USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1067 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 138 ASN : amide:sc= -0.125! C(o=0.58!,f=-2.5!) USER MOD Set 1.2: A 163 ASN : amide:sc= 0.702 K(o=0.58,f=-1.1) USER MOD Set 2.1: A 93 HIS : no HE2:sc= -7.63! C(o=-11!,f=-11!) USER MOD Set 2.2: A 129 HIS :FLIP no HD1:sc= -2.87! C(o=-11!,f=-11!) USER MOD Set 3.1: A 40 TYR OH : rot 30:sc= -0.217 USER MOD Set 3.2: A 77 MET CE :methyl -148:sc= -1.97! (180deg=-2.37!) USER MOD Single : A 8 GLN :FLIP amide:sc= -0.206 F(o=-1.2,f=-0.21) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -148:sc= -0.481 (180deg=-2.37!) USER MOD Single : A 18 LYS NZ :NH3+ 166:sc= -0.0039 (180deg=-0.0967) USER MOD Single : A 20 ASN : amide:sc= 0.0301 X(o=0.03,f=0) USER MOD Single : A 26 THR OG1 : rot -94:sc= 2.03 USER MOD Single : A 28 SER OG : rot -35:sc= 0.882 USER MOD Single : A 29 HIS : no HD1:sc= -0.0477 X(o=-0.048,f=-0.067) USER MOD Single : A 36 HIS : no HD1:sc= -1.63 X(o=-1.6,f=-1.1) USER MOD Single : A 38 SER OG : rot -35:sc= 0.194 USER MOD Single : A 39 ASN : amide:sc= -0.319 X(o=-0.32,f=0) USER MOD Single : A 41 MET CE :methyl 162:sc= -0.235 (180deg=-0.624) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.066 F(o=-2.1!,f=-0.066) USER MOD Single : A 55 TYR OH : rot 30:sc= -2.12 USER MOD Single : A 56 THR OG1 : rot 19:sc= 0.389 USER MOD Single : A 74 ASN : amide:sc= -0.0126 K(o=-0.013,f=-0.96) USER MOD Single : A 80 LYS NZ :NH3+ 162:sc= -0.0585 (180deg=-0.379) USER MOD Single : A 81 ASN : amide:sc= -1.17 K(o=-1.2,f=-3.2!) USER MOD Single : A 82 SER OG : rot 95:sc= 1.22 USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 91 THR OG1 : rot 180:sc=-0.00665 USER MOD Single : A 92 THR OG1 : rot -164:sc= 0.66 USER MOD Single : A 94 ASN : amide:sc= -0.0578 X(o=-0.058,f=-0.54) USER MOD Single : A 123 THR OG1 : rot 73:sc= 0.247 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.0358 USER MOD Single : A 127 SER OG : rot 180:sc= 0.615 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 THR OG1 : rot -131:sc= 0.0715 USER MOD Single : A 135 SER OG : rot 177:sc= -1.01! USER MOD Single : A 139 LYS NZ :NH3+ 155:sc= 1.3 (180deg=1.19) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 32:sc= 0.028 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 130:sc= 0.368 USER MOD ----------------------------------------------------------------- ATOM 65 N GLN A 8 4.084 9.838 -3.169 1.00 1.20 N ATOM 66 CA GLN A 8 5.318 10.559 -3.389 1.00 1.13 C ATOM 67 C GLN A 8 5.057 12.034 -3.615 1.00 0.98 C ATOM 68 O GLN A 8 4.399 12.423 -4.576 1.00 0.93 O ATOM 69 CB GLN A 8 6.083 9.991 -4.577 1.00 1.19 C ATOM 70 CG GLN A 8 7.207 9.044 -4.187 1.00 1.42 C ATOM 71 CD GLN A 8 8.281 9.721 -3.354 1.00 1.54 C ATOM 72 OE1 GLN A 8 8.482 11.015 -3.568 1.00 2.00 O flip ATOM 73 NE2 GLN A 8 8.930 9.087 -2.529 1.00 1.75 N flip ATOM 0 HA GLN A 8 5.923 10.441 -2.490 1.00 1.13 H new ATOM 0 HB2 GLN A 8 5.386 9.464 -5.228 1.00 1.19 H new ATOM 0 HB3 GLN A 8 6.499 10.815 -5.157 1.00 1.19 H new ATOM 0 HG2 GLN A 8 6.793 8.206 -3.626 1.00 1.42 H new ATOM 0 HG3 GLN A 8 7.659 8.632 -5.089 1.00 1.42 H new ATOM 0 HE21 GLN A 8 8.748 8.093 -2.391 1.00 1.75 H new ATOM 0 HE22 GLN A 8 9.652 9.554 -1.980 1.00 1.75 H new ATOM 82 N VAL A 9 5.571 12.844 -2.713 1.00 0.94 N ATOM 83 CA VAL A 9 5.511 14.284 -2.857 1.00 0.81 C ATOM 84 C VAL A 9 6.812 14.778 -3.465 1.00 0.79 C ATOM 85 O VAL A 9 7.882 14.639 -2.872 1.00 0.87 O ATOM 86 CB VAL A 9 5.273 14.983 -1.507 1.00 0.81 C ATOM 87 CG1 VAL A 9 5.196 16.491 -1.679 1.00 1.16 C ATOM 88 CG2 VAL A 9 4.012 14.457 -0.850 1.00 1.27 C ATOM 0 H VAL A 9 6.039 12.526 -1.865 1.00 0.94 H new ATOM 0 HA VAL A 9 4.671 14.526 -3.508 1.00 0.81 H new ATOM 0 HB VAL A 9 6.120 14.761 -0.858 1.00 0.81 H new ATOM 0 HG11 VAL A 9 5.027 16.960 -0.709 1.00 1.16 H new ATOM 0 HG12 VAL A 9 6.132 16.857 -2.101 1.00 1.16 H new ATOM 0 HG13 VAL A 9 4.374 16.739 -2.350 1.00 1.16 H new ATOM 0 HG21 VAL A 9 3.860 14.963 0.103 1.00 1.27 H new ATOM 0 HG22 VAL A 9 3.158 14.644 -1.500 1.00 1.27 H new ATOM 0 HG23 VAL A 9 4.110 13.385 -0.680 1.00 1.27 H new ATOM 98 N TYR A 10 6.714 15.337 -4.650 1.00 0.71 N ATOM 99 CA TYR A 10 7.884 15.757 -5.390 1.00 0.71 C ATOM 100 C TYR A 10 8.232 17.178 -5.021 1.00 0.62 C ATOM 101 O TYR A 10 7.357 18.030 -4.879 1.00 0.57 O ATOM 102 CB TYR A 10 7.612 15.633 -6.887 1.00 0.74 C ATOM 103 CG TYR A 10 6.923 14.333 -7.251 1.00 0.83 C ATOM 104 CD1 TYR A 10 7.560 13.112 -7.075 1.00 0.95 C ATOM 105 CD2 TYR A 10 5.628 14.331 -7.754 1.00 0.84 C ATOM 106 CE1 TYR A 10 6.927 11.923 -7.396 1.00 1.04 C ATOM 107 CE2 TYR A 10 4.990 13.149 -8.079 1.00 0.94 C ATOM 108 CZ TYR A 10 5.643 11.948 -7.898 1.00 1.03 C ATOM 109 OH TYR A 10 5.008 10.769 -8.219 1.00 1.14 O ATOM 0 H TYR A 10 5.829 15.513 -5.126 1.00 0.71 H new ATOM 0 HA TYR A 10 8.731 15.118 -5.139 1.00 0.71 H new ATOM 0 HB2 TYR A 10 6.993 16.470 -7.210 1.00 0.74 H new ATOM 0 HB3 TYR A 10 8.554 15.705 -7.430 1.00 0.74 H new ATOM 0 HD1 TYR A 10 8.565 13.089 -6.681 1.00 0.95 H new ATOM 0 HD2 TYR A 10 5.111 15.269 -7.893 1.00 0.84 H new ATOM 0 HE1 TYR A 10 7.436 10.981 -7.254 1.00 1.04 H new ATOM 0 HE2 TYR A 10 3.985 13.166 -8.473 1.00 0.94 H new ATOM 0 HH TYR A 10 4.109 10.963 -8.558 1.00 1.14 H new ATOM 119 N ARG A 11 9.508 17.424 -4.856 1.00 0.66 N ATOM 120 CA ARG A 11 9.976 18.713 -4.423 1.00 0.64 C ATOM 121 C ARG A 11 10.820 19.337 -5.516 1.00 0.56 C ATOM 122 O ARG A 11 11.676 18.674 -6.099 1.00 0.66 O ATOM 123 CB ARG A 11 10.771 18.548 -3.131 1.00 0.85 C ATOM 124 CG ARG A 11 11.163 19.855 -2.476 1.00 0.85 C ATOM 125 CD ARG A 11 11.805 19.611 -1.121 1.00 1.11 C ATOM 126 NE ARG A 11 10.892 18.953 -0.187 1.00 1.37 N ATOM 127 CZ ARG A 11 11.286 18.181 0.825 1.00 1.76 C ATOM 128 NH1 ARG A 11 12.577 17.986 1.065 1.00 2.15 N ATOM 129 NH2 ARG A 11 10.385 17.632 1.623 1.00 2.31 N ATOM 0 H ARG A 11 10.246 16.739 -5.018 1.00 0.66 H new ATOM 0 HA ARG A 11 9.134 19.376 -4.226 1.00 0.64 H new ATOM 0 HB2 ARG A 11 10.180 17.963 -2.426 1.00 0.85 H new ATOM 0 HB3 ARG A 11 11.674 17.975 -3.343 1.00 0.85 H new ATOM 0 HG2 ARG A 11 11.857 20.395 -3.120 1.00 0.85 H new ATOM 0 HG3 ARG A 11 10.282 20.486 -2.357 1.00 0.85 H new ATOM 0 HD2 ARG A 11 12.696 18.997 -1.249 1.00 1.11 H new ATOM 0 HD3 ARG A 11 12.131 20.562 -0.699 1.00 1.11 H new ATOM 0 HE ARG A 11 9.890 19.094 -0.319 1.00 1.37 H new ATOM 0 HH11 ARG A 11 13.279 18.429 0.472 1.00 2.15 H new ATOM 0 HH12 ARG A 11 12.867 17.393 1.843 1.00 2.15 H new ATOM 0 HH21 ARG A 11 9.392 17.800 1.463 1.00 2.31 H new ATOM 0 HH22 ARG A 11 10.683 17.041 2.399 1.00 2.31 H new ATOM 143 N GLY A 12 10.547 20.591 -5.815 1.00 0.46 N ATOM 144 CA GLY A 12 11.289 21.287 -6.840 1.00 0.45 C ATOM 145 C GLY A 12 11.332 22.770 -6.577 1.00 0.44 C ATOM 146 O GLY A 12 11.174 23.206 -5.436 1.00 0.50 O ATOM 0 H GLY A 12 9.819 21.145 -5.363 1.00 0.46 H new ATOM 0 HA2 GLY A 12 12.305 20.895 -6.886 1.00 0.45 H new ATOM 0 HA3 GLY A 12 10.832 21.101 -7.812 1.00 0.45 H new ATOM 150 N PHE A 13 11.553 23.551 -7.617 1.00 0.44 N ATOM 151 CA PHE A 13 11.604 24.993 -7.473 1.00 0.46 C ATOM 152 C PHE A 13 11.047 25.684 -8.711 1.00 0.43 C ATOM 153 O PHE A 13 11.071 25.130 -9.812 1.00 0.45 O ATOM 154 CB PHE A 13 13.037 25.478 -7.184 1.00 0.57 C ATOM 155 CG PHE A 13 14.114 24.444 -7.389 1.00 0.57 C ATOM 156 CD1 PHE A 13 14.668 24.232 -8.640 1.00 0.63 C ATOM 157 CD2 PHE A 13 14.586 23.697 -6.316 1.00 0.58 C ATOM 158 CE1 PHE A 13 15.673 23.302 -8.817 1.00 0.68 C ATOM 159 CE2 PHE A 13 15.586 22.766 -6.490 1.00 0.63 C ATOM 160 CZ PHE A 13 16.129 22.568 -7.742 1.00 0.67 C ATOM 0 H PHE A 13 11.700 23.213 -8.568 1.00 0.44 H new ATOM 0 HA PHE A 13 10.980 25.259 -6.620 1.00 0.46 H new ATOM 0 HB2 PHE A 13 13.250 26.334 -7.824 1.00 0.57 H new ATOM 0 HB3 PHE A 13 13.084 25.830 -6.154 1.00 0.57 H new ATOM 0 HD1 PHE A 13 14.310 24.800 -9.486 1.00 0.63 H new ATOM 0 HD2 PHE A 13 14.163 23.848 -5.334 1.00 0.58 H new ATOM 0 HE1 PHE A 13 16.102 23.149 -9.796 1.00 0.68 H new ATOM 0 HE2 PHE A 13 15.944 22.192 -5.648 1.00 0.63 H new ATOM 0 HZ PHE A 13 16.912 21.837 -7.881 1.00 0.67 H new ATOM 170 N ILE A 14 10.529 26.888 -8.513 1.00 0.42 N ATOM 171 CA ILE A 14 9.971 27.682 -9.604 1.00 0.42 C ATOM 172 C ILE A 14 11.088 28.201 -10.506 1.00 0.48 C ATOM 173 O ILE A 14 11.922 28.991 -10.066 1.00 0.56 O ATOM 174 CB ILE A 14 9.169 28.892 -9.063 1.00 0.43 C ATOM 175 CG1 ILE A 14 8.124 28.452 -8.026 1.00 0.41 C ATOM 176 CG2 ILE A 14 8.496 29.640 -10.211 1.00 0.46 C ATOM 177 CD1 ILE A 14 7.003 27.602 -8.592 1.00 0.38 C ATOM 0 H ILE A 14 10.483 27.341 -7.600 1.00 0.42 H new ATOM 0 HA ILE A 14 9.302 27.034 -10.171 1.00 0.42 H new ATOM 0 HB ILE A 14 9.870 29.563 -8.567 1.00 0.43 H new ATOM 0 HG12 ILE A 14 8.626 27.892 -7.237 1.00 0.41 H new ATOM 0 HG13 ILE A 14 7.693 29.339 -7.563 1.00 0.41 H new ATOM 0 HG21 ILE A 14 7.936 30.487 -9.815 1.00 0.46 H new ATOM 0 HG22 ILE A 14 9.255 29.999 -10.906 1.00 0.46 H new ATOM 0 HG23 ILE A 14 7.815 28.968 -10.733 1.00 0.46 H new ATOM 0 HD11 ILE A 14 6.310 27.335 -7.794 1.00 0.38 H new ATOM 0 HD12 ILE A 14 6.472 28.164 -9.360 1.00 0.38 H new ATOM 0 HD13 ILE A 14 7.420 26.695 -9.029 1.00 0.38 H new ATOM 189 N ALA A 15 11.121 27.754 -11.753 1.00 0.49 N ATOM 190 CA ALA A 15 12.146 28.208 -12.688 1.00 0.58 C ATOM 191 C ALA A 15 11.552 29.086 -13.783 1.00 0.65 C ATOM 192 O ALA A 15 12.128 30.110 -14.148 1.00 0.76 O ATOM 193 CB ALA A 15 12.878 27.026 -13.298 1.00 0.59 C ATOM 0 H ALA A 15 10.457 27.083 -12.141 1.00 0.49 H new ATOM 0 HA ALA A 15 12.860 28.810 -12.126 1.00 0.58 H new ATOM 0 HB1 ALA A 15 13.637 27.387 -13.992 1.00 0.59 H new ATOM 0 HB2 ALA A 15 13.355 26.446 -12.508 1.00 0.59 H new ATOM 0 HB3 ALA A 15 12.168 26.395 -13.833 1.00 0.59 H new ATOM 199 N VAL A 16 10.394 28.690 -14.302 1.00 0.66 N ATOM 200 CA VAL A 16 9.738 29.451 -15.358 1.00 0.78 C ATOM 201 C VAL A 16 8.424 30.039 -14.874 1.00 0.69 C ATOM 202 O VAL A 16 7.537 29.319 -14.414 1.00 0.67 O ATOM 203 CB VAL A 16 9.467 28.593 -16.617 1.00 0.94 C ATOM 204 CG1 VAL A 16 8.608 29.355 -17.624 1.00 1.55 C ATOM 205 CG2 VAL A 16 10.773 28.153 -17.260 1.00 1.42 C ATOM 0 H VAL A 16 9.893 27.851 -14.010 1.00 0.66 H new ATOM 0 HA VAL A 16 10.425 30.254 -15.625 1.00 0.78 H new ATOM 0 HB VAL A 16 8.919 27.704 -16.305 1.00 0.94 H new ATOM 0 HG11 VAL A 16 8.432 28.730 -18.499 1.00 1.55 H new ATOM 0 HG12 VAL A 16 7.654 29.614 -17.166 1.00 1.55 H new ATOM 0 HG13 VAL A 16 9.124 30.266 -17.927 1.00 1.55 H new ATOM 0 HG21 VAL A 16 10.559 27.551 -18.143 1.00 1.42 H new ATOM 0 HG22 VAL A 16 11.350 29.031 -17.550 1.00 1.42 H new ATOM 0 HG23 VAL A 16 11.348 27.561 -16.548 1.00 1.42 H new ATOM 215 N MET A 17 8.314 31.351 -14.982 1.00 0.73 N ATOM 216 CA MET A 17 7.076 32.047 -14.684 1.00 0.71 C ATOM 217 C MET A 17 6.507 32.655 -15.951 1.00 0.81 C ATOM 218 O MET A 17 7.138 33.514 -16.566 1.00 0.89 O ATOM 219 CB MET A 17 7.297 33.150 -13.655 1.00 0.74 C ATOM 220 CG MET A 17 7.235 32.665 -12.223 1.00 1.23 C ATOM 221 SD MET A 17 7.413 34.003 -11.036 1.00 1.42 S ATOM 222 CE MET A 17 6.975 33.154 -9.526 1.00 0.90 C ATOM 0 H MET A 17 9.076 31.961 -15.277 1.00 0.73 H new ATOM 0 HA MET A 17 6.375 31.321 -14.272 1.00 0.71 H new ATOM 0 HB2 MET A 17 8.269 33.611 -13.832 1.00 0.74 H new ATOM 0 HB3 MET A 17 6.545 33.926 -13.800 1.00 0.74 H new ATOM 0 HG2 MET A 17 6.285 32.158 -12.055 1.00 1.23 H new ATOM 0 HG3 MET A 17 8.022 31.929 -12.057 1.00 1.23 H new ATOM 0 HE1 MET A 17 6.491 33.852 -8.843 1.00 0.90 H new ATOM 0 HE2 MET A 17 6.292 32.336 -9.754 1.00 0.90 H new ATOM 0 HE3 MET A 17 7.875 32.755 -9.059 1.00 0.90 H new ATOM 232 N LYS A 18 5.342 32.192 -16.358 1.00 0.83 N ATOM 233 CA LYS A 18 4.658 32.785 -17.486 1.00 0.97 C ATOM 234 C LYS A 18 3.405 33.482 -16.977 1.00 1.03 C ATOM 235 O LYS A 18 3.148 33.491 -15.775 1.00 1.01 O ATOM 236 CB LYS A 18 4.313 31.725 -18.541 1.00 1.02 C ATOM 237 CG LYS A 18 4.431 32.238 -19.968 1.00 1.31 C ATOM 238 CD LYS A 18 5.879 32.546 -20.332 1.00 1.39 C ATOM 239 CE LYS A 18 6.610 31.321 -20.856 1.00 1.29 C ATOM 240 NZ LYS A 18 6.169 30.966 -22.229 1.00 2.03 N ATOM 0 H LYS A 18 4.852 31.409 -15.925 1.00 0.83 H new ATOM 0 HA LYS A 18 5.310 33.513 -17.970 1.00 0.97 H new ATOM 0 HB2 LYS A 18 4.974 30.867 -18.414 1.00 1.02 H new ATOM 0 HB3 LYS A 18 3.296 31.371 -18.372 1.00 1.02 H new ATOM 0 HG2 LYS A 18 4.032 31.494 -20.657 1.00 1.31 H new ATOM 0 HG3 LYS A 18 3.826 33.137 -20.084 1.00 1.31 H new ATOM 0 HD2 LYS A 18 5.903 33.332 -21.086 1.00 1.39 H new ATOM 0 HD3 LYS A 18 6.399 32.930 -19.454 1.00 1.39 H new ATOM 0 HE2 LYS A 18 7.684 31.510 -20.856 1.00 1.29 H new ATOM 0 HE3 LYS A 18 6.434 30.478 -20.188 1.00 1.29 H new ATOM 0 HZ1 LYS A 18 6.839 30.288 -22.644 1.00 2.03 H new ATOM 0 HZ2 LYS A 18 5.222 30.537 -22.190 1.00 2.03 H new ATOM 0 HZ3 LYS A 18 6.136 31.824 -22.816 1.00 2.03 H new ATOM 254 N GLU A 19 2.625 34.047 -17.882 1.00 1.21 N ATOM 255 CA GLU A 19 1.470 34.846 -17.503 1.00 1.32 C ATOM 256 C GLU A 19 0.370 33.993 -16.869 1.00 1.18 C ATOM 257 O GLU A 19 -0.195 34.364 -15.841 1.00 1.24 O ATOM 258 CB GLU A 19 0.933 35.573 -18.734 1.00 1.62 C ATOM 259 CG GLU A 19 -0.216 36.518 -18.448 1.00 2.11 C ATOM 260 CD GLU A 19 -0.787 37.105 -19.718 1.00 2.65 C ATOM 261 OE1 GLU A 19 -0.128 37.979 -20.318 1.00 2.89 O ATOM 262 OE2 GLU A 19 -1.886 36.677 -20.130 1.00 3.24 O ATOM 0 H GLU A 19 2.770 33.967 -18.888 1.00 1.21 H new ATOM 0 HA GLU A 19 1.788 35.571 -16.754 1.00 1.32 H new ATOM 0 HB2 GLU A 19 1.746 36.136 -19.192 1.00 1.62 H new ATOM 0 HB3 GLU A 19 0.606 34.833 -19.465 1.00 1.62 H new ATOM 0 HG2 GLU A 19 -1.000 35.985 -17.909 1.00 2.11 H new ATOM 0 HG3 GLU A 19 0.128 37.322 -17.798 1.00 2.11 H new ATOM 269 N ASN A 20 0.069 32.854 -17.480 1.00 1.10 N ATOM 270 CA ASN A 20 -1.056 32.034 -17.033 1.00 1.07 C ATOM 271 C ASN A 20 -0.592 30.724 -16.400 1.00 0.95 C ATOM 272 O ASN A 20 -1.341 30.078 -15.664 1.00 0.97 O ATOM 273 CB ASN A 20 -2.007 31.749 -18.202 1.00 1.19 C ATOM 274 CG ASN A 20 -2.632 33.019 -18.760 1.00 1.48 C ATOM 275 OD1 ASN A 20 -3.657 33.483 -18.269 1.00 2.03 O ATOM 276 ND2 ASN A 20 -2.028 33.587 -19.795 1.00 1.59 N ATOM 0 H ASN A 20 0.580 32.478 -18.278 1.00 1.10 H new ATOM 0 HA ASN A 20 -1.587 32.600 -16.267 1.00 1.07 H new ATOM 0 HB2 ASN A 20 -1.462 31.236 -18.994 1.00 1.19 H new ATOM 0 HB3 ASN A 20 -2.796 31.074 -17.870 1.00 1.19 H new ATOM 0 HD21 ASN A 20 -2.414 34.436 -20.208 1.00 1.59 H new ATOM 0 HD22 ASN A 20 -1.177 33.175 -20.178 1.00 1.59 H new ATOM 283 N PHE A 21 0.644 30.339 -16.665 1.00 0.88 N ATOM 284 CA PHE A 21 1.153 29.062 -16.189 1.00 0.80 C ATOM 285 C PHE A 21 2.665 29.121 -16.039 1.00 0.75 C ATOM 286 O PHE A 21 3.266 30.182 -16.187 1.00 0.79 O ATOM 287 CB PHE A 21 0.756 27.931 -17.148 1.00 0.87 C ATOM 288 CG PHE A 21 1.369 28.041 -18.517 1.00 0.94 C ATOM 289 CD1 PHE A 21 2.416 27.213 -18.886 1.00 0.97 C ATOM 290 CD2 PHE A 21 0.898 28.968 -19.430 1.00 1.14 C ATOM 291 CE1 PHE A 21 2.979 27.306 -20.142 1.00 1.05 C ATOM 292 CE2 PHE A 21 1.458 29.068 -20.687 1.00 1.25 C ATOM 293 CZ PHE A 21 2.501 28.234 -21.045 1.00 1.15 C ATOM 0 H PHE A 21 1.312 30.889 -17.205 1.00 0.88 H new ATOM 0 HA PHE A 21 0.712 28.856 -15.214 1.00 0.80 H new ATOM 0 HB2 PHE A 21 1.047 26.977 -16.707 1.00 0.87 H new ATOM 0 HB3 PHE A 21 -0.329 27.918 -17.248 1.00 0.87 H new ATOM 0 HD1 PHE A 21 2.796 26.487 -18.183 1.00 0.97 H new ATOM 0 HD2 PHE A 21 0.083 29.621 -19.155 1.00 1.14 H new ATOM 0 HE1 PHE A 21 3.793 26.653 -20.419 1.00 1.05 H new ATOM 0 HE2 PHE A 21 1.082 29.797 -21.390 1.00 1.25 H new ATOM 0 HZ PHE A 21 2.941 28.308 -22.029 1.00 