.12 C ATOM 0 H LEU A 133 16.034 2.389 -21.664 1.00 63.01 H new ATOM 0 HA LEU A 133 15.915 -0.474 -21.752 1.00 61.14 H new ATOM 0 HB2 LEU A 133 15.874 1.774 -23.549 1.00 5.34 H new ATOM 0 HB3 LEU A 133 17.119 0.664 -24.086 1.00 5.34 H new ATOM 0 HG LEU A 133 14.338 -0.321 -23.472 1.00 73.30 H new ATOM 0 HD11 LEU A 133 13.786 -0.028 -25.855 1.00 23.03 H new ATOM 0 HD12 LEU A 133 14.079 1.531 -25.048 1.00 23.03 H new ATOM 0 HD13 LEU A 133 15.327 0.826 -26.103 1.00 23.03 H new ATOM 0 HD21 LEU A 133 14.956 -2.063 -25.102 1.00 2.12 H new ATOM 0 HD22 LEU A 133 16.544 -1.290 -25.319 1.00 2.12 H new ATOM 0 HD23 LEU A 133 16.104 -1.993 -23.744 1.00 2.12 H new ATOM 2065 N LYS A 134 18.821 1.014 -21.644 1.00 2.43 N ATOM 2066 CA LYS A 134 20.254 0.795 -21.484 1.00 52.32 C ATOM 2067 C LYS A 134 20.529 -0.234 -20.392 1.00 54.41 C ATOM 2068 O LYS A 134 21.448 -1.044 -20.507 1.00 11.40 O ATOM 2069 CB LYS A 134 20.958 2.112 -21.148 1.00 34.11 C ATOM 2070 CG LYS A 134 21.677 2.737 -22.331 1.00 31.41 C ATOM 2071 CD LYS A 134 22.294 4.076 -21.964 1.00 61.24 C ATOM 2072 CE LYS A 134 22.937 4.742 -23.171 1.00 42.01 C ATOM 2073 NZ LYS A 134 22.476 6.148 -23.340 1.00 21.12 N ATOM 0 H LYS A 134 18.528 1.984 -21.530 1.00 2.43 H new ATOM 0 HA LYS A 134 20.645 0.411 -22.426 1.00 52.32 H new ATOM 0 HB2 LYS A 134 20.223 2.820 -20.765 1.00 34.11 H new ATOM 0 HB3 LYS A 134 21.677 1.936 -20.348 1.00 34.11 H new ATOM 0 HG2 LYS A 134 22.456 2.061 -22.683 1.00 31.41 H new ATOM 0 HG3 LYS A 134 20.976 2.872 -23.154 1.00 31.41 H new ATOM 0 HD2 LYS A 134 21.526 4.731 -21.552 1.00 61.24 H new ATOM 0 HD3 LYS A 134 23.042 3.932 -21.185 1.00 61.24 H new ATOM 0 HE2 LYS A 134 24.021 4.726 -23.060 1.00 42.01 H new ATOM 0 HE3 LYS A 134 22.700 4.172 -24.069 1.00 42.01 H new ATOM 0 HZ1 LYS A 134 22.937 6.567 -24.173 1.00 21.12 H new ATOM 0 HZ2 LYS A 134 21.444 6.162 -23.472 1.00 21.12 H new ATOM 0 HZ3 LYS A 134 22.724 6.699 -22.494 1.00 21.12 H new ATOM 2087 N MET A 135 19.725 -0.196 -19.334 1.00 72.35 N ATOM 2088 CA MET A 135 19.881 -1.128 -18.223 1.00 53.14 C ATOM 2089 C MET A 135 19.272 -2.485 -18.562 1.00 53.22 C ATOM 2090 O MET A 135 19.923 -3.520 -18.419 1.00 75.44 O ATOM 2091 CB MET A 135 19.227 -0.563 -16.961 1.00 34.22 C ATOM 2092 CG MET A 135 19.382 -1.460 -15.743 1.00 51.31 C ATOM 2093 SD MET A 135 17.812 -1.793 -14.921 1.00 