USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=31 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 56 THR OG1 : rot 180:sc= -0.774 USER MOD Set 1.2: A 74 ASN : amide:sc= -0.342 K(o=-1.1,f=-4.7!) USER MOD Set 2.1: A 40 TYR OH : rot -134:sc= -1.56 USER MOD Set 2.2: A 77 MET CE :methyl -137:sc= -1.82 (180deg=-2.54!) USER MOD Single : A 8 GLN :FLIP amide:sc= -0.718 F(o=-1.3!,f=-0.72) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 178:sc= -1.66 (180deg=-1.7) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN :FLIP amide:sc= 0 F(o=-0.6,f=0) USER MOD Single : A 26 THR OG1 : rot -86:sc= 1.81 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HE2:sc= -0.687 K(o=-0.69,f=-3.1!) USER MOD Single : A 36 HIS : no HD1:sc= -0.275 X(o=-0.28,f=-0.0042) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 41 MET CE :methyl -162:sc= -0.127 (180deg=-0.54) USER MOD Single : A 43 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 45 ASN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.0975 K(o=-0.097,f=-1.1) USER MOD Single : A 55 TYR OH : rot 100:sc=-0.00926 USER MOD Single : A 80 LYS NZ :NH3+ -112:sc= 2.27 (180deg=0.0564) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot -25:sc= 1.14 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -163:sc= 0.215 USER MOD Single : A 93 HIS : no HD1:sc= -0.568 X(o=-0.57,f=-0.1) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 123 THR OG1 : rot 83:sc= 0.405 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0.64 USER MOD Single : A 128 GLN :FLIP amide:sc= -0.133 F(o=-1.6!,f=-0.13) USER MOD Single : A 129 HIS :FLIP no HD1:sc= -1.79 F(o=-2.9,f=-1.8) USER MOD Single : A 134 THR OG1 : rot -106:sc= 0.0791 USER MOD Single : A 135 SER OG : rot -167:sc= -0.822! USER MOD Single : A 138 ASN :FLIP amide:sc= -0.962 F(o=-1.7,f=-0.96) USER MOD Single : A 139 LYS NZ :NH3+ 151:sc= 0.634 (180deg=0.146) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 108:sc= 0.346 USER MOD Single : A 161 CYS SG : rot 180:sc= 0 USER MOD Single : A 163 ASN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD ----------------------------------------------------------------- ATOM 65 N GLN A 8 4.012 9.472 -5.032 1.00 1.20 N ATOM 66 CA GLN A 8 5.250 10.223 -4.902 1.00 1.13 C ATOM 67 C GLN A 8 5.019 11.713 -5.073 1.00 0.98 C ATOM 68 O GLN A 8 4.499 12.165 -6.095 1.00 0.93 O ATOM 69 CB GLN A 8 6.289 9.725 -5.905 1.00 1.19 C ATOM 70 CG GLN A 8 6.880 8.384 -5.517 1.00 1.42 C ATOM 71 CD GLN A 8 7.641 8.463 -4.209 1.00 1.54 C ATOM 72 OE1 GLN A 8 6.928 8.323 -3.102 1.00 2.00 O flip ATOM 73 NE2 GLN A 8 8.853 8.668 -4.191 1.00 1.75 N flip ATOM 0 HA GLN A 8 5.630 10.059 -3.894 1.00 1.13 H new ATOM 0 HB2 GLN A 8 5.828 9.643 -6.889 1.00 1.19 H new ATOM 0 HB3 GLN A 8 7.090 10.460 -5.988 1.00 1.19 H new ATOM 0 HG2 GLN A 8 6.082 7.647 -5.430 1.00 1.42 H new ATOM 0 HG3 GLN A 8 7.548 8.039 -6.306 1.00 1.42 H new ATOM 0 HE21 GLN A 8 9.366 8.770 -5.067 1.00 1.75 H new ATOM 0 HE22 GLN A 8 9.346 8.736 -3.300 1.00 1.75 H new ATOM 82 N VAL A 9 5.400 12.464 -4.054 1.00 0.94 N ATOM 83 CA VAL A 9 5.314 13.909 -4.091 1.00 0.81 C ATOM 84 C VAL A 9 6.637 14.467 -4.574 1.00 0.79 C ATOM 85 O VAL A 9 7.686 14.192 -3.991 1.00 0.87 O ATOM 86 CB VAL A 9 4.979 14.501 -2.707 1.00 0.81 C ATOM 87 CG1 VAL A 9 4.575 15.963 -2.831 1.00 1.16 C ATOM 88 CG2 VAL A 9 3.892 13.677 -2.032 1.00 1.27 C ATOM 0 H VAL A 9 5.776 12.089 -3.183 1.00 0.94 H new ATOM 0 HA VAL A 9 4.508 14.186 -4.771 1.00 0.81 H new ATOM 0 HB VAL A 9 5.870 14.460 -2.081 1.00 0.81 H new ATOM 0 HG11 VAL A 9 4.343 16.361 -1.843 1.00 1.16 H new ATOM 0 HG12 VAL A 9 5.396 16.532 -3.268 1.00 1.16 H new ATOM 0 HG13 VAL A 9 3.696 16.045 -3.471 1.00 1.16 H new ATOM 0 HG21 VAL A 9 3.664 14.105 -1.056 1.00 1.27 H new ATOM 0 HG22 VAL A 9 2.994 13.684 -2.650 1.00 1.27 H new ATOM 0 HG23 VAL A 9 4.238 12.651 -1.907 1.00 1.27 H new ATOM 98 N TYR A 10 6.590 15.227 -5.647 1.00 0.71 N ATOM 99 CA TYR A 10 7.800 15.711 -6.276 1.00 0.71 C ATOM 100 C TYR A 10 8.162 17.081 -5.736 1.00 0.62 C ATOM 101 O TYR A 10 7.299 17.942 -5.562 1.00 0.57 O ATOM 102 CB TYR A 10 7.603 15.760 -7.792 1.00 0.74 C ATOM 103 CG TYR A 10 6.961 14.501 -8.345 1.00 0.83 C ATOM 104 CD1 TYR A 10 7.512 13.250 -8.096 1.00 0.95 C ATOM 105 CD2 TYR A 10 5.800 14.565 -9.105 1.00 0.84 C ATOM 106 CE1 TYR A 10 6.926 12.099 -8.588 1.00 1.04 C ATOM 107 CE2 TYR A 10 5.208 13.418 -9.602 1.00 0.94 C ATOM 108 CZ TYR A 10 5.774 12.187 -9.341 1.00 1.03 C ATOM 109 OH TYR A 10 5.189 11.039 -9.832 1.00 1.14 O ATOM 0 H TYR A 10 5.727 15.523 -6.102 1.00 0.71 H new ATOM 0 HA TYR A 10 8.621 15.031 -6.049 1.00 0.71 H new ATOM 0 HB2 TYR A 10 6.982 16.620 -8.045 1.00 0.74 H new ATOM 0 HB3 TYR A 10 8.569 15.911 -8.274 1.00 0.74 H new ATOM 0 HD1 TYR A 10 8.414 13.176 -7.507 1.00 0.95 H new ATOM 0 HD2 TYR A 10 5.352 15.526 -9.311 1.00 0.84 H new ATOM 0 HE1 TYR A 10 7.368 11.135 -8.384 1.00 1.04 H new ATOM 0 HE2 TYR A 10 4.306 13.486 -10.192 1.00 0.94 H new ATOM 0 HH TYR A 10 4.385 11.273 -10.341 1.00 1.14 H new ATOM 119 N ARG A 11 9.441 17.283 -5.474 1.00 0.66 N ATOM 120 CA ARG A 11 9.910 18.537 -4.931 1.00 0.64 C ATOM 121 C ARG A 11 10.642 19.317 -6.006 1.00 0.56 C ATOM 122 O ARG A 11 11.352 18.736 -6.831 1.00 0.66 O ATOM 123 CB ARG A 11 10.829 18.292 -3.732 1.00 0.85 C ATOM 124 CG ARG A 11 11.202 19.561 -2.990 1.00 0.85 C ATOM 125 CD ARG A 11 12.090 19.266 -1.793 1.00 1.11 C ATOM 126 NE ARG A 11 11.457 18.345 -0.846 1.00 1.37 N ATOM 127 CZ ARG A 11 11.963 18.044 0.351 1.00 1.76 C ATOM 128 NH1 ARG A 11 13.100 18.599 0.757 1.00 2.15 N ATOM 129 NH2 ARG A 11 11.330 17.193 1.148 1.00 2.31 N ATOM 0 H ARG A 11 10.173 16.590 -5.631 1.00 0.66 H new ATOM 0 HA ARG A 11 9.053 19.118 -4.591 1.00 0.64 H new ATOM 0 HB2 ARG A 11 10.338 17.607 -3.041 1.00 0.85 H new ATOM 0 HB3 ARG A 11 11.739 17.800 -4.076 1.00 0.85 H new ATOM 0 HG2 ARG A 11 11.717 20.242 -3.668 1.00 0.85 H new ATOM 0 HG3 ARG A 11 10.297 20.068 -2.656 1.00 0.85 H new ATOM 0 HD2 ARG A 11 13.031 18.839 -2.138 1.00 1.11 H new ATOM 0 HD3 ARG A 11 12.331 20.199 -1.283 1.00 1.11 H new ATOM 0 HE ARG A 11 10.577 17.908 -1.118 1.00 1.37 H new ATOM 0 HH11 ARG A 11 13.590 19.258 0.152 1.00 2.15 H new ATOM 0 HH12 ARG A 11 13.483 18.366 1.673 1.00 2.15 H new ATOM 0 HH21 ARG A 11 10.454 16.767 0.846 1.00 2.31 H new ATOM 0 HH22 ARG A 11 11.719 16.965 2.063 1.00 2.31 H new ATOM 143 N GLY A 12 10.459 20.620 -5.998 1.00 0.46 N ATOM 144 CA GLY A 12 11.111 21.469 -6.963 1.00 0.45 C ATOM 145 