1.15 H new ATOM 303 N GLY A 22 3.273 27.988 -15.744 1.00 0.71 N ATOM 304 CA GLY A 22 4.714 27.929 -15.637 1.00 0.68 C ATOM 305 C GLY A 22 5.212 26.500 -15.637 1.00 0.66 C ATOM 306 O GLY A 22 4.445 25.570 -15.893 1.00 0.70 O ATOM 0 H GLY A 22 2.794 27.103 -15.576 1.00 0.71 H new ATOM 0 HA2 GLY A 22 5.164 28.472 -16.468 1.00 0.68 H new ATOM 0 HA3 GLY A 22 5.033 28.426 -14.721 1.00 0.68 H new ATOM 310 N PHE A 23 6.488 26.321 -15.339 1.00 0.66 N ATOM 311 CA PHE A 23 7.074 24.992 -15.269 1.00 0.65 C ATOM 312 C PHE A 23 7.843 24.832 -13.968 1.00 0.56 C ATOM 313 O PHE A 23 8.642 25.699 -13.599 1.00 0.59 O ATOM 314 CB PHE A 23 8.007 24.746 -16.459 1.00 0.76 C ATOM 315 CG PHE A 23 7.315 24.825 -17.793 1.00 0.85 C ATOM 316 CD1 PHE A 23 6.408 23.847 -18.178 1.00 0.88 C ATOM 317 CD2 PHE A 23 7.562 25.879 -18.660 1.00 0.98 C ATOM 318 CE1 PHE A 23 5.769 23.916 -19.401 1.00 0.98 C ATOM 319 CE2 PHE A 23 6.926 25.952 -19.886 1.00 1.08 C ATOM 320 CZ PHE A 23 6.025 24.971 -20.255 1.00 1.06 C ATOM 0 H PHE A 23 7.139 27.081 -15.141 1.00 0.66 H new ATOM 0 HA PHE A 23 6.268 24.259 -15.304 1.00 0.65 H new ATOM 0 HB2 PHE A 23 8.815 25.478 -16.434 1.00 0.76 H new ATOM 0 HB3 PHE A 23 8.465 23.762 -16.354 1.00 0.76 H new ATOM 0 HD1 PHE A 23 6.199 23.022 -17.513 1.00 0.88 H new ATOM 0 HD2 PHE A 23 8.260 26.652 -18.374 1.00 0.98 H new ATOM 0 HE1 PHE A 23 5.070 23.145 -19.689 1.00 0.98 H new ATOM 0 HE2 PHE A 23 7.133 26.775 -20.554 1.00 1.08 H new ATOM 0 HZ PHE A 23 5.522 25.029 -21.209 1.00 1.06 H new ATOM 330 N ILE A 24 7.581 23.742 -13.266 1.00 0.54 N ATOM 331 CA ILE A 24 8.297 23.446 -12.043 1.00 0.48 C ATOM 332 C ILE A 24 9.524 22.621 -12.364 1.00 0.54 C ATOM 333 O ILE A 24 9.428 21.563 -12.991 1.00 0.61 O ATOM 334 CB ILE A 24 7.432 22.679 -11.024 1.00 0.42 C ATOM 335 CG1 ILE A 24 6.147 23.446 -10.724 1.00 0.41 C ATOM 336 CG2 ILE A 24 8.221 22.451 -9.741 1.00 0.40 C ATOM 337 CD1 ILE A 24 5.194 22.706 -9.814 1.00 0.41 C ATOM 0 H ILE A 24 6.878 23.050 -13.524 1.00 0.54 H new ATOM 0 HA ILE A 24 8.575 24.399 -11.593 1.00 0.48 H new ATOM 0 HB ILE A 24 7.163 21.714 -11.453 1.00 0.42 H new ATOM 0 HG12 ILE A 24 6.404 24.402 -10.266 1.00 0.41 H new ATOM 0 HG13 ILE A 24 5.640 23.668 -11.663 1.00 0.41 H new ATOM 0 HG21 ILE A 24 7.603 21.908 -9.025 1.00 0.40 H new ATOM 0 HG22 ILE A 24 9.116 21.869 -9.963 1.00 0.40 H new ATOM 0 HG23 ILE A 24 8.510 23.412 -9.316 1.00 0.40 H new ATOM 0 HD11 ILE A 24 4.305 23.314 -9.647 1.00 0.41 H new ATOM 0 HD12 ILE A 24 4.907 21.762 -10.278 1.00 0.41 H new ATOM 0 HD13 ILE A 24 5.682 22.507 -8.860 1.00 0.41 H new ATOM 349 N GLU A 25 10.673 23.113 -11.951 1.00 0.58 N ATOM 350 CA GLU A 25 11.917 22.417 -12.184 1.00 0.67 C ATOM 351 C GLU A 25 12.035 21.251 -11.215 1.00 0.64 C ATOM 352 O GLU A 25 11.913 21.433 -9.998 1.00 0.63 O ATOM 353 CB GLU A 25 13.086 23.377 -11.990 1.00 0.78 C ATOM 354 CG GLU A 25 14.419 22.827 -12.454 1.00 0.95 C ATOM 355 CD GLU A 25 14.503 22.740 -13.960 1.00 1.60 C ATOM 356 OE1 GLU A 25 15.007 23.693 -14.587 1.00 2.07 O ATOM 357 OE2 GLU A 25 14.067 21.707 -14.514 1.00 2.30 O ATOM 0 H GLU A 25 10.769 23.996 -11.450 1.00 0.58 H new ATOM 0 HA GLU A 25 11.936 22.037 -13.205 1.00 0.67 H new ATOM 0 HB2 GLU A 25 12.878 24.300 -12.530 1.00 0.78 H new ATOM 0 HB3 GLU A 25 13.159 23.635 -10.934 1.00 0.78 H new ATOM 0 HG2 GLU A 25 15.223 23.463 -12.082 1.00 0.95 H new ATOM 0 HG3 GLU A 25 14.572 21.837 -12.025 1.00 0.95 H new ATOM 364 N THR A 26 12.243 20.059 -11.752 1.00 0.68 N ATOM 365 CA THR A 26 12.419 18.880 -10.926 1.00 0.69 C ATOM 366 C THR A 26 13.703 19.003 -10.110 1.00 0.71 C ATOM 367 O THR A 26 14.691 19.551 -10.592 1.00 0.82 O ATOM 368 CB THR A 26 12.454 17.595 -11.775 1.00 0.79 C ATOM 369 OG1 THR A 26 13.232 17.803 -12.960 1.00 0.84 O ATOM 370 CG2 THR A 26 11.050 17.147 -12.157 1.00 0.87 C ATOM 0 H THR A 26 12.294 19.885 -12.756 1.00 0.68 H new ATOM 0 HA THR A 26 11.565 18.812 -10.252 1.00 0.69 H new ATOM 0 HB THR A 26 12.914 16.812 -11.172 1.00 0.79 H new ATOM 0 HG1 THR A 26 12.641 18.059 -13.699 1.00 0.84 H new ATOM 0 HG21 THR A 26 11.108 16.238 -12.756 1.00 0.87 H new ATOM 0 HG22 THR A 26 10.472 16.950 -11.254 1.00 0.87 H new ATOM 0 HG23 THR A 26 10.562 17.932 -12.736 1.00 0.87 H new ATOM 378 N LEU A 27 13.677 18.496 -8.879 1.00 0.68 N ATOM 379 CA LEU A 27 14.800 18.651 -7.954 1.00 0.74 C ATOM 380 C LEU A 27 16.105 18.183 -8.596 1.00 0.89 C ATOM 381 O LEU A 27 17.123 18.870 -8.537 1.00 1.00 O ATOM 382 CB LEU A 27 14.526 17.861 -6.661 1.00 0.74 C ATOM 383 CG LEU A 27 15.206 18.399 -5.388 1.00 0.80 C ATOM 384 CD1 LEU A 27 16.724 18.318 -5.467 1.00 1.48 C ATOM 385 CD2 LEU A 27 14.776 19.831 -5.121 1.00 1.58 C ATOM 0 H LEU A 27 12.889 17.973 -8.497 1.00 0.68 H new ATOM 0 HA LEU A 27 14.904 19.708 -7.711 1.00 0.74 H new ATOM 0 HB2 LEU A 27 13.449 17.839 -6.493 1.00 0.74 H new ATOM 0 HB3 LEU A 27 14.846 16.830 -6.813 1.00 0.74 H new ATOM 0 HG LEU A 27 14.886 17.764 -4.562 1.00 0.80 H new ATOM 0 HD11 LEU A 27 17.158 18.709 -4.546 1.00 1.48 H new ATOM 0 HD12 LEU A 27 17.027 17.279 -5.598 1.00 1.48 H new ATOM 0 HD13 LEU A 27 17.076 18.908 -6.313 1.00 1.48 H new ATOM 0 HD21 LEU A 27 15.266 20.196 -4.218 1.00 1.58 H new ATOM 0 HD22 LEU A 27 15.058 20.459 -5.966 1.00 1.58 H new ATOM 0 HD23 LEU A 27 13.695 19.867 -4.987 1.00 1.58 H new ATOM 397 N SER A 28 16.059 17.023 -9.228 1.00 0.97 N ATOM 398 CA SER A 28 17.246 16.441 -9.839 1.00 1.16 C ATOM 399 C SER A 28 17.369 16.833 -11.311 1.00 1.12 C ATOM 400 O SER A 28 18.267 16.350 -12.005 1.00 1.25 O ATOM 401 CB SER A 28 17.203 14.913 -9.704 1.00 1.34 C ATOM 402 OG SER A 28 18.364 14.307 -10.253 1.00 2.04 O ATOM 0 H SER A 28 15.213 16.464 -9.333 1.00 0.97 H new ATOM 0 HA SER A 28 18.120 16.830 -9.317 1.00 1.16 H new ATOM 0 HB2 SER A 28 17.114 14.642 -8.652 1.00 1.34 H new ATOM 0 HB3 SER A 28 16.317 14.527 -10.209 1.00 1.34 H new ATOM 0 HG SER A 28 18.656 14.813 -11.040 1.00 2.04 H new ATOM 408 N HIS A 29 16.490 17.727 -11.775 1.00 1.00 N ATOM 409 CA HIS A 29 16.424 18.091 -13.193 1.00 1.01 C ATOM 410 C HIS A 29 16.252 16.835 -14.035 1.00 1.02 C ATOM 411 O HIS A 29 17.048 16.531 -14.924 1.00 1.13 O ATOM 412 CB HIS A 29 17.671 18.863 -13.630 1.00 1.17 C ATOM 413 CG HIS A 29 17.856 20.175 -12.932 1.00 1.75 C ATOM 414 ND1 HIS A 29 17.503 21.389 -13.476 1.00 2.53 N ATOM 415 CD2 HIS A 29 18.405 20.451 -11.721 1.00 2.06 C ATOM 416 CE1 HIS A 29 17.848 22.344 -12.606 1.00 3.29 C ATOM 417 NE2 HIS A 29 18.398 21.828 -11.522 1.00 3.03 N ATOM 0 H HIS A 29 15.813 18.213 -11.187 1.00 1.00 H new ATOM 0 HA HIS A 29 15.565 18.746 -13.341 1.00 1.01 H new ATOM 0 HB2 HIS A 29 18.550 18.243 -13.453 1.00 1.17 H new ATOM 0 HB3 HIS A 29 17.617 19.040 -14.704 1.00 1.17 H new ATOM 0 HD2 HIS A 29 18.786 19.719 -11.024 1.00 2.06 H new ATOM 0 HE1 HIS A 29 17.696 23.401 -12.769 1.00 3.29 H new ATOM 0 HE2 HIS A 29 18.746 22.334 -10.708 1.00 3.03 H new ATOM 425 N ASP A 30 15.198 16.107 -13.728 1.00 1.05 N ATOM 426 CA ASP A 30 14.966 14.800 -14.307 1.00 1.17 C ATOM 427 C ASP A 30 13.812 14.846 -15.297 1.00 1.15 C ATOM 428 O ASP A 30 13.821 14.146 -16.309 1.00 1.31 O ATOM 429 CB ASP A 30 14.686 13.802 -13.181 1.00 1.31 C ATOM 430 CG ASP A 30 14.407 12.395 -13.673 1.00 2.12 C ATOM 431 OD1 ASP A 30 13.439 11.776 -13.181 1.00 2.89 O ATOM 432 OD2 ASP A 30 15.165 11.894 -14.527 1.00 2.47 O ATOM 0 H ASP A 30 14.478 16.405 -13.070 1.00 1.05 H new ATOM 0 HA ASP A 30 15.852 14.482 -14.857 1.00 1.17 H new ATOM 0 HB2 ASP A 30 15.542 13.779 -12.506 1.00 1.31 H new ATOM 0 HB3 ASP A 30 13.832 14.151 -12.601 1.00 1.31 H new ATOM 437 N GLU A 31 12.828 15.697 -15.016 1.00 1.06 N ATOM 438 CA GLU A 31 11.629 15.780 -15.846 1.00 1.19 C ATOM 439 C GLU A 31 11.149 17.224 -15.967 1.00 1.07 C ATOM 440 O GLU A 31 11.588 18.100 -15.218 1.00 0.94 O ATOM 441 CB GLU A 31 10.503 14.922 -15.251 1.00 1.37 C ATOM 442 CG GLU A 31 10.900 13.476 -15.003 1.00 1.33 C ATOM 443 CD GLU A 31 9.775 12.636 -14.434 1.00 1.49 C ATOM 444 OE1 GLU A 31 9.642 12.575 -13.190 1.00 1.80 O ATOM 445 OE2 GLU A 31 9.013 12.043 -15.231 1.00 1.65 O ATOM 0 H GLU A 31 12.837 16.337 -14.222 1.00 1.06 H new ATOM 0 HA GLU A 31 11.886 15.406 -16.837 1.00 1.19 H new ATOM 0 HB2 GLU A 31 10.179 15.366 -14.310 1.00 1.37 H new ATOM 0 HB3 GLU A 31 9.647 14.944 -15.926 1.00 1.37 H new ATOM 0 HG2 GLU A 31 11.237 13.033 -15.940 1.00 1.33 H new ATOM 0 HG3 GLU A 31 11.746 13.451 -14.316 1.00 1.33 H new ATOM 452 N GLU A 32 10.243 17.457 -16.913 1.00 1.20 N ATOM 453 CA GLU A 32 9.596 18.754 -17.066 1.00 1.14 C ATOM 454 C GLU A 32 8.185 18.663 -16.502 1.00 1.04 C ATOM 455 O GLU A 32 7.422 17.768 -16.871 1.00 1.17 O ATOM 456 CB GLU A 32 9.523 19.155 -18.548 1.00 1.41 C ATOM 457 CG GLU A 32 8.782 20.464 -18.795 1.00 1.85 C ATOM 458 CD GLU A 32 8.264 20.590 -20.219 1.00 2.71 C ATOM 459 OE1 GLU A 32 7.062 20.342 -20.451 1.00 3.37 O ATOM 460 OE2 GLU A 32 9.066 20.923 -21.115 1.00 3.06 O ATOM 0 H GLU A 32 9.939 16.757 -17.590 1.00 1.20 H new ATOM 0 HA GLU A 32 10.176 19.507 -16.532 1.00 1.14 H new ATOM 0 HB2 GLU A 32 10.536 19.242 -18.942 1.00 1.41 H new ATOM 0 HB3 GLU A 32 9.031 18.359 -19.106 1.00 1.41 H new ATOM 0 HG2 GLU A 32 7.945 20.538 -18.101 1.00 1.85 H new ATOM 0 HG3 GLU A 32 9.449 21.299 -18.581 1.00 1.85 H new ATOM 467 N VAL A 33 7.838 19.565 -15.600 1.00 0.87 N ATOM 468 CA VAL A 33 6.522 19.533 -14.990 1.00 0.80 C ATOM 469 C VAL A 33 5.739 20.797 -15.291 1.00 0.75 C ATOM 470 O VAL A 33 6.114 21.897 -14.876 1.00 0.71 O ATOM 471 CB VAL A 33 6.595 19.346 -13.466 1.00 0.71 C ATOM 472 CG1 VAL A 33 5.194 19.269 -12.879 1.00 0.78 C ATOM 473 CG2 VAL A 33 7.391 18.103 -13.110 1.00 0.76 C ATOM 0 H VAL A 33 8.442 20.321 -15.277 1.00 0.87 H new ATOM 0 HA VAL A 33 6.009 18.675 -15.426 1.00 0.80 H new ATOM 0 HB VAL A 33 7.107 20.208 -13.038 1.00 0.71 H new ATOM 0 HG11 VAL A 33 5.259 19.137 -11.799 1.00 0.78 H new ATOM 0 HG12 VAL A 33 4.656 20.191 -13.100 1.00 0.78 H new ATOM 0 HG13 VAL A 33 4.662 18.424 -13.317 1.00 0.78 H new ATOM 0 HG21 VAL A 33 7.428 17.993 -12.026 1.00 0.76 H new ATOM 0 HG22 VAL A 33 6.913 17.227 -13.548 1.00 0.76 H new ATOM 0 HG23 VAL A 33 8.405 18.196 -13.500 1.00 0.76 H new ATOM 483 N PHE A 34 4.652 20.628 -16.020 1.00 0.83 N ATOM 484 CA PHE A 34 3.742 21.718 -16.306 1.00 0.82 C ATOM 485 C PHE A 34 2.799 21.948 -15.130 1.00 0.75 C ATOM 486 O PHE A 34 2.055 21.049 -14.730 1.00 0.78 O ATOM 487 CB PHE A 34 2.949 21.411 -17.584 1.00 0.94 C ATOM 488 CG PHE A 34 1.610 22.095 -17.658 1.00 0.95 C ATOM 489 CD1 PHE A 34 0.442 21.364 -17.499 1.00 1.02 C ATOM 490 CD2 PHE A 34 1.519 23.459 -17.875 1.00 0.93 C ATOM 491 CE1 PHE A 34 -0.790 21.980 -17.550 1.00 1.06 C ATOM 492 CE2 PHE A 34 0.286 24.082 -17.930 1.00 0.97 C ATOM 493 CZ PHE A 34 -0.870 23.339 -17.768 1.00 1.04 C ATOM 0 H PHE A 34 4.377 19.735 -16.429 1.00 0.83 H new ATOM 0 HA PHE A 34 4.318 22.630 -16.461 1.00 0.82 H new ATOM 0 HB2 PHE A 34 3.544 21.707 -18.448 1.00 0.94 H new ATOM 0 HB3 PHE A 34 2.799 20.334 -17.655 1.00 0.94 H new ATOM 0 HD1 PHE A 34 0.499 20.298 -17.333 1.00 1.02 H new ATOM 0 HD2 PHE A 34 2.419 24.042 -18.002 1.00 0.93 H new ATOM 0 HE1 PHE A 34 -1.691 21.399 -17.419 1.00 1.06 H new ATOM 0 HE2 PHE A 34 0.225 25.147 -18.099 1.00 0.97 H new ATOM 0 HZ PHE A 34 -1.834 23.823 -17.812 1.00 1.04 H new ATOM 503 N PHE A 35 2.839 23.144 -14.570 1.00 0.68 N ATOM 504 CA PHE A 35 1.903 23.509 -13.527 1.00 0.65 C ATOM 505 C PHE A 35 1.151 24.763 -13.955 1.00 0.66 C ATOM 506 O PHE A 35 1.670 25.581 -14.719 1.00 0.67 O ATOM 507 CB PHE A 35 2.615 23.720 -12.183 1.00 0.62 C ATOM 508 CG PHE A 35 3.132 25.112 -11.936 1.00 0.80 C ATOM 509 CD1 PHE A 35 4.309 25.547 -12.520 1.00 1.17 C ATOM 510 CD2 PHE A 35 2.448 25.979 -11.097 1.00 1.23 C ATOM 511 CE1 PHE A 35 4.795 26.816 -12.275 1.00 1.72 C ATOM 512 CE2 PHE A 35 2.928 27.251 -10.852 1.00 1.76 C ATOM 513 CZ PHE A 35 4.104 27.670 -11.440 1.00 1.96 C ATOM 0 H PHE A 35 3.506 23.874 -14.820 1.00 0.68 H new ATOM 0 HA PHE A 35 1.194 22.694 -13.382 1.00 0.65 H new ATOM 0 HB2 PHE A 35 1.924 23.460 -11.381 1.00 0.62 H new ATOM 0 HB3 PHE A 35 3.452 23.024 -12.121 1.00 0.62 H new ATOM 0 HD1 PHE A 35 4.855 24.885 -13.176 1.00 1.17 H new ATOM 0 HD2 PHE A 35 1.529 25.656 -10.630 1.00 1.23 H new ATOM 0 HE1 PHE A 35 5.716 27.140 -12.737 1.00 1.72 H new ATOM 0 HE2 PHE A 35 2.383 27.918 -10.200 1.00 1.76 H new ATOM 0 HZ PHE A 35 4.482 28.663 -11.247 1.00 1.96 H new ATOM 523 N HIS A 36 -0.067 24.915 -13.483 1.00 0.72 N ATOM 524 CA HIS A 36 -0.877 26.054 -13.867 1.00 0.74 C ATOM 525 C HIS A 36 -1.245 26.847 -12.619 1.00 0.70 C ATOM 526 O HIS A 36 -1.682 26.266 -11.628 1.00 0.74 O ATOM 527 CB HIS A 36 -2.131 25.571 -14.602 1.00 0.84 C ATOM 528 CG HIS A 36 -2.740 26.592 -15.510 1.00 0.94 C ATOM 529 ND1 HIS A 36 -2.482 26.665 -16.861 1.00 1.06 N ATOM 530 CD2 HIS A 36 -3.630 27.579 -15.246 1.00 1.15 C ATOM 531 CE1 HIS A 36 -3.205 27.671 -17.365 1.00 1.12 C ATOM 532 NE2 HIS A 36 -3.922 28.257 -16.426 1.00 1.18 N ATOM 0 H HIS A 36 -0.518 24.269 -12.836 1.00 0.72 H new ATOM 0 HA HIS A 36 -0.317 26.702 -14.541 1.00 0.74 H new ATOM 0 HB2 HIS A 36 -1.878 24.686 -15.186 1.00 0.84 H new ATOM 0 HB3 HIS A 36 -2.875 25.265 -13.866 1.00 0.84 H new ATOM 0 HD2 HIS A 36 -4.046 27.804 -14.275 1.00 1.15 H new ATOM 0 HE1 HIS A 36 -3.202 27.965 -18.404 1.00 1.12 H new ATOM 0 HE2 HIS A 36 -4.559 29.045 -16.541 1.00 1.18 H new ATOM 540 N PHE A 37 -1.062 28.163 -12.660 1.00 0.68 N ATOM 541 CA PHE A 37 -1.290 29.008 -11.486 1.00 0.67 C ATOM 542 C PHE A 37 -2.734 28.934 -10.981 1.00 0.73 C ATOM 543 O PHE A 37 -2.995 29.171 -9.802 1.00 0.75 O ATOM 544 CB PHE A 37 -0.906 30.459 -11.782 1.00 0.71 C ATOM 545 CG PHE A 37 0.583 30.710 -11.761 1.00 0.68 C ATOM 546 CD1 PHE A 37 1.280 31.007 -12.925 1.00 0.73 C ATOM 547 CD2 PHE A 37 1.287 30.651 -10.565 1.00 0.69 C ATOM 548 CE1 PHE A 37 2.647 31.241 -12.892 1.00 0.74 C ATOM 549 CE2 PHE A 37 2.651 30.884 -10.529 1.00 0.72 C ATOM 550 CZ PHE A 37 3.330 31.179 -11.693 1.00 0.73 C ATOM 0 H PHE A 37 -0.757 28.670 -13.491 1.00 0.68 H new ATOM 0 HA PHE A 37 -0.650 28.623 -10.692 1.00 0.67 H new ATOM 0 HB2 PHE A 37 -1.298 30.737 -12.760 1.00 0.71 H new ATOM 0 HB3 PHE A 37 -1.385 31.109 -11.050 1.00 0.71 H new ATOM 0 HD1 PHE A 37 0.752 31.056 -13.866 1.00 0.73 H new ATOM 0 HD2 PHE A 37 0.762 30.420 -9.650 1.00 0.69 H new ATOM 0 HE1 PHE A 37 3.177 31.472 -13.804 1.00 0.74 H new ATOM 0 HE2 PHE A 37 3.183 30.835 -9.590 1.00 0.72 H new ATOM 0 HZ PHE A 37 4.394 31.361 -11.667 1.00 0.73 H new ATOM 560 N SER A 38 -3.666 28.590 -11.861 1.00 0.80 N ATOM 561 CA SER A 38 -5.065 28.441 -11.467 1.00 0.90 C ATOM 562 C SER A 38 -5.267 27.186 -10.606 1.00 0.92 C ATOM 563 O SER A 38 -6.320 27.006 -9.997 1.00 1.07 O ATOM 564 CB SER A 38 -5.972 28.382 -12.701 1.00 0.98 C ATOM 565 OG SER A 38 -7.339 28.342 -12.330 1.00 1.63 O ATOM 0 H SER A 38 -3.482 28.409 -12.848 1.00 0.80 H new ATOM 0 HA SER A 38 -5.336 29.313 -10.872 1.00 0.90 H new ATOM 0 HB2 SER A 38 -5.789 29.252 -13.332 1.00 0.98 H new ATOM 0 HB3 SER A 38 -5.727 27.501 -13.294 1.00 0.98 H new ATOM 0 HG SER A 38 -7.438 27.827 -11.502 1.00 1.63 H new ATOM 571 N ASN A 39 -4.255 26.323 -10.563 1.00 0.82 N ATOM 572 CA ASN A 39 -4.307 25.113 -9.742 1.00 0.87 C ATOM 573 C ASN A 39 -3.349 25.227 -8.561 1.00 0.80 C ATOM 574 O ASN A 39 -3.236 24.310 -7.742 1.00 0.87 O ATOM 575 CB ASN A 39 -3.971 23.861 -10.569 1.00 0.92 C ATOM 576 CG ASN A 39 -5.124 23.388 -11.437 1.00 1.28 C ATOM 577 OD1 ASN A 39 -5.949 22.582 -11.010 1.00 2.07 O ATOM 578 ND2 ASN A 39 -5.180 23.873 -12.668 1.00 1.54 N ATOM 0 H ASN A 39 -3.388 26.438 -11.087 