41.30 S ATOM 2094 CE MET A 135 18.043 -0.910 -13.380 1.00 21.13 C ATOM 0 H MET A 135 18.960 0.469 -19.223 1.00 72.35 H new ATOM 0 HA MET A 135 20.947 -1.264 -18.042 1.00 53.14 H new ATOM 0 HB2 MET A 135 19.662 0.412 -16.742 1.00 34.22 H new ATOM 0 HB3 MET A 135 18.166 -0.403 -17.152 1.00 34.22 H new ATOM 0 HG2 MET A 135 19.836 -2.403 -16.047 1.00 51.31 H new ATOM 0 HG3 MET A 135 20.066 -0.991 -15.036 1.00 51.31 H new ATOM 0 HE1 MET A 135 17.360 -1.305 -12.628 1.00 21.13 H new ATOM 0 HE2 MET A 135 19.070 -1.037 -13.039 1.00 21.13 H new ATOM 0 HE3 MET A 135 17.840 0.150 -13.534 1.00 21.13 H new ATOM 2104 N ILE A 136 18.021 -2.472 -19.011 1.00 0.34 N ATOM 2105 CA ILE A 136 17.326 -3.701 -19.370 1.00 30.50 C ATOM 2106 C ILE A 136 18.128 -4.510 -20.384 1.00 51.12 C ATOM 2107 O ILE A 136 18.475 -5.665 -20.138 1.00 4.34 O ATOM 2108 CB ILE A 136 15.930 -3.410 -19.951 1.00 51.23 C ATOM 2109 CG1 ILE A 136 15.090 -2.620 -18.946 1.00 13.22 C ATOM 2110 CG2 ILE A 136 15.232 -4.708 -20.329 1.00 52.42 C ATOM 2111 CD1 ILE A 136 13.881 -1.952 -19.562 1.00 15.52 C ATOM 0 H ILE A 136 17.469 -1.623 -19.135 1.00 0.34 H new ATOM 0 HA ILE A 136 17.215 -4.280 -18.453 1.00 30.50 H new ATOM 0 HB ILE A 136 16.046 -2.807 -20.852 1.00 51.23 H new ATOM 0 HG12 ILE A 136 14.760 -3.292 -18.154 1.00 13.22 H new ATOM 0 HG13 ILE A 136 15.716 -1.860 -18.479 1.00 13.22 H new ATOM 0 HG21 ILE A 136 14.247 -4.485 -20.738 1.00 52.42 H new ATOM 0 HG22 ILE A 136 15.825 -5.235 -21.077 1.00 52.42 H new ATOM 0 HG23 ILE A 136 15.124 -5.334 -19.443 1.00 52.42 H new ATOM 0 HD11 ILE A 136 13.333 -1.410 -18.791 1.00 15.52 H new ATOM 0 HD12 ILE A 136 14.205 -1.255 -20.335 1.00 15.52 H new ATOM 0 HD13 ILE A 136 13.233 -2.709 -20.004 1.00 15.52 H new ATOM 2123 N SER A 137 18.420 -3.894 -21.525 1.00 61.34 N ATOM 2124 CA SER A 137 19.180 -4.557 -22.579 1.00 31.22 C ATOM 2125 C SER A 137 20.669 -4.576 -22.245 1.00 54.12 C ATOM 2126 O SER A 137 21.482 -3.986 -22.956 1.00 74.23 O ATOM 2127 CB SER A 137 18.955 -3.854 -23.919 1.00 32.22 C ATOM 2128 OG SER A 137 19.380 -4.667 -24.999 1.00 33.21 O ATOM 0 H SER A 137 18.142 -2.937 -21.743 1.00 61.34 H new ATOM 0 HA SER A 137 18.829 -5.586 -22.654 1.00 31.22 H new ATOM 0 HB2 SER A 137 17.898 -3.614 -24.034 1.00 32.22 H new ATOM 0 HB3 SER A 137 19.500 -2.910 -23.934 1.00 32.22 H new ATOM 0 HG SER A 137 19.224 -4.196 -25.844 1.00 33.21 H new ATOM 2272 N GLU A 162 2.056 9.673 -30.841 1.00 2.21 N ATOM 2273 CA GLU A 162 0.929 10.597 -30.790 1.00 21.12 C ATOM 2274 C GLU A 162 1.381 11.982 -30.337 1.00 1.22 C ATOM 2275 O GLU A 162 0.928 12.999 -30.864 1.00 44.04 O ATOM 2276 CB GLU A 162 -0.151 10.067 -29.845 1.00 32.42 C ATOM 2277 CG GLU A 162 -1.468 10.818 -29.944 1.00 33.45 C ATOM 2278 CD GLU A 162 -2.574 10.164 -29.138 1.00 12.34 C ATOM 2279 OE1 GLU A 162 -2.791 8.946 -29.305 1.00 24.13 O ATOM 2280 OE2 GLU A 162 -3.223 10.872 -28.339 1.00 52.32 O ATOM 0 HA GLU A 162 0.514 10.680 -31.795 1.00 21.12 H new ATOM 0 HB2 GLU A 162 -0.326 9.013 -30.062 1.00 32.42 H new ATOM 0 HB3 GLU A 162 0.215 10.125 -28.820 1.00 32.42 H new ATOM 0 HG2 GLU A 162 -1.326 11.841 -29.596 1.00 33.45 H new ATOM 0 HG3 GLU A 162 -1.771 10.876 -30.989 1.00 33.45 H new ATOM 2287 N LEU A 163 2.276 12.014 -29.356 1.00 1.44 N ATOM 2288 CA LEU A 163 2.790 13.274 -28.830 1.00 2.31 C ATOM 2289 C LEU A 163 3.744 13.930 -29.823 1.00 63.01 C ATOM 2290 O LEU A 163 3.652 15.128 -30.090 1.00 14.34 O ATOM 2291 CB LEU A 163 3.504 13.040 -27.498 1.00 4.24 C ATOM 2292 CG LEU A 163 2.628 13.101 -26.246 1.00 73.43 C ATOM 2293 CD1 LEU A 163 2.085 11.721 -25.908 1.00 32.12 C ATOM 2294 CD2 LEU A 163 3.412 13.670 -25.073 1.00 34.02 C ATOM 0 H LEU A 163 2.661 11.182 -28.909 1.00 1.44 H new ATOM 0 HA LEU A 163 1.945 13.944 -28.669 1.00 2.31 H new ATOM 0 HB2 LEU A 163 3.985 12.062 -27.533 1.00 4.24 H new ATOM 0 HB3 LEU A 163 4.297 13.781 -27.399 1.00 4.24 H new ATOM 0 HG LEU A 163 1.785 13.762 -26.447 1.00 73.43 H new ATOM 0 HD11 LEU A 163 1.464 11.783 -25.014 1.00 32.12 H new ATOM 0 HD12 LEU A 163 1.487 11.351 -26.741 1.00 32.12 H new ATOM 0 HD13 LEU A 163 2.915 11.038 -25.726 1.00 32.12 H new ATOM 0 HD21 LEU A 163 2.772 13.706 -24.191 1.00 34.02 H new ATOM 0 HD22 LEU A 163 4.275 13.036 -24.870 1.00 34.02 H new ATOM 0 HD23 LEU A 163 3.751 14.677 -25.316 1.00 34.02 H new ATOM 2306 N ASP A 164 4.659 13.136 -30.369 1.00 11.11 N ATOM 2307 CA ASP A 164 5.628 13.638 -31.336 1.00 3.32 C ATOM 2308 C ASP A 164 4.925 14.269 -32.533 1.00 54.13 C ATOM 2309 O ASP A 164 5.256 15.381 -32.945 1.00 73.14 O ATOM 2310 CB ASP A 164 6.545 12.508 -31.805 1.00 25.23 C ATOM 2311 CG ASP A 164 7.558 12.108 -30.749 1.00 73.03 C ATOM 2312 OD1 ASP A 164 7.157 11.466 -29.756 1.00 