C GLY A 12 11.045 22.912 -6.549 1.00 0.44 C ATOM 146 O GLY A 12 10.582 23.230 -5.452 1.00 0.50 O ATOM 0 H GLY A 12 9.863 21.112 -5.332 1.00 0.46 H new ATOM 0 HA2 GLY A 12 12.152 21.167 -7.073 1.00 0.45 H new ATOM 0 HA3 GLY A 12 10.639 21.346 -7.938 1.00 0.45 H new ATOM 150 N PHE A 13 11.502 23.786 -7.417 1.00 0.44 N ATOM 151 CA PHE A 13 11.536 25.201 -7.114 1.00 0.46 C ATOM 152 C PHE A 13 11.156 26.024 -8.335 1.00 0.43 C ATOM 153 O PHE A 13 11.471 25.656 -9.470 1.00 0.45 O ATOM 154 CB PHE A 13 12.915 25.605 -6.574 1.00 0.57 C ATOM 155 CG PHE A 13 14.019 24.633 -6.898 1.00 0.57 C ATOM 156 CD1 PHE A 13 14.766 24.778 -8.053 1.00 0.63 C ATOM 157 CD2 PHE A 13 14.317 23.576 -6.041 1.00 0.58 C ATOM 158 CE1 PHE A 13 15.787 23.899 -8.349 1.00 0.68 C ATOM 159 CE2 PHE A 13 15.333 22.694 -6.338 1.00 0.63 C ATOM 160 CZ PHE A 13 16.069 22.856 -7.491 1.00 0.67 C ATOM 0 H PHE A 13 11.857 23.542 -8.342 1.00 0.44 H new ATOM 0 HA PHE A 13 10.800 25.405 -6.336 1.00 0.46 H new ATOM 0 HB2 PHE A 13 13.178 26.583 -6.978 1.00 0.57 H new ATOM 0 HB3 PHE A 13 12.850 25.715 -5.491 1.00 0.57 H new ATOM 0 HD1 PHE A 13 14.547 25.589 -8.731 1.00 0.63 H new ATOM 0 HD2 PHE A 13 13.745 23.446 -5.134 1.00 0.58 H new ATOM 0 HE1 PHE A 13 16.365 24.027 -9.252 1.00 0.68 H new ATOM 0 HE2 PHE A 13 15.552 21.876 -5.667 1.00 0.63 H new ATOM 0 HZ PHE A 13 16.867 22.166 -7.723 1.00 0.67 H new ATOM 170 N ILE A 14 10.455 27.126 -8.089 1.00 0.42 N ATOM 171 CA ILE A 14 9.959 27.987 -9.155 1.00 0.42 C ATOM 172 C ILE A 14 11.111 28.591 -9.951 1.00 0.48 C ATOM 173 O ILE A 14 11.911 29.356 -9.414 1.00 0.56 O ATOM 174 CB ILE A 14 9.085 29.134 -8.593 1.00 0.43 C ATOM 175 CG1 ILE A 14 7.961 28.583 -7.707 1.00 0.41 C ATOM 176 CG2 ILE A 14 8.507 29.976 -9.725 1.00 0.46 C ATOM 177 CD1 ILE A 14 7.008 27.652 -8.427 1.00 0.38 C ATOM 0 H ILE A 14 10.216 27.446 -7.150 1.00 0.42 H new ATOM 0 HA ILE A 14 9.352 27.362 -9.810 1.00 0.42 H new ATOM 0 HB ILE A 14 9.721 29.771 -7.979 1.00 0.43 H new ATOM 0 HG12 ILE A 14 8.404 28.052 -6.864 1.00 0.41 H new ATOM 0 HG13 ILE A 14 7.395 29.418 -7.295 1.00 0.41 H new ATOM 0 HG21 ILE A 14 7.896 30.776 -9.308 1.00 0.46 H new ATOM 0 HG22 ILE A 14 9.320 30.407 -10.309 1.00 0.46 H new ATOM 0 HG23 ILE A 14 7.891 29.347 -10.368 1.00 0.46 H new ATOM 0 HD11 ILE A 14 6.243 27.306 -7.732 1.00 0.38 H new ATOM 0 HD12 ILE A 14 6.535 28.183 -9.253 1.00 0.38 H new ATOM 0 HD13 ILE A 14 7.560 26.796 -8.815 1.00 0.38 H new ATOM 189 N ALA A 15 11.198 28.232 -11.223 1.00 0.49 N ATOM 190 CA ALA A 15 12.222 28.775 -12.105 1.00 0.58 C ATOM 191 C ALA A 15 11.616 29.794 -13.063 1.00 0.65 C ATOM 192 O ALA A 15 12.168 30.871 -13.276 1.00 0.76 O ATOM 193 CB ALA A 15 12.901 27.653 -12.876 1.00 0.59 C ATOM 0 H ALA A 15 10.569 27.564 -11.670 1.00 0.49 H new ATOM 0 HA ALA A 15 12.972 29.282 -11.498 1.00 0.58 H new ATOM 0 HB1 ALA A 15 13.664 28.072 -13.532 1.00 0.59 H new ATOM 0 HB2 ALA A 15 13.366 26.959 -12.175 1.00 0.59 H new ATOM 0 HB3 ALA A 15 12.160 27.123 -13.474 1.00 0.59 H new ATOM 199 N VAL A 16 10.467 29.450 -13.628 1.00 0.66 N ATOM 200 CA VAL A 16 9.776 30.336 -14.555 1.00 0.78 C ATOM 201 C VAL A 16 8.416 30.739 -14.005 1.00 0.69 C ATOM 202 O VAL A 16 7.584 29.885 -13.696 1.00 0.67 O ATOM 203 CB VAL A 16 9.591 29.678 -15.940 1.00 0.94 C ATOM 204 CG1 VAL A 16 8.763 30.564 -16.861 1.00 1.55 C ATOM 205 CG2 VAL A 16 10.941 29.371 -16.567 1.00 1.42 C ATOM 0 H VAL A 16 9.993 28.562 -13.460 1.00 0.66 H new ATOM 0 HA VAL A 16 10.398 31.223 -14.672 1.00 0.78 H new ATOM 0 HB VAL A 16 9.051 28.741 -15.800 1.00 0.94 H new ATOM 0 HG11 VAL A 16 8.649 30.076 -17.829 1.00 1.55 H new ATOM 0 HG12 VAL A 16 7.780 30.730 -16.420 1.00 1.55 H new ATOM 0 HG13 VAL A 16 9.267 31.521 -16.994 1.00 1.55 H new ATOM 0 HG21 VAL A 16 10.792 28.908 -17.542 1.00 1.42 H new ATOM 0 HG22 VAL A 16 11.505 30.296 -16.687 1.00 1.42 H new ATOM 0 HG23 VAL A 16 11.495 28.689 -15.922 1.00 1.42 H new ATOM 215 N MET A 17 8.203 32.038 -13.885 1.00 0.73 N ATOM 216 CA MET A 17 6.931 32.575 -13.428 1.00 0.71 C ATOM 217 C MET A 17 6.379 33.554 -14.458 1.00 0.81 C ATOM 218 O MET A 17 6.949 34.622 -14.674 1.00 0.89 O ATOM 219 CB MET A 17 7.101 33.268 -12.072 1.00 0.74 C ATOM 220 CG MET A 17 5.853 33.991 -11.583 1.00 1.23 C ATOM 221 SD MET A 17 6.065 34.731 -9.948 1.00 1.42 S ATOM 222 CE MET A 17 6.196 33.273 -8.915 1.00 0.90 C ATOM 0 H MET A 17 8.903 32.748 -14.100 1.00 0.73 H new ATOM 0 HA MET A 17 6.225 31.753 -13.309 1.00 0.71 H new ATOM 0 HB2 MET A 17 7.391 32.524 -11.330 1.00 0.74 H new ATOM 0 HB3 MET A 17 7.919 33.985 -12.142 1.00 0.74 H new ATOM 0 HG2 MET A 17 5.587 34.770 -12.297 1.00 1.23 H new ATOM 0 HG3 MET A 17 5.020 33.288 -11.553 1.00 1.23 H new ATOM 0 HE1 MET A 17 6.366 33.574 -7.881 1.00 0.90 H new ATOM 0 HE2 MET A 17 5.272 32.698 -8.978 1.00 0.90 H new ATOM 0 HE3 MET A 17 7.030 32.659 -9.256 1.00 0.90 H new ATOM 232 N LYS A 18 5.294 33.171 -15.116 1.00 0.83 N ATOM 233 CA LYS A 18 4.628 34.047 -16.068 1.00 0.97 C ATOM 234 C LYS A 18 3.405 34.678 -15.418 1.00 1.03 C ATOM 235 O LYS A 18 3.163 34.507 -14.223 1.00 1.01 O ATOM 236 CB LYS A 18 4.199 33.274 -17.325 1.00 1.02 C ATOM 237 CG LYS A 18 5.352 32.724 -18.149 1.00 1.31 C ATOM 238 CD LYS A 18 6.150 33.837 -18.806 1.00 1.39 C ATOM 239 CE LYS A 18 7.135 33.286 -19.822 1.00 1.29 C ATOM 240 NZ LYS A 18 7.892 34.365 -20.508 1.00 2.03 N ATOM 0 H LYS A 18 4.856 32.257 -15.007 1.00 0.83 H new ATOM 0 HA LYS A 18 5.332 34.825 -16.365 1.00 0.97 H new ATOM 0 HB2 LYS A 18 3.555 32.447 -17.026 1.00 1.02 H new ATOM 0 HB3 LYS A 18 3.600 33.932 -17.955 1.00 1.02 H new ATOM 0 HG2 LYS A 18 6.008 32.134 -17.509 1.00 1.31 H new ATOM 0 HG3 LYS A 18 4.965 32.052 -18.915 1.00 1.31 H new ATOM 0 HD2 LYS A 18 5.470 34.534 -19.297 1.00 1.39 H new ATOM 0 HD3 LYS A 18 6.688 34.400 -18.043 1.00 1.39 H new ATOM 0 HE2 LYS A 18 7.834 32.615 -19.322 1.00 1.29 H new ATOM 0 HE3 LYS A 18 6.598 32.693 -20.562 1.00 1.29 H new ATOM 0 HZ1 LYS A 18 8.552 33.944 -21.192 1.00 2.03 H new ATOM 0 HZ2 LYS A 18 7.228 34.991 -21.007 1.00 2.03 H new ATOM 0 HZ3 LYS A 18 8.426 34.915 -19.805 1.00 2.03 H new ATOM 254 N GLU A 19 2.641 35.407 -16.211 1.00 1.21 N ATOM 255 CA GLU A 19 1.426 36.042 -15.732 1.00 1.32 C ATOM 256 C GLU A 19 0.267 35.043 -15.724 1.00 1.18 C ATOM 257 O GLU A 19 -0.730 35.239 -15.031 1.00 1.24 O ATOM 258 CB GLU A 19 1.094 37.246 -16.620 1.00 1.62 C ATOM 259 CG GLU A 19 -0.072 38.083 -16.125 1.00 2.11 C ATOM 260 CD GLU A 19 -0.320 39.290 -17.002 1.00 2.65 