1.00 0.82 H new ATOM 0 HA ASN A 39 -5.326 25.012 -9.367 1.00 0.87 H new ATOM 0 HB2 ASN A 39 -3.111 24.073 -11.204 1.00 0.92 H new ATOM 0 HB3 ASN A 39 -3.679 23.056 -9.895 1.00 0.92 H new ATOM 0 HD21 ASN A 39 -5.926 23.579 -13.298 1.00 1.54 H new ATOM 0 HD22 ASN A 39 -4.477 24.540 -12.986 1.00 1.54 H new ATOM 585 N TYR A 40 -2.666 26.361 -8.475 1.00 0.72 N ATOM 586 CA TYR A 40 -1.730 26.615 -7.388 1.00 0.66 C ATOM 587 C TYR A 40 -2.473 27.181 -6.181 1.00 0.73 C ATOM 588 O TYR A 40 -3.207 28.164 -6.298 1.00 0.87 O ATOM 589 CB TYR A 40 -0.634 27.588 -7.850 1.00 0.65 C ATOM 590 CG TYR A 40 0.370 27.946 -6.773 1.00 0.59 C ATOM 591 CD1 TYR A 40 1.511 27.178 -6.575 1.00 0.55 C ATOM 592 CD2 TYR A 40 0.171 29.050 -5.952 1.00 0.75 C ATOM 593 CE1 TYR A 40 2.422 27.500 -5.588 1.00 0.64 C ATOM 594 CE2 TYR A 40 1.080 29.378 -4.968 1.00 0.81 C ATOM 595 CZ TYR A 40 2.201 28.599 -4.787 1.00 0.74 C ATOM 596 OH TYR A 40 3.101 28.919 -3.803 1.00 0.91 O ATOM 0 H TYR A 40 -2.744 27.123 -9.149 1.00 0.72 H new ATOM 0 HA TYR A 40 -1.259 25.676 -7.098 1.00 0.66 H new ATOM 0 HB2 TYR A 40 -0.104 27.147 -8.694 1.00 0.65 H new ATOM 0 HB3 TYR A 40 -1.104 28.502 -8.212 1.00 0.65 H new ATOM 0 HD1 TYR A 40 1.688 26.317 -7.202 1.00 0.55 H new ATOM 0 HD2 TYR A 40 -0.710 29.661 -6.087 1.00 0.75 H new ATOM 0 HE1 TYR A 40 3.304 26.893 -5.445 1.00 0.64 H new ATOM 0 HE2 TYR A 40 0.913 30.242 -4.342 1.00 0.81 H new ATOM 0 HH TYR A 40 3.998 28.630 -4.073 1.00 0.91 H new ATOM 606 N MET A 41 -2.286 26.559 -5.025 1.00 0.69 N ATOM 607 CA MET A 41 -2.968 27.001 -3.818 1.00 0.79 C ATOM 608 C MET A 41 -2.028 27.825 -2.941 1.00 0.77 C ATOM 609 O MET A 41 -1.205 27.282 -2.202 1.00 0.77 O ATOM 610 CB MET A 41 -3.522 25.799 -3.047 1.00 0.87 C ATOM 611 CG MET A 41 -4.354 26.181 -1.832 1.00 1.35 C ATOM 612 SD MET A 41 -5.179 24.762 -1.072 1.00 1.73 S ATOM 613 CE MET A 41 -3.778 23.760 -0.580 1.00 1.39 C ATOM 0 H MET A 41 -1.673 25.754 -4.898 1.00 0.69 H new ATOM 0 HA MET A 41 -3.805 27.637 -4.106 1.00 0.79 H new ATOM 0 HB2 MET A 41 -4.133 25.198 -3.720 1.00 0.87 H new ATOM 0 HB3 MET A 41 -2.691 25.172 -2.724 1.00 0.87 H new ATOM 0 HG2 MET A 41 -3.711 26.660 -1.093 1.00 1.35 H new ATOM 0 HG3 MET A 41 -5.103 26.916 -2.127 1.00 1.35 H new ATOM 0 HE1 MET A 41 -4.096 23.032 0.166 1.00 1.39 H new ATOM 0 HE2 MET A 41 -3.380 23.238 -1.450 1.00 1.39 H new ATOM 0 HE3 MET A 41 -3.004 24.400 -0.156 1.00 1.39 H new ATOM 623 N GLY A 42 -2.139 29.140 -3.060 1.00 0.87 N ATOM 624 CA GLY A 42 -1.298 30.042 -2.303 1.00 0.91 C ATOM 625 C GLY A 42 -1.186 31.389 -2.981 1.00 0.92 C ATOM 626 O GLY A 42 -2.021 31.729 -3.820 1.00 1.05 O ATOM 0 H GLY A 42 -2.807 29.603 -3.677 1.00 0.87 H new ATOM 0 HA2 GLY A 42 -1.708 30.170 -1.301 1.00 0.91 H new ATOM 0 HA3 GLY A 42 -0.305 29.607 -2.188 1.00 0.91 H new ATOM 630 N ASN A 43 -0.161 32.151 -2.630 1.00 0.89 N ATOM 631 CA ASN A 43 0.060 33.463 -3.230 1.00 0.91 C ATOM 632 C ASN A 43 1.179 33.388 -4.261 1.00 0.83 C ATOM 633 O ASN A 43 2.355 33.325 -3.908 1.00 0.83 O ATOM 634 CB ASN A 43 0.406 34.492 -2.154 1.00 1.02 C ATOM 635 CG ASN A 43 -0.732 34.715 -1.179 1.00 1.48 C ATOM 636 OD1 ASN A 43 -0.844 34.022 -0.167 1.00 2.14 O ATOM 637 ND2 ASN A 43 -1.586 35.677 -1.482 1.00 2.03 N ATOM 0 H ASN A 43 0.533 31.885 -1.932 1.00 0.89 H new ATOM 0 HA ASN A 43 -0.858 33.775 -3.727 1.00 0.91 H new ATOM 0 HB2 ASN A 43 1.289 34.159 -1.608 1.00 1.02 H new ATOM 0 HB3 ASN A 43 0.664 35.438 -2.630 1.00 1.02 H new ATOM 0 HD21 ASN A 43 -2.376 35.870 -0.867 1.00 2.03 H new ATOM 0 HD22 ASN A 43 -1.455 36.227 -2.331 1.00 2.03 H new ATOM 644 N PRO A 44 0.829 33.371 -5.554 1.00 0.84 N ATOM 645 CA PRO A 44 1.804 33.183 -6.629 1.00 0.82 C ATOM 646 C PRO A 44 2.621 34.436 -6.941 1.00 0.88 C ATOM 647 O PRO A 44 3.735 34.344 -7.452 1.00 0.91 O ATOM 648 CB PRO A 44 0.935 32.793 -7.824 1.00 0.92 C ATOM 649 CG PRO A 44 -0.387 33.432 -7.568 1.00 1.01 C ATOM 650 CD PRO A 44 -0.547 33.514 -6.070 1.00 0.93 C ATOM 0 HA PRO A 44 2.555 32.440 -6.359 1.00 0.82 H new ATOM 0 HB2 PRO A 44 1.369 33.147 -8.759 1.00 0.92 H new ATOM 0 HB3 PRO A 44 0.840 31.710 -7.906 1.00 0.92 H new ATOM 0 HG2 PRO A 44 -0.430 34.424 -8.017 1.00 1.01 H new ATOM 0 HG3 PRO A 44 -1.192 32.846 -8.012 1.00 1.01 H new ATOM 0 HD2 PRO A 44 -0.990 34.463 -5.768 1.00 0.93 H new ATOM 0 HD3 PRO A 44 -1.198 32.724 -5.695 1.00 0.93 H new ATOM 658 N ASN A 45 2.075 35.602 -6.616 1.00 0.94 N ATOM 659 CA ASN A 45 2.732 36.866 -6.937 1.00 1.05 C ATOM 660 C ASN A 45 3.843 37.186 -5.944 1.00 1.04 C ATOM 661 O ASN A 45 4.555 38.176 -6.101 1.00 1.15 O ATOM 662 CB ASN A 45 1.714 38.010 -6.985 1.00 1.15 C ATOM 663 CG ASN A 45 0.858 37.975 -8.236 1.00 1.43 C ATOM 664 OD1 ASN A 45 -0.184 37.319 -8.276 1.00 2.08 O ATOM 665 ND2 ASN A 45 1.295 38.680 -9.269 1.00 1.88 N ATOM 0 H ASN A 45 1.182 35.700 -6.132 1.00 0.94 H new ATOM 0 HA ASN A 45 3.184 36.759 -7.923 1.00 1.05 H new ATOM 0 HB2 ASN A 45 1.070 37.956 -6.107 1.00 1.15 H new ATOM 0 HB3 ASN A 45 2.241 38.963 -6.936 1.00 1.15 H new ATOM 0 HD21 ASN A 45 0.763 38.693 -10.139 1.00 1.88 H new ATOM 0 HD22 ASN A 45 2.163 39.210 -9.194 1.00 1.88 H new ATOM 672 N TRP A 46 3.988 36.352 -4.921 1.00 0.98 N ATOM 673 CA TRP A 46 5.066 36.518 -3.953 1.00 1.04 C ATOM 674 C TRP A 46 6.057 35.364 -4.047 1.00 0.96 C ATOM 675 O TRP A 46 6.835 35.111 -3.128 1.00 1.02 O ATOM 676 CB TRP A 46 4.505 36.653 -2.539 1.00 1.10 C ATOM 677 CG TRP A 46 4.094 38.059 -2.214 1.00 1.28 C ATOM 678 CD1 TRP A 46 2.883 38.649 -2.452 1.00 1.30 C ATOM 679 CD2 TRP A 46 4.915 39.061 -1.608 1.00 1.56 C ATOM 680 NE1 TRP A 46 2.903 39.956 -2.017 1.00 1.52 N ATOM 681 CE2 TRP A 46 4.140 40.229 -1.494 1.00 1.67 C ATOM 682 CE3 TRP A 46 6.230 39.076 -1.142 1.00 1.80 C ATOM 683 CZ2 TRP A 46 4.641 41.404 -0.936 1.00 1.97 C ATOM 684 CZ3 TRP A 46 6.729 40.242 -0.590 1.00 2.13 C ATOM 685 CH2 TRP A 46 5.934 41.391 -0.488 1.00 2.18 C ATOM 0 H TRP A 46 3.375 35.557 -4.740 1.00 0.98 H new ATOM 0 HA TRP A 46 5.602 37.437 -4.188 1.00 1.04 H new ATOM 0 HB2 TRP A 46 3.645 35.992 -2.428 1.00 1.10 H new ATOM 0 HB3 TRP A 46 5.256 36.322 -1.821 1.00 1.10 H new ATOM 0 HD1 TRP A 46 2.036 38.162 -2.913 1.00 1.30 H new ATOM 0 HE1 TRP A 46 2.125 40.613 -2.075 1.00 1.52 H new ATOM 0 HE3 TRP A 46 6.848 38.193 -1.211 1.00 1.80 H new ATOM 0 HZ2 TRP A 46 4.031 42.292 -0.860 1.00 1.97 H new ATOM 0 HZ3 TRP A 46 7.748 40.267 -0.232 1.00 2.13 H new ATOM 0 HH2 TRP A 46 6.350 42.285 -0.047 1.00 2.18 H new ATOM 696 N LEU A 47 6.023 34.684 -5.178 1.00 0.85 N ATOM 697 CA LEU A 47 6.995 33.660 -5.493 1.00 0.78 C ATOM 698 C LEU A 47 8.105 34.273 -6.327 1.00 0.82 C ATOM 699 O LEU A 47 7.915 35.322 -6.947 1.00 0.92 O ATOM 700 CB LEU A 47 6.343 32.521 -6.284 1.00 0.68 C ATOM 701 CG LEU A 47 5.464 31.559 -5.488 1.00 0.62 C ATOM 702 CD1 LEU A 47 4.693 30.644 -6.429 1.00 0.57 C ATOM 703 CD2 LEU A 47 6.316 30.735 -4.540 1.00 0.66 C ATOM 0 H LEU A 47 5.320 34.828 -5.903 1.00 0.85 H new ATOM 0 HA LEU A 47 7.396 33.256 -4.564 1.00 0.78 H new ATOM 0 HB2 LEU A 47 5.738 32.959 -7.078 1.00 0.68 H new ATOM 0 HB3 LEU A 47 7.132 31.944 -6.766 1.00 0.68 H new ATOM 0 HG LEU A 47 4.750 32.141 -4.905 1.00 0.62 H new ATOM 0 HD11 LEU A 47 4.071 29.964 -5.847 1.00 0.57 H new ATOM 0 HD12 LEU A 47 4.061 31.244 -7.083 1.00 0.57 H new ATOM 0 HD13 LEU A 47 5.395 30.068 -7.032 1.00 0.57 H new ATOM 0 HD21 LEU A 47 5.679 30.053 -3.978 1.00 0.66 H new ATOM 0 HD22 LEU A 47 7.046 30.162 -5.112 1.00 0.66 H new ATOM 0 HD23 LEU A 47 6.836 31.398 -3.849 1.00 0.66 H new ATOM 715 N GLU A 48 9.247 33.621 -6.360 1.00 0.81 N ATOM 716 CA GLU A 48 10.348 34.075 -7.186 1.00 0.89 C ATOM 717 C GLU A 48 11.034 32.887 -7.825 1.00 0.71 C ATOM 718 O GLU A 48 10.817 31.743 -7.418 1.00 0.62 O ATOM 719 CB GLU A 48 11.358 34.900 -6.380 1.00 1.15 C ATOM 720 CG GLU A 48 11.848 34.224 -5.109 1.00 1.48 C ATOM 721 CD GLU A 48 13.122 34.857 -4.576 1.00 1.86 C ATOM 722 OE1 GLU A 48 14.152 34.154 -4.495 1.00 2.35 O ATOM 723 OE2 GLU A 48 13.108 36.065 -4.263 1.00 2.13 O ATOM 0 H GLU A 48 9.439 32.774 -5.825 1.00 0.81 H new ATOM 0 HA GLU A 48 9.941 34.722 -7.963 1.00 0.89 H new ATOM 0 HB2 GLU A 48 12.217 35.121 -7.014 1.00 1.15 H new ATOM 0 HB3 GLU A 48 10.902 35.854 -6.117 1.00 1.15 H new ATOM 0 HG2 GLU A 48 11.071 34.280 -4.347 1.00 1.48 H new ATOM 0 HG3 GLU A 48 12.025 33.167 -5.307 1.00 1.48 H new ATOM 730 N LEU A 49 11.845 33.154 -8.833 1.00 0.75 N ATOM 731 CA LEU A 49 12.552 32.096 -9.523 1.00 0.67 C ATOM 732 C LEU A 49 13.630 31.516 -8.621 1.00 0.67 C ATOM 733 O LEU A 49 14.620 32.177 -8.300 1.00 0.73 O ATOM 734 CB LEU A 49 13.167 32.621 -10.822 1.00 0.76 C ATOM 735 CG LEU A 49 12.190 33.333 -11.765 1.00 0.85 C ATOM 736 CD1 LEU A 49 12.894 33.774 -13.034 1.00 1.40 C ATOM 737 CD2 LEU A 49 11.013 32.441 -12.115 1.00 1.11 C ATOM 0 H LEU A 49 12.028 34.092 -9.189 1.00 0.75 H new ATOM 0 HA LEU A 49 11.843 31.307 -9.775 1.00 0.67 H new ATOM 0 HB2 LEU A 49 13.973 33.311 -10.571 1.00 0.76 H new ATOM 0 HB3 LEU A 49 13.618 31.785 -11.356 1.00 0.76 H new ATOM 0 HG LEU A 49 11.814 34.212 -11.243 1.00 0.85 H new ATOM 0 HD11 LEU A 49 12.182 34.277 -13.689 1.00 1.40 H new ATOM 0 HD12 LEU A 49 13.703 34.460 -12.782 1.00 1.40 H new ATOM 0 HD13 LEU A 49 13.304 32.902 -13.545 1.00 1.40 H new ATOM 0 HD21 LEU A 49 10.339 32.975 -12.785 1.00 1.11 H new ATOM 0 HD22 LEU A 49 11.374 31.538 -12.607 1.00 1.11 H new ATOM 0 HD23 LEU A 49 10.479 32.169 -11.204 1.00 1.11 H new ATOM 749 N GLY A 50 13.444 30.267 -8.235 1.00 0.66 N ATOM 750 CA GLY A 50 14.360 29.631 -7.318 1.00 0.72 C ATOM 751 C GLY A 50 13.739 29.369 -5.961 1.00 0.69 C ATOM 752 O GLY A 50 14.425 28.914 -5.047 1.00 0.75 O ATOM 0 H GLY A 50 12.670 29.679 -8.543 1.00 0.66 H new ATOM 0 HA2 GLY A 50 14.700 28.688 -7.746 1.00 0.72 H new ATOM 0 HA3 GLY A 50 15.241 30.261 -7.195 1.00 0.72 H new ATOM 756 N GLN A 51 12.450 29.665 -5.823 1.00 0.62 N ATOM 757 CA GLN A 51 11.732 29.388 -4.581 1.00 0.60 C ATOM 758 C GLN A 51 11.392 27.906 -4.483 1.00 0.56 C ATOM 759 O GLN A 51 10.773 27.339 -5.387 1.00 0.53 O ATOM 760 CB GLN A 51 10.456 30.232 -4.489 1.00 0.59 C ATOM 761 CG GLN A 51 9.603 29.959 -3.247 1.00 0.60 C ATOM 762 CD GLN A 51 10.346 30.182 -1.940 1.00 0.70 C ATOM 763 OE1 GLN A 51 10.871 29.112 -1.362 1.00 1.06 O flip ATOM 764 NE2 GLN A 51 10.409 31.298 -1.430 1.00 0.87 N flip ATOM 0 H GLN A 51 11.882 30.095 -6.553 1.00 0.62 H new ATOM 0 HA GLN A 51 12.381 29.655 -3.747 1.00 0.60 H new ATOM 0 HB2 GLN A 51 10.731 31.287 -4.501 1.00 0.59 H new ATOM 0 HB3 GLN A 51 9.851 30.051 -5.377 1.00 0.59 H new ATOM 0 HG2 GLN A 51 8.724 30.604 -3.271 1.00 0.60 H new ATOM 0 HG3 GLN A 51 9.245 28.930 -3.281 1.00 0.60 H new ATOM 0 HE21 GLN A 51 9.993 32.100 -1.904 1.00 0.87 H new ATOM 0 HE22 GLN A 51 10.877 31.423 -0.532 1.00 0.87 H new ATOM 773 N GLU A 52 11.819 27.299 -3.388 1.00 0.57 N ATOM 774 CA GLU A 52 11.569 25.895 -3.115 1.00 0.55 C ATOM 775 C GLU A 52 10.083 25.636 -2.857 1.00 0.50 C ATOM 776 O GLU A 52 9.466 26.287 -2.010 1.00 0.55 O ATOM 777 CB GLU A 52 12.400 25.451 -1.900 1.00 0.63 C ATOM 778 CG GLU A 52 13.898 25.708 -2.051 1.00 1.15 C ATOM 779 CD GLU A 52 14.354 27.053 -1.503 1.00 1.94 C ATOM 780 OE1 GLU A 52 13.580 28.029 -1.614 1.00 2.44 O ATOM 781 OE2 GLU A 52 15.474 27.148 -0.963 1.00 2.51 O ATOM 0 H GLU A 52 12.353 27.771 -2.658 1.00 0.57 H new ATOM 0 HA GLU A 52 11.863 25.317 -3.991 1.00 0.55 H new ATOM 0 HB2 GLU A 52 12.039 25.973 -1.014 1.00 0.63 H new ATOM 0 HB3 GLU A 52 12.239 24.386 -1.731 1.00 0.63 H new ATOM 0 HG2 GLU A 52 14.445 24.915 -1.541 1.00 1.15 H new ATOM 0 HG3 GLU A 52 14.162 25.649 -3.107 1.00 1.15 H new ATOM 788 N VAL A 53 9.519 24.683 -3.596 1.00 0.43 N ATOM 789 CA VAL A 53 8.123 24.276 -3.429 1.00 0.40 C ATOM 790 C VAL A 53 7.993 22.762 -3.628 1.00 0.41 C ATOM 791 O VAL A 53 8.767 22.160 -4.373 1.00 0.44 O ATOM 792 CB VAL A 53 7.176 24.997 -4.426 1.00 0.37 C ATOM 793 CG1 VAL A 53 7.080 26.486 -4.119 1.00 0.41 C ATOM 794 CG2 VAL A 53 7.645 24.784 -5.857 1.00 0.37 C ATOM 0 H VAL A 53 10.014 24.171 -4.326 1.00 0.43 H new ATOM 0 HA VAL A 53 7.827 24.556 -2.418 1.00 0.40 H new ATOM 0 HB VAL A 53 6.182 24.564 -4.313 1.00 0.37 H new ATOM 0 HG11 VAL A 53 6.410 26.963 -4.834 1.00 0.41 H new ATOM 0 HG12 VAL A 53 6.692 26.625 -3.110 1.00 0.41 H new ATOM 0 HG13 VAL A 53 8.069 26.937 -4.193 1.00 0.41 H new ATOM 0 HG21 VAL A 53 6.969 25.297 -6.542 1.00 0.37 H new ATOM 0 HG22 VAL A 53 8.652 25.185 -5.973 1.00 0.37 H new ATOM 0 HG23 VAL A 53 7.651 23.718 -6.083 1.00 0.37 H new ATOM 804 N GLU A 54 7.033 22.143 -2.957 1.00 0.47 N ATOM 805 CA GLU A 54 6.781 20.718 -3.145 1.00 0.54 C ATOM 806 C GLU A 54 5.310 20.475 -3.448 1.00 0.52 C ATOM 807 O GLU A 54 4.454 21.291 -3.102 1.00 0.54 O ATOM 808 CB GLU A 54 7.240 19.885 -1.939 1.00 0.72 C ATOM 809 CG GLU A 54 6.633 20.289 -0.605 1.00 0.81 C ATOM 810 CD GLU A 54 6.954 19.289 0.492 1.00 1.05 C ATOM 811 OE1 GLU A 54 8.110 18.807 0.548 1.00 1.49 O ATOM 812 OE2 GLU A 54 6.053 18.965 1.294 1.00 1.30 O ATOM 0 H GLU A 54 6.419 22.599 -2.282 1.00 0.47 H new ATOM 0 HA GLU A 54 7.373 20.390 -3.999 1.00 0.54 H new ATOM 0 HB2 GLU A 54 6.999 18.839 -2.128 1.00 0.72 H new ATOM 0 HB3 GLU A 54 8.325 19.954 -1.862 1.00 0.72 H new ATOM 0 HG2 GLU A 54 7.006 21.272 -0.320 1.00 0.81 H new ATOM 0 HG3 GLU A 54 5.552 20.377 -0.710 1.00 0.81 H new ATOM 819 N TYR A 55 5.018 19.358 -4.102 1.00 0.54 N ATOM 820 CA TYR A 55 3.690 19.124 -4.643 1.00 0.58 C ATOM 821 C TYR A 55 3.536 17.687 -5.131 1.00 0.64 C ATOM 822 O TYR A 55 4.472 16.891 -5.057 1.00 0.66 O ATOM 823 CB TYR A 55 3.443 20.089 -5.801 1.00 0.55 C ATOM 824 CG TYR A 55 4.341 19.859 -6.988 1.00 0.52 C ATOM 825 CD1 TYR A 55 5.718 19.997 -6.881 1.00 0.54 C ATOM 826 CD2 TYR A 55 3.810 19.510 -8.214 1.00 0.63 C ATOM 827 CE1 TYR A 55 6.541 19.783 -7.961 1.00 0.56 C ATOM 828 CE2 TYR A 55 4.624 19.296 -9.303 1.00 0.65 C ATOM 829 CZ TYR A 55 5.990 19.440 -9.171 1.00 0.57 C ATOM 830 OH TYR A 55 6.809 19.228 -10.251 1.00 0.63 O ATOM 0 H TYR A 55 5.683 18.603 -4.269 1.00 0.54 H new ATOM 0 HA TYR A 55 2.959 19.291 -3.852 1.00 0.58 H new ATOM 0 HB2 TYR A 55 2.405 20.000 -6.120 1.00 0.55 H new ATOM 0 HB3 TYR A 55 3.581 21.110 -5.446 1.00 0.55 H new ATOM 0 HD1 TYR A 55 6.151 20.278 -5.932 1.00 0.54 H new ATOM 0 HD2 TYR A 55 2.740 19.403 -8.320 1.00 0.63 H new ATOM 0 HE1 TYR A 55 7.611 19.884 -7.859 1.00 0.56 H new ATOM 0 HE2 TYR A 55 4.196 19.017 -10.255 1.00 0.65 H new ATOM 0 HH TYR A 55 7.676 18.891 -9.943 1.00 0.63 H new ATOM 840 N THR A 56 2.355 17.366 -5.633 1.00 0.72 N ATOM 841 CA THR A 56 2.085 16.038 -6.159 1.00 0.82 C ATOM 842 C THR A 56 1.674 16.113 -7.630 1.00 0.85 C ATOM 843 O THR A 56 1.473 17.203 -8.168 1.00 0.85 O ATOM 844 CB THR A 56 0.994 15.320 -5.338 1.00 0.88 C ATOM 845 OG1 THR A 56 -0.129 16.192 -5.128 1.00 0.84 O ATOM 846 CG2 THR A 56 1.543 14.853 -3.992 1.00 0.94 C ATOM 0 H THR A 56 1.565 18.009 -5.687 1.00 0.72 H new ATOM 0 HA THR A 56 3.005 15.459 -6.080 1.00 0.82 H new ATOM 0 HB THR A 56 0.669 14.446 -5.903 1.00 0.88 H new ATOM 0 HG1 THR A 56 -0.101 16.924 -5.779 1.00 0.84 H new ATOM 0 HG21 THR A 56 0.755 14.350 -3.432 1.00 0.94 H new ATOM 0 HG22 THR A 56 2.369 14.161 -4.156 1.00 0.94 H new ATOM 0 HG23 THR A 56 1.898 15.714 -3.425 1.00 0.94 H new ATOM 854 N LEU A 57 1.550 14.962 -8.281 1.00 0.96 N ATOM 855 CA LEU A 57 1.211 14.920 -9.698 1.00 1.03 C ATOM 856 C LEU A 57 -0.020 14.070 -9.951 1.00 1.12 C ATOM 857 O LEU A 57 -0.244 13.064 -9.276 1.00 1.19 O ATOM 858 CB LEU A 57 2.370 14.356 -10.519 1.00 1.09 C ATOM 859 CG LEU A 57 3.622 15.232 -10.583 1.00 1.04 C ATOM 860 CD1 LEU A 57 