22.24 O ATOM 2313 OD2 ASP A 164 8.751 12.436 -30.917 1.00 54.43 O ATOM 0 H ASP A 164 4.750 12.142 -30.158 1.00 11.11 H new ATOM 0 HA ASP A 164 6.229 14.404 -30.846 1.00 3.32 H new ATOM 0 HB2 ASP A 164 5.941 11.641 -32.072 1.00 25.23 H new ATOM 0 HB3 ASP A 164 7.070 12.821 -32.708 1.00 25.23 H new ATOM 2318 N ARG A 165 3.953 13.551 -33.088 1.00 4.20 N ATOM 2319 CA ARG A 165 3.205 14.040 -34.240 1.00 33.43 C ATOM 2320 C ARG A 165 2.495 15.350 -33.911 1.00 31.31 C ATOM 2321 O ARG A 165 2.604 16.330 -34.649 1.00 71.32 O ATOM 2322 CB ARG A 165 2.184 12.994 -34.692 1.00 60.22 C ATOM 2323 CG ARG A 165 1.361 13.426 -35.894 1.00 51.45 C ATOM 2324 CD ARG A 165 1.830 12.739 -37.167 1.00 70.12 C ATOM 2325 NE ARG A 165 1.730 13.615 -38.331 1.00 51.03 N ATOM 2326 CZ ARG A 165 0.577 13.965 -38.891 1.00 1.13 C ATOM 2327 NH1 ARG A 165 -0.568 13.516 -38.395 1.00 4.23 N ATOM 2328 NH2 ARG A 165 0.568 14.766 -39.948 1.00 53.43 N ATOM 0 H ARG A 165 3.666 12.629 -32.758 1.00 4.20 H new ATOM 0 HA ARG A 165 3.911 14.223 -35.050 1.00 33.43 H new ATOM 0 HB2 ARG A 165 2.707 12.069 -34.934 1.00 60.22 H new ATOM 0 HB3 ARG A 165 1.512 12.773 -33.863 1.00 60.22 H new ATOM 0 HG2 ARG A 165 0.311 13.193 -35.720 1.00 51.45 H new ATOM 0 HG3 ARG A 165 1.432 14.507 -36.015 1.00 51.45 H new ATOM 0 HD2 ARG A 165 2.864 12.416 -37.045 1.00 70.12 H new ATOM 0 HD3 ARG A 165 1.233 11.842 -37.336 1.00 70.12 H new ATOM 0 HE ARG A 165 2.593 13.978 -38.736 1.00 51.03 H new ATOM 0 HH11 ARG A 165 -0.565 12.900 -37.582 1.00 4.23 H new ATOM 0 HH12 ARG A 165 -1.452 13.786 -38.827 1.00 4.23 H new ATOM 0 HH21 ARG A 165 1.447 15.114 -40.332 1.00 53.43 H new ATOM 0 HH22 ARG A 165 -0.318 15.034 -40.377 1.00 53.43 H new ATOM 2342 N LEU A 166 1.768 15.360 -32.799 1.00 74.43 N ATOM 2343 CA LEU A 166 1.039 16.549 -32.372 1.00 50.13 C ATOM 2344 C LEU A 166 1.973 17.750 -32.264 1.00 10.13 C ATOM 2345 O LEU A 166 1.638 18.852 -32.700 1.00 12.34 O ATOM 2346 CB LEU A 166 0.355 16.297 -31.027 1.00 63.03 C ATOM 2347 CG LEU A 166 -1.151 16.556 -30.981 1.00 70.41 C ATOM 2348 CD1 LEU A 166 -1.469 17.952 -31.493 1.00 61.22 C ATOM 2349 CD2 LEU A 166 -1.897 15.506 -31.791 1.00 75.41 C ATOM 0 H LEU A 166 1.668 14.558 -32.177 1.00 74.43 H new ATOM 0 HA LEU A 166 0.280 16.769 -33.122 1.00 50.13 H new ATOM 0 HB2 LEU A 166 0.534 15.261 -30.739 1.00 63.03 H new ATOM 0 