C ATOM 261 OE1 GLU A 19 0.442 40.274 -16.891 1.00 2.89 O ATOM 262 OE2 GLU A 19 -1.274 39.260 -17.806 1.00 3.24 O ATOM 0 H GLU A 19 2.842 35.575 -17.197 1.00 1.21 H new ATOM 0 HA GLU A 19 1.581 36.386 -14.710 1.00 1.32 H new ATOM 0 HB2 GLU A 19 1.976 37.881 -16.696 1.00 1.62 H new ATOM 0 HB3 GLU A 19 0.870 36.890 -17.626 1.00 1.62 H new ATOM 0 HG2 GLU A 19 -0.971 37.468 -16.093 1.00 2.11 H new ATOM 0 HG3 GLU A 19 0.126 38.412 -15.105 1.00 2.11 H new ATOM 269 N ASN A 20 0.401 33.970 -16.498 1.00 1.10 N ATOM 270 CA ASN A 20 -0.670 32.979 -16.613 1.00 1.07 C ATOM 271 C ASN A 20 -0.273 31.652 -15.975 1.00 0.95 C ATOM 272 O ASN A 20 -1.013 31.087 -15.173 1.00 0.97 O ATOM 273 CB ASN A 20 -1.028 32.753 -18.087 1.00 1.19 C ATOM 274 CG ASN A 20 -1.433 34.027 -18.808 1.00 1.48 C ATOM 275 OD1 ASN A 20 -2.074 34.949 -18.102 1.00 2.03 O flip ATOM 276 ND2 ASN A 20 -1.171 34.180 -20.000 1.00 1.59 N flip ATOM 0 H ASN A 20 1.232 33.763 -17.052 1.00 1.10 H new ATOM 0 HA ASN A 20 -1.538 33.369 -16.082 1.00 1.07 H new ATOM 0 HB2 ASN A 20 -0.173 32.311 -18.598 1.00 1.19 H new ATOM 0 HB3 ASN A 20 -1.844 32.033 -18.149 1.00 1.19 H new ATOM 0 HD21 ASN A 20 -0.676 33.449 -20.511 1.00 1.59 H new ATOM 0 HD22 ASN A 20 -1.448 35.038 -20.477 1.00 1.59 H new ATOM 283 N PHE A 21 0.912 31.167 -16.320 1.00 0.88 N ATOM 284 CA PHE A 21 1.383 29.872 -15.845 1.00 0.80 C ATOM 285 C PHE A 21 2.872 29.949 -15.532 1.00 0.75 C ATOM 286 O PHE A 21 3.459 31.025 -15.575 1.00 0.79 O ATOM 287 CB PHE A 21 1.112 28.781 -16.895 1.00 0.87 C ATOM 288 CG PHE A 21 1.923 28.926 -18.156 1.00 0.94 C ATOM 289 CD1 PHE A 21 2.939 28.032 -18.443 1.00 0.97 C ATOM 290 CD2 PHE A 21 1.671 29.957 -19.050 1.00 1.14 C ATOM 291 CE1 PHE A 21 3.688 28.164 -19.594 1.00 1.05 C ATOM 292 CE2 PHE A 21 2.419 30.093 -20.202 1.00 1.25 C ATOM 293 CZ PHE A 21 3.429 29.193 -20.475 1.00 1.15 C ATOM 0 H PHE A 21 1.568 31.654 -16.931 1.00 0.88 H new ATOM 0 HA PHE A 21 0.842 29.612 -14.935 1.00 0.80 H new ATOM 0 HB2 PHE A 21 1.319 27.807 -16.453 1.00 0.87 H new ATOM 0 HB3 PHE A 21 0.053 28.795 -17.153 1.00 0.87 H new ATOM 0 HD1 PHE A 21 3.148 27.223 -17.759 1.00 0.97 H new ATOM 0 HD2 PHE A 21 0.880 30.662 -18.842 1.00 1.14 H new ATOM 0 HE1 PHE A 21 4.479 27.460 -19.806 1.00 1.05 H new ATOM 0 HE2 PHE A 21 2.214 30.902 -20.888 1.00 1.25 H new ATOM 0 HZ PHE A 21 4.015 29.294 -21.376 1.00 1.15 H new ATOM 303 N GLY A 22 3.476 28.821 -15.203 1.00 0.71 N ATOM 304 CA GLY A 22 4.896 28.799 -14.930 1.00 0.68 C ATOM 305 C GLY A 22 5.495 27.427 -15.127 1.00 0.66 C ATOM 306 O GLY A 22 4.786 26.465 -15.437 1.00 0.70 O ATOM 0 H GLY A 22 3.008 27.918 -15.120 1.00 0.71 H new ATOM 0 HA2 GLY A 22 5.401 29.511 -15.583 1.00 0.68 H new ATOM 0 HA3 GLY A 22 5.072 29.126 -13.905 1.00 0.68 H new ATOM 310 N PHE A 23 6.801 27.344 -14.945 1.00 0.66 N ATOM 311 CA PHE A 23 7.519 26.087 -15.066 1.00 0.65 C ATOM 312 C PHE A 23 8.378 25.860 -13.834 1.00 0.56 C ATOM 313 O PHE A 23 9.000 26.792 -13.310 1.00 0.59 O ATOM 314 CB PHE A 23 8.392 26.068 -16.321 1.00 0.76 C ATOM 315 CG PHE A 23 7.615 26.068 -17.609 1.00 0.85 C ATOM 316 CD1 PHE A 23 6.814 24.986 -17.946 1.00 0.88 C ATOM 317 CD2 PHE A 23 7.700 27.133 -18.491 1.00 0.98 C ATOM 318 CE1 PHE A 23 6.114 24.967 -19.136 1.00 0.98 C ATOM 319 CE2 PHE A 23 6.997 27.121 -19.682 1.00 1.08 C ATOM 320 CZ PHE A 23 6.204 26.035 -20.004 1.00 1.06 C ATOM 0 H PHE A 23 7.392 28.142 -14.710 1.00 0.66 H new ATOM 0 HA PHE A 23 6.786 25.284 -15.150 1.00 0.65 H new ATOM 0 HB2 PHE A 23 9.050 26.937 -16.306 1.00 0.76 H new ATOM 0 HB3 PHE A 23 9.030 25.184 -16.294 1.00 0.76 H new ATOM 0 HD1 PHE A 23 6.737 24.148 -17.269 1.00 0.88 H new ATOM 0 HD2 PHE A 23 8.322 27.981 -18.246 1.00 0.98 H new ATOM 0 HE1 PHE A 23 5.497 24.117 -19.387 1.00 0.98 H new ATOM 0 HE2 PHE A 23 7.067 27.959 -20.360 1.00 1.08 H new ATOM 0 HZ PHE A 23 5.656 26.023 -20.934 1.00 1.06 H new ATOM 330 N ILE A 24 8.400 24.627 -13.368 1.00 0.54 N ATOM 331 CA ILE A 24 9.116 24.291 -12.153 1.00 0.48 C ATOM 332 C ILE A 24 10.312 23.399 -12.456 1.00 0.54 C ATOM 333 O ILE A 24 10.165 22.357 -13.098 1.00 0.61 O ATOM 334 CB ILE A 24 8.196 23.563 -11.146 1.00 0.42 C ATOM 335 CG1 ILE A 24 6.913 24.366 -10.913 1.00 0.41 C ATOM 336 CG2 ILE A 24 8.920 23.329 -9.828 1.00 0.40 C ATOM 337 CD1 ILE A 24 5.912 23.674 -10.012 1.00 0.41 C ATOM 0 H ILE A 24 7.929 23.839 -13.813 1.00 0.54 H new ATOM 0 HA ILE A 24 9.460 25.228 -11.715 1.00 0.48 H new ATOM 0 HB ILE A 24 7.928 22.595 -11.568 1.00 0.42 H new ATOM 0 HG12 ILE A 24 7.174 25.330 -10.477 1.00 0.41 H new ATOM 0 HG13 ILE A 24 6.442 24.568 -11.875 1.00 0.41 H new ATOM 0 HG21 ILE A 24 8.255 22.816 -9.134 1.00 0.40 H new ATOM 0 HG22 ILE A 24 9.805 22.717 -10.003 1.00 0.40 H new ATOM 0 HG23 ILE A 24 9.220 24.287 -9.402 1.00 0.40 H new ATOM 0 HD11 ILE A 24 5.031 24.305 -9.895 1.00 0.41 H new ATOM 0 HD12 ILE A 24 5.621 22.722 -10.456 1.00 0.41 H new ATOM 0 HD13 ILE A 24 6.363 23.496 -9.036 1.00 0.41 H new ATOM 349 N GLU A 25 11.487 23.818 -12.005 1.00 0.58 N ATOM 350 CA GLU A 25 12.668 22.976 -12.080 1.00 0.67 C ATOM 351 C GLU A 25 12.544 21.865 -11.047 1.00 0.64 C ATOM 352 O GLU A 25 12.208 22.116 -9.882 1.00 0.63 O ATOM 353 CB GLU A 25 13.946 23.800 -11.846 1.00 0.78 C ATOM 354 CG GLU A 25 15.179 22.972 -11.477 1.00 0.95 C ATOM 355 CD GLU A 25 15.699 22.085 -12.594 1.00 1.60 C ATOM 356 OE1 GLU A 25 16.925 22.073 -12.831 1.00 2.07 O ATOM 357 OE2 GLU A 25 14.864 21.430 -13.264 1.00 2.30 O ATOM 0 H GLU A 25 11.645 24.734 -11.585 1.00 0.58 H new ATOM 0 HA GLU A 25 12.740 22.541 -13.077 1.00 0.67 H new ATOM 0 HB2 GLU A 25 14.165 24.371 -12.748 1.00 0.78 H new ATOM 0 HB3 GLU A 25 13.757 24.521 -11.051 1.00 0.78 H new ATOM 0 HG2 GLU A 25 15.975 23.648 -11.167 1.00 0.95 H new ATOM 0 HG3 GLU A 25 14.938 22.348 -10.617 1.00 0.95 H new ATOM 364 N THR A 26 12.798 20.644 -11.472 1.00 0.68 N ATOM 365 CA THR A 26 12.663 19.504 -10.599 1.00 0.69 C ATOM 366 C THR A 26 13.925 19.323 -9.774 1.00 0.71 C ATOM 367 O THR A 26 15.017 19.682 -10.211 1.00 0.82 O ATOM 368 CB THR A 26 12.349 18.222 -11.393 1.00 0.79 C ATOM 369 OG1 THR A 26 13.127 18.187 -12.594 1.00 0.84 O ATOM 370 CG2 THR A 26 10.865 18.135 -11.739 1.00 0.87 C ATOM 0 H THR A 26 13.100 20.419 -12.420 1.00 0.68 H new ATOM 0 HA THR A 26 11.825 19.691 -9.928 1.00 0.69 H new ATOM 0 HB THR A 26 12.605 17.367 -10.767 1.00 0.79 H new ATOM 0 HG1 THR A 26 12.659 18.679 -13.301 1.00 0.84 H new ATOM 0 HG21 THR A 26 10.675 17.219 -12.299 1.00 0.87 H new