4.710 14.558 -11.403 1.00 1.13 C ATOM 861 CD2 LEU A 57 3.293 16.589 -11.173 1.00 1.03 C ATOM 0 H LEU A 57 1.679 14.046 -7.850 1.00 0.96 H new ATOM 0 HA LEU A 57 1.006 15.946 -10.004 1.00 1.03 H new ATOM 0 HB2 LEU A 57 2.647 13.387 -10.105 1.00 1.09 H new ATOM 0 HB3 LEU A 57 2.019 14.180 -11.536 1.00 1.09 H new ATOM 0 HG LEU A 57 3.989 15.371 -9.566 1.00 1.04 H new ATOM 0 HD11 LEU A 57 5.591 15.199 -11.435 1.00 1.13 H new ATOM 0 HD12 LEU A 57 4.972 13.604 -10.946 1.00 1.13 H new ATOM 0 HD13 LEU A 57 4.348 14.387 -12.417 1.00 1.13 H new ATOM 0 HD21 LEU A 57 4.196 17.198 -11.210 1.00 1.03 H new ATOM 0 HD22 LEU A 57 2.899 16.462 -12.181 1.00 1.03 H new ATOM 0 HD23 LEU A 57 2.547 17.084 -10.552 1.00 1.03 H new ATOM 873 N ALA A 58 -0.806 14.469 -10.940 1.00 1.17 N ATOM 874 CA ALA A 58 -1.952 13.683 -11.364 1.00 1.30 C ATOM 875 C ALA A 58 -1.520 12.635 -12.383 1.00 1.40 C ATOM 876 O ALA A 58 -1.636 12.840 -13.589 1.00 2.04 O ATOM 877 CB ALA A 58 -3.033 14.578 -11.950 1.00 1.33 C ATOM 0 H ALA A 58 -0.670 15.334 -11.464 1.00 1.17 H new ATOM 0 HA ALA A 58 -2.366 13.177 -10.492 1.00 1.30 H new ATOM 0 HB1 ALA A 58 -3.881 13.968 -12.261 1.00 1.33 H new ATOM 0 HB2 ALA A 58 -3.359 15.296 -11.197 1.00 1.33 H new ATOM 0 HB3 ALA A 58 -2.635 15.112 -12.813 1.00 1.33 H new ATOM 1026 N LEU A 70 0.193 15.989 -18.079 1.00 1.49 N ATOM 1027 CA LEU A 70 -0.791 16.195 -17.040 1.00 1.50 C ATOM 1028 C LEU A 70 -0.395 17.384 -16.165 1.00 1.25 C ATOM 1029 O LEU A 70 0.790 17.679 -16.010 1.00 1.15 O ATOM 1030 CB LEU A 70 -0.966 14.917 -16.191 1.00 1.71 C ATOM 1031 CG LEU A 70 0.235 13.944 -16.095 1.00 1.88 C ATOM 1032 CD1 LEU A 70 0.429 13.146 -17.383 1.00 2.30 C ATOM 1033 CD2 LEU A 70 1.524 14.657 -15.696 1.00 2.29 C ATOM 0 HA LEU A 70 -1.750 16.418 -17.508 1.00 1.50 H new ATOM 0 HB2 LEU A 70 -1.232 15.221 -15.179 1.00 1.71 H new ATOM 0 HB3 LEU A 70 -1.815 14.363 -16.591 1.00 1.71 H new ATOM 0 HG LEU A 70 -0.007 13.237 -15.301 1.00 1.88 H new ATOM 0 HD11 LEU A 70 1.282 12.477 -17.271 1.00 2.30 H new ATOM 0 HD12 LEU A 70 -0.468 12.561 -17.587 1.00 2.30 H new ATOM 0 HD13 LEU A 70 0.611 13.831 -18.211 1.00 2.30 H new ATOM 0 HD21 LEU A 70 2.338 13.934 -15.642 1.00 2.29 H new ATOM 0 HD22 LEU A 70 1.764 15.418 -16.439 1.00 2.29 H new ATOM 0 HD23 LEU A 70 1.392 15.129 -14.722 1.00 2.29 H new ATOM 1045 N PRO A 71 -1.381 18.097 -15.604 1.00 1.22 N ATOM 1046 CA PRO A 71 -1.126 19.253 -14.743 1.00 1.05 C ATOM 1047 C PRO A 71 -0.620 18.844 -13.361 1.00 0.97 C ATOM 1048 O PRO A 71 -0.929 17.756 -12.870 1.00 1.14 O ATOM 1049 CB PRO A 71 -2.499 19.912 -14.626 1.00 1.18 C ATOM 1050 CG PRO A 71 -3.470 18.797 -14.807 1.00 1.38 C ATOM 1051 CD PRO A 71 -2.825 17.830 -15.762 1.00 1.43 C ATOM 0 HA PRO A 71 -0.354 19.905 -15.152 1.00 1.05 H new ATOM 0 HB2 PRO A 71 -2.626 20.394 -13.657 1.00 1.18 H new ATOM 0 HB3 PRO A 71 -2.635 20.682 -15.385 1.00 1.18 H new ATOM 0 HG2 PRO A 71 -3.691 18.315 -13.855 1.00 1.38 H new ATOM 0 HG3 PRO A 71 -4.416 19.165 -15.205 1.00 1.38 H new ATOM 0 HD2 PRO A 71 -3.071 16.797 -15.514 1.00 1.43 H new ATOM 0 HD3 PRO A 71 -3.154 17.999 -16.787 1.00 1.43 H new ATOM 1059 N ALA A 72 0.171 19.712 -12.750 1.00 0.80 N ATOM 1060 CA ALA A 72 0.630 19.502 -11.387 1.00 0.74 C ATOM 1061 C ALA A 72 -0.452 19.933 -10.406 1.00 0.72 C ATOM 1062 O ALA A 72 -0.989 21.040 -10.515 1.00 0.82 O ATOM 1063 CB ALA A 72 1.918 20.279 -11.149 1.00 0.70 C ATOM 0 H ALA A 72 0.510 20.573 -13.180 1.00 0.80 H new ATOM 0 HA ALA A 72 0.834 18.443 -11.232 1.00 0.74 H new ATOM 0 HB1 ALA A 72 2.257 20.117 -10.126 1.00 0.70 H new ATOM 0 HB2 ALA A 72 2.684 19.935 -11.843 1.00 0.70 H new ATOM 0 HB3 ALA A 72 1.736 21.342 -11.307 1.00 0.70 H new ATOM 1069 N GLU A 73 -0.782 19.067 -9.457 1.00 0.74 N ATOM 1070 CA GLU A 73 -1.866 19.345 -8.526 1.00 0.77 C ATOM 1071 C GLU A 73 -1.349 19.457 -7.101 1.00 0.69 C ATOM 1072 O GLU A 73 -0.435 18.729 -6.698 1.00 0.71 O ATOM 1073 CB GLU A 73 -2.943 18.260 -8.597 1.00 0.94 C ATOM 1074 CG GLU A 73 -3.610 18.142 -9.956 1.00 1.28 C ATOM 1075 CD GLU A 73 -5.048 17.683 -9.851 1.00 1.84 C ATOM 1076 OE1 GLU A 73 -5.891 18.481 -9.391 1.00 2.30 O ATOM 1077 OE2 GLU A 73 -5.351 16.534 -10.236 1.00 2.28 O ATOM 0 H GLU A 73 -0.317 18.171 -9.312 1.00 0.74 H new ATOM 0 HA GLU A 73 -2.306 20.299 -8.816 1.00 0.77 H new ATOM 0 HB2 GLU A 73 -2.495 17.300 -8.338 1.00 0.94 H new ATOM 0 HB3 GLU A 73 -3.705 18.469 -7.846 1.00 0.94 H new ATOM 0 HG2 GLU A 73 -3.575 19.107 -10.461 1.00 1.28 H new ATOM 0 HG3 GLU A 73 -3.051 17.439 -10.573 1.00 1.28 H new ATOM 1084 N ASN A 74 -1.951 20.375 -6.346 1.00 0.68 N ATOM 1085 CA ASN A 74 -1.597 20.608 -4.947 1.00 0.69 C ATOM 1086 C ASN A 74 -0.147 21.046 -4.812 1.00 0.59 C ATOM 1087 O ASN A 74 0.702 20.290 -4.344 1.00 0.66 O ATOM 1088 CB ASN A 74 -1.851 19.357 -4.094 1.00 0.81 C ATOM 1089 CG ASN A 74 -3.324 19.049 -3.941 1.00 1.39 C ATOM 1090 OD1 ASN A 74 -4.157 19.951 -3.907 1.00 1.81 O ATOM 1091 ND2 ASN A 74 -3.656 17.770 -3.859 1.00 2.01 N ATOM 0 H ASN A 74 -2.699 20.979 -6.688 1.00 0.68 H new ATOM 0 HA ASN A 74 -2.236 21.411 -4.581 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -1.350 18.503 -4.550 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -1.408 19.498 -3.108 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -4.636 17.503 -3.764 1.00 2.01 H new ATOM 0 HD22 ASN A 74 -2.932 17.052 -3.891 1.00 2.01 H new ATOM 1098 N VAL A 75 0.134 22.266 -5.246 1.00 0.66 N ATOM 1099 CA VAL A 75 1.472 22.818 -5.127 1.00 0.58 C ATOM 1100 C VAL A 75 1.567 23.675 -3.873 1.00 0.59 C ATOM 1101 O VAL A 75 0.764 24.589 -3.679 1.00 0.64 O ATOM 1102 CB VAL A 75 1.858 23.664 -6.358 1.00 0.56 C ATOM 1103 CG1 VAL A 75 3.318 24.091 -6.284 1.00 0.72 C ATOM 1104 CG2 VAL A 75 1.582 22.902 -7.646 1.00 0.80 C ATOM 0 H VAL A 75 -0.545 22.889 -5.682 1.00 0.66 H new ATOM 0 HA VAL A 75 2.168 21.982 -5.063 1.00 0.58 H new ATOM 0 HB VAL A 75 1.242 24.563 -6.358 1.00 0.56 H new ATOM 0 HG11 VAL A 75 3.568 24.686 -7.162 1.00 0.72 H new ATOM 0 HG12 VAL A 75 3.478 24.686 -5.385 1.00 0.72 H new ATOM 0 HG13 VAL A 75 3.955 23.207 -6.252 1.00 0.72 H new ATOM 0 HG21 VAL A 75 1.862 23.518 -8.500 1.00 0.80 H new ATOM 0 HG22 VAL A 75 2.165 21.981 -7.656 1.00 0.80 H new ATOM 0 HG23 VAL A 75 0.521 22.660 -7.705 1.00 0.80 H new ATOM 1114 N ARG A 76 2.534 23.370 -3.015 1.00 0.58 N ATOM 1115 CA ARG A 76 2.665 24.061 -1.739 1.00 0.62 C ATOM 1116 C ARG A 76 4.081 24.596 -1.546 1.00 0.55 C ATOM 1117 O ARG A 76 5.048 24.024 -2.048 1.00 0.52 O ATOM 1118 CB ARG A 76 2.309 23.108 -0.594 1.00 0.73 C ATOM 1119 CG ARG A 76 0.918 22.499 -0.718 1.00 1.28 C ATOM 1120 CD ARG A 76 -0.169 23.533 -0.481 1.00 1.58 C ATOM 1121 NE ARG A 76 -0.271 23.907 0.930 1.00 2.10 N ATOM 1122 CZ ARG A 76 -0.601 25.123 1.368 1.00 2.75 C ATOM 1123 NH1 ARG A 76 -0.831 26.109 0.505 1.00 3.11 N ATOM 1124 NH2 ARG A 76 -0.708 25.343 2.674 1.00 3.51 N ATOM 0 H ARG A 76 3.237 22.650 -3.180 1.00 0.58 H new ATOM 0 HA ARG A 76 1.978 24.907 -1.737 1.00 0.62 H new ATOM 0 HB2 ARG A 76 3.046 22.306 -0.558 1.00 0.73 H new ATOM 0 HB3 ARG A 76 2.378 23.647 0.351 1.00 0.73 H new ATOM 0 HG2 ARG A 76 0.798 22.065 -1.711 1.00 1.28 H new ATOM 0 HG3 ARG A 76 0.811 21.686 0.001 1.00 1.28 H new ATOM 0 HD2 ARG A 76 0.039 24.421 -1.077 1.00 1.58 H new ATOM 0 HD3 ARG A 76 -1.126 23.138 -0.821 1.00 1.58 H new ATOM 0 HE ARG A 76 -0.076 23.188 1.627 1.00 2.10 H new ATOM 0 HH11 ARG A 76 -0.755 25.937 -0.498 1.00 3.11 H new ATOM 0 HH12 ARG A 76 -1.083 27.037 0.846 1.00 3.11 H new ATOM 0 HH21 ARG A 76 -0.538 24.585 3.335 1.00 3.51 H new ATOM 0 HH22 ARG A 76 -0.960 26.270 3.016 1.00 3.51 H new ATOM 1138 N MET A 77 4.193 25.700 -0.815 1.00 0.63 N ATOM 1139 CA MET A 77 5.493 26.270 -0.475 1.00 0.60 C ATOM 1140 C MET A 77 6.110 25.500 0.678 1.00 0.70 C ATOM 1141 O MET A 77 5.394 24.897 1.478 1.00 0.91 O ATOM 1142 CB MET A 77 5.354 27.732 -0.045 1.00 0.72 C ATOM 1143 CG MET A 77 4.853 28.682 -1.116 1.00 0.80 C ATOM 1144 SD MET A 77 4.659 30.360 -0.471 1.00 1.12 S ATOM 1145 CE MET A 77 4.017 31.227 -1.896 1.00 0.86 C ATOM 0 H MET A 77 3.397 26.220 -0.445 1.00 0.63 H new ATOM 0 HA MET A 77 6.124 26.207 -1.362 1.00 0.60 H new ATOM 0 HB2 MET A 77 4.674 27.779 0.805 1.00 0.72 H new ATOM 0 HB3 MET A 77 6.325 28.084 0.303 1.00 0.72 H new ATOM 0 HG2 MET A 77 5.552 28.691 -1.953 1.00 0.80 H new ATOM 0 HG3 MET A 77 3.898 28.326 -1.502 1.00 0.80 H new ATOM 0 HE1 MET A 77 4.364 32.260 -1.880 1.00 0.86 H new ATOM 0 HE2 MET A 77 4.367 30.740 -2.806 1.00 0.86 H new ATOM 0 HE3 MET A 77 2.927 31.210 -1.872 1.00 0.86 H new ATOM 1155 N LEU A 78 7.430 25.517 0.766 1.00 0.65 N ATOM 1156 CA LEU A 78 8.099 25.014 1.956 1.00 0.83 C ATOM 1157 C LEU A 78 9.363 25.825 2.215 1.00 0.83 C ATOM 1158 O LEU A 78 9.988 26.319 1.277 1.00 0.93 O ATOM 1159 CB LEU A 78 8.409 23.509 1.853 1.00 0.99 C ATOM 1160 CG LEU A 78 9.663 23.116 1.069 1.00 1.05 C ATOM 1161 CD1 LEU A 78 10.006 21.666 1.347 1.00 1.49 C ATOM 1162 CD2 LEU A 78 9.467 23.321 -0.421 1.00 1.67 C ATOM 0 H LEU A 78 8.053 25.868 0.039 1.00 0.65 H new ATOM 0 HA LEU A 78 7.423 25.132 2.803 1.00 0.83 H new ATOM 0 HB2 LEU A 78 8.501 23.111 2.864 1.00 0.99 H new ATOM 0 HB3 LEU A 78 7.552 23.016 1.393 1.00 0.99 H new ATOM 0 HG LEU A 78 10.483 23.757 1.394 1.00 1.05 H new ATOM 0 HD11 LEU A 78 10.899 21.390 0.787 1.00 1.49 H new ATOM 0 HD12 LEU A 78 10.191 21.534 2.413 1.00 1.49 H new ATOM 0 HD13 LEU A 78 9.175 21.030 1.041 1.00 1.49 H new ATOM 0 HD21 LEU A 78 10.375 23.033 -0.950 1.00 1.67 H new ATOM 0 HD22 LEU A 78 8.635 22.707 -0.766 1.00 1.67 H new ATOM 0 HD23 LEU A 78 9.249 24.371 -0.618 1.00 1.67 H new ATOM 1174 N PRO A 79 9.738 25.994 3.494 1.00 1.15 N ATOM 1175 CA PRO A 79 10.881 26.824 3.876 1.00 1.27 C ATOM 1176 C PRO A 79 12.209 26.289 3.347 1.00 1.13 C ATOM 1177 O PRO A 79 12.323 25.121 2.960 1.00 1.59 O ATOM 1178 CB PRO A 79 10.863 26.796 5.408 1.00 1.97 C ATOM 1179 CG PRO A 79 10.087 25.576 5.761 1.00 2.15 C ATOM 1180 CD PRO A 79 9.074 25.399 4.667 1.00 1.65 C ATOM 0 HA PRO A 79 10.798 27.826 3.456 1.00 1.27 H new ATOM 0 HB2 PRO A 79 11.874 26.752 5.814 1.00 1.97 H new ATOM 0 HB3 PRO A 79 10.395 27.693 5.814 1.00 1.97 H new ATOM 0 HG2 PRO A 79 10.739 24.706 5.833 1.00 2.15 H new ATOM 0 HG3 PRO A 79 9.600 25.690 6.729 1.00 2.15 H new ATOM 0 HD2 PRO A 79 8.836 24.348 4.505 1.00 1.65 H new ATOM 0 HD3 PRO A 79 8.137 25.906 4.900 1.00 1.65 H new ATOM 1188 N LYS A 80 13.212 27.156 3.348 1.00 1.09 N ATOM 1189 CA LYS A 80 14.527 26.821 2.824 1.00 1.37 C ATOM 1190 C LYS A 80 15.224 25.782 3.702 1.00 1.18 C ATOM 1191 O LYS A 80 14.722 25.420 4.771 1.00 1.19 O ATOM 1192 CB LYS A 80 15.381 28.085 2.704 1.00 1.96 C ATOM 1193 CG LYS A 80 15.611 28.801 4.026 1.00 2.65 C ATOM 1194 CD LYS A 80 16.395 30.090 3.842 1.00 3.44 C ATOM 1195 CE LYS A 80 15.569 31.162 3.149 1.00 4.04 C ATOM 1196 NZ LYS A 80 14.376 31.549 3.949 1.00 4.61 N ATOM 0 H LYS A 80 13.137 28.107 3.710 1.00 1.09 H new ATOM 0 HA LYS A 80 14.400 26.385 1.833 1.00 1.37 H new ATOM 0 HB2 LYS A 80 16.346 27.820 2.273 1.00 1.96 H new ATOM 0 HB3 LYS A 80 14.899 28.772 2.009 1.00 1.96 H new ATOM 0 HG2 LYS A 80 14.650 29.023 4.491 1.00 2.65 H new ATOM 0 HG3 LYS A 80 16.150 28.142 4.707 1.00 2.65 H new ATOM 0 HD2 LYS A 80 16.724 30.457 4.814 1.00 3.44 H new ATOM 0 HD3 LYS A 80 17.293 29.889 3.257 1.00 3.44 H new ATOM 0 HE2 LYS A 80 16.189 32.041 2.974 1.00 4.04 H new ATOM 0 HE3 LYS A 80 15.249 30.798 2.173 1.00 4.04 H new ATOM 0 HZ1 LYS A 80 14.016 32.465 3.614 1.00 4.61 H new ATOM 0 HZ2 LYS A 80 13.636 30.826 3.842 1.00 4.61 H new ATOM 0 HZ3 LYS A 80 14.641 31.627 4.952 1.00 4.61 H new ATOM 1210 N ASN A 81 16.376 25.304 3.223 1.00 1.26 N ATOM 1211 CA ASN A 81 17.166 24.262 3.893 1.00 1.35 C ATOM 1212 C ASN A 81 16.504 22.896 3.747 1.00 1.23 C ATOM 1213 O ASN A 81 16.993 21.899 4.278 1.00 1.43 O ATOM 1214 CB ASN A 81 17.402 24.574 5.376 1.00 1.57 C ATOM 1215 CG ASN A 81 18.228 25.824 5.591 1.00 2.26 C ATOM 1216 OD1 ASN A 81 17.691 26.928 5.709 1.00 2.84 O ATOM 1217 ND2 ASN A 81 19.537 25.660 5.659 1.00 2.81 N ATOM 0 H ASN A 81 16.792 25.631 2.351 1.00 1.26 H new ATOM 0 HA ASN A 81 18.138 24.242 3.400 1.00 1.35 H new ATOM 0 HB2 ASN A 81 16.440 24.690 5.875 1.00 1.57 H new ATOM 0 HB3 ASN A 81 17.904 23.728 5.845 1.00 1.57 H new ATOM 0 HD21 ASN A 81 20.144 26.465 5.815 1.00 2.81 H new ATOM 0 HD22 ASN A 81 19.940 24.729 5.556 1.00 2.81 H new ATOM 1224 N SER A 82 15.400 22.856 3.010 1.00 1.01 N ATOM 1225 CA SER A 82 14.700 21.607 2.739 1.00 1.03 C ATOM 1226 C SER A 82 15.247 20.956 1.470 1.00 0.96 C ATOM 1227 O SER A 82 14.811 19.874 1.074 1.00 1.12 O ATOM 1228 CB SER A 82 13.198 21.865 2.597 1.00 1.08 C ATOM 1229 OG SER A 82 12.685 22.554 3.726 1.00 1.70 O ATOM 0 H SER A 82 14.969 23.679 2.588 1.00 1.01 H new ATOM 0 HA SER A 82 14.862 20.927 3.575 1.00 1.03 H new ATOM 0 HB2 SER A 82 13.011 22.449 1.696 1.00 1.08 H new ATOM 0 HB3 SER A 82 12.674 20.917 2.477 1.00 1.08 H new ATOM 0 HG SER A 82 12.673 23.517 3.544 1.00 1.70 H new ATOM 1235 N ILE A 83 16.190 21.633 0.829 1.00 0.83 N ATOM 1236 CA ILE A 83 16.849 21.095 -0.348 1.00 0.77 C ATOM 1237 C ILE A 83 18.295 20.767 -0.006 1.00 0.76 C ATOM 1238 O ILE A 83 19.028 21.630 0.476 1.00 0.78 O ATOM 1239 CB ILE A 83 16.828 22.089 -1.540 1.00 0.76 C ATOM 1240 CG1 ILE A 83 15.420 22.643 -1.780 1.00 0.92 C ATOM 1241 CG2 ILE A 83 17.361 21.426 -2.801 1.00 0.79 C ATOM 1242 CD1 ILE A 83 14.360 21.596 -2.018 1.00 0.69 C ATOM 0 H ILE A 83 16.515 22.559 1.107 1.00 0.83 H new ATOM 0 HA ILE A 83 16.305 20.200 -0.649 1.00 0.77 H new ATOM 0 HB ILE A 83 17.478 22.926 -1.285 1.00 0.76 H new ATOM 0 HG12 ILE A 83 15.130 23.244 -0.918 1.00 0.92 H new ATOM 0 HG13 ILE A 83 15.450 23.312 -2.640 1.00 0.92 H new ATOM 0 HG21 ILE A 83 17.338 22.139 -3.625 1.00 0.79 H new ATOM 0 HG22 ILE A 83 18.387 21.098 -2.634 1.00 0.79 H new ATOM 0 HG23 ILE A 83 16.741 20.565 -3.049 1.00 0.79 H new ATOM 0 HD11 ILE A 83 13.398 22.082 -2.178 1.00 0.69 H new ATOM 0 HD12 ILE A 83 14.620 21.008 -2.898 1.00 0.69 H new ATOM 0 HD13 ILE A 83 14.295 20.940 -1.150 1.00 0.69 H new ATOM 1254 N PRO A 84 18.720 19.511 -0.209 1.00 0.82 N ATOM 1255 CA PRO A 84 20.097 19.103 0.069 1.00 0.89 C ATOM 1256 C PRO A 84 21.064 19.708 -0.934 1.00 0.83 C ATOM 1257 O PRO A 84 20.775 19.772 -2.130 1.00 0.82 O ATOM 1258 CB PRO A 84 20.055 17.584 -0.088 1.00 1.03 C ATOM 1259 CG PRO A 84 18.951 17.352 -1.055 1.00 1.03 C ATOM 1260 CD PRO A 84 17.913 18.394 -0.731 1.00 0.91 C ATOM 0 HA PRO A 84 20.439 19.430 1.051 1.00 0.89 H new ATOM 0 HB2 PRO A 84 21.002 17.195 -0.463 1.00 1.03 H new ATOM 0 HB3 PRO A 84 19.862 17.090 0.864 1.00 1.03 H new ATOM 0 HG2 PRO A 84 19.301 17.452 -2.083 1.00 1.03 H new ATOM 0 HG3 PRO A 84 18.544 16.346 -0.953 1.00 1.03 H new ATOM 0 HD2 PRO A 84 17.343 18.685 -1.614 1.00 0.91 H new ATOM 0 HD3 PRO A 84 17.196 18.034 0.007 1.00 0.91 H new ATOM 1268 N GLN A 85 22.207 20.149 -0.458 1.00 0.88 N ATOM 1269 CA GLN A 85 23.183 20.772 -1.329 1.00 0.88 C ATOM 1270 C GLN A 85 24.475 19.962 -1.346 1.00 0.77 C ATOM 1271 O GLN A 85 24.818 19.313 -0.356 1.00 0.74 O ATOM 1272 CB GLN A 85 23.453 22.217 -0.889 1.00 1.06 C ATOM 1273 CG GLN A 85 23.946 22.343 0.544 1.00 1.73 C ATOM 1274 CD GLN A 85 24.185 23.783 0.964 1.00 2.21 C ATOM 1275 OE1 GLN A 85 23.519 24.704 0.492 1.00 2.76 O ATOM 1276 NE2 GLN A 85 25.142 23.985 1.853 1.00 2.65 N ATOM 0 H GLN A 85 22.484 20.089 0.522 1.00 0.88 H new ATOM 0 HA GLN A 85 22.779 20.794 -2.341 1.00 0.88 H new ATOM 0 HB2 GLN A 85 24.193 22.658 -1.557 1.00 1.06 H new ATOM 0 HB3 GLN A 85 22.537 22.797 -1.000 1.00 1.06 H new ATOM 0 HG2 GLN