HB3 LEU A 166 0.834 16.924 -30.275 1.00 63.03 H new ATOM 0 HG LEU A 166 -1.480 16.488 -29.944 1.00 70.41 H new ATOM 0 HD11 LEU A 166 -2.546 18.118 -31.453 1.00 61.22 H new ATOM 0 HD12 LEU A 166 -0.964 18.691 -30.871 1.00 61.22 H new ATOM 0 HD13 LEU A 166 -1.125 18.049 -32.523 1.00 61.22 H new ATOM 0 HD21 LEU A 166 -2.968 15.706 -31.747 1.00 75.41 H new ATOM 0 HD22 LEU A 166 -1.563 15.542 -32.828 1.00 75.41 H new ATOM 0 HD23 LEU A 166 -1.695 14.517 -31.379 1.00 75.41 H new ATOM 2361 N LEU A 167 3.147 17.529 -31.682 1.00 15.53 N ATOM 2362 CA LEU A 167 4.131 18.593 -31.518 1.00 3.22 C ATOM 2363 C LEU A 167 4.461 19.241 -32.859 1.00 2.34 C ATOM 2364 O LEU A 167 4.474 20.467 -32.982 1.00 32.24 O ATOM 2365 CB LEU A 167 5.406 18.041 -30.878 1.00 62.31 C ATOM 2366 CG LEU A 167 5.740 18.568 -29.482 1.00 53.32 C ATOM 2367 CD1 LEU A 167 4.561 18.372 -28.542 1.00 30.15 C ATOM 2368 CD2 LEU A 167 6.982 17.880 -28.935 1.00 12.33 C ATOM 0 H LEU A 167 3.440 16.623 -31.316 1.00 15.53 H new ATOM 0 HA LEU A 167 3.703 19.353 -30.864 1.00 3.22 H new ATOM 0 HB2 LEU A 167 5.321 16.956 -30.824 1.00 62.31 H new ATOM 0 HB3 LEU A 167 6.245 18.262 -31.538 1.00 62.31 H new ATOM 0 HG LEU A 167 5.945 19.636 -29.557 1.00 53.32 H new ATOM 0 HD11 LEU A 167 4.817 18.753 -27.553 1.00 30.15 H new ATOM 0 HD12 LEU A 167 3.696 18.912 -28.926 1.00 30.15 H new ATOM 0 HD13 LEU A 167 4.324 17.310 -28.472 1.00 30.15 H new ATOM 0 HD21 LEU A 167 7.205 18.268 -27.941 1.00 12.33 H new ATOM 0 HD22 LEU A 167 6.806 16.806 -28.875 1.00 12.33 H new ATOM 0 HD23 LEU A 167 7.826 18.073 -29.597 1.00 12.33 H new ATOM 2380 N LEU A 168 4.726 18.411 -33.862 1.00 14.44 N ATOM 2381 CA LEU A 168 5.053 18.903 -35.195 1.00 44.24 C ATOM 2382 C LEU A 168 4.005 19.899 -35.681 1.00 61.14 C ATOM 2383 O LEU A 168 4.340 20.963 -36.200 1.00 43.13 O ATOM 2384 CB LEU A 168 5.160 17.736 -36.179 1.00 14.32 C ATOM 2385 CG LEU A 168 6.499 17.587 -36.901 1.00 1.10 C ATOM 2386 CD1 LEU A 168 6.520 16.312 -37.730 1.00 15.12 C ATOM 2387 CD2 LEU A 168 6.770 18.800 -37.779 1.00 10.33 C ATOM 0 H LEU A 168 4.721 17.395 -33.777 1.00 14.44 H new ATOM 0 HA LEU A 168 6.014 19.414 -35.141 1.00 44.24 H new ATOM 0 HB2 LEU A 168 4.957 16.812 -35.639 1.00 14.32 H new ATOM 0 HB3 LEU A 168 4.376 17.846 -36.928 1.00 14.32 H new ATOM 0 HG LEU A 168 7.288 17.522 -36.152 1.00 1.10 H new ATOM 