ATOM 0 HG22 THR A 26 10.277 18.127 -10.821 1.00 0.87 H new ATOM 0 HG23 THR A 26 10.581 18.996 -12.344 1.00 0.87 H new ATOM 378 N LEU A 27 13.758 18.778 -8.575 1.00 0.68 N ATOM 379 CA LEU A 27 14.849 18.636 -7.621 1.00 0.74 C ATOM 380 C LEU A 27 16.086 18.011 -8.262 1.00 0.89 C ATOM 381 O LEU A 27 17.201 18.500 -8.092 1.00 1.00 O ATOM 382 CB LEU A 27 14.405 17.763 -6.452 1.00 0.74 C ATOM 383 CG LEU A 27 15.188 17.975 -5.161 1.00 0.80 C ATOM 384 CD1 LEU A 27 14.671 19.201 -4.438 1.00 1.48 C ATOM 385 CD2 LEU A 27 15.108 16.739 -4.279 1.00 1.58 C ATOM 0 H LEU A 27 12.863 18.423 -8.238 1.00 0.68 H new ATOM 0 HA LEU A 27 15.109 19.635 -7.272 1.00 0.74 H new ATOM 0 HB2 LEU A 27 13.350 17.953 -6.256 1.00 0.74 H new ATOM 0 HB3 LEU A 27 14.491 16.717 -6.745 1.00 0.74 H new ATOM 0 HG LEU A 27 16.238 18.140 -5.405 1.00 0.80 H new ATOM 0 HD11 LEU A 27 15.236 19.345 -3.517 1.00 1.48 H new ATOM 0 HD12 LEU A 27 14.788 20.077 -5.077 1.00 1.48 H new ATOM 0 HD13 LEU A 27 13.616 19.065 -4.199 1.00 1.48 H new ATOM 0 HD21 LEU A 27 15.673 16.909 -3.362 1.00 1.58 H new ATOM 0 HD22 LEU A 27 14.066 16.536 -4.031 1.00 1.58 H new ATOM 0 HD23 LEU A 27 15.528 15.885 -4.811 1.00 1.58 H new ATOM 397 N SER A 28 15.875 16.935 -9.004 1.00 0.97 N ATOM 398 CA SER A 28 16.973 16.196 -9.605 1.00 1.16 C ATOM 399 C SER A 28 16.995 16.396 -11.118 1.00 1.12 C ATOM 400 O SER A 28 17.413 15.498 -11.850 1.00 1.25 O ATOM 401 CB SER A 28 16.821 14.711 -9.278 1.00 1.34 C ATOM 402 OG SER A 28 16.590 14.521 -7.892 1.00 2.04 O ATOM 0 H SER A 28 14.950 16.554 -9.205 1.00 0.97 H new ATOM 0 HA SER A 28 17.913 16.568 -9.198 1.00 1.16 H new ATOM 0 HB2 SER A 28 15.994 14.291 -9.850 1.00 1.34 H new ATOM 0 HB3 SER A 28 17.721 14.174 -9.578 1.00 1.34 H new ATOM 0 HG SER A 28 16.494 13.564 -7.705 1.00 2.04 H new ATOM 408 N HIS A 29 16.527 17.575 -11.561 1.00 1.00 N ATOM 409 CA HIS A 29 16.422 17.938 -12.983 1.00 1.01 C ATOM 410 C HIS A 29 15.956 16.754 -13.827 1.00 1.02 C ATOM 411 O HIS A 29 16.617 16.306 -14.764 1.00 1.13 O ATOM 412 CB HIS A 29 17.705 18.613 -13.531 1.00 1.17 C ATOM 413 CG HIS A 29 18.938 17.759 -13.668 1.00 1.75 C ATOM 414 ND1 HIS A 29 19.625 17.614 -14.854 1.00 2.53 N ATOM 415 CD2 HIS A 29 19.645 17.059 -12.746 1.00 2.06 C ATOM 416 CE1 HIS A 29 20.692 16.848 -14.626 1.00 3.29 C ATOM 417 NE2 HIS A 29 20.755 16.484 -13.359 1.00 3.03 N ATOM 0 H HIS A 29 16.207 18.312 -10.933 1.00 1.00 H new ATOM 0 HA HIS A 29 15.648 18.702 -13.061 1.00 1.01 H new ATOM 0 HB2 HIS A 29 17.473 19.028 -14.512 1.00 1.17 H new ATOM 0 HB3 HIS A 29 17.948 19.452 -12.879 1.00 1.17 H new ATOM 0 HD1 HIS A 29 19.362 18.022 -15.751 1.00 2.53 H new ATOM 0 HD2 HIS A 29 19.388 16.963 -11.702 1.00 2.06 H new ATOM 0 HE1 HIS A 29 21.411 16.563 -15.380 1.00 3.29 H new ATOM 425 N ASP A 30 14.796 16.250 -13.442 1.00 1.05 N ATOM 426 CA ASP A 30 14.192 15.090 -14.080 1.00 1.17 C ATOM 427 C ASP A 30 13.415 15.523 -15.313 1.00 1.15 C ATOM 428 O ASP A 30 13.391 14.824 -16.329 1.00 1.31 O ATOM 429 CB ASP A 30 13.269 14.375 -13.087 1.00 1.31 C ATOM 430 CG ASP A 30 12.665 13.104 -13.650 1.00 2.12 C ATOM 431 OD1 ASP A 30 11.501 13.143 -14.103 1.00 2.89 O ATOM 432 OD2 ASP A 30 13.352 12.067 -13.662 1.00 2.47 O ATOM 0 H ASP A 30 14.244 16.634 -12.675 1.00 1.05 H new ATOM 0 HA ASP A 30 14.976 14.399 -14.389 1.00 1.17 H new ATOM 0 HB2 ASP A 30 13.831 14.135 -12.185 1.00 1.31 H new ATOM 0 HB3 ASP A 30 12.467 15.052 -12.792 1.00 1.31 H new ATOM 437 N GLU A 31 12.797 16.693 -15.208 1.00 1.06 N ATOM 438 CA GLU A 31 12.052 17.290 -16.308 1.00 1.19 C ATOM 439 C GLU A 31 11.594 18.692 -15.930 1.00 1.07 C ATOM 440 O GLU A 31 11.797 19.135 -14.796 1.00 0.94 O ATOM 441 CB GLU A 31 10.828 16.436 -16.679 1.00 1.37 C ATOM 442 CG GLU A 31 9.799 16.312 -15.565 1.00 1.33 C ATOM 443 CD GLU A 31 8.531 15.612 -16.019 1.00 1.49 C ATOM 444 OE1 GLU A 31 7.598 16.303 -16.479 1.00 1.80 O ATOM 445 OE2 GLU A 31 8.460 14.370 -15.914 1.00 1.65 O ATOM 0 H GLU A 31 12.799 17.255 -14.357 1.00 1.06 H new ATOM 0 HA GLU A 31 12.715 17.340 -17.172 1.00 1.19 H new ATOM 0 HB2 GLU A 31 10.348 16.869 -17.556 1.00 1.37 H new ATOM 0 HB3 GLU A 31 11.166 15.439 -16.960 1.00 1.37 H new ATOM 0 HG2 GLU A 31 10.235 15.761 -14.732 1.00 1.33 H new ATOM 0 HG3 GLU A 31 9.548 17.306 -15.194 1.00 1.33 H new ATOM 452 N GLU A 32 10.987 19.387 -16.881 1.00 1.20 N ATOM 453 CA GLU A 32 10.333 20.648 -16.597 1.00 1.14 C ATOM 454 C GLU A 32 8.835 20.408 -16.564 1.00 1.04 C ATOM 455 O GLU A 32 8.275 19.821 -17.492 1.00 1.17 O ATOM 456 CB GLU A 32 10.666 21.712 -17.645 1.00 1.41 C ATOM 457 CG GLU A 32 9.934 23.023 -17.405 1.00 1.85 C ATOM 458 CD GLU A 32 10.069 24.005 -18.548 1.00 2.71 C ATOM 459 OE1 GLU A 32 10.730 25.047 -18.363 1.00 3.37 O ATOM 460 OE2 GLU A 32 9.485 23.752 -19.621 1.00 3.06 O ATOM 0 H GLU A 32 10.936 19.095 -17.857 1.00 1.20 H new ATOM 0 HA GLU A 32 10.689 21.021 -15.636 1.00 1.14 H new ATOM 0 HB2 GLU A 32 11.741 21.895 -17.642 1.00 1.41 H new ATOM 0 HB3 GLU A 32 10.410 21.334 -18.635 1.00 1.41 H new ATOM 0 HG2 GLU A 32 8.877 22.815 -17.237 1.00 1.85 H new ATOM 0 HG3 GLU A 32 10.317 23.483 -16.494 1.00 1.85 H new ATOM 467 N VAL A 33 8.187 20.846 -15.505 1.00 0.87 N ATOM 468 CA VAL A 33 6.777 20.565 -15.334 1.00 0.80 C ATOM 469 C VAL A 33 5.936 21.788 -15.647 1.00 0.75 C ATOM 470 O VAL A 33 6.143 22.861 -15.074 1.00 0.71 O ATOM 471 CB VAL A 33 6.452 20.093 -13.901 1.00 0.71 C ATOM 472 CG1 VAL A 33 4.971 19.770 -13.780 1.00 0.78 C ATOM 473 CG2 VAL A 33 7.303 18.890 -13.520 1.00 0.76 C ATOM 0 H VAL A 33 8.610 21.394 -14.755 1.00 0.87 H new ATOM 0 HA VAL A 33 6.536 19.763 -16.032 1.00 0.80 H new ATOM 0 HB VAL A 33 6.689 20.900 -13.208 1.00 0.71 H new ATOM 0 HG11 VAL A 33 4.753 19.438 -12.765 1.00 0.78 H new ATOM 0 HG12 VAL A 33 4.385 20.661 -14.004 1.00 0.78 H new ATOM 0 HG13 VAL A 33 4.712 18.979 -14.484 1.00 0.78 H new ATOM 0 HG21 VAL A 33 7.056 18.576 -12.506 1.00 0.76 H new ATOM 0 HG22 VAL A 33 7.106 18.071 -14.212 1.00 0.76 H new ATOM 0 HG23 VAL A 33 8.358 19.160 -13.569 1.00 0.76 H new ATOM 483 N PHE A 34 4.998 21.623 -16.570 1.00 0.83 N ATOM 484 CA PHE A 34 4.020 22.655 -16.839 1.00 0.82 C ATOM 485 C PHE A 34 3.104 22.816 -15.634 1.00 0.75 C ATOM 486 O PHE A 34 2.326 21.921 -15.294 1.00 0.78 O ATOM 487 CB PHE A 34 3.198 22.333 -18.092 1.00 0.94 C ATOM 488 CG PHE A 34 1.877 23.045 -18.117 1.00 0.95 C ATOM 489 CD1 PHE A 34 0.694 22.327 -18.073 1.00 1.02 C ATOM 490 CD2 PHE A 34 1.819 24.429 -18.140 1.00 0.93 C ATOM 491 CE1 