A 85 23.216 21.891 1.215 1.00 1.73 H new ATOM 0 HG3 GLN A 85 24.872 21.779 0.655 1.00 1.73 H new ATOM 0 HE21 GLN A 85 25.672 23.195 2.221 1.00 2.65 H new ATOM 0 HE22 GLN A 85 25.351 24.931 2.172 1.00 2.65 H new ATOM 1285 N PRO A 86 25.190 19.972 -2.486 1.00 0.81 N ATOM 1286 CA PRO A 86 26.461 19.252 -2.647 1.00 0.79 C ATOM 1287 C PRO A 86 27.468 19.628 -1.569 1.00 0.77 C ATOM 1288 O PRO A 86 27.706 20.810 -1.316 1.00 0.85 O ATOM 1289 CB PRO A 86 26.966 19.690 -4.032 1.00 0.88 C ATOM 1290 CG PRO A 86 26.135 20.870 -4.404 1.00 1.08 C ATOM 1291 CD PRO A 86 24.819 20.691 -3.709 1.00 0.95 C ATOM 0 HA PRO A 86 26.329 18.174 -2.559 1.00 0.79 H new ATOM 0 HB2 PRO A 86 28.024 19.950 -4.000 1.00 0.88 H new ATOM 0 HB3 PRO A 86 26.857 18.887 -4.761 1.00 0.88 H new ATOM 0 HG2 PRO A 86 26.616 21.798 -4.094 1.00 1.08 H new ATOM 0 HG3 PRO A 86 26.000 20.926 -5.484 1.00 1.08 H new ATOM 0 HD2 PRO A 86 24.346 21.648 -3.488 1.00 0.95 H new ATOM 0 HD3 PRO A 86 24.116 20.120 -4.316 1.00 0.95 H new ATOM 1299 N ALA A 87 28.063 18.627 -0.943 1.00 0.84 N ATOM 1300 CA ALA A 87 28.953 18.872 0.172 1.00 0.93 C ATOM 1301 C ALA A 87 30.383 19.053 -0.308 1.00 0.90 C ATOM 1302 O ALA A 87 31.126 18.086 -0.477 1.00 0.98 O ATOM 1303 CB ALA A 87 28.862 17.733 1.175 1.00 1.10 C ATOM 0 H ALA A 87 27.945 17.644 -1.188 1.00 0.84 H new ATOM 0 HA ALA A 87 28.645 19.795 0.664 1.00 0.93 H new ATOM 0 HB1 ALA A 87 29.536 17.928 2.009 1.00 1.10 H new ATOM 0 HB2 ALA A 87 27.840 17.655 1.545 1.00 1.10 H new ATOM 0 HB3 ALA A 87 29.145 16.798 0.691 1.00 1.10 H new ATOM 1309 N VAL A 88 30.753 20.304 -0.539 1.00 0.87 N ATOM 1310 CA VAL A 88 32.102 20.656 -0.949 1.00 0.88 C ATOM 1311 C VAL A 88 32.498 21.953 -0.251 1.00 1.02 C ATOM 1312 O VAL A 88 31.782 22.950 -0.339 1.00 1.23 O ATOM 1313 CB VAL A 88 32.215 20.850 -2.480 1.00 0.81 C ATOM 1314 CG1 VAL A 88 33.669 20.909 -2.905 1.00 0.87 C ATOM 1315 CG2 VAL A 88 31.489 19.748 -3.240 1.00 0.94 C ATOM 0 H VAL A 88 30.126 21.103 -0.447 1.00 0.87 H new ATOM 0 HA VAL A 88 32.766 19.838 -0.671 1.00 0.88 H new ATOM 0 HB VAL A 88 31.736 21.798 -2.726 1.00 0.81 H new ATOM 0 HG11 VAL A 88 33.727 21.046 -3.985 1.00 0.87 H new ATOM 0 HG12 VAL A 88 34.160 21.745 -2.406 1.00 0.87 H new ATOM 0 HG13 VAL A 88 34.167 19.979 -2.630 1.00 0.87 H new ATOM 0 HG21 VAL A 88 31.590 19.918 -4.312 1.00 0.94 H new ATOM 0 HG22 VAL A 88 31.923 18.782 -2.983 1.00 0.94 H new ATOM 0 HG23 VAL A 88 30.433 19.755 -2.970 1.00 0.94 H new ATOM 1325 N LEU A 89 33.629 21.941 0.444 1.00 1.09 N ATOM 1326 CA LEU A 89 34.011 23.070 1.287 1.00 1.27 C ATOM 1327 C LEU A 89 34.567 24.231 0.455 1.00 1.15 C ATOM 1328 O LEU A 89 34.017 25.331 0.474 1.00 1.29 O ATOM 1329 CB LEU A 89 35.040 22.614 2.329 1.00 1.54 C ATOM 1330 CG LEU A 89 35.027 23.371 3.666 1.00 2.14 C ATOM 1331 CD1 LEU A 89 35.396 24.834 3.484 1.00 2.87 C ATOM 1332 CD2 LEU A 89 33.669 23.246 4.340 1.00 2.45 C ATOM 0 H LEU A 89 34.295 21.168 0.442 1.00 1.09 H new ATOM 0 HA LEU A 89 33.118 23.432 1.797 1.00 1.27 H new ATOM 0 HB2 LEU A 89 34.877 21.556 2.532 1.00 1.54 H new ATOM 0 HB3 LEU A 89 36.035 22.705 1.892 1.00 1.54 H new ATOM 0 HG LEU A 89 35.781 22.915 4.308 1.00 2.14 H new ATOM 0 HD11 LEU A 89 35.376 25.337 4.451 1.00 2.87 H new ATOM 0 HD12 LEU A 89 36.396 24.907 3.058 1.00 2.87 H new ATOM 0 HD13 LEU A 89 34.680 25.309 2.813 1.00 2.87 H new ATOM 0 HD21 LEU A 89 33.681 23.789 5.285 1.00 2.45 H new ATOM 0 HD22 LEU A 89 32.900 23.665 3.690 1.00 2.45 H new ATOM 0 HD23 LEU A 89 33.452 22.195 4.528 1.00 2.45 H new ATOM 1344 N GLU A 90 35.647 23.989 -0.277 1.00 1.05 N ATOM 1345 CA GLU A 90 36.285 25.057 -1.040 1.00 1.13 C ATOM 1346 C GLU A 90 35.723 25.138 -2.455 1.00 1.04 C ATOM 1347 O GLU A 90 35.217 26.180 -2.868 1.00 1.34 O ATOM 1348 CB GLU A 90 37.797 24.823 -1.102 1.00 1.30 C ATOM 1349 CG GLU A 90 38.485 24.899 0.251 1.00 1.98 C ATOM 1350 CD GLU A 90 38.466 26.294 0.840 1.00 2.31 C ATOM 1351 OE1 GLU A 90 37.833 26.487 1.903 1.00 2.59 O ATOM 1352 OE2 GLU A 90 39.081 27.204 0.245 1.00 2.84 O ATOM 0 H GLU A 90 36.095 23.077 -0.359 1.00 1.05 H new ATOM 0 HA GLU A 90 36.079 26.000 -0.534 1.00 1.13 H new ATOM 0 HB2 GLU A 90 37.986 23.843 -1.541 1.00 1.30 H new ATOM 0 HB3 GLU A 90 38.243 25.562 -1.768 1.00 1.30 H new ATOM 0 HG2 GLU A 90 37.997 24.211 0.941 1.00 1.98 H new ATOM 0 HG3 GLU A 90 39.518 24.567 0.148 1.00 1.98 H new ATOM 1359 N THR A 91 35.772 24.020 -3.168 1.00 0.84 N ATOM 1360 CA THR A 91 35.311 23.959 -4.551 1.00 0.77 C ATOM 1361 C THR A 91 35.696 22.618 -5.168 1.00 0.77 C ATOM 1362 O THR A 91 36.591 21.933 -4.666 1.00 0.95 O ATOM 1363 CB THR A 91 35.910 25.104 -5.409 1.00 0.81 C ATOM 1364 OG1 THR A 91 35.329 25.100 -6.720 1.00 1.42 O ATOM 1365 CG2 THR A 91 37.427 24.981 -5.528 1.00 1.41 C ATOM 0 H THR A 91 36.130 23.135 -2.808 1.00 0.84 H new ATOM 0 HA THR A 91 34.227 24.072 -4.540 1.00 0.77 H new ATOM 0 HB THR A 91 35.679 26.043 -4.907 1.00 0.81 H new ATOM 0 HG1 THR A 91 35.714 25.828 -7.251 1.00 1.42 H new ATOM 0 HG21 THR A 91 37.812 25.800 -6.136 1.00 1.41 H new ATOM 0 HG22 THR A 91 37.875 25.025 -4.535 1.00 1.41 H new ATOM 0 HG23 THR A 91 37.679 24.031 -5.998 1.00 1.41 H new ATOM 1373 N THR A 92 35.018 22.231 -6.236 1.00 0.69 N ATOM 1374 CA THR A 92 35.369 21.011 -6.937 1.00 0.73 C ATOM 1375 C THR A 92 36.141 21.349 -8.205 1.00 0.65 C ATOM 1376 O THR A 92 37.259 20.876 -8.409 1.00 0.69 O ATOM 1377 CB THR A 92 34.125 20.188 -7.302 1.00 0.81 C ATOM 1378 OG1 THR A 92 33.111 20.360 -6.299 1.00 1.30 O ATOM 1379 CG2 THR A 92 34.482 18.712 -7.421 1.00 0.82 C ATOM 0 H THR A 92 34.228 22.740 -6.633 1.00 0.69 H new ATOM 0 HA THR A 92 35.988 20.412 -6.270 1.00 0.73 H new ATOM 0 HB THR A 92 33.746 20.539 -8.262 1.00 0.81 H new ATOM 0 HG1 THR A 92 32.436 19.655 -6.392 1.00 1.30 H new ATOM 0 HG21 THR A 92 33.590 18.142 -7.680 1.00 0.82 H new ATOM 0 HG22 THR A 92 35.235 18.581 -8.198 1.00 0.82 H new ATOM 0 HG23 THR A 92 34.877 18.355 -6.470 1.00 0.82 H new ATOM 1387 N HIS A 93 35.542 22.192 -9.039 1.00 0.59 N ATOM 1388 CA HIS A 93 36.173 22.645 -10.271 1.00 0.54 C ATOM 1389 C HIS A 93 35.459 23.890 -10.784 1.00 0.49 C ATOM 1390 O HIS A 93 34.382 24.233 -10.298 1.00 0.63 O ATOM 1391 CB HIS A 93 36.172 21.544 -11.347 1.00 0.68 C ATOM 1392 CG HIS A 93 34.812 21.057 -11.751 1.00 0.62 C ATOM 1393 ND1 HIS A 93 34.107 21.575 -12.810 1.00 0.98 N ATOM 1394 CD2 HIS A 93 34.043 20.053 -11.249 1.00 0.72 C ATOM 1395 CE1 HIS A 93 32.966 20.886 -12.915 1.00 1.29 C ATOM 1396 NE2 HIS A 93 32.880 19.958 -11.997 1.00 1.10 N ATOM 0 H HIS A 93 34.611 22.578 -8.881 1.00 0.59 H new ATOM 0 HA HIS A 93 37.213 22.886 -10.052 1.00 0.54 H new ATOM 0 HB2 HIS A 93 36.685 21.921 -12.232 1.00 0.68 H new ATOM 0 HB3 HIS A 93 36.751 20.697 -10.980 1.00 0.68 H new ATOM 0 HD1 HIS A 93 34.401 22.347 -13.409 1.00 0.98 H new ATOM 0 HD2 HIS A 93 34.298 19.431 -10.404 1.00 0.72 H new ATOM 0 HE1 HIS A 93 32.210 21.072 -13.664 1.00 1.29 H new ATOM 1404 N ASN A 94 36.055 24.561 -11.757 1.00 0.45 N ATOM 1405 CA ASN A 94 35.451 25.758 -12.332 1.00 0.48 C ATOM 1406 C ASN A 94 35.079 25.510 -13.787 1.00 0.51 C ATOM 1407 O ASN A 94 35.226 24.391 -14.288 1.00 0.78 O ATOM 1408 CB ASN A 94 36.386 26.974 -12.215 1.00 0.57 C ATOM 1409 CG ASN A 94 37.683 26.815 -12.989 1.00 0.67 C ATOM 1410 OD1 ASN A 94 37.757 27.127 -14.176 1.00 1.36 O ATOM 1411 ND2 ASN A 94 38.723 26.359 -12.309 1.00 1.19 N ATOM 0 H ASN A 94 36.953 24.301 -12.165 1.00 0.45 H new ATOM 0 HA ASN A 94 34.546 25.983 -11.767 1.00 0.48 H new ATOM 0 HB2 ASN A 94 35.864 27.860 -12.574 1.00 0.57 H new ATOM 0 HB3 ASN A 94 36.618 27.145 -11.164 1.00 0.57 H new ATOM 0 HD21 ASN A 94 39.627 26.256 -12.769 1.00 1.19 H new ATOM 0 HD22 ASN A 94 38.620 26.111 -11.325 1.00 1.19 H new ATOM 1418 N GLY A 95 34.565 26.537 -14.447 1.00 0.45 N ATOM 1419 CA GLY A 95 34.198 26.414 -15.838 1.00 0.49 C ATOM 1420 C GLY A 95 33.711 27.726 -16.405 1.00 0.47 C ATOM 1421 O GLY A 95 33.642 28.730 -15.691 1.00 0.53 O ATOM 0 H GLY A 95 34.396 27.457 -14.040 1.00 0.45 H new ATOM 0 HA2 GLY A 95 35.057 26.066 -16.412 1.00 0.49 H new ATOM 0 HA3 GLY A 95 33.418 25.660 -15.943 1.00 0.49 H new ATOM 1425 N VAL A 96 33.368 27.721 -17.679 1.00 0.47 N ATOM 1426 CA VAL A 96 32.873 28.918 -18.336 1.00 0.48 C ATOM 1427 C VAL A 96 31.510 28.636 -18.970 1.00 0.45 C ATOM 1428 O VAL A 96 31.255 27.518 -19.420 1.00 0.43 O ATOM 1429 CB VAL A 96 33.884 29.426 -19.397 1.00 0.55 C ATOM 1430 CG1 VAL A 96 34.052 28.439 -20.541 1.00 1.21 C ATOM 1431 CG2 VAL A 96 33.482 30.787 -19.923 1.00 1.37 C ATOM 0 H VAL A 96 33.423 26.900 -18.282 1.00 0.47 H new ATOM 0 HA VAL A 96 32.756 29.704 -17.590 1.00 0.48 H new ATOM 0 HB VAL A 96 34.849 29.519 -18.899 1.00 0.55 H new ATOM 0 HG11 VAL A 96 34.769 28.835 -21.261 1.00 1.21 H new ATOM 0 HG12 VAL A 96 34.417 27.489 -20.151 1.00 1.21 H new ATOM 0 HG13 VAL A 96 33.091 28.285 -21.033 1.00 1.21 H new ATOM 0 HG21 VAL A 96 34.208 31.119 -20.665 1.00 1.37 H new ATOM 0 HG22 VAL A 96 32.496 30.722 -20.383 1.00 1.37 H new ATOM 0 HG23 VAL A 96 33.452 31.501 -19.100 1.00 1.37 H new ATOM 1441 N VAL A 97 30.627 29.630 -18.971 1.00 0.50 N ATOM 1442 CA VAL A 97 29.288 29.464 -19.534 1.00 0.53 C ATOM 1443 C VAL A 97 29.376 29.067 -21.008 1.00 0.60 C ATOM 1444 O VAL A 97 29.985 29.777 -21.809 1.00 0.67 O ATOM 1445 CB VAL A 97 28.451 30.757 -19.390 1.00 0.60 C ATOM 1446 CG1 VAL A 97 27.062 30.568 -19.980 1.00 0.69 C ATOM 1447 CG2 VAL A 97 28.360 31.171 -17.927 1.00 0.57 C ATOM 0 H VAL A 97 30.812 30.558 -18.589 1.00 0.50 H new ATOM 0 HA VAL A 97 28.791 28.671 -18.975 1.00 0.53 H new ATOM 0 HB VAL A 97 28.950 31.552 -19.944 1.00 0.60 H new ATOM 0 HG11 VAL A 97 26.491 31.489 -19.868 1.00 0.69 H new ATOM 0 HG12 VAL A 97 27.147 30.320 -21.038 1.00 0.69 H new ATOM 0 HG13 VAL A 97 26.552 29.759 -19.457 1.00 0.69 H new ATOM 0 HG21 VAL A 97 27.768 32.082 -17.843 1.00 0.57 H new ATOM 0 HG22 VAL A 97 27.885 30.376 -17.353 1.00 0.57 H new ATOM 0 HG23 VAL A 97 29.362 31.352 -17.537 1.00 0.57 H new ATOM 1457 N ALA A 98 28.765 27.933 -21.354 1.00 0.61 N ATOM 1458 CA ALA A 98 28.905 27.367 -22.690 1.00 0.70 C ATOM 1459 C ALA A 98 28.085 28.133 -23.720 1.00 0.83 C ATOM 1460 O ALA A 98 28.642 28.754 -24.625 1.00 0.89 O ATOM 1461 CB ALA A 98 28.521 25.895 -22.684 1.00 0.76 C ATOM 0 H ALA A 98 28.170 27.392 -20.727 1.00 0.61 H new ATOM 0 HA ALA A 98 29.952 27.457 -22.978 1.00 0.70 H new ATOM 0 HB1 ALA A 98 28.631 25.486 -23.689 1.00 0.76 H new ATOM 0 HB2 ALA A 98 29.172 25.352 -21.998 1.00 0.76 H new ATOM 0 HB3 ALA A 98 27.485 25.790 -22.361 1.00 0.76 H new ATOM 1467 N ARG A 99 26.767 28.081 -23.590 1.00 0.97 N ATOM 1468 CA ARG A 99 25.888 28.790 -24.504 1.00 1.17 C ATOM 1469 C ARG A 99 24.531 29.034 -23.852 1.00 1.38 C ATOM 1470 O ARG A 99 24.089 28.239 -23.021 1.00 1.41 O ATOM 1471 CB ARG A 99 25.712 28.009 -25.818 1.00 1.25 C ATOM 1472 CG ARG A 99 24.896 26.730 -25.694 1.00 1.85 C ATOM 1473 CD ARG A 99 24.738 26.051 -27.046 1.00 2.04 C ATOM 1474 NE ARG A 99 23.820 24.912 -26.992 1.00 2.61 N ATOM 1475 CZ ARG A 99 23.382 24.256 -28.064 1.00 2.99 C ATOM 1476 NH1 ARG A 99 23.828 24.573 -29.273 1.00 2.82 N ATOM 1477 NH2 ARG A 99 22.506 23.270 -27.924 1.00 3.92 N ATOM 0 H ARG A 99 26.285 27.555 -22.861 1.00 0.97 H new ATOM 0 HA ARG A 99 26.347 29.751 -24.737 1.00 1.17 H new ATOM 0 HB2 ARG A 99 25.233 28.660 -26.550 1.00 1.25 H new ATOM 0 HB3 ARG A 99 26.698 27.758 -26.210 1.00 1.25 H new ATOM 0 HG2 ARG A 99 25.384 26.049 -24.996 1.00 1.85 H new ATOM 0 HG3 ARG A 99 23.914 26.960 -25.281 1.00 1.85 H new ATOM 0 HD2 ARG A 99 24.372 26.776 -27.773 1.00 2.04 H new ATOM 0 HD3 ARG A 99 25.713 25.713 -27.396 1.00 2.04 H new ATOM 0 HE ARG A 99 23.496 24.602 -26.076 1.00 2.61 H new ATOM 0 HH11 ARG A 99 24.510 25.323 -29.384 1.00 2.82 H new ATOM 0 HH12 ARG A 99 23.489 24.067 -30.091 1.00 2.82 H new ATOM 0 HH21 ARG A 99 22.169 23.015 -26.996 1.00 3.92 H new ATOM 0 HH22 ARG A 99 22.169 22.766 -28.745 1.00 3.92 H new ATOM 1688 N ALA A 112 17.870 24.100 -18.831 1.00 1.24 N ATOM 1689 CA ALA A 112 18.380 24.487 -17.524 1.00 1.02 C ATOM 1690 C ALA A 112 19.688 25.262 -17.656 1.00 0.97 C ATOM 1691 O ALA A 112 20.118 25.927 -16.719 1.00 1.15 O ATOM 1692 CB ALA A 112 18.569 23.260 -16.648 1.00 1.06 C ATOM 0 HA ALA A 112 17.649 25.142 -17.051 1.00 1.02 H new ATOM 0 HB1 ALA A 112 18.951 23.564 -15.673 1.00 1.06 H new ATOM 0 HB2 ALA A 112 17.613 22.753 -16.521 1.00 1.06 H new ATOM 0 HB3 ALA A 112 19.279 22.582 -17.120 1.00 1.06 H new ATOM 1698 N GLY A 113 20.305 25.181 -18.832 1.00 0.94 N ATOM 1699 CA GLY A 113 21.537 25.903 -19.089 1.00 0.89 C ATOM 1700 C GLY A 113 22.767 25.041 -18.864 1.00 0.79 C ATOM 1701 O GLY A 113 22.792 24.220 -17.945 1.00 0.83 O ATOM 0 H GLY A 113 19.969 24.623 -19.617 1.00 0.94 H new ATOM 0 HA2 GLY A 113 21.534 26.268 -20.116 1.00 0.89 H new ATOM 0 HA3 GLY A 113 21.585 26.778 -18.440 1.00 0.89 H new ATOM 1705 N LEU A 114 23.805 25.237 -19.676 1.00 0.73 N ATOM 1706 CA LEU A 114 24.983 24.384 -19.611 1.00 0.66 C ATOM 1707 C LEU A 114 26.270 25.190 -19.504 1.00 0.58 C ATOM 1708 O LEU A 114 26.407 26.275 -20.081 1.00 0.63 O ATOM 1709 CB LEU A 114 25.054 23.463 -20.831 1.00 0.74 C ATOM 1710 CG LEU A 114 24.082 22.278 -20.823 1.00 0.83 C ATOM 1711 CD1 LEU A 114 24.146 21.528 -22.140 1.00 0.93 C ATOM 1712 CD2 LEU A 114 24.409 21.329 -19.685 1.00 0.80 C ATOM 0 H LEU A 114 23.851 25.974 -20.380 1.00 0.73 H new ATOM 0 HA LEU A 114 24.886 23.783 -18.707 1.00 0.66 H new ATOM 0 HB2 LEU A 114 24.866 24.058 -21.725 1.00 0.74 H new ATOM 0 HB3 LEU A 114 26.070 23.076 -20.913 1.00 0.74 H new ATOM 0 HG LEU A 114 23.074 22.670 -20.684 1.00 0.83 H new ATOM 0 HD11 LEU A 114 23.449 20.690 -22.116 1.00 0.93 H new ATOM 0 HD12 LEU A 114 23.877 22.200 -22.955 1.00 0.93 H new ATOM 0 HD13 LEU A 114 25.158 21.154 -22.297 1.00 0.93 H new ATOM 0 HD21 LEU A 114 23.709 20.494 -19.695 1.00 0.80 H new ATOM 0 HD22 LEU A 114 25.425 20.952 -19.806 1.00 0.80 H new ATOM 0 HD23 LEU A 114 24.329 21.858 -18.735 1.00 0.80 H new ATOM 1724 N ILE A 115 27.205 24.629 -18.759 1.00 0.49 N ATOM 1725 CA ILE A 115 28.521 25.203 -18.557 1.00 0.42 C ATOM 1726 C ILE A 115 29.563 24.215 -19.064 1.00 0.43 C ATOM 1727 O ILE A 115 29.440 23.008 -18.833 1.00 0.47 O ATOM 1728 CB ILE A 115 28.769 25.481 -17.056 1.00 0.34 C ATOM 1729 CG1 ILE A 115 27.631 26.323 -16.483 1.00 0.36 C ATOM 1730 CG2 ILE A 115 30.106 26.177 -16.838 1.00 0.31 C ATOM 1731 CD1 ILE A 115 27.638 26.408 -14.974 1.00 0.28 C ATOM 0 H ILE A 115 27.067 23.745 -18.269 1.00 0.49 H new ATOM 0 HA ILE A 115 28.590 26.146 -19.100 1.00 0.42 H new ATOM 0 HB ILE A 115 28.801 24.525 -16.534 1.00 0.34 H new ATOM 0 HG12 ILE A 115 27.693 27.330 -16.895 1.00 0.36 H new ATOM 0 HG13 ILE A 115 26.680 25.903 -16.810 1.00 0.36 H new ATOM 0 HG21 ILE A 115 30.252 26.359 -15.773 1.00 0.31 H new ATOM 0 HG22 ILE A 115 30.911 25.544 -17.212 1.00 0.31 H new ATOM 0 HG23 ILE A 115 30.113 27.127 -17.373 1.00 0.31 H new ATOM 0 HD11 ILE A 115 26.801 27.022 -14.640 1.00 0.28 H new ATOM 0 HD12 ILE A 115 27.544 25.407 -14.553 1.00 0.28 H new ATOM 0 HD13 ILE A 115 28.573 26.857 -14.639 1.00 0.28 H new ATOM 1743 N GLU A 116 30.573 24.702 -19.764 1.00 0.43 N ATOM 1744 CA GLU A 116 31.609 23.823 -20.265 1.00 0.47 C ATOM 1745 C GLU A 116 32.738 23.698 -19.252 1.00 0.45 C ATOM 1746 O GLU A 116 33.308 24.694 -18.795 1.00 0.49 O ATOM 1747 CB GLU A 116 32.128 24.273 -21.632 1.00 0.54 C ATOM 1748 CG GLU A 116 32.484 25.742 -21.726 1.00 0.84 C ATOM 1749 CD GLU A 116 32.926 26.134 -23.120 1.00 1.03 C ATOM 1750 OE1 GLU A 116 34.150 26.203 -23.361 1.00 1.14 O ATOM 