0 HD11 LEU A 168 7.481 16.223 -38.237 1.00 15.12 H new ATOM 0 HD12 LEU A 168 6.373 15.451 -37.078 1.00 15.12 H new ATOM 0 HD13 LEU A 168 5.721 16.346 -38.471 1.00 15.12 H new ATOM 0 HD21 LEU A 168 7.727 18.676 -38.285 1.00 10.33 H new ATOM 0 HD22 LEU A 168 5.977 18.897 -38.521 1.00 10.33 H new ATOM 0 HD23 LEU A 168 6.800 19.697 -37.161 1.00 10.33 H new ATOM 2399 N GLU A 169 2.735 19.546 -35.507 1.00 63.25 N ATOM 2400 CA GLU A 169 1.638 20.410 -35.928 1.00 24.05 C ATOM 2401 C GLU A 169 1.706 21.759 -35.217 1.00 35.32 C ATOM 2402 O GLU A 169 1.488 22.806 -35.827 1.00 12.41 O ATOM 2403 CB GLU A 169 0.293 19.738 -35.644 1.00 42.12 C ATOM 2404 CG GLU A 169 -0.813 20.167 -36.593 1.00 13.42 C ATOM 2405 CD GLU A 169 -2.156 19.559 -36.237 1.00 22.31 C ATOM 2406 OE1 GLU A 169 -2.672 19.859 -35.141 1.00 13.54 O ATOM 2407 OE2 GLU A 169 -2.690 18.781 -37.056 1.00 3.33 O ATOM 0 H GLU A 169 2.441 18.669 -35.078 1.00 63.25 H new ATOM 0 HA GLU A 169 1.732 20.579 -37.001 1.00 24.05 H new ATOM 0 HB2 GLU A 169 0.416 18.657 -35.707 1.00 42.12 H new ATOM 0 HB3 GLU A 169 -0.009 19.965 -34.621 1.00 42.12 H new ATOM 0 HG2 GLU A 169 -0.896 21.254 -36.581 1.00 13.42 H new ATOM 0 HG3 GLU A 169 -0.546 19.879 -37.610 1.00 13.42 H new ATOM 2414 N LEU A 170 2.007 21.725 -33.924 1.00 25.34 N ATOM 2415 CA LEU A 170 2.103 22.944 -33.128 1.00 61.20 C ATOM 2416 C LEU A 170 3.029 23.957 -33.793 1.00 64.21 C ATOM 2417 O LEU A 170 2.727 25.148 -33.846 1.00 12.03 O ATOM 2418 CB LEU A 170 2.609 22.620 -31.721 1.00 70.33 C ATOM 2419 CG LEU A 170 2.601 23.777 -30.722 1.00 11.01 C ATOM 2420 CD1 LEU A 170 1.174 24.156 -30.355 1.00 64.50 C ATOM 2421 CD2 LEU A 170 3.395 23.412 -29.476 1.00 71.42 C ATOM 0 H LEU A 170 2.189 20.867 -33.404 1.00 25.34 H new ATOM 0 HA LEU A 170 1.107 23.381 -33.057 1.00 61.20 H new ATOM 0 HB2 LEU A 170 2.001 21.812 -31.315 1.00 70.33 H new ATOM 0 HB3 LEU A 170 3.628 22.243 -31.801 1.00 70.33 H new ATOM 0 HG LEU A 170 3.075 24.639 -31.191 1.00 11.01 H new ATOM 0 HD11 LEU A 170 1.188 24.981 -29.643 1.00 64.50 H new ATOM 0 HD12 LEU A 170 0.636 24.461 -31.253 1.00 64.50 H new ATOM 0 HD13 LEU A 170 0.674 23.298 -29.906 1.00 64.50 H new ATOM 0 HD21 LEU A 170 3.378 24.248 -28.776 1.00 71.42 H new ATOM 0 HD22 LEU A 170 2.950 22.535 -29.005 1.00 71.42 H new ATOM 0 HD23 LEU A 170 4.426 23.191 -29.753 1.00 71.42 H new