PHE A 34 -0.522 22.977 -18.050 1.00 1.06 C ATOM 492 CE2 PHE A 34 0.606 25.083 -18.124 1.00 0.97 C ATOM 493 CZ PHE A 34 -0.565 24.356 -18.076 1.00 1.04 C ATOM 0 H PHE A 34 4.898 20.784 -17.141 1.00 0.83 H new ATOM 0 HA PHE A 34 4.549 23.590 -17.022 1.00 0.82 H new ATOM 0 HB2 PHE A 34 3.771 22.608 -18.978 1.00 0.94 H new ATOM 0 HB3 PHE A 34 3.028 21.258 -18.143 1.00 0.94 H new ATOM 0 HD1 PHE A 34 0.724 21.248 -18.057 1.00 1.02 H new ATOM 0 HD2 PHE A 34 2.734 25.002 -18.171 1.00 0.93 H new ATOM 0 HE1 PHE A 34 -1.439 22.408 -18.012 1.00 1.06 H new ATOM 0 HE2 PHE A 34 0.573 26.162 -18.149 1.00 0.97 H new ATOM 0 HZ PHE A 34 -1.517 24.866 -18.059 1.00 1.04 H new ATOM 503 N PHE A 35 3.207 23.951 -14.980 1.00 0.68 N ATOM 504 CA PHE A 35 2.402 24.216 -13.816 1.00 0.65 C ATOM 505 C PHE A 35 1.562 25.469 -14.014 1.00 0.66 C ATOM 506 O PHE A 35 2.076 26.555 -14.282 1.00 0.67 O ATOM 507 CB PHE A 35 3.301 24.309 -12.575 1.00 0.62 C ATOM 508 CG PHE A 35 2.761 25.164 -11.462 1.00 0.80 C ATOM 509 CD1 PHE A 35 3.391 26.353 -11.128 1.00 1.17 C ATOM 510 CD2 PHE A 35 1.635 24.784 -10.751 1.00 1.23 C ATOM 511 CE1 PHE A 35 2.911 27.143 -10.105 1.00 1.72 C ATOM 512 CE2 PHE A 35 1.150 25.573 -9.726 1.00 1.76 C ATOM 513 CZ PHE A 35 1.789 26.755 -9.404 1.00 1.96 C ATOM 0 H PHE A 35 3.843 24.705 -15.238 1.00 0.68 H new ATOM 0 HA PHE A 35 1.705 23.392 -13.663 1.00 0.65 H new ATOM 0 HB2 PHE A 35 3.470 23.303 -12.191 1.00 0.62 H new ATOM 0 HB3 PHE A 35 4.272 24.702 -12.877 1.00 0.62 H new ATOM 0 HD1 PHE A 35 4.268 26.664 -11.676 1.00 1.17 H new ATOM 0 HD2 PHE A 35 1.131 23.862 -11.000 1.00 1.23 H new ATOM 0 HE1 PHE A 35 3.414 28.065 -9.853 1.00 1.72 H new ATOM 0 HE2 PHE A 35 0.272 25.266 -9.177 1.00 1.76 H new ATOM 0 HZ PHE A 35 1.410 27.374 -8.604 1.00 1.96 H new ATOM 523 N HIS A 36 0.258 25.293 -13.905 1.00 0.72 N ATOM 524 CA HIS A 36 -0.674 26.391 -14.037 1.00 0.74 C ATOM 525 C HIS A 36 -1.056 26.878 -12.645 1.00 0.70 C ATOM 526 O HIS A 36 -1.462 26.080 -11.801 1.00 0.74 O ATOM 527 CB HIS A 36 -1.919 25.932 -14.803 1.00 0.84 C ATOM 528 CG HIS A 36 -2.643 27.035 -15.513 1.00 0.94 C ATOM 529 ND1 HIS A 36 -3.212 26.901 -16.761 1.00 1.06 N ATOM 530 CD2 HIS A 36 -2.896 28.310 -15.123 1.00 1.15 C ATOM 531 CE1 HIS A 36 -3.776 28.070 -17.084 1.00 1.12 C ATOM 532 NE2 HIS A 36 -3.614 28.959 -16.122 1.00 1.18 N ATOM 0 H HIS A 36 -0.180 24.390 -13.724 1.00 0.72 H new ATOM 0 HA HIS A 36 -0.212 27.206 -14.594 1.00 0.74 H new ATOM 0 HB2 HIS A 36 -1.626 25.177 -15.532 1.00 0.84 H new ATOM 0 HB3 HIS A 36 -2.605 25.452 -14.105 1.00 0.84 H new ATOM 0 HD2 HIS A 36 -2.589 28.751 -14.186 1.00 1.15 H new ATOM 0 HE1 HIS A 36 -4.296 28.261 -18.011 1.00 1.12 H new ATOM 0 HE2 HIS A 36 -3.947 29.923 -16.113 1.00 1.18 H new ATOM 540 N PHE A 37 -0.930 28.180 -12.414 1.00 0.68 N ATOM 541 CA PHE A 37 -1.170 28.765 -11.094 1.00 0.67 C ATOM 542 C PHE A 37 -2.611 28.563 -10.633 1.00 0.73 C ATOM 543 O PHE A 37 -2.913 28.681 -9.448 1.00 0.75 O ATOM 544 CB PHE A 37 -0.844 30.258 -11.112 1.00 0.71 C ATOM 545 CG PHE A 37 0.630 30.562 -11.207 1.00 0.68 C ATOM 546 CD1 PHE A 37 1.180 31.075 -12.370 1.00 0.73 C ATOM 547 CD2 PHE A 37 1.465 30.335 -10.123 1.00 0.69 C ATOM 548 CE1 PHE A 37 2.533 31.356 -12.448 1.00 0.74 C ATOM 549 CE2 PHE A 37 2.818 30.613 -10.196 1.00 0.72 C ATOM 550 CZ PHE A 37 3.352 31.125 -11.360 1.00 0.73 C ATOM 0 H PHE A 37 -0.661 28.857 -13.128 1.00 0.68 H new ATOM 0 HA PHE A 37 -0.516 28.252 -10.389 1.00 0.67 H new ATOM 0 HB2 PHE A 37 -1.355 30.721 -11.956 1.00 0.71 H new ATOM 0 HB3 PHE A 37 -1.242 30.717 -10.207 1.00 0.71 H new ATOM 0 HD1 PHE A 37 0.546 31.258 -13.225 1.00 0.73 H new ATOM 0 HD2 PHE A 37 1.053 29.935 -9.208 1.00 0.69 H new ATOM 0 HE1 PHE A 37 2.949 31.756 -13.361 1.00 0.74 H new ATOM 0 HE2 PHE A 37 3.455 30.430 -9.343 1.00 0.72 H new ATOM 0 HZ PHE A 37 4.408 31.345 -11.421 1.00 0.73 H new ATOM 560 N SER A 38 -3.493 28.267 -11.574 1.00 0.80 N ATOM 561 CA SER A 38 -4.891 28.004 -11.260 1.00 0.90 C ATOM 562 C SER A 38 -5.026 26.808 -10.311 1.00 0.92 C ATOM 563 O SER A 38 -5.906 26.787 -9.453 1.00 1.07 O ATOM 564 CB SER A 38 -5.676 27.749 -12.551 1.00 0.98 C ATOM 565 OG SER A 38 -7.068 27.665 -12.302 1.00 1.63 O ATOM 0 H SER A 38 -3.266 28.202 -12.566 1.00 0.80 H new ATOM 0 HA SER A 38 -5.302 28.880 -10.758 1.00 0.90 H new ATOM 0 HB2 SER A 38 -5.480 28.551 -13.262 1.00 0.98 H new ATOM 0 HB3 SER A 38 -5.331 26.823 -13.012 1.00 0.98 H new ATOM 0 HG SER A 38 -7.542 27.503 -13.144 1.00 1.63 H new ATOM 571 N ASN A 39 -4.139 25.824 -10.455 1.00 0.82 N ATOM 572 CA ASN A 39 -4.189 24.619 -9.625 1.00 0.87 C ATOM 573 C ASN A 39 -3.252 24.735 -8.426 1.00 0.80 C ATOM 574 O ASN A 39 -2.859 23.730 -7.829 1.00 0.87 O ATOM 575 CB ASN A 39 -3.795 23.406 -10.461 1.00 0.92 C ATOM 576 CG ASN A 39 -4.665 23.241 -11.687 1.00 1.28 C ATOM 577 OD1 ASN A 39 -5.884 23.405 -11.643 1.00 2.07 O ATOM 578 ND2 ASN A 39 -4.028 22.952 -12.804 1.00 1.54 N ATOM 0 H ASN A 39 -3.379 25.836 -11.136 1.00 0.82 H new ATOM 0 HA ASN A 39 -5.208 24.503 -9.255 1.00 0.87 H new ATOM 0 HB2 ASN A 39 -2.754 23.503 -10.769 1.00 0.92 H new ATOM 0 HB3 ASN A 39 -3.863 22.508 -9.847 1.00 0.92 H new ATOM 0 HD21 ASN A 39 -4.547 22.856 -13.677 1.00 1.54 H new ATOM 0 HD22 ASN A 39 -3.016 22.824 -12.796 1.00 1.54 H new ATOM 585 N TYR A 40 -2.899 25.961 -8.075 1.00 0.72 N ATOM 586 CA TYR A 40 -1.982 26.200 -6.974 1.00 0.66 C ATOM 587 C TYR A 40 -2.744 26.447 -5.676 1.00 0.73 C ATOM 588 O TYR A 40 -3.768 27.127 -5.665 1.00 0.87 O ATOM 589 CB TYR A 40 -1.075 27.390 -7.292 1.00 0.65 C ATOM 590 CG TYR A 40 -0.129 27.748 -6.169 1.00 0.59 C ATOM 591 CD1 TYR A 40 1.008 26.989 -5.923 1.00 0.55 C ATOM 592 CD2 TYR A 40 -0.382 28.837 -5.347 1.00 0.75 C ATOM 593 CE1 TYR A 40 1.863 27.307 -4.888 1.00 0.64 C ATOM 594 CE2 TYR A 40 0.472 29.160 -4.314 1.00 0.81 C ATOM 595 CZ TYR A 40 1.589 28.392 -4.090 1.00 0.74 C ATOM 596 OH TYR A 40 2.432 28.710 -3.056 1.00 0.91 O ATOM 0 H TYR A 40 -3.234 26.806 -8.537 1.00 0.72 H new ATOM 0 HA TYR A 40 -1.365 25.311 -6.842 1.00 0.66 H new ATOM 0 HB2 TYR A 40 -0.495 27.165 -8.187 1.00 0.65 H new ATOM 0 HB3 TYR A 40 -1.695 28.256 -7.524 1.00 0.65 H new ATOM 0 HD1 TYR A 40 1.226 26.138 -6.551 1.00 0.55 H new ATOM 0 HD2 TYR A 40 -1.261 29.441 -5.519 1.00 0.75 H new ATOM 0 HE1 TYR A 40 2.742 26.707 -4.706 1.00 0.64 H new ATOM 0 HE2 TYR A 40 0.264 30.012 -3.684 1.00 0.81 H new ATOM 0 HH TYR A 40 1.906 28.897 -2.251 1.00 0.91 H new ATOM 606 N MET A 41 -2.235 25.889 -4.587 