1751 OE2 GLU A 116 32.058 26.389 -23.978 1.00 1.40 O ATOM 0 H GLU A 116 30.695 25.688 -19.995 1.00 0.43 H new ATOM 0 HA GLU A 116 31.168 22.836 -20.407 1.00 0.47 H new ATOM 0 HB2 GLU A 116 33.010 23.683 -21.882 1.00 0.54 H new ATOM 0 HB3 GLU A 116 31.371 24.048 -22.384 1.00 0.54 H new ATOM 0 HG2 GLU A 116 31.621 26.343 -21.438 1.00 0.84 H new ATOM 0 HG3 GLU A 116 33.281 25.967 -21.017 1.00 0.84 H new ATOM 1758 N ILE A 117 33.033 22.458 -18.897 1.00 0.47 N ATOM 1759 CA ILE A 117 33.993 22.147 -17.851 1.00 0.50 C ATOM 1760 C ILE A 117 35.363 21.885 -18.450 1.00 0.56 C ATOM 1761 O ILE A 117 35.473 21.199 -19.467 1.00 0.63 O ATOM 1762 CB ILE A 117 33.542 20.888 -17.088 1.00 0.53 C ATOM 1763 CG1 ILE A 117 32.121 21.081 -16.590 1.00 0.48 C ATOM 1764 CG2 ILE A 117 34.472 20.568 -15.925 1.00 0.60 C ATOM 1765 CD1 ILE A 117 31.950 22.304 -15.721 1.00 0.41 C ATOM 0 H ILE A 117 32.611 21.635 -19.328 1.00 0.47 H new ATOM 0 HA ILE A 117 34.049 22.998 -17.173 1.00 0.50 H new ATOM 0 HB ILE A 117 33.579 20.042 -17.774 1.00 0.53 H new ATOM 0 HG12 ILE A 117 31.451 21.157 -17.446 1.00 0.48 H new ATOM 0 HG13 ILE A 117 31.819 20.199 -16.026 1.00 0.48 H new ATOM 0 HG21 ILE A 117 34.119 19.673 -15.413 1.00 0.60 H new ATOM 0 HG22 ILE A 117 35.480 20.397 -16.302 1.00 0.60 H new ATOM 0 HG23 ILE A 117 34.483 21.405 -15.227 1.00 0.60 H new ATOM 0 HD11 ILE A 117 30.911 22.380 -15.401 1.00 0.41 H new ATOM 0 HD12 ILE A 117 32.594 22.221 -14.846 1.00 0.41 H new ATOM 0 HD13 ILE A 117 32.221 23.194 -16.288 1.00 0.41 H new ATOM 1777 N LEU A 118 36.397 22.425 -17.829 1.00 0.61 N ATOM 1778 CA LEU A 118 37.758 22.138 -18.246 1.00 0.70 C ATOM 1779 C LEU A 118 38.363 21.100 -17.309 1.00 0.79 C ATOM 1780 O LEU A 118 38.053 21.086 -16.117 1.00 0.88 O ATOM 1781 CB LEU A 118 38.628 23.409 -18.279 1.00 0.84 C ATOM 1782 CG LEU A 118 39.081 23.983 -16.925 1.00 0.96 C ATOM 1783 CD1 LEU A 118 40.080 25.109 -17.146 1.00 1.15 C ATOM 1784 CD2 LEU A 118 37.900 24.495 -16.115 1.00 1.21 C ATOM 0 H LEU A 118 36.321 23.063 -17.037 1.00 0.61 H new ATOM 0 HA LEU A 118 37.730 21.744 -19.262 1.00 0.70 H new ATOM 0 HB2 LEU A 118 39.518 23.195 -18.870 1.00 0.84 H new ATOM 0 HB3 LEU A 118 38.074 24.185 -18.807 1.00 0.84 H new ATOM 0 HG LEU A 118 39.555 23.179 -16.362 1.00 0.96 H new ATOM 0 HD11 LEU A 118 40.396 25.510 -16.183 1.00 1.15 H new ATOM 0 HD12 LEU A 118 40.948 24.725 -17.681 1.00 1.15 H new ATOM 0 HD13 LEU A 118 39.613 25.900 -17.733 1.00 1.15 H new ATOM 0 HD21 LEU A 118 38.256 24.893 -15.165 1.00 1.21 H new ATOM 0 HD22 LEU A 118 37.392 25.283 -16.671 1.00 1.21 H new ATOM 0 HD23 LEU A 118 37.205 23.676 -15.928 1.00 1.21 H new ATOM 1796 N ASP A 119 39.191 20.217 -17.853 1.00 0.83 N ATOM 1797 CA ASP A 119 39.850 19.180 -17.060 1.00 0.95 C ATOM 1798 C ASP A 119 40.832 19.796 -16.056 1.00 1.01 C ATOM 1799 O ASP A 119 41.161 20.979 -16.146 1.00 0.98 O ATOM 1800 CB ASP A 119 40.563 18.196 -18.000 1.00 1.05 C ATOM 1801 CG ASP A 119 41.468 17.225 -17.276 1.00 1.65 C ATOM 1802 OD1 ASP A 119 40.945 16.232 -16.736 1.00 2.29 O ATOM 1803 OD2 ASP A 119 42.700 17.426 -17.278 1.00 2.22 O ATOM 0 H ASP A 119 39.425 20.196 -18.846 1.00 0.83 H new ATOM 0 HA ASP A 119 39.098 18.639 -16.486 1.00 0.95 H new ATOM 0 HB2 ASP A 119 39.816 17.635 -18.562 1.00 1.05 H new ATOM 0 HB3 ASP A 119 41.151 18.759 -18.725 1.00 1.05 H new ATOM 1808 N GLU A 120 41.296 18.987 -15.106 1.00 1.17 N ATOM 1809 CA GLU A 120 42.197 19.445 -14.057 1.00 1.32 C ATOM 1810 C GLU A 120 43.502 19.995 -14.638 1.00 1.33 C ATOM 1811 O GLU A 120 44.121 20.884 -14.051 1.00 1.44 O ATOM 1812 CB GLU A 120 42.487 18.301 -13.077 1.00 1.55 C ATOM 1813 CG GLU A 120 43.107 17.079 -13.732 1.00 1.63 C ATOM 1814 CD GLU A 120 43.317 15.936 -12.766 1.00 1.96 C ATOM 1815 OE1 GLU A 120 44.282 15.984 -11.976 1.00 1.89 O ATOM 1816 OE2 GLU A 120 42.523 14.973 -12.798 1.00 2.78 O ATOM 0 H GLU A 120 41.057 17.997 -15.044 1.00 1.17 H new ATOM 0 HA GLU A 120 41.706 20.258 -13.522 1.00 1.32 H new ATOM 0 HB2 GLU A 120 43.157 18.663 -12.297 1.00 1.55 H new ATOM 0 HB3 GLU A 120 41.558 18.008 -12.589 1.00 1.55 H new ATOM 0 HG2 GLU A 120 42.465 16.745 -14.548 1.00 1.63 H new ATOM 0 HG3 GLU A 120 44.065 17.356 -14.173 1.00 1.63 H new ATOM 1823 N LEU A 121 43.918 19.480 -15.793 1.00 1.28 N ATOM 1824 CA LEU A 121 45.129 19.974 -16.440 1.00 1.34 C ATOM 1825 C LEU A 121 44.800 21.132 -17.379 1.00 1.21 C ATOM 1826 O LEU A 121 45.671 21.632 -18.094 1.00 1.27 O ATOM 1827 CB LEU A 121 45.859 18.859 -17.203 1.00 1.45 C ATOM 1828 CG LEU A 121 46.392 17.695 -16.350 1.00 1.65 C ATOM 1829 CD1 LEU A 121 46.718 18.155 -14.936 1.00 1.77 C ATOM 1830 CD2 LEU A 121 45.400 16.543 -16.321 1.00 1.65 C ATOM 0 H LEU A 121 43.441 18.730 -16.294 1.00 1.28 H new ATOM 0 HA LEU A 121 45.797 20.333 -15.657 1.00 1.34 H new ATOM 0 HB2 LEU A 121 45.179 18.453 -17.952 1.00 1.45 H new ATOM 0 HB3 LEU A 121 46.697 19.303 -17.741 1.00 1.45 H new ATOM 0 HG LEU A 121 47.314 17.341 -16.812 1.00 1.65 H new ATOM 0 HD11 LEU A 121 47.092 17.311 -14.356 1.00 1.77 H new ATOM 0 HD12 LEU A 121 47.478 18.936 -14.973 1.00 1.77 H new ATOM 0 HD13 LEU A 121 45.817 18.548 -14.464 1.00 1.77 H new ATOM 0 HD21 LEU A 121 45.801 15.733 -15.711 1.00 1.65 H new ATOM 0 HD22 LEU A 121 44.457 16.885 -15.895 1.00 1.65 H new ATOM 0 HD23 LEU A 121 45.230 16.183 -17.336 1.00 1.65 H new ATOM 1842 N ARG A 122 43.538 21.553 -17.340 1.00 1.11 N ATOM 1843 CA ARG A 122 43.038 22.687 -18.113 1.00 1.08 C ATOM 1844 C ARG A 122 42.988 22.377 -19.605 1.00 1.13 C ATOM 1845 O ARG A 122 43.932 22.637 -20.350 1.00 1.46 O ATOM 1846 CB ARG A 122 43.850 23.955 -17.826 1.00 1.24 C ATOM 1847 CG ARG A 122 43.689 24.458 -16.401 1.00 1.80 C ATOM 1848 CD ARG A 122 44.509 25.710 -16.147 1.00 2.04 C ATOM 1849 NE ARG A 122 45.945 25.430 -16.089 1.00 2.50 N ATOM 1850 CZ ARG A 122 46.842 26.270 -15.581 1.00 3.32 C ATOM 1851 NH1 ARG A 122 46.460 27.455 -15.117 1.00 3.73 N ATOM 1852 NH2 ARG A 122 48.123 25.920 -15.525 1.00 4.14 N ATOM 0 H ARG A 122 42.824 21.110 -16.762 1.00 1.11 H new ATOM 0 HA ARG A 122 42.013 22.873 -17.793 1.00 1.08 H new ATOM 0 HB2 ARG A 122 44.904 23.755 -18.017 1.00 1.24 H new ATOM 0 HB3 ARG A 122 43.544 24.739 -18.518 1.00 1.24 H new ATOM 0 HG2 ARG A 122 42.637 24.667 -16.206 1.00 1.80 H new ATOM 0 HG3 ARG A 122 43.993 23.677 -15.704 1.00 1.80 H new ATOM 0 HD2 ARG A 122 44.314 26.436 -16.936 1.00 2.04 H new ATOM 0 HD3 ARG A 122 44.192 26.166 -15.209 1.00 2.04 H new ATOM 0 HE ARG A 122 46.276 24.539 -16.460 1.00 2.50 H new ATOM 0 HH11 ARG A 122 45.476 27.723 -15.150 1.00 3.73 H new ATOM 0 HH12 ARG A 122 47.150 28.097 -14.728 1.00 3.73 H new ATOM 0 HH21 ARG A 122 48.418 25.007 -15.872 1.00 4.14 H new ATOM 0 HH22 ARG A 122 48.811 26.564 -15.135 1.00 4.14 H new ATOM 1866 N THR A 123 41.870 21.801 -20.018 1.00 1.08 N ATOM 1867 CA THR A 123 41.625 21.469 -21.410 1.00 1.20 C ATOM 1868 C THR A 123 40.446 22.285 -21.932 1.00 1.15 C ATOM 1869 O THR A 123 40.113 23.336 -21.376 1.00 1.38 O ATOM 1870 CB THR A 123 41.306 19.968 -21.557 1.00 1.40 C ATOM 1871 OG1 THR A 123 40.155 19.640 -20.760 1.00 1.86 O ATOM 1872 CG2 THR A 123 42.492 19.108 -21.134 1.00 1.87 C ATOM 0 H THR A 123 41.104 21.550 -19.393 1.00 1.08 H new ATOM 0 HA THR A 123 42.521 21.701 -21.986 1.00 1.20 H new ATOM 0 HB THR A 123 41.097 19.762 -22.607 1.00 1.40 H new ATOM 0 HG1 THR A 123 39.349 20.000 -21.185 1.00 1.86 H new ATOM 0 HG21 THR A 123 42.237 18.055 -21.249 1.00 1.87 H new ATOM 0 HG22 THR A 123 43.353 19.343 -21.759 1.00 1.87 H new ATOM 0 HG23 THR A 123 42.735 19.311 -20.091 1.00 1.87 H new ATOM 1880 N THR A 124 39.833 21.811 -23.006 1.00 1.01 N ATOM 1881 CA THR A 124 38.586 22.374 -23.483 1.00 1.03 C ATOM 1882 C THR A 124 37.409 21.727 -22.755 1.00 0.89 C ATOM 1883 O THR A 124 37.585 21.114 -21.696 1.00 0.85 O ATOM 1884 CB THR A 124 38.447 22.163 -25.003 1.00 1.26 C ATOM 1885 OG1 THR A 124 38.854 20.833 -25.350 1.00 1.54 O ATOM 1886 CG2 THR A 124 39.283 23.171 -25.770 1.00 1.53 C ATOM 0 H THR A 124 40.184 21.033 -23.564 1.00 1.01 H new ATOM 0 HA THR A 124 38.586 23.445 -23.279 1.00 1.03 H new ATOM 0 HB THR A 124 37.401 22.306 -25.273 1.00 1.26 H new ATOM 0 HG1 THR A 124 38.762 20.705 -26.317 1.00 1.54 H new ATOM 0 HG21 THR A 124 39.167 23.000 -26.840 1.00 1.53 H new ATOM 0 HG22 THR A 124 38.951 24.180 -25.525 1.00 1.53 H new ATOM 0 HG23 THR A 124 40.332 23.058 -25.496 1.00 1.53 H new ATOM 1894 N VAL A 125 36.220 21.856 -23.325 1.00 0.90 N ATOM 1895 CA VAL A 125 35.014 21.297 -22.733 1.00 0.82 C ATOM 1896 C VAL A 125 35.075 19.769 -22.683 1.00 0.86 C ATOM 1897 O VAL A 125 35.228 19.104 -23.713 1.00 0.96 O ATOM 1898 CB VAL A 125 33.751 21.751 -23.510 1.00 0.82 C ATOM 1899 CG1 VAL A 125 33.892 21.474 -25.000 1.00 1.17 C ATOM 1900 CG2 VAL A 125 32.504 21.075 -22.960 1.00 1.29 C ATOM 0 H VAL A 125 36.064 22.348 -24.205 1.00 0.90 H new ATOM 0 HA VAL A 125 34.951 21.672 -21.712 1.00 0.82 H new ATOM 0 HB VAL A 125 33.649 22.828 -23.374 1.00 0.82 H new ATOM 0 HG11 VAL A 125 32.991 21.803 -25.518 1.00 1.17 H new ATOM 0 HG12 VAL A 125 34.754 22.015 -25.391 1.00 1.17 H new ATOM 0 HG13 VAL A 125 34.032 20.405 -25.160 1.00 1.17 H new ATOM 0 HG21 VAL A 125 31.631 21.409 -23.521 1.00 1.29 H new ATOM 0 HG22 VAL A 125 32.604 19.994 -23.055 1.00 1.29 H new ATOM 0 HG23 VAL A 125 32.382 21.337 -21.909 1.00 1.29 H new ATOM 1910 N ILE A 126 34.986 19.221 -21.473 1.00 0.82 N ATOM 1911 CA ILE A 126 34.983 17.774 -21.292 1.00 0.90 C ATOM 1912 C ILE A 126 33.690 17.175 -21.833 1.00 0.93 C ATOM 1913 O ILE A 126 33.702 16.447 -22.824 1.00 1.03 O ATOM 1914 CB ILE A 126 35.104 17.390 -19.802 1.00 0.89 C ATOM 1915 CG1 ILE A 126 36.341 18.029 -19.173 1.00 0.87 C ATOM 1916 CG2 ILE A 126 35.154 15.876 -19.641 1.00 1.00 C ATOM 1917 CD1 ILE A 126 36.402 17.848 -17.674 1.00 0.87 C ATOM 0 H ILE A 126 34.915 19.756 -20.607 1.00 0.82 H new ATOM 0 HA ILE A 126 35.842 17.382 -21.836 1.00 0.90 H new ATOM 0 HB ILE A 126 34.222 17.767 -19.285 1.00 0.89 H new ATOM 0 HG12 ILE A 126 37.235 17.596 -19.622 1.00 0.87 H new ATOM 0 HG13 ILE A 126 36.351 19.094 -19.405 1.00 0.87 H new ATOM 0 HG21 ILE A 126 35.239 15.625 -18.584 1.00 1.00 H new ATOM 0 HG22 ILE A 126 34.242 15.437 -20.046 1.00 1.00 H new ATOM 0 HG23 ILE A 126 36.016 15.481 -20.178 1.00 1.00 H new ATOM 0 HD11 ILE A 126 37.303 18.324 -17.286 1.00 0.87 H new ATOM 0 HD12 ILE A 126 35.525 18.305 -17.216 1.00 0.87 H new ATOM 0 HD13 ILE A 126 36.422 16.784 -17.436 1.00 0.87 H new ATOM 1929 N SER A 127 32.574 17.485 -21.182 1.00 0.87 N ATOM 1930 CA SER A 127 31.282 17.051 -21.677 1.00 0.92 C ATOM 1931 C SER A 127 30.268 18.197 -21.666 1.00 0.84 C ATOM 1932 O SER A 127 30.108 18.907 -22.659 1.00 0.85 O ATOM 1933 CB SER A 127 30.790 15.870 -20.832 1.00 0.99 C ATOM 1934 OG SER A 127 30.778 16.203 -19.450 1.00 1.56 O ATOM 0 H SER A 127 32.542 18.029 -20.320 1.00 0.87 H new ATOM 0 HA SER A 127 31.389 16.731 -22.713 1.00 0.92 H new ATOM 0 HB2 SER A 127 29.787 15.584 -21.150 1.00 0.99 H new ATOM 0 HB3 SER A 127 31.435 15.007 -20.996 1.00 0.99 H new ATOM 0 HG SER A 127 30.459 15.435 -18.931 1.00 1.56 H new ATOM 1940 N GLN A 128 29.612 18.376 -20.522 1.00 0.79 N ATOM 1941 CA GLN A 128 28.659 19.457 -20.305 1.00 0.74 C ATOM 1942 C GLN A 128 28.129 19.395 -18.874 1.00 0.69 C ATOM 1943 O GLN A 128 27.708 18.331 -18.418 1.00 0.73 O ATOM 1944 CB GLN A 128 27.508 19.383 -21.321 1.00 0.86 C ATOM 1945 CG GLN A 128 26.844 18.018 -21.410 1.00 1.02 C ATOM 1946 CD GLN A 128 25.975 17.875 -22.645 1.00 1.43 C ATOM 1947 OE1 GLN A 128 24.776 18.150 -22.619 1.00 2.08 O ATOM 1948 NE2 GLN A 128 26.583 17.450 -23.741 1.00 1.88 N ATOM 0 H GLN A 128 29.730 17.767 -19.712 1.00 0.79 H new ATOM 0 HA GLN A 128 29.166 20.411 -20.451 1.00 0.74 H new ATOM 0 HB2 GLN A 128 26.755 20.125 -21.055 1.00 0.86 H new ATOM 0 HB3 GLN A 128 27.889 19.655 -22.306 1.00 0.86 H new ATOM 0 HG2 GLN A 128 27.611 17.244 -21.418 1.00 1.02 H new ATOM 0 HG3 GLN A 128 26.236 17.855 -20.520 1.00 1.02 H new ATOM 0 HE21 GLN A 128 27.579 17.233 -23.720 1.00 1.88 H new ATOM 0 HE22 GLN A 128 26.055 17.340 -24.607 1.00 1.88 H new ATOM 1957 N HIS A 129 28.167 20.506 -18.151 1.00 0.63 N ATOM 1958 CA HIS A 129 27.597 20.533 -16.809 1.00 0.60 C ATOM 1959 C HIS A 129 26.437 21.495 -16.754 1.00 0.58 C ATOM 1960 O HIS A 129 26.541 22.641 -17.174 1.00 0.54 O ATOM 1961 CB HIS A 129 28.625 20.896 -15.733 1.00 0.54 C ATOM 1962 CG HIS A 129 29.514 19.758 -15.327 1.00 0.58 C ATOM 1963 ND1 HIS A 129 29.918 18.668 -16.028 1.00 0.58 N flip ATOM 1964 CD2 HIS A 129 30.111 19.656 -14.091 1.00 0.65 C flip ATOM 1965 CE1 HIS A 129 30.760 17.897 -15.230 1.00 0.65 C flip ATOM 1966 NE2 HIS A 129 30.844 18.534 -14.078 1.00 0.68 N flip ATOM 0 H HIS A 129 28.578 21.386 -18.463 1.00 0.63 H new ATOM 0 HA HIS A 129 27.251 19.522 -16.595 1.00 0.60 H new ATOM 0 HB2 HIS A 129 29.245 21.714 -16.099 1.00 0.54 H new ATOM 0 HB3 HIS A 129 28.099 21.264 -14.852 1.00 0.54 H new ATOM 0 HD2 HIS A 129 30.007 20.356 -13.276 1.00 0.65 H new ATOM 0 HE1 HIS A 129 31.244 16.970 -15.499 1.00 0.65 H new ATOM 0 HE2 HIS A 129 31.395 18.214 -13.281 1.00 0.68 H new ATOM 1974 N GLU A 130 25.339 21.011 -16.229 1.00 0.64 N ATOM 1975 CA GLU A 130 24.099 21.755 -16.218 1.00 0.64 C ATOM 1976 C GLU A 130 23.928 22.460 -14.880 1.00 0.56 C ATOM 1977 O GLU A 130 24.417 21.981 -13.856 1.00 0.54 O ATOM 1978 CB GLU A 130 22.973 20.761 -16.469 1.00 0.77 C ATOM 1979 CG GLU A 130 21.776 21.318 -17.206 1.00 0.82 C ATOM 1980 CD GLU A 130 20.854 20.209 -17.649 1.00 0.98 C ATOM 1981 OE1 GLU A 130 21.023 19.720 -18.786 1.00 1.18 O ATOM 1982 OE2 GLU A 130 19.990 19.793 -16.843 1.00 1.19 O ATOM 0 H GLU A 130 25.277 20.089 -15.796 1.00 0.64 H new ATOM 0 HA GLU A 130 24.093 22.524 -16.990 1.00 0.64 H new ATOM 0 HB2 GLU A 130 23.371 19.921 -17.038 1.00 0.77 H new ATOM 0 HB3 GLU A 130 22.638 20.366 -15.510 1.00 0.77 H new ATOM 0 HG2 GLU A 130 21.235 22.010 -16.560 1.00 0.82 H new ATOM 0 HG3 GLU A 130 22.110 21.887 -18.073 1.00 0.82 H new ATOM 1989 N PHE A 131 23.259 23.599 -14.882 1.00 0.53 N ATOM 1990 CA PHE A 131 23.032 24.327 -13.646 1.00 0.46 C ATOM 1991 C PHE A 131 21.544 24.435 -13.351 1.00 0.51 C ATOM 1992 O PHE A 131 20.715 23.957 -14.119 1.00 0.74 O ATOM 1993 CB PHE A 131 23.700 25.711 -13.652 1.00 0.42 C ATOM 1994 CG PHE A 131 23.346 26.606 -14.807 1.00 0.48 C ATOM 1995 CD1 PHE A 131 22.168 27.331 -14.814 1.00 0.60 C ATOM 1996 CD2 PHE A 131 24.216 26.747 -15.871 1.00 0.46 C ATOM 1997 CE1 PHE A 131 21.867 28.177 -15.865 1.00 0.70 C ATOM 1998 CE2 PHE A 131 23.921 27.587 -16.926 1.00 0.56 C ATOM 1999 CZ PHE A 131 22.744 28.304 -16.922 1.00 0.68 C ATOM 0 H PHE A 131 22.867 24.036 -15.716 1.00 0.53 H new ATOM 0 HA PHE A 131 23.502 23.757 -12.845 1.00 0.46 H new ATOM 0 HB2 PHE A 131 23.438 26.224 -12.727 1.00 0.42 H new ATOM 0 HB3 PHE A 131 24.781 25.571 -13.644 1.00 0.42 H new ATOM 0 HD1 PHE A 131 21.476 27.235 -13.990 1.00 0.60 H new ATOM 0 HD2 PHE A 131 25.142 26.191 -15.877 1.00 0.46 H new ATOM 0 HE1 PHE A 131 20.945 28.739 -15.858 1.00 0.70 H new ATOM 0 HE2 PHE A 131 24.610 27.682 -17.752 1.00 0.56 H new ATOM 0 HZ PHE A 131 22.509 28.964 -17.744 1.00 0.68 H new ATOM 2009 N GLY A 132 21.222 25.029 -12.215 1.00 0.48 N ATOM 2010 CA GLY A 132 19.847 25.121 -11.779 1.00 0.51 C ATOM 2011 C GLY A 132 19.509 26.503 -11.274 1.00 0.50 C ATOM 2012 O GLY A 132 20.396 27.228 -10.840 1.00 0.47 O ATOM 0 H GLY A 132 21.898 25.454 -11.580 1.00 0.48 H new ATOM 0 HA2 GLY A 132 19.186 24.865 -12.607 1.00 0.51 H new ATOM 0 HA3 GLY A 132 19.667 24.392 -10.989 1.00 0.51 H new ATOM 2016 N ILE A 133 18.242 26.883 -11.368 1.00 0.54 N ATOM 2017 CA ILE A 133 17.776 28.190 -10.896 1.00 0.55 C ATOM 2018 C ILE A 133 18.185 28.452 -9.438 1.00 0.54 C ATOM 2019 O ILE A 133 18.378 29.598 -9.032 1.00 0.56 O ATOM 2020 CB ILE A 133 16.241 28.305 -11.040 1.00 0.60 C ATOM 2021 CG1 ILE A 133 15.771 29.734 -10.750 1.00 0.64 C ATOM 2022 CG2 ILE A 133 15.526 27.310 -10.137 1.00 0.61 C ATOM 2023 CD1 ILE A 133 16.155 30.733 -11.820 1.00 0.67 C ATOM 0 H ILE A 133 17.508 26.301 -11.771 1.00 0.54 H new ATOM 0 HA ILE A 133 18.254 28.946 -11.519 1.00 0.55 H new ATOM 0 HB ILE A 133 15.986 28.064 -12.072 1.00 0.60 H new ATOM 0 HG12 ILE A 133 14.687 29.734 -10.638 1.00 0.64 H new ATOM 0 HG13 ILE A 133 16.190 30.058 -9.797 1.00 0.64 H new ATOM 0 HG21 ILE A 133 14.448 27.415 -10.261 1.00 0.61 H new ATOM 0 HG22 ILE A 133 15.825 26.296 -10.404 1.00 0.61 H new ATOM 0 HG23 ILE A 133 15.793 27.505 -9.098 1.00 0.61 H new ATOM 0 HD11 ILE A 133 15.788 31.721 -11.544 1.00 0.67 H new ATOM 0 HD12 ILE A 133 17.240 30.763 -11.917 1.00 0.67 H new ATOM 0 HD13 ILE A 133 15.714 30.435 -12.771 1.00 0.67 H new ATOM 2035 N THR A 134 18.322 27.382 -8.666 1.00 0.57 N ATOM 2036 CA THR A 134 18.759 27.474 -7.282 1.00 0.61 C ATOM 2037 C THR A 134 20.267 27.688 -7.213 1.00 0.57 C ATOM 2038 O THR A 134 20.778 28.365 -6.323 1.00 0.61 O ATOM 2039 CB THR A 134 18.389 26.185 -6.534 1.00 0.71 C ATOM 2040 OG1 THR A 134 18.759 25.048 -7.330 1.00 1.35 O ATOM 2041 CG2 THR A 134 16.901 26.142 -6.246 1.00 0.86 C ATOM 0 H THR A 134 18.134 26.430 -8.981 1.00 0.57 H new ATOM 0 HA THR A 134 18.260 28.323 -6.815 1.00 0.61 H new ATOM 0 HB THR A 134 18.927 26.163 -5.586 1.00 0.71 H new ATOM 0 HG1 THR A 134 18.006 24.423 -7.378 1.00 1.35 H new ATOM 0 HG21 THR A 134 16.660 25.221 -5.716 1.00 0.86 H new ATOM 0 HG22 THR A 134 16.625 26.998 -5.631 1.00 0.86 H new ATOM 0 HG23 THR A 134 16.348 26.176 -7.184 1.00 0.86 H new ATOM 2049 N SER A 135 20.962 27.102 -8.175 1.00 0.54 N ATOM 2050 CA SER A 135 22.400 27.241 -8.304 1.00 0.57 C ATOM 2051 C SER A 135 22.755 28.643 -8.787 1.00 0.46 C ATOM 2052 O SER A 135 23.831 29.160 -8.494 1.00 0.44 O ATOM 2053 CB SER A 135 22.915 26.188 -9.292 1.00 0.72 C ATOM 2054 OG SER A 135 24.312 26.274 -9.479 1.00 1.10 O ATOM 0 H SER A 135 20.539 26.513 -8.892 1.00 0.54 H new ATOM 0 HA SER A 135 22.871 27.089 -7.333 1.00 0.57 H new ATOM 0 HB2 SER A 135 22.659 25.193 -8.927 1.00 0.72 H new ATOM 0 HB3 SER A 135 22.413 26.315 -10.251 1.00 0.72 H new ATOM 0 HG SER A 135 24.608 25.551 -10.071 1.00 1.10 H new ATOM 2060 N LEU A 136 21.821 29.249 -9.516 1.00 0.45 N ATOM 2061 CA LEU A 136 22.008 30.566 -10.115 1.00 0.43 C ATOM 2062 C LEU A 136 21.990 31.687 -9.079 1.00 0.47 C ATOM 2063 O LEU A 136 21.123 32.553 -9.117 1.00 0.53 O ATOM 2064 CB LEU A 136 20.947 30.832 -11.189 1.00 0.48 C ATOM 2065 CG LEU A 136 21.116 30.046 -12.492 1.00 0.81 C ATOM 2066 CD1 LEU A 136 19.954 30.325 -13.433 1.00 1.46 C ATOM 2067 CD2 LEU A 136 22.443 30.401 -13.158 1.00 1.24 C ATOM 0 H LEU A 136 20.908 28.837 -9.708 1.00 0.45 H new ATOM 0 HA LEU A 136 22.996 30.560 -10.576 1.00 0.43 H new ATOM 0 HB2 LEU A 136 19.967 30.602 -10.771 1.00 0.48 H new ATOM 0 HB3 LEU A 136 20.952 31.896 -11.424 1.00 0.48 H new ATOM 0 HG LEU A 136 21.122 28.981 -12.258 1.00 0.81 H new ATOM 0 HD11 LEU A 136 20.088 29.759 -14.355 1.00 1.46 H new ATOM 0 HD12 LEU A 136 19.020 30.026 -12.957 1.00 1.46 H new ATOM 0 HD13 LEU A 136 19.919 31.390 -13.663 1.00 1.46 H new ATOM 0 HD21 LEU A 136 22.549 29.834 -14.083 1.00 1.24 H new ATOM 0 HD22 LEU A 136 22.464 31.468 -13.381 1.00 1.24 H new ATOM 0 HD23 LEU A 136 23.265 30.155 -12.486 1.00 1.24 H new ATOM 2079 N VAL A 137 22.899 31.628 -8.117 1.00 0.49 N ATOM 2080 CA VAL A 137 23.074 32.716 -7.158 1.00 0.60 C ATOM 2081 C VAL A 137 23.164 34.059 -7.890 1.00 0.65 C ATOM 2082 O VAL A 137 22.556 35.052 -7.482 1.00 0.77 O ATOM 2083 CB VAL A 137 24.348 32.511 -6.308 1.00 0.63 C ATOM 2084 CG1 VAL A 137 24.537 33.657 -5.327 1.00 0.82 C ATOM 2085 CG2 VAL A 137 24.291 31.181 -5.576 1.00 0.59 C ATOM 0 H VAL A 137 23.529 30.838 -7.977 1.00 0.49 H new ATOM 0 HA VAL A 137 22.208 32.717 -6.496 1.00 0.60 H new ATOM 0 HB VAL A 137 25.207 32.498 -6.979 1.00 0.63 H new ATOM 0 HG11 VAL A 137 25.440 33.489 -4.741 1.00 0.82 H new ATOM 0 HG12 VAL A 137 24.630 34.594 -5.876 1.00 0.82 H new ATOM 0 HG13 VAL A 137 23.677 33.711 -4.660 1.00 0.82 H new ATOM 0 HG21 VAL A 137 25.196 31.053 -4.982 1.00 0.59 H new ATOM 0 HG22 VAL A 137 23.421 31.164 -4.919 1.00 0.59 H new ATOM 0 HG23 VAL A 137 24.215 30.370 -6.300 1.00 0.59 H new ATOM 2095 N ASN A 138 23.898 34.065 -8.997 1.00 0.59 N ATOM 2096 CA ASN A 138 24.050 35.259 -9.827 1.00 0.66 C ATOM 2097 C ASN A 138 22.935 35.360 -10.870 1.00 0.58 C ATOM 2098 O ASN A 138 23.149 35.889 -11.958 1.00 0.60 O ATOM 2099 CB ASN A 138 25.416 35.254 -10.533 1.00 0.76 C ATOM 2100 CG ASN A 138 26.577 35.515 -9.592 1.00 1.36 C ATOM 2101 OD1 ASN A 138 27.107 34.595 -8.973 1.00 2.08 O ATOM 2102 ND2 ASN A 138 27.005 36.767 -9.497 1.00 2.17 N ATOM 0 H ASN A 138 24.402 33.249 -9.345 1.00 0.59 H new ATOM 0 HA ASN A 138 23.986 36.125 -9.169 1.00 0.66 H new ATOM 0 HB2 ASN A 138 25.562 34.290 -11.021 1.00 0.76 H new ATOM 0 HB3 ASN A 138 25.415 36.011 -11.317 1.00 0.76 H new ATOM 0 HD21 ASN A 138 27.798 36.991 -8.896 1.00 2.17 H new ATOM 0 HD22 ASN A 138 26.541 37.506 -10.025 1.00 2.17 H new ATOM 2109 N LYS A 139 21.737 34.882 -10.527 1.00 0.55 N ATOM 2110 CA LYS A 139 20.584 34.934 -11.439 1.00 0.56 C ATOM 2111 C LYS A 139 20.234 36.378 -11.810 1.00 0.66 C ATOM 2112 O LYS A 139 19.586 36.635 -12.821 1.00 0.76 O ATOM 2113 CB LYS A 139 19.361 34.249 -10.802 1.00 0.62 C ATOM 2114 CG LYS A 139 18.877 34.927 -9.525 1.00 0.75 C ATOM 2115 CD LYS A 139 17.736 34.168 -8.851 1.00 0.96 C ATOM 2116 CE LYS A 139 18.189 32.823 -8.295 1.00 0.74 C ATOM 2117 NZ LYS A 139 17.157 32.208 -7.414 1.00 1.39 N ATOM 0 H LYS A 139 21.536 34.453 -9.624 1.00 0.55 H new ATOM 0 HA LYS A 139 20.859 34.402 -12.350 1.00 0.56 H new ATOM 0 HB2 LYS A 139 18.546 34.233 -11.526 1.00 0.62 H new ATOM 0 HB3 LYS A 139 19.611 33.211 -10.580 1.00 0.62 H new ATOM 0 HG2 LYS A 139 19.710 35.017 -8.828 1.00 0.75 H new ATOM 0 HG3 LYS A 139 18.547 35.939 -9.759 1.00 0.75 H new ATOM 0 HD2 LYS A 139 17.326 34.774 -8.043 1.00 0.96 H new ATOM 0 HD3 LYS A 139 16.932 34.010 -9.570 1.00 0.96 H new ATOM 0 HE2 LYS A 139 18.412 32.146 -9.120 1.00 0.74 H new ATOM 0 HE3 LYS A 139 19.113 32.956 -7.733 1.00 0.74 H new ATOM 0 HZ1 LYS A 139 17.284 31.176 -7.399 1.00 1.39 H new ATOM 0 HZ2 LYS A 139 17.256 32.583 -6.449 1.00 1.39 H new ATOM 0 HZ3 LYS A 139 16.210 32.435 -7.778 1.00 1.39 H new ATOM 2131 N ARG A 140 20.664 37.310 -10.971 1.00 0.73 N ATOM 2132 CA ARG A 140 20.383 38.728 -11.169 1.00 0.87 C ATOM 2133 C ARG A 140 21.505 39.414 -11.934 1.00 0.86 C ATOM 2134 O ARG A 140 21.406 40.589 -12.288 1.00 1.01 O ATOM 2135 CB ARG A 140 20.219 39.401 -9.814 1.00 1.03 C ATOM 2136 CG ARG A 140 21.484 39.363 -8.966 1.00 1.11 C ATOM 2137 CD ARG A 140 21.302 40.099 -7.651 1.00 1.39 C ATOM 2138 NE ARG A 140 22.465 39.950 -6.775 1.00 1.65 N ATOM 2139 CZ ARG A 140 22.741 40.760 -5.754 1.00 2.04 C ATOM 2140 NH1 ARG A 140 21.958 41.802 -5.496 1.00 2.31 N ATOM 2141 NH2 ARG A 140 23.809 40.529 -4.998 1.00 2.46 N ATOM 0 H ARG A 140 21.215 37.108 -10.137 1.00 0.73 H new ATOM 0 HA ARG A 140 19.466 38.816 -11.752 1.00 0.87 H new ATOM 0 HB2 ARG A 140 19.922 40.439 -9.965 1.00 1.03 H new ATOM 0 HB3 ARG A 140 19.410 38.914 -9.270 1.00 1.03 H new ATOM 0 HG2 ARG A 140 21.758 38.327 -8.768 1.00 1.11 H new ATOM 0 HG3 ARG A 140 22.308 39.810 -9.522 1.00 1.11 H new ATOM 0 HD2 ARG A 140 21.130 41.157 -7.848 1.00 1.39 H new ATOM 0 HD3 ARG A 140 20.415 39.721 -7.143 1.00 1.39 H new ATOM 0 HE ARG A 140 23.105 39.177 -6.958 1.00 1.65 H new ATOM 0 HH11 ARG A 140 21.142 41.984 -6.081 1.00 2.31 H new ATOM 0 HH12 ARG A 140 22.173 42.420 -4.713 1.00 2.31 H new ATOM 0 HH21 ARG A 140 24.415 39.734 -5.200 1.00 2.46 H new ATOM 0 HH22 ARG A 140 24.023 41.147 -4.215 1.00 2.46 H new ATOM 2155 N ASP A 141 22.571 38.677 -12.170 1.00 0.73 N ATOM 2156 CA ASP A 141 23.780 39.244 -12.762 1.00 0.75 C ATOM 2157 C ASP A 141 23.725 39.191 -14.285 1.00 0.72 C ATOM 2158 O ASP A 141 22.999 38.383 -14.863 1.00 0.75 O ATOM 2159 CB ASP A 141 25.013 38.483 -12.271 1.00 0.74 C ATOM 2160 CG ASP A 141 26.211 39.386 -12.057 1.00 1.24 C ATOM 2161 OD1 ASP A 141 26.871 39.252 -11.005 1.00 1.89 O ATOM 2162 OD2 ASP A 141 26.481 40.252 -12.918 1.00 1.57 O ATOM 0 H ASP A 141 22.631 37.680 -11.962 1.00 0.73 H new ATOM 0 HA ASP A 141 23.846 40.287 -12.453 1.00 0.75 H new ATOM 0 HB2 ASP A 141 24.774 37.976 -11.336 1.00 0.74 H new ATOM 0 HB3 ASP A 141 25.270 37.710 -12.996 1.00 0.74 H new ATOM 2167 N LEU A 142 24.510 40.049 -14.927 1.00 0.85 N ATOM 2168 CA LEU A 142 24.615 40.083 -16.379 1.00 0.92 C ATOM 2169 C LEU A 142 25.575 39.003 -16.869 1.00 0.80 C ATOM 2170 O LEU A 142 26.463 39.263 -17.684 1.00 1.03 O ATOM 2171 CB LEU A 142 25.114 41.460 -16.827 1.00 1.16 C ATOM 2172 CG LEU A 142 24.121 42.626 -16.687 1.00 2.05 C ATOM 2173 CD1 LEU A 142 22.871 42.378 -17.520 1.00 2.56 C ATOM 2174 CD2 LEU A 142 23.747 42.882 -15.232 1.00 2.88 C ATOM 0 H LEU A 142 25.092 40.741 -14.454 1.00 0.85 H new ATOM 0 HA LEU A 142 23.630 39.896 -16.807 1.00 0.92 H new ATOM 0 HB2 LEU A 142 26.009 41.702 -16.253 1.00 1.16 H new ATOM 0 HB3 LEU A 142 25.415 41.391 -17.872 1.00 1.16 H new ATOM 0 HG LEU A 142 24.620 43.519 -17.063 1.00 2.05 H new ATOM 0 HD11 LEU A 142 22.184 43.217 -17.404 1.00 2.56 H new ATOM 0 HD12 LEU A 142 23.147 42.277 -18.570 1.00 2.56 H new ATOM 0 HD13 LEU A 142 22.385 41.462 -17.183 1.00 2.56 H new ATOM 0 HD21 LEU A 142 23.044 43.713 -15.178 1.00 2.88 H new ATOM 0 HD22 LEU A 142 23.285 41.988 -14.812 1.00 2.88 H new ATOM 0 HD23 LEU A 142 24.644 43.128 -14.664 1.00 2.88 H new ATOM 2186 N LEU A 143 25.372 37.793 -16.378 1.00 0.90 N ATOM 2187 CA LEU A 143 26.252 36.674 -16.677 1.00 0.81 C ATOM 2188 C LEU A 143 25.975 36.156 -18.086 1.00 0.88 C ATOM 2189 O LEU A 143 24.844 35.788 -18.402 1.00 0.97 O ATOM 2190 CB LEU A 143 26.029 35.564 -15.641 1.00 0.70 C ATOM 2191 CG LEU A 143 27.082 34.461 -15.610 1.00 0.60 C ATOM 2192 CD1 LEU A 143 28.438 35.038 -15.248 1.00 0.65 C ATOM 2193 CD2 LEU A 143 26.690 33.383 -14.613 1.00 0.58 C ATOM 0 H LEU A 143 24.594 37.557 -15.762 1.00 0.90 H new ATOM 0 HA LEU A 143 27.291 37.001 -16.630 1.00 0.81 H new ATOM 0 HB2 LEU A 143 25.980 36.021 -14.653 1.00 0.70 H new ATOM 0 HB3 LEU A 143 25.058 35.107 -15.830 1.00 0.70 H new ATOM 0 HG LEU A 143 27.144 34.014 -16.602 1.00 0.60 H new ATOM 0 HD11 LEU A 143 29.180 34.240 -15.230 1.00 0.65 H new ATOM 0 HD12 LEU A 143 28.726 35.784 -15.989 1.00 0.65 H new ATOM 0 HD13 LEU A 143 28.384 35.506 -14.265 1.00 0.65 H new ATOM 0 HD21 LEU A 143 27.451 32.603 -14.602 1.00 0.58 H new ATOM 0 HD22 LEU A 143 26.605 33.821 -13.618 1.00 0.58 H new ATOM 0 HD23 LEU A 143 25.732 32.951 -14.902 1.00 0.58 H new ATOM 2205 N GLN A 144 26.996 36.134 -18.935 1.00 0.90 N ATOM 2206 CA GLN A 144 26.805 35.745 -20.324 1.00 1.00 C ATOM 2207 C GLN A 144 27.715 34.584 -20.716 1.00 0.92 C ATOM 2208 O GLN A 144 28.481 34.064 -19.903 1.00 0.84 O ATOM 2209 CB GLN A 144 27.073 36.929 -21.259 1.00 1.21 C ATOM 2210 CG GLN A 144 28.531 37.356 -21.296 1.00 1.27 C ATOM 2211 CD GLN A 144 28.804 38.431 -22.325 1.00 1.47 C ATOM 2212 OE1 GLN A 144 27.945 39.257 -22.628 1.00 1.71 O ATOM 2213 NE2 GLN A 144 30.002 38.417 -22.881 1.00 1.77 N ATOM 0 H GLN A 144 27.955 36.379 -18.688 1.00 0.90 H new ATOM 0 HA GLN A 144 25.768 35.424 -20.425 1.00 1.00 H new ATOM 0 HB2 GLN A 144 26.755 36.664 -22.267 1.00 1.21 H new ATOM 0 HB3 GLN A 144 26.463 37.776 -20.944 1.00 1.21 H new ATOM 0 HG2 GLN A 144 28.823 37.721 -20.311 1.00 1.27 H new ATOM 0 HG3 GLN A 144 29.153 36.487 -21.512 1.00 1.27 H new ATOM 0 HE21 GLN A 144 30.686 37.714 -22.601 1.00 1.77 H new ATOM 0 HE22 GLN A 144 30.243 39.109 -23.590 1.00 1.77 H new ATOM 2222 N LYS A 145 27.607 34.191 -21.979 1.00 0.97 N ATOM 2223 CA LYS A 145 28.478 33.182 -22.565 1.00 0.98 C ATOM 2224 C LYS A 145 29.917 33.690 -22.592 1.00 1.01 C ATOM 2225 O LYS A 145 30.203 34.741 -23.170 1.00 1.11 O ATOM 2226 CB LYS A 145 28.000 32.860 -23.985 1.00 1.06 C ATOM 2227 CG LYS A 145 28.918 31.935 -24.771 1.00 1.17 C ATOM 2228 CD LYS A 145 28.378 31.694 -26.172 1.00 1.25 C ATOM 2229 CE LYS A 145 29.294 30.791 -26.977 1.00 1.41 C ATOM 2230 NZ LYS A 145 28.748 30.521 -28.331 1.00 1.43 N ATOM 0 H LYS A 145 26.912 34.564 -22.626 1.00 0.97 H new ATOM 0 HA LYS A 145 28.442 32.275 -21.962 1.00 0.98 H new ATOM 0 HB2 LYS A 145 27.011 32.404 -23.926 1.00 1.06 H new ATOM 0 HB3 LYS A 145 27.889 33.794 -24.537 1.00 1.06 H new ATOM 0 HG2 LYS A 145 29.915 32.372 -24.832 1.00 1.17 H new ATOM 0 HG3 LYS A 145 29.018 30.984 -24.247 1.00 1.17 H new ATOM 0 HD2 LYS A 145 27.387 31.244 -26.108 1.00 1.25 H new ATOM 0 HD3 LYS A 145 28.262 32.648 -26.687 1.00 1.25 H new ATOM 0 HE2 LYS A 145 30.276 31.256 -27.067 1.00 1.41 H new ATOM 0 HE3 LYS A 145 29.434 29.849 -26.447 1.00 1.41 H new ATOM 0 HZ1 LYS A 145 29.401 29.901 -28.851 1.00 1.43 H new ATOM 0 HZ2 LYS A 145 27.822 30.055 -28.245 1.00 1.43 H new ATOM 0 HZ3 LYS A 145 28.638 31.418 -28.846 1.00 1.43 H new ATOM 2244 N GLY A 146 30.811 32.956 -21.953 1.00 0.97 N ATOM 2245 CA GLY A 146 32.202 33.350 -21.937 1.00 1.06 C ATOM 2246 C GLY A 146 32.621 33.950 -20.608 1.00 1.00 C ATOM 2247 O GLY A 146 33.766 34.372 -20.446 1.00 1.07 O ATOM 0 H GLY A 146 30.600 32.096 -21.446 1.00 0.97 H new ATOM 0 HA2 GLY A 146 32.825 32.482 -22.152 1.00 1.06 H new ATOM 0 HA3 GLY A 146 32.380 34.075 -22.731 1.00 1.06 H new ATOM 2251 N ASP A 147 31.698 33.997 -19.657 1.00 0.90 N ATOM 2252 CA ASP A 147 32.030 34.424 -18.302 1.00 0.87 C ATOM 2253 C ASP A 147 32.420 33.227 -17.450 1.00 0.72 C ATOM 2254 O ASP A 147 31.817 32.154 -17.558 1.00 0.63 O ATOM 2255 CB ASP A 147 30.866 35.163 -17.641 1.00 0.89 C ATOM 2256 CG ASP A 147 30.782 36.623 -18.040 1.00 1.35 C ATOM 2257 OD1 ASP A 147 29.711 37.051 -18.529 1.00 1.94 O ATOM 2258 OD2 ASP A 147 31.788 37.343 -17.896 1.00 1.60 O ATOM 0 H ASP A 147 30.719 33.747 -19.796 1.00 0.90 H new ATOM 0 HA ASP A 147 32.873 35.111 -18.376 1.00 0.87 H new ATOM 0 HB2 ASP A 147 29.932 34.667 -17.905 1.00 0.89 H new ATOM 0 HB3 ASP A 147 30.969 35.094 -16.558 1.00 0.89 H new ATOM 2263 N LEU A 148 33.433 33.405 -16.613 1.00 0.75 N ATOM 2264 CA LEU A 148 33.907 32.338 -15.746 1.00 0.66 C ATOM 2265 C LEU A 148 33.087 32.277 -14.462 1.00 0.60 C ATOM 2266 O LEU A 148 32.744 33.308 -13.880 1.00 0.63 O ATOM 2267 CB LEU A 148 35.384 32.538 -15.406 1.00 0.75 C ATOM 2268 CG LEU A 148 36.339 32.488 -16.599 1.00 0.93 C ATOM 2269 CD1 LEU A 148 37.762 32.757 -16.148 1.00 1.46 C ATOM 2270 CD2 LEU A 148 36.248 31.139 -17.298 1.00 1.79 C ATOM 0 H LEU A 148 33.943 34.283 -16.517 1.00 0.75 H new ATOM 0 HA LEU A 148 33.790 31.396 -16.281 1.00 0.66 H new ATOM 0 HB2 LEU A 148 35.499 33.501 -14.909 1.00 0.75 H new ATOM 0 HB3 LEU A 148 35.682 31.772 -14.690 1.00 0.75 H new ATOM 0 HG LEU A 148 36.048 33.263 -17.308 1.00 0.93 H new ATOM 0 HD11 LEU A 148 38.430 32.718 -17.008 1.00 1.46 H new ATOM 0 HD12 LEU A 148 37.818 33.744 -15.690 1.00 1.46 H new ATOM 0 HD13 LEU A 148 38.062 32.002 -15.421 1.00 1.46 H new ATOM 0 HD21 LEU A 148 36.934 31.121 -18.145 1.00 1.79 H new ATOM 0 HD22 LEU A 148 36.515 30.348 -16.598 1.00 1.79 H new ATOM 0 HD23 LEU A 148 35.230 30.981 -17.653 1.00 1.79 H new ATOM 2282 N VAL A 149 32.773 31.066 -14.025 1.00 0.53 N ATOM 2283 CA VAL A 149 