1.00 0.69 N ATOM 607 CA MET A 41 -2.850 26.063 -3.280 1.00 0.79 C ATOM 608 C MET A 41 -2.120 27.143 -2.487 1.00 0.77 C ATOM 609 O MET A 41 -1.001 26.931 -2.012 1.00 0.77 O ATOM 610 CB MET A 41 -2.829 24.739 -2.511 1.00 0.87 C ATOM 611 CG MET A 41 -3.444 24.826 -1.122 1.00 1.35 C ATOM 612 SD MET A 41 -3.257 23.293 -0.191 1.00 1.73 S ATOM 613 CE MET A 41 -4.146 22.141 -1.238 1.00 1.39 C ATOM 0 H MET A 41 -1.395 25.310 -4.583 1.00 0.69 H new ATOM 0 HA MET A 41 -3.885 26.376 -3.420 1.00 0.79 H new ATOM 0 HB2 MET A 41 -3.364 23.985 -3.089 1.00 0.87 H new ATOM 0 HB3 MET A 41 -1.798 24.398 -2.421 1.00 0.87 H new ATOM 0 HG2 MET A 41 -2.976 25.642 -0.571 1.00 1.35 H new ATOM 0 HG3 MET A 41 -4.503 25.067 -1.211 1.00 1.35 H new ATOM 0 HE1 MET A 41 -4.396 21.248 -0.666 1.00 1.39 H new ATOM 0 HE2 MET A 41 -5.062 22.609 -1.598 1.00 1.39 H new ATOM 0 HE3 MET A 41 -3.521 21.865 -2.088 1.00 1.39 H new ATOM 623 N GLY A 42 -2.744 28.302 -2.363 1.00 0.87 N ATOM 624 CA GLY A 42 -2.146 29.392 -1.620 1.00 0.91 C ATOM 625 C GLY A 42 -2.078 30.667 -2.432 1.00 0.92 C ATOM 626 O GLY A 42 -2.913 30.897 -3.307 1.00 1.05 O ATOM 0 H GLY A 42 -3.658 28.509 -2.765 1.00 0.87 H new ATOM 0 HA2 GLY A 42 -2.723 29.571 -0.713 1.00 0.91 H new ATOM 0 HA3 GLY A 42 -1.141 29.108 -1.307 1.00 0.91 H new ATOM 630 N ASN A 43 -1.083 31.496 -2.150 1.00 0.89 N ATOM 631 CA ASN A 43 -0.914 32.754 -2.864 1.00 0.91 C ATOM 632 C ASN A 43 0.293 32.688 -3.797 1.00 0.83 C ATOM 633 O ASN A 43 1.434 32.774 -3.347 1.00 0.83 O ATOM 634 CB ASN A 43 -0.741 33.914 -1.881 1.00 1.02 C ATOM 635 CG ASN A 43 -2.002 34.222 -1.094 1.00 1.48 C ATOM 636 OD1 ASN A 43 -3.115 34.023 -1.577 1.00 2.14 O ATOM 637 ND2 ASN A 43 -1.834 34.716 0.125 1.00 2.03 N ATOM 0 H ASN A 43 -0.380 31.320 -1.432 1.00 0.89 H new ATOM 0 HA ASN A 43 -1.812 32.924 -3.459 1.00 0.91 H new ATOM 0 HB2 ASN A 43 0.065 33.676 -1.186 1.00 1.02 H new ATOM 0 HB3 ASN A 43 -0.436 34.805 -2.430 1.00 1.02 H new ATOM 0 HD21 ASN A 43 -2.646 34.946 0.699 1.00 2.03 H new ATOM 0 HD22 ASN A 43 -0.893 34.866 0.489 1.00 2.03 H new ATOM 644 N PRO A 44 0.059 32.542 -5.110 1.00 0.84 N ATOM 645 CA PRO A 44 1.139 32.420 -6.098 1.00 0.82 C ATOM 646 C PRO A 44 1.893 33.727 -6.314 1.00 0.88 C ATOM 647 O PRO A 44 3.021 33.729 -6.802 1.00 0.91 O ATOM 648 CB PRO A 44 0.405 32.012 -7.372 1.00 0.92 C ATOM 649 CG PRO A 44 -0.973 32.551 -7.208 1.00 1.01 C ATOM 650 CD PRO A 44 -1.276 32.470 -5.739 1.00 0.93 C ATOM 0 HA PRO A 44 1.901 31.709 -5.777 1.00 0.82 H new ATOM 0 HB2 PRO A 44 0.889 32.426 -8.257 1.00 0.92 H new ATOM 0 HB3 PRO A 44 0.394 30.929 -7.492 1.00 0.92 H new ATOM 0 HG2 PRO A 44 -1.035 33.580 -7.563 1.00 1.01 H new ATOM 0 HG3 PRO A 44 -1.691 31.970 -7.787 1.00 1.01 H new ATOM 0 HD2 PRO A 44 -1.918 33.290 -5.415 1.00 0.93 H new ATOM 0 HD3 PRO A 44 -1.790 31.543 -5.485 1.00 0.93 H new ATOM 658 N ASN A 45 1.266 34.835 -5.944 1.00 0.94 N ATOM 659 CA ASN A 45 1.891 36.150 -6.077 1.00 1.05 C ATOM 660 C ASN A 45 3.026 36.297 -5.069 1.00 1.04 C ATOM 661 O ASN A 45 3.959 37.076 -5.262 1.00 1.15 O ATOM 662 CB ASN A 45 0.849 37.249 -5.851 1.00 1.15 C ATOM 663 CG ASN A 45 1.391 38.650 -6.072 1.00 1.43 C ATOM 664 OD1 ASN A 45 2.256 38.808 -7.062 1.00 2.08 O flip ATOM 665 ND2 ASN A 45 1.009 39.588 -5.373 1.00 1.88 N flip ATOM 0 H ASN A 45 0.326 34.853 -5.549 1.00 0.94 H new ATOM 0 HA ASN A 45 2.298 36.245 -7.084 1.00 1.05 H new ATOM 0 HB2 ASN A 45 0.006 37.084 -6.522 1.00 1.15 H new ATOM 0 HB3 ASN A 45 0.466 37.172 -4.833 1.00 1.15 H new ATOM 0 HD21 ASN A 45 0.341 39.424 -4.620 1.00 1.88 H new ATOM 0 HD22 ASN A 45 1.360 40.530 -5.547 1.00 1.88 H new ATOM 672 N TRP A 46 2.950 35.506 -4.011 1.00 0.98 N ATOM 673 CA TRP A 46 3.903 35.588 -2.918 1.00 1.04 C ATOM 674 C TRP A 46 5.004 34.552 -3.097 1.00 0.96 C ATOM 675 O TRP A 46 5.715 34.203 -2.154 1.00 1.02 O ATOM 676 CB TRP A 46 3.179 35.394 -1.587 1.00 1.10 C ATOM 677 CG TRP A 46 2.228 36.514 -1.273 1.00 1.28 C ATOM 678 CD1 TRP A 46 1.096 36.847 -1.962 1.00 1.30 C ATOM 679 CD2 TRP A 46 2.328 37.452 -0.194 1.00 1.56 C ATOM 680 NE1 TRP A 46 0.490 37.931 -1.382 1.00 1.52 N ATOM 681 CE2 TRP A 46 1.228 38.325 -0.297 1.00 1.67 C ATOM 682 CE3 TRP A 46 3.245 37.646 0.841 1.00 1.80 C ATOM 683 CZ2 TRP A 46 1.013 39.362 0.606 1.00 1.97 C ATOM 684 CZ3 TRP A 46 3.029 38.675 1.736 1.00 2.13 C ATOM 685 CH2 TRP A 46 1.927 39.527 1.608 1.00 2.18 C ATOM 0 H TRP A 46 2.231 34.794 -3.887 1.00 0.98 H new ATOM 0 HA TRP A 46 4.367 36.574 -2.919 1.00 1.04 H new ATOM 0 HB2 TRP A 46 2.630 34.453 -1.611 1.00 1.10 H new ATOM 0 HB3 TRP A 46 3.915 35.313 -0.787 1.00 1.10 H new ATOM 0 HD1 TRP A 46 0.731 36.330 -2.838 1.00 1.30 H new ATOM 0 HE1 TRP A 46 -0.371 38.373 -1.706 1.00 1.52 H new ATOM 0 HE3 TRP A 46 4.107 37.003 0.940 1.00 1.80 H new ATOM 0 HZ2 TRP A 46 0.155 40.012 0.518 1.00 1.97 H new ATOM 0 HZ3 TRP A 46 3.723 38.825 2.550 1.00 2.13 H new ATOM 0 HH2 TRP A 46 1.796 40.332 2.316 1.00 2.18 H new ATOM 696 N LEU A 47 5.138 34.079 -4.326 1.00 0.85 N ATOM 697 CA LEU A 47 6.184 33.145 -4.692 1.00 0.78 C ATOM 698 C LEU A 47 7.368 33.890 -5.285 1.00 0.82 C ATOM 699 O LEU A 47 7.215 34.980 -5.842 1.00 0.92 O ATOM 700 CB LEU A 47 5.658 32.119 -5.701 1.00 0.68 C ATOM 701 CG LEU A 47 4.761 31.031 -5.117 1.00 0.62 C ATOM 702 CD1 LEU A 47 4.114 30.210 -6.220 1.00 0.57 C ATOM 703 CD2 LEU A 47 5.568 30.125 -4.211 1.00 0.66 C ATOM 0 H LEU A 47 4.522 34.334 -5.098 1.00 0.85 H new ATOM 0 HA LEU A 47 6.507 32.620 -3.793 1.00 0.78 H new ATOM 0 HB2 LEU A 47 5.103 32.648 -6.476 1.00 0.68 H new ATOM 0 HB3 LEU A 47 6.509 31.643 -6.187 1.00 0.68 H new ATOM 0 HG LEU A 47 3.973 31.514 -4.539 1.00 0.62 H new ATOM 0 HD11 LEU A 47 3.480 29.442 -5.777 1.00 0.57 H new ATOM 0 HD12 LEU A 47 3.509 30.861 -6.851 1.00 0.57 H new ATOM 0 HD13 LEU A 47 4.889 29.738 -6.824 1.00 0.57 H new ATOM 0 HD21 LEU A 47 4.920 29.352 -3.799 1.00 0.66 H new ATOM 0 HD22 LEU A 47 6.370 29.659 -4.783 1.00 0.66 H new ATOM 0 HD23 LEU A 47 5.996 30.711 -3.398 1.00 0.66 H new ATOM 715 N GLU A 48 8.541 33.301 -5.162 1.00 0.81 N ATOM 716 CA GLU A 48 9.755 33.889 -5.694 1.00 0.89 C ATOM 717 C GLU A 48 10.462 32.891 -6.596 1.00 0.71 C ATOM 718 O GLU A 48 10.186 31.688 -6.537 1.00 0.62 O ATOM 719 CB GLU A 48 10.681 34.303 -4.549 1.00 1.15 C ATOM 720 CG GLU A 48 10.883 33.207 -3.516 1.00 1.48 C ATOM 721 CD GLU A 48 12.029 33.489 -2.565 1.00 1.86 C ATOM 722 OE1 GLU A 48 12.978 32.677 -2.508 1.00 2.35 O ATOM 723 OE2 GLU A 48 11.995 34.528 -1.874 1.00 2.13 O ATOM 0 