32.005 30.868 -12.803 1.00 0.48 C ATOM 2284 C VAL A 149 32.608 29.751 -11.959 1.00 0.46 C ATOM 2285 O VAL A 149 33.176 28.793 -12.489 1.00 0.49 O ATOM 2286 CB VAL A 149 30.519 30.535 -13.093 1.00 0.50 C ATOM 2287 CG1 VAL A 149 29.781 31.743 -13.643 1.00 1.16 C ATOM 2288 CG2 VAL A 149 30.404 29.368 -14.058 1.00 1.10 C ATOM 0 H VAL A 149 33.039 30.203 -14.500 1.00 0.53 H new ATOM 0 HA VAL A 149 32.047 31.809 -12.255 1.00 0.48 H new ATOM 0 HB VAL A 149 30.056 30.253 -12.147 1.00 0.50 H new ATOM 0 HG11 VAL A 149 28.742 31.477 -13.836 1.00 1.16 H new ATOM 0 HG12 VAL A 149 29.819 32.555 -12.916 1.00 1.16 H new ATOM 0 HG13 VAL A 149 30.252 32.065 -14.572 1.00 1.16 H new ATOM 0 HG21 VAL A 149 29.352 29.153 -14.246 1.00 1.10 H new ATOM 0 HG22 VAL A 149 30.896 29.622 -14.997 1.00 1.10 H new ATOM 0 HG23 VAL A 149 30.882 28.489 -13.625 1.00 1.10 H new ATOM 2298 N SER A 150 32.511 29.896 -10.651 1.00 0.46 N ATOM 2299 CA SER A 150 32.948 28.861 -9.735 1.00 0.47 C ATOM 2300 C SER A 150 31.734 28.142 -9.164 1.00 0.41 C ATOM 2301 O SER A 150 30.771 28.786 -8.748 1.00 0.49 O ATOM 2302 CB SER A 150 33.788 29.469 -8.611 1.00 0.59 C ATOM 2303 OG SER A 150 33.105 30.548 -7.994 1.00 1.44 O ATOM 0 H SER A 150 32.131 30.727 -10.197 1.00 0.46 H new ATOM 0 HA SER A 150 33.566 28.142 -10.273 1.00 0.47 H new ATOM 0 HB2 SER A 150 34.015 28.705 -7.868 1.00 0.59 H new ATOM 0 HB3 SER A 150 34.740 29.818 -9.011 1.00 0.59 H new ATOM 0 HG SER A 150 32.140 30.378 -8.014 1.00 1.44 H new ATOM 2309 N PHE A 151 31.778 26.819 -9.154 1.00 0.34 N ATOM 2310 CA PHE A 151 30.652 26.013 -8.701 1.00 0.34 C ATOM 2311 C PHE A 151 31.139 24.744 -8.020 1.00 0.41 C ATOM 2312 O PHE A 151 32.302 24.360 -8.164 1.00 0.49 O ATOM 2313 CB PHE A 151 29.735 25.660 -9.879 1.00 0.30 C ATOM 2314 CG PHE A 151 30.465 25.340 -11.158 1.00 0.35 C ATOM 2315 CD1 PHE A 151 30.715 26.338 -12.090 1.00 0.39 C ATOM 2316 CD2 PHE A 151 30.896 24.052 -11.441 1.00 0.47 C ATOM 2317 CE1 PHE A 151 31.381 26.059 -13.267 1.00 0.53 C ATOM 2318 CE2 PHE A 151 31.563 23.778 -12.621 1.00 0.59 C ATOM 2319 CZ PHE A 151 31.802 24.780 -13.528 1.00 0.61 C ATOM 0 H PHE A 151 32.587 26.276 -9.456 1.00 0.34 H new ATOM 0 HA PHE A 151 30.084 26.599 -7.978 1.00 0.34 H new ATOM 0 HB2 PHE A 151 29.120 24.804 -9.602 1.00 0.30 H new ATOM 0 HB3 PHE A 151 29.058 26.495 -10.060 1.00 0.30 H new ATOM 0 HD1 PHE A 151 30.384 27.347 -11.892 1.00 0.39 H new ATOM 0 HD2 PHE A 151 30.709 23.257 -10.734 1.00 0.47 H new ATOM 0 HE1 PHE A 151 31.570 26.847 -13.981 1.00 0.53 H new ATOM 0 HE2 PHE A 151 31.897 22.772 -12.830 1.00 0.59 H new ATOM 0 HZ PHE A 151 32.322 24.561 -14.449 1.00 0.61 H new ATOM 2329 N ARG A 152 30.256 24.092 -7.272 1.00 0.44 N ATOM 2330 CA ARG A 152 30.619 22.852 -6.616 1.00 0.51 C ATOM 2331 C ARG A 152 29.745 21.715 -7.122 1.00 0.50 C ATOM 2332 O ARG A 152 28.516 21.764 -7.027 1.00 0.54 O ATOM 2333 CB ARG A 152 30.472 22.968 -5.092 1.00 0.69 C ATOM 2334 CG ARG A 152 31.461 23.919 -4.429 1.00 0.94 C ATOM 2335 CD ARG A 152 30.999 25.369 -4.472 1.00 1.05 C ATOM 2336 NE ARG A 152 29.787 25.584 -3.676 1.00 1.29 N ATOM 2337 CZ ARG A 152 29.789 25.984 -2.399 1.00 1.57 C ATOM 2338 NH1 ARG A 152 30.938 26.171 -1.753 1.00 2.03 N ATOM 2339 NH2 ARG A 152 28.640 26.184 -1.762 1.00 2.20 N ATOM 0 H ARG A 152 29.297 24.400 -7.109 1.00 0.44 H new ATOM 0 HA ARG A 152 31.663 22.644 -6.851 1.00 0.51 H new ATOM 0 HB2 ARG A 152 29.459 23.300 -4.862 1.00 0.69 H new ATOM 0 HB3 ARG A 152 30.590 21.978 -4.652 1.00 0.69 H new ATOM 0 HG2 ARG A 152 31.608 23.619 -3.391 1.00 0.94 H new ATOM 0 HG3 ARG A 152 32.428 23.835 -4.925 1.00 0.94 H new ATOM 0 HD2 ARG A 152 31.795 26.014 -4.101 1.00 1.05 H new ATOM 0 HD3 ARG A 152 30.810 25.659 -5.506 1.00 1.05 H new ATOM 0 HE ARG A 152 28.886 25.418 -4.124 1.00 1.29 H new ATOM 0 HH11 ARG A 152 31.824 26.009 -2.231 1.00 2.03 H new ATOM 0 HH12 ARG A 152 30.932 26.476 -0.780 1.00 2.03 H new ATOM 0 HH21 ARG A 152 27.755 26.033 -2.246 1.00 2.20 H new ATOM 0 HH22 ARG A 152 28.643 26.489 -0.789 1.00 2.20 H new ATOM 2353 N ILE A 153 30.388 20.698 -7.667 1.00 0.51 N ATOM 2354 CA ILE A 153 29.716 19.465 -8.034 1.00 0.56 C ATOM 2355 C ILE A 153 29.962 18.404 -6.964 1.00 0.65 C ATOM 2356 O ILE A 153 31.082 18.275 -6.463 1.00 0.75 O ATOM 2357 CB ILE A 153 30.180 18.961 -9.421 1.00 0.58 C ATOM 2358 CG1 ILE A 153 29.519 17.638 -9.790 1.00 1.23 C ATOM 2359 CG2 ILE A 153 31.679 18.795 -9.443 1.00 0.93 C ATOM 2360 CD1 ILE A 153 29.835 17.184 -11.200 1.00 1.24 C ATOM 0 H ILE A 153 31.388 20.703 -7.867 1.00 0.51 H new ATOM 0 HA ILE A 153 28.646 19.663 -8.100 1.00 0.56 H new ATOM 0 HB ILE A 153 29.881 19.709 -10.155 1.00 0.58 H new ATOM 0 HG12 ILE A 153 29.842 16.870 -9.087 1.00 1.23 H new ATOM 0 HG13 ILE A 153 28.439 17.736 -9.681 1.00 1.23 H new ATOM 0 HG21 ILE A 153 31.991 18.440 -10.425 1.00 0.93 H new ATOM 0 HG22 ILE A 153 32.154 19.754 -9.236 1.00 0.93 H new ATOM 0 HG23 ILE A 153 31.976 18.071 -8.684 1.00 0.93 H new ATOM 0 HD11 ILE A 153 29.334 16.237 -11.398 1.00 1.24 H new ATOM 0 HD12 ILE A 153 29.487 17.934 -11.910 1.00 1.24 H new ATOM 0 HD13 ILE A 153 30.912 17.054 -11.308 1.00 1.24 H new ATOM 2372 N ASP A 154 28.925 17.666 -6.599 1.00 0.71 N ATOM 2373 CA ASP A 154 29.064 16.583 -5.626 1.00 0.82 C ATOM 2374 C ASP A 154 27.792 15.738 -5.578 1.00 0.96 C ATOM 2375 O ASP A 154 27.621 14.838 -6.393 1.00 1.09 O ATOM 2376 CB ASP A 154 29.425 17.144 -4.239 1.00 0.84 C ATOM 2377 CG ASP A 154 29.423 16.101 -3.139 1.00 1.45 C ATOM 2378 OD1 ASP A 154 30.324 15.236 -3.128 1.00 1.92 O ATOM 2379 OD2 ASP A 154 28.526 16.167 -2.273 1.00 1.73 O ATOM 0 H ASP A 154 27.979 17.793 -6.958 1.00 0.71 H new ATOM 0 HA ASP A 154 29.880 15.933 -5.941 1.00 0.82 H new ATOM 0 HB2 ASP A 154 30.412 17.604 -4.289 1.00 0.84 H new ATOM 0 HB3 ASP A 154 28.718 17.933 -3.981 1.00 0.84 H new ATOM 2384 N GLU A 155 26.884 16.060 -4.669 1.00 1.00 N ATOM 2385 CA GLU A 155 25.639 15.305 -4.526 1.00 1.17 C ATOM 2386 C GLU A 155 24.597 15.763 -5.536 1.00 1.23 C ATOM 2387 O GLU A 155 23.643 15.045 -5.826 1.00 1.46 O ATOM 2388 CB GLU A 155 25.088 15.444 -3.105 1.00 1.25 C ATOM 2389 CG GLU A 155 25.781 14.550 -2.093 1.00 1.32 C ATOM 2390 CD GLU A 155 25.413 13.087 -2.252 1.00 2.00 C ATOM 2391 OE1 GLU A 155 24.555 12.590 -1.488 1.00 2.28 O ATOM 2392 OE2 GLU A 155 25.978 12.429 -3.152 1.00 2.76 O ATOM 0 H GLU A 155 26.982 16.838 -4.017 1.00 1.00 H new ATOM 0 HA GLU A 155 25.863 14.256 -4.719 1.00 1.17 H new ATOM 0 HB2 GLU A 155 25.185 16.482 -2.787 1.00 1.25 H new ATOM 0 HB3 GLU A 155 24.023 15.212 -3.113 1.00 1.25 H new ATOM 0 HG2 GLU A 155 26.860 14.662 -2.195 1.00 1.32 H new ATOM 0 HG3 GLU A 155 25.521 14.878 -1.087 1.00 1.32 H new ATOM 2399 N SER A 156 24.780 16.963 -6.066 1.00 1.10 N ATOM 2400 CA SER A 156 23.870 17.487 -7.072 1.00 1.19 C ATOM 2401 C SER A 156 24.233 16.925 -8.446 1.00 1.14 C ATOM 2402 O SER A 156 23.428 16.961 -9.376 1.00 1.27 O ATOM 2403 CB SER A 156 23.916 19.021 -7.077 1.00 1.17 C ATOM 2404 OG SER A 156 22.966 19.568 -7.970 1.00 1.98 O ATOM 0 H SER A 156 25.546 17.589 -5.818 1.00 1.10 H new ATOM 0 HA SER A 156 22.853 17.178 -6.832 1.00 1.19 H new ATOM 0 HB2 SER A 156 23.727 19.394 -6.071 1.00 1.17 H new ATOM 0 HB3 SER A 156 24.915 19.355 -7.358 1.00 1.17 H new ATOM 0 HG SER A 156 23.021 20.546 -7.947 1.00 1.98 H new ATOM 2410 N GLY A 157 25.450 16.390 -8.551 1.00 1.04 N ATOM 2411 CA GLY A 157 25.914 15.795 -9.797 1.00 1.09 C ATOM 2412 C GLY A 157 25.922 16.763 -10.963 1.00 1.02 C ATOM 2413 O GLY A 157 25.878 16.352 -12.121 1.00 1.27 O ATOM 0 H GLY A 157 26.127 16.358 -7.789 1.00 1.04 H new ATOM 0 HA2 GLY A 157 26.922 15.406 -9.651 1.00 1.09 H new ATOM 0 HA3 GLY A 157 25.277 14.946 -10.044 1.00 1.09 H new ATOM 2417 N ARG A 158 25.988 18.050 -10.655 1.00 0.79 N ATOM 2418 CA ARG A 158 26.039 19.089 -11.664 1.00 0.72 C ATOM 2419 C ARG A 158 26.666 20.340 -11.071 1.00 0.56 C ATOM 2420 O ARG A 158 27.207 20.294 -9.966 1.00 0.57 O ATOM 2421 CB ARG A 158 24.638 19.390 -12.206 1.00 0.85 C ATOM 2422 CG ARG A 158 23.620 19.776 -11.142 1.00 1.47 C ATOM 2423 CD ARG A 158 22.302 20.205 -11.769 1.00 1.52 C ATOM 2424 NE ARG A 158 21.777 19.196 -12.690 1.00 2.12 N ATOM 2425 CZ ARG A 158 21.123 19.485 -13.819 1.00 2.75 C ATOM 2426 NH1 ARG A 158 20.822 20.742 -14.120 1.00 3.00 N ATOM 2427 NH2 ARG A 158 20.722 18.511 -14.629 1.00 3.61 N ATOM 0 H ARG A 158 26.008 18.400 -9.697 1.00 0.79 H new ATOM 0 HA ARG A 158 26.650 18.744 -12.498 1.00 0.72 H new ATOM 0 HB2 ARG A 158 24.709 20.199 -12.933 1.00 0.85 H new ATOM 0 HB3 ARG A 158 24.272 18.513 -12.740 1.00 0.85 H new ATOM 0 HG2 ARG A 158 23.450 18.931 -10.475 1.00 1.47 H new ATOM 0 HG3 ARG A 158 24.017 20.588 -10.533 1.00 1.47 H new ATOM 0 HD2 ARG A 158 21.571 20.393 -10.983 1.00 1.52 H new ATOM 0 HD3 ARG A 158 22.444 21.144 -12.303 1.00 1.52 H new ATOM 0 HE ARG A 158 21.919 18.213 -12.456 1.00 2.12 H new ATOM 0 HH11 ARG A 158 21.090 21.496 -13.488 1.00 3.00 H new ATOM 0 HH12 ARG A 158 20.323 20.954 -14.984 1.00 3.00 H new ATOM 0 HH21 ARG A 158 20.913 17.538 -14.390 1.00 3.61 H new ATOM 0 HH22 ARG A 158 20.223 18.736 -15.490 1.00 3.61 H new ATOM 2441 N ALA A 159 26.579 21.454 -11.780 1.00 0.48 N ATOM 2442 CA ALA A 159 27.195 22.681 -11.314 1.00 0.39 C ATOM 2443 C ALA A 159 26.254 23.420 -10.368 1.00 0.39 C ATOM 2444 O ALA A 159 25.235 23.971 -10.791 1.00 0.48 O ATOM 2445 CB ALA A 159 27.570 23.553 -12.501 1.00 0.37 C ATOM 0 H ALA A 159 26.092 21.532 -12.673 1.00 0.48 H new ATOM 0 HA ALA A 159 28.104 22.439 -10.763 1.00 0.39 H new ATOM 0 HB1 ALA A 159 28.032 24.473 -12.145 1.00 0.37 H new ATOM 0 HB2 ALA A 159 28.273 23.017 -13.139 1.00 0.37 H new ATOM 0 HB3 ALA A 159 26.674 23.795 -13.072 1.00 0.37 H new ATOM 2451 N ALA A 160 26.593 23.417 -9.086 1.00 0.38 N ATOM 2452 CA ALA A 160 25.751 24.032 -8.079 1.00 0.41 C ATOM 2453 C ALA A 160 26.462 25.192 -7.394 1.00 0.41 C ATOM 2454 O ALA A 160 27.677 25.150 -7.190 1.00 0.42 O ATOM 2455 CB ALA A 160 25.319 22.999 -7.056 1.00 0.49 C ATOM 0 H ALA A 160 27.447 22.994 -8.722 1.00 0.38 H new ATOM 0 HA ALA A 160 24.867 24.431 -8.577 1.00 0.41 H new ATOM 0 HB1 ALA A 160 24.687 23.473 -6.305 1.00 0.49 H new ATOM 0 HB2 ALA A 160 24.760 22.206 -7.553 1.00 0.49 H new ATOM 0 HB3 ALA A 160 26.199 22.574 -6.574 1.00 0.49 H new ATOM 2461 N CYS A 161 25.689 26.219 -7.051 1.00 0.47 N ATOM 2462 CA CYS A 161 26.204 27.415 -6.395 1.00 0.51 C ATOM 2463 C CYS A 161 27.135 28.175 -7.333 1.00 0.42 C ATOM 2464 O CYS A 161 28.196 28.638 -6.920 1.00 0.49 O ATOM 2465 CB CYS A 161 26.933 27.058 -5.092 1.00 0.63 C ATOM 2466 SG CYS A 161 25.944 26.082 -3.931 1.00 1.55 S ATOM 0 H CYS A 161 24.684 26.244 -7.221 1.00 0.47 H new ATOM 0 HA CYS A 161 25.358 28.055 -6.145 1.00 0.51 H new ATOM 0 HB2 CYS A 161 27.839 26.503 -5.336 1.00 0.63 H new ATOM 0 HB3 CYS A 161 27.246 27.979 -4.600 1.00 0.63 H new ATOM 0 HG CYS A 161 26.627 25.046 -3.543 1.00 1.55 H new ATOM 2472 N VAL A 162 26.725 28.305 -8.595 1.00 0.37 N ATOM 2473 CA VAL A 162 27.532 28.995 -9.594 1.00 0.35 C ATOM 2474 C VAL A 162 27.675 30.475 -9.247 1.00 0.39 C ATOM 2475 O VAL A 162 26.693 31.212 -9.143 1.00 0.48 O ATOM 2476 CB VAL A 162 26.959 28.843 -11.028 1.00 0.45 C ATOM 2477 CG1 VAL A 162 27.011 27.395 -11.482 1.00 1.15 C ATOM 2478 CG2 VAL A 162 25.531 29.357 -11.122 1.00 1.26 C ATOM 0 H VAL A 162 25.839 27.941 -8.947 1.00 0.37 H new ATOM 0 HA VAL A 162 28.515 28.523 -9.580 1.00 0.35 H new ATOM 0 HB VAL A 162 27.584 29.447 -11.685 1.00 0.45 H new ATOM 0 HG11 VAL A 162 26.604 27.315 -12.490 1.00 1.15 H new ATOM 0 HG12 VAL A 162 28.045 27.050 -11.480 1.00 1.15 H new ATOM 0 HG13 VAL A 162 26.422 26.779 -10.803 1.00 1.15 H new ATOM 0 HG21 VAL A 162 25.166 29.233 -12.142 1.00 1.26 H new ATOM 0 HG22 VAL A 162 24.896 28.794 -10.438 1.00 1.26 H new ATOM 0 HG23 VAL A 162 25.506 30.413 -10.854 1.00 1.26 H new ATOM 2488 N ASN A 163 28.906 30.891 -9.037 1.00 0.43 N ATOM 2489 CA ASN A 163 29.198 32.272 -8.715 1.00 0.53 C ATOM 2490 C ASN A 163 30.135 32.859 -9.758 1.00 0.52 C ATOM 2491 O ASN A 163 31.202 32.304 -10.020 1.00 0.53 O ATOM 2492 CB ASN A 163 29.830 32.374 -7.325 1.00 0.67 C ATOM 2493 CG ASN A 163 30.152 33.806 -6.918 1.00 1.29 C ATOM 2494 OD1 ASN A 163 31.158 34.059 -6.259 1.00 1.96 O ATOM 2495 ND2 ASN A 163 29.293 34.752 -7.279 1.00 2.05 N ATOM 0 H ASN A 163 29.727 30.287 -9.084 1.00 0.43 H new ATOM 0 HA ASN A 163 28.266 32.836 -8.715 1.00 0.53 H new ATOM 0 HB2 ASN A 163 29.152 31.938 -6.591 1.00 0.67 H new ATOM 0 HB3 ASN A 163 30.745 31.782 -7.304 1.00 0.67 H new ATOM 0 HD21 ASN A 163 29.459 35.722 -7.009 1.00 2.05 H new ATOM 0 HD22 ASN A 163 28.467 34.509 -7.826 1.00 2.05 H new ATOM 2502 N ALA A 164 29.714 33.964 -10.367 1.00 0.53 N ATOM 2503 CA ALA A 164 30.521 34.657 -11.359 1.00 0.56 C ATOM 2504 C ALA A 164 31.799 35.203 -10.739 1.00 0.63 C ATOM 2505 O ALA A 164 31.756 36.091 -9.885 1.00 0.75 O ATOM 2506 CB ALA A 164 29.727 35.786 -11.991 1.00 0.60 C ATOM 0 H ALA A 164 28.810 34.400 -10.186 1.00 0.53 H new ATOM 0 HA ALA A 164 30.794 33.938 -12.132 1.00 0.56 H new ATOM 0 HB1 ALA A 164 30.344 36.295 -12.731 1.00 0.60 H new ATOM 0 HB2 ALA A 164 28.840 35.380 -12.476 1.00 0.60 H new ATOM 0 HB3 ALA A 164 29.426 36.495 -11.220 1.00 0.60 H new ATOM 2512 N VAL A 165 32.926 34.646 -11.151 1.00 0.62 N ATOM 2513 CA VAL A 165 34.225 35.097 -10.678 1.00 0.70 C ATOM 2514 C VAL A 165 35.235 35.164 -11.827 1.00 0.71 C ATOM 2515 O VAL A 165 35.380 34.218 -12.601 1.00 0.95 O ATOM 2516 CB VAL A 165 34.759 34.178 -9.552 1.00 1.07 C ATOM 2517 CG1 VAL A 165 34.916 32.740 -10.033 1.00 1.43 C ATOM 2518 CG2 VAL A 165 36.073 34.713 -8.985 1.00 1.56 C ATOM 0 H VAL A 165 32.967 33.875 -11.817 1.00 0.62 H new ATOM 0 HA VAL A 165 34.095 36.100 -10.272 1.00 0.70 H new ATOM 0 HB VAL A 165 34.021 34.178 -8.750 1.00 1.07 H new ATOM 0 HG11 VAL A 165 35.293 32.123 -9.217 1.00 1.43 H new ATOM 0 HG12 VAL A 165 33.949 32.358 -10.360 1.00 1.43 H new ATOM 0 HG13 VAL A 165 35.619 32.710 -10.866 1.00 1.43 H new ATOM 0 HG21 VAL A 165 36.426 34.049 -8.196 1.00 1.56 H new ATOM 0 HG22 VAL A 165 36.819 34.762 -9.779 1.00 1.56 H new ATOM 0 HG23 VAL A 165 35.913 35.710 -8.575 1.00 1.56 H new ATOM 2528 N ARG A 166 35.916 36.294 -11.954 1.00 0.84 N ATOM 2529 CA ARG A 166 36.977 36.428 -12.941 1.00 1.15 C ATOM 2530 C ARG A 166 38.330 36.214 -12.284 1.00 1.13 C ATOM 2531 O ARG A 166 38.734 36.976 -11.402 1.00 1.05 O ATOM 2532 CB ARG A 166 36.949 37.798 -13.627 1.00 1.51 C ATOM 2533 CG ARG A 166 35.851 37.949 -14.668 1.00 1.76 C ATOM 2534 CD ARG A 166 34.485 38.154 -14.035 1.00 1.58 C ATOM 2535 NE ARG A 166 33.434 38.268 -15.043 1.00 1.94 N ATOM 2536 CZ ARG A 166 32.550 39.268 -15.093 1.00 2.24 C ATOM 2537 NH1 ARG A 166 32.587 40.248 -14.196 1.00 2.45 N ATOM 2538 NH2 ARG A 166 31.632 39.294 -16.049 1.00 2.94 N ATOM 0 H ARG A 166 35.754 37.127 -11.389 1.00 0.84 H new ATOM 0 HA ARG A 166 36.812 35.667 -13.704 1.00 1.15 H new ATOM 0 HB2 ARG A 166 36.824 38.570 -12.868 1.00 1.51 H new ATOM 0 HB3 ARG A 166 37.913 37.973 -14.104 1.00 1.51 H new ATOM 0 HG2 ARG A 166 36.080 38.795 -15.315 1.00 1.76 H new ATOM 0 HG3 ARG A 166 35.827 37.061 -15.300 1.00 1.76 H new ATOM 0 HD2 ARG A 166 34.263 37.319 -13.371 1.00 1.58 H new ATOM 0 HD3 ARG A 166 34.500 39.055 -13.421 1.00 1.58 H new ATOM 0 HE ARG A 166 33.371 37.538 -15.753 1.00 1.94 H new ATOM 0 HH11 ARG A 166 33.295 40.241 -13.461 1.00 2.45 H new ATOM 0 HH12 ARG A 166 31.908 41.008 -14.242 1.00 2.45 H new ATOM 0 HH21 ARG A 166 31.601 38.550 -16.746 1.00 2.94 H new ATOM 0 HH22 ARG A 166 30.957 40.058 -16.087 1.00 2.94 H new