H GLU A 48 8.680 32.406 -4.693 1.00 0.81 H new ATOM 0 HA GLU A 48 9.495 34.773 -6.277 1.00 0.89 H new ATOM 0 HB2 GLU A 48 11.649 34.590 -4.959 1.00 1.15 H new ATOM 0 HB3 GLU A 48 10.269 35.185 -4.058 1.00 1.15 H new ATOM 0 HG2 GLU A 48 9.965 33.083 -2.942 1.00 1.48 H new ATOM 0 HG3 GLU A 48 11.068 32.263 -4.028 1.00 1.48 H new ATOM 730 N LEU A 49 11.365 33.381 -7.427 1.00 0.75 N ATOM 731 CA LEU A 49 12.182 32.505 -8.245 1.00 0.67 C ATOM 732 C LEU A 49 13.206 31.807 -7.356 1.00 0.67 C ATOM 733 O LEU A 49 14.089 32.447 -6.786 1.00 0.73 O ATOM 734 CB LEU A 49 12.876 33.291 -9.357 1.00 0.76 C ATOM 735 CG LEU A 49 11.937 34.043 -10.307 1.00 0.85 C ATOM 736 CD1 LEU A 49 12.735 34.760 -11.385 1.00 1.40 C ATOM 737 CD2 LEU A 49 10.916 33.092 -10.931 1.00 1.11 C ATOM 0 H LEU A 49 11.550 34.376 -7.552 1.00 0.75 H new ATOM 0 HA LEU A 49 11.546 31.758 -8.719 1.00 0.67 H new ATOM 0 HB2 LEU A 49 13.558 34.009 -8.902 1.00 0.76 H new ATOM 0 HB3 LEU A 49 13.484 32.601 -9.943 1.00 0.76 H new ATOM 0 HG LEU A 49 11.391 34.789 -9.729 1.00 0.85 H new ATOM 0 HD11 LEU A 49 12.053 35.289 -12.051 1.00 1.40 H new ATOM 0 HD12 LEU A 49 13.415 35.474 -10.920 1.00 1.40 H new ATOM 0 HD13 LEU A 49 13.309 34.032 -11.957 1.00 1.40 H new ATOM 0 HD21 LEU A 49 10.261 33.650 -11.601 1.00 1.11 H new ATOM 0 HD22 LEU A 49 11.437 32.318 -11.494 1.00 1.11 H new ATOM 0 HD23 LEU A 49 10.321 32.630 -10.144 1.00 1.11 H new ATOM 749 N GLY A 50 13.082 30.494 -7.240 1.00 0.66 N ATOM 750 CA GLY A 50 13.902 29.759 -6.302 1.00 0.72 C ATOM 751 C GLY A 50 13.120 29.324 -5.075 1.00 0.69 C ATOM 752 O GLY A 50 13.692 28.776 -4.131 1.00 0.75 O ATOM 0 H GLY A 50 12.429 29.925 -7.778 1.00 0.66 H new ATOM 0 HA2 GLY A 50 14.318 28.881 -6.796 1.00 0.72 H new ATOM 0 HA3 GLY A 50 14.743 30.380 -5.993 1.00 0.72 H new ATOM 756 N GLN A 51 11.814 29.584 -5.074 1.00 0.62 N ATOM 757 CA GLN A 51 10.959 29.152 -3.976 1.00 0.60 C ATOM 758 C GLN A 51 10.730 27.651 -4.035 1.00 0.56 C ATOM 759 O GLN A 51 10.405 27.103 -5.086 1.00 0.53 O ATOM 760 CB GLN A 51 9.608 29.874 -3.987 1.00 0.59 C ATOM 761 CG GLN A 51 8.661 29.386 -2.898 1.00 0.60 C ATOM 762 CD GLN A 51 9.216 29.566 -1.496 1.00 0.70 C ATOM 763 OE1 GLN A 51 9.942 30.518 -1.216 1.00 1.06 O ATOM 764 NE2 GLN A 51 8.911 28.624 -0.617 1.00 0.87 N ATOM 0 H GLN A 51 11.330 30.088 -5.817 1.00 0.62 H new ATOM 0 HA GLN A 51 11.475 29.407 -3.050 1.00 0.60 H new ATOM 0 HB2 GLN A 51 9.774 30.944 -3.863 1.00 0.59 H new ATOM 0 HB3 GLN A 51 9.136 29.735 -4.960 1.00 0.59 H new ATOM 0 HG2 GLN A 51 7.716 29.924 -2.979 1.00 0.60 H new ATOM 0 HG3 GLN A 51 8.442 28.331 -3.062 1.00 0.60 H new ATOM 0 HE21 GLN A 51 8.305 27.850 -0.889 1.00 0.87 H new ATOM 0 HE22 GLN A 51 9.282 28.672 0.332 1.00 0.87 H new ATOM 773 N GLU A 52 10.883 27.009 -2.892 1.00 0.57 N ATOM 774 CA GLU A 52 10.757 25.568 -2.781 1.00 0.55 C ATOM 775 C GLU A 52 9.299 25.166 -2.564 1.00 0.50 C ATOM 776 O GLU A 52 8.618 25.712 -1.691 1.00 0.55 O ATOM 777 CB GLU A 52 11.653 25.102 -1.633 1.00 0.63 C ATOM 778 CG GLU A 52 13.121 25.381 -1.925 1.00 1.15 C ATOM 779 CD GLU A 52 13.960 25.590 -0.684 1.00 1.94 C ATOM 780 OE1 GLU A 52 14.204 24.602 0.049 1.00 2.44 O ATOM 781 OE2 GLU A 52 14.360 26.736 -0.416 1.00 2.51 O ATOM 0 H GLU A 52 11.099 27.475 -2.011 1.00 0.57 H new ATOM 0 HA GLU A 52 11.076 25.086 -3.705 1.00 0.55 H new ATOM 0 HB2 GLU A 52 11.361 25.608 -0.713 1.00 0.63 H new ATOM 0 HB3 GLU A 52 11.510 24.034 -1.468 1.00 0.63 H new ATOM 0 HG2 GLU A 52 13.533 24.549 -2.495 1.00 1.15 H new ATOM 0 HG3 GLU A 52 13.195 26.267 -2.556 1.00 1.15 H new ATOM 788 N VAL A 53 8.818 24.238 -3.390 1.00 0.43 N ATOM 789 CA VAL A 53 7.432 23.779 -3.327 1.00 0.40 C ATOM 790 C VAL A 53 7.348 22.261 -3.530 1.00 0.41 C ATOM 791 O VAL A 53 8.278 21.641 -4.057 1.00 0.44 O ATOM 792 CB VAL A 53 6.543 24.483 -4.390 1.00 0.37 C ATOM 793 CG1 VAL A 53 6.483 25.989 -4.160 1.00 0.41 C ATOM 794 CG2 VAL A 53 7.049 24.194 -5.798 1.00 0.37 C ATOM 0 H VAL A 53 9.374 23.786 -4.116 1.00 0.43 H new ATOM 0 HA VAL A 53 7.061 24.036 -2.335 1.00 0.40 H new ATOM 0 HB VAL A 53 5.535 24.081 -4.286 1.00 0.37 H new ATOM 0 HG11 VAL A 53 5.853 26.449 -4.922 1.00 0.41 H new ATOM 0 HG12 VAL A 53 6.065 26.190 -3.174 1.00 0.41 H new ATOM 0 HG13 VAL A 53 7.488 26.407 -4.220 1.00 0.41 H new ATOM 0 HG21 VAL A 53 6.411 24.697 -6.524 1.00 0.37 H new ATOM 0 HG22 VAL A 53 8.071 24.558 -5.899 1.00 0.37 H new ATOM 0 HG23 VAL A 53 7.027 23.119 -5.979 1.00 0.37 H new ATOM 804 N GLU A 54 6.238 21.676 -3.096 1.00 0.47 N ATOM 805 CA GLU A 54 5.971 20.253 -3.298 1.00 0.54 C ATOM 806 C GLU A 54 4.678 20.092 -4.090 1.00 0.52 C ATOM 807 O GLU A 54 3.716 20.836 -3.872 1.00 0.54 O ATOM 808 CB GLU A 54 5.870 19.518 -1.953 1.00 0.72 C ATOM 809 CG GLU A 54 4.782 20.057 -1.033 1.00 0.81 C ATOM 810 CD GLU A 54 4.724 19.351 0.309 1.00 1.05 C ATOM 811 OE1 GLU A 54 5.624 18.535 0.605 1.00 1.49 O ATOM 812 OE2 GLU A 54 3.771 19.613 1.078 1.00 1.30 O ATOM 0 H GLU A 54 5.499 22.170 -2.596 1.00 0.47 H new ATOM 0 HA GLU A 54 6.797 19.813 -3.857 1.00 0.54 H new ATOM 0 HB2 GLU A 54 5.682 18.461 -2.141 1.00 0.72 H new ATOM 0 HB3 GLU A 54 6.830 19.584 -1.441 1.00 0.72 H new ATOM 0 HG2 GLU A 54 4.950 21.121 -0.868 1.00 0.81 H new ATOM 0 HG3 GLU A 54 3.816 19.960 -1.529 1.00 0.81 H new ATOM 819 N TYR A 55 4.654 19.146 -5.020 1.00 0.54 N ATOM 820 CA TYR A 55 3.496 18.982 -5.889 1.00 0.58 C ATOM 821 C TYR A 55 3.471 17.612 -6.558 1.00 0.64 C ATOM 822 O TYR A 55 4.423 16.836 -6.455 1.00 0.66 O ATOM 823 CB TYR A 55 3.468 20.091 -6.949 1.00 0.55 C ATOM 824 CG TYR A 55 4.659 20.122 -7.894 1.00 0.52 C ATOM 825 CD1 TYR A 55 5.960 20.301 -7.428 1.00 0.54 C ATOM 826 CD2 TYR A 55 4.474 19.999 -9.264 1.00 0.63 C ATOM 827 CE1 TYR A 55 7.030 20.354 -8.297 1.00 0.56 C ATOM 828 CE2 TYR A 55 5.541 20.049 -10.139 1.00 0.65 C ATOM 829 CZ TYR A 55 6.815 20.226 -9.651 1.00 0.57 C ATOM 830 OH TYR A 55 7.879 20.279 -10.522 1.00 0.63 O ATOM 0 H TYR A 55 5.414 18.487 -5.191 1.00 0.54 H new ATOM 0 HA TYR A 55 2.606 19.056 -5.265 1.00 0.58 H new ATOM 0 HB2 TYR A 55 2.559 19.981 -7.541 1.00 0.55 H new ATOM 0 HB3 TYR A 55 3.404 21.053 -6.441 1.00 0.55 H new ATOM 0 HD1 TYR A 55 6.134 20.400 -6.367 1.00 0.54 H new ATOM 0 HD2 TYR A 55 3.476 19.861 -9.653 1.00 0.63 H new ATOM 0 HE1 TYR A 55 8.031 20.495 -7.917 1.00 0.56 H new ATOM 0 HE2 TYR A 55 5.376 19.950 -11.202 1.00 0.65 H new ATOM 0 HH TYR A 55 8.134 19.369 -10.783 1.00 0.63 H new ATOM 840 N THR A 56 2.371 17.327 -7.245 1.00 0.72 N ATOM 841 CA THR A 56 2.190 16.056 -7.925 1.00 0.82 C ATOM 842 C THR A 56 1.705 16.272 -9.356 1.00 0.85 C ATOM 843 O THR A 56 1.144 17.320 -9.677 1.00 0.85 O ATOM 844 CB THR A 56 1.196 15.162 -7.159 1.00 0.88 C ATOM 845 OG1 THR A 56 0.077 15.940 -6.710 1.00 0.84 O ATOM 846 CG2 THR A 56 1.872 14.502 -5.967 1.00 0.94 C ATOM 0 H THR A 56 1.585 17.969 -7.344 1.00 0.72 H new ATOM 0 HA THR A 56 3.157 15.553 -7.957 1.00 0.82 H new ATOM 0 HB THR A 56 0.846 14.384 -7.837 1.00 0.88 H new ATOM 0 HG1 THR A 56 -0.550 15.363 -6.226 1.00 0.84 H new ATOM 0 HG21 THR A 56 1.152 13.876 -5.441 1.00 0.94 H new ATOM 0 HG22 THR A 56 2.702 13.887 -6.314 1.00 0.94 H new ATOM 0 HG23 THR A 56 2.247 15.270 -5.290 1.00 0.94 H new ATOM 854 N LEU A 57 1.928 15.281 -10.212 1.00 0.96 N ATOM 855 CA LEU A 57 1.560 15.384 -11.619 1.00 1.03 C ATOM 856 C LEU A 57 0.148 14.871 -11.856 1.00 1.12 C ATOM 857 O LEU A 57 -0.323 13.971 -11.158 1.00 1.19 O ATOM 858 CB LEU A 57 2.548 14.603 -12.491 1.00 1.09 C ATOM 859 CG LEU A 57 3.981 15.135 -12.490 1.00 1.04 C ATOM 860 CD1 LEU A 57 4.892 14.219 -13.294 1.00 1.13 C ATOM 861 CD2 LEU A 57 4.018 16.549 -13.047 1.00 1.03 C ATOM 0 H LEU A 57 2.363 14.395 -9.955 1.00 0.96 H new ATOM 0 HA LEU A 57 1.596 16.438 -11.895 1.00 1.03 H new ATOM 0 HB2 LEU A 57 2.563 13.566 -12.155 1.00 1.09 H new ATOM 0 HB3 LEU A 57 2.179 14.601 -13.517 1.00 1.09 H new ATOM 0 HG LEU A 57 4.342 15.158 -11.462 1.00 1.04 H new ATOM 0 HD11 LEU A 57 5.908 14.614 -13.282 1.00 1.13 H new ATOM 0 HD12 LEU A 57 4.885 13.222 -12.854 1.00 1.13 H new ATOM 0 HD13 LEU A 57 4.536 14.164 -14.323 1.00 1.13 H new ATOM 0 HD21 LEU A 57 5.044 16.916 -13.041 1.00 1.03 H new ATOM 0 HD22 LEU A 57 3.640 16.547 -14.069 1.00 1.03 H new ATOM 0 HD23 LEU A 57 3.397 17.199 -12.431 1.00 1.03 H new ATOM 873 N ALA A 58 -0.518 15.444 -12.844 1.00 1.17 N ATOM 874 CA ALA A 58 -1.874 15.053 -13.175 1.00 1.30 C ATOM 875 C ALA A 58 -1.949 14.465 -14.580 1.00 1.40 C ATOM 876 O ALA A 58 -1.976 15.189 -15.573 1.00 2.04 O ATOM 877 CB ALA A 58 -2.806 16.245 -13.056 1.00 1.33 C ATOM 0 H ALA A 58 -0.138 16.185 -13.433 1.00 1.17 H new ATOM 0 HA ALA A 58 -2.187 14.284 -12.469 1.00 1.30 H new ATOM 0 HB1 ALA A 58 -3.822 15.939 -13.307 1.00 1.33 H new ATOM 0 HB2 ALA A 58 -2.783 16.624 -12.034 1.00 1.33 H new ATOM 0 HB3 ALA A 58 -2.483 17.029 -13.741 1.00 1.33 H new ATOM 1026 N LEU A 70 2.105 17.166 -18.881 1.00 1.49 N ATOM 1027 CA LEU A 70 0.820 17.288 -18.227 1.00 1.50 C ATOM 1028 C LEU A 70 0.828 18.389 -17.166 1.00 1.25 C ATOM 1029 O LEU A 70 1.880 18.738 -16.630 1.00 1.15 O ATOM 1030 CB LEU A 70 0.466 15.950 -17.578 1.00 1.71 C ATOM 1031 CG LEU A 70 0.331 14.754 -18.531 1.00 1.88 C ATOM 1032 CD1 LEU A 70 -0.648 15.053 -19.656 1.00 2.30 C ATOM 1033 CD2 LEU A 70 1.672 14.309 -19.091 1.00 2.29 C ATOM 0 HA LEU A 70 0.076 17.557 -18.977 1.00 1.50 H new ATOM 0 HB2 LEU A 70 1.230 15.715 -16.838 1.00 1.71 H new ATOM 0 HB3 LEU A 70 -0.474 16.068 -17.039 1.00 1.71 H new ATOM 0 HG LEU A 70 -0.064 13.927 -17.941 1.00 1.88 H new ATOM 0 HD11 LEU A 70 -0.722 14.187 -20.314 1.00 2.30 H new ATOM 0 HD12 LEU A 70 -1.629 15.274 -19.235 1.00 2.30 H new ATOM 0 HD13 LEU A 70 -0.296 15.913 -20.226 1.00 2.30 H new ATOM 0 HD21 LEU A 70 1.524 13.461 -19.759 1.00 2.29 H new ATOM 0 HD22 LEU A 70 2.126 15.131 -19.644 1.00 2.29 H new ATOM 0 HD23 LEU A 70 2.329 14.015 -18.272 1.00 2.29 H new ATOM 1045 N PRO A 71 -0.355 18.951 -16.857 1.00 1.22 N ATOM 1046 CA PRO A 71 -0.507 19.955 -15.797 1.00 1.05 C ATOM 1047 C PRO A 71 -0.181 19.394 -14.413 1.00 0.97 C ATOM 1048 O PRO A 71 -0.278 18.186 -14.175 1.00 1.14 O ATOM 1049 CB PRO A 71 -1.987 20.344 -15.871 1.00 1.18 C ATOM 1050 CG PRO A 71 -2.653 19.207 -16.566 1.00 1.38 C ATOM 1051 CD PRO A 71 -1.634 18.660 -17.524 1.00 1.43 C ATOM 0 HA PRO A 71 0.175 20.793 -15.939 1.00 1.05 H new ATOM 0 HB2 PRO A 71 -2.405 20.497 -14.876 1.00 1.18 H new ATOM 0 HB3 PRO A 71 -2.123 21.276 -16.420 1.00 1.18 H new ATOM 0 HG2 PRO A 71 -2.969 18.445 -15.854 1.00 1.38 H new ATOM 0 HG3 PRO A 71 -3.547 19.541 -17.094 1.00 1.38 H new ATOM 0 HD2 PRO A 71 -1.769 17.591 -17.688 1.00 1.43 H new ATOM 0 HD3 PRO A 71 -1.698 19.142 -18.499 1.00 1.43 H new ATOM 1059 N ALA A 72 0.204 20.277 -13.505 1.00 0.80 N ATOM 1060 CA ALA A 72 0.491 19.891 -12.134 1.00 0.74 C ATOM 1061 C ALA A 72 -0.649 20.299 -11.211 1.00 0.72 C ATOM 1062 O ALA A 72 -1.281 21.338 -11.417 1.00 0.82 O ATOM 1063 CB ALA A 72 1.789 20.532 -11.677 1.00 0.70 C ATOM 0 H ALA A 72 0.325 21.272 -13.695 1.00 0.80 H new ATOM 0 HA ALA A 72 0.595 18.807 -12.093 1.00 0.74 H new ATOM 0 HB1 ALA A 72 1.998 20.238 -10.648 1.00 0.70 H new ATOM 0 HB2 ALA A 72 2.604 20.202 -12.321 1.00 0.70 H new ATOM 0 HB3 ALA A 72 1.699 21.617 -11.733 1.00 0.70 H new ATOM 1069 N GLU A 73 -0.907 19.477 -10.202 1.00 0.74 N ATOM 1070 CA GLU A 73 -1.922 19.773 -9.201 1.00 0.77 C ATOM 1071 C GLU A 73 -1.357 19.507 -7.808 1.00 0.69 C ATOM 1072 O GLU A 73 -0.274 18.923 -7.680 1.00 0.71 O ATOM 1073 CB GLU A 73 -3.180 18.922 -9.429 1.00 0.94 C ATOM 1074 CG GLU A 73 -2.980 17.437 -9.150 1.00 1.28 C ATOM 1075 CD GLU A 73 -4.266 16.639 -9.257 1.00 1.84 C ATOM 1076 OE1 GLU A 73 -5.065 16.658 -8.301 1.00 2.30 O ATOM 1077 OE2 GLU A 73 -4.491 15.991 -10.304 1.00 2.28 O ATOM 0 H GLU A 73 -0.422 18.592 -10.055 1.00 0.74 H new ATOM 0 HA GLU A 73 -2.202 20.823 -9.287 1.00 0.77 H new ATOM 0 HB2 GLU A 73 -3.981 19.297 -8.791 1.00 0.94 H new ATOM 0 HB3 GLU A 73 -3.509 19.047 -10.461 1.00 0.94 H new ATOM 0 HG2 GLU A 73 -2.249 17.035 -9.852 1.00 1.28 H new ATOM 0 HG3 GLU A 73 -2.563 17.313 -8.151 1.00 1.28 H new ATOM 1084 N ASN A 74 -2.087 19.938 -6.777 1.00 0.68 N ATOM 1085 CA ASN A 74 -1.669 19.731 -5.387 1.00 0.69 C ATOM 1086 C ASN A 74 -0.317 20.407 -5.144 1.00 0.59 C ATOM 1087 O ASN A 74 0.591 19.835 -4.548 1.00 0.66 O ATOM 1088 CB ASN A 74 -1.611 18.223 -5.079 1.00 0.81 C ATOM 1089 CG ASN A 74 -1.294 17.901 -3.627 1.00 1.39 C ATOM 1090 OD1 ASN A 74 -1.635 18.651 -2.712 1.00 1.81 O ATOM 1091 ND2 ASN A 74 -0.646 16.764 -3.414 1.00 2.01 N ATOM 0 H ASN A 74 -2.973 20.434 -6.878 1.00 0.68 H new ATOM 0 HA ASN A 74 -2.396 20.184 -4.713 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -2.568 17.772 -5.340 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -0.857 17.761 -5.716 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -0.411 16.481 -2.462 1.00 2.01 H new ATOM 0 HD22 ASN A 74 -0.382 16.172 -4.202 1.00 2.01 H new ATOM 1098 N VAL A 75 -0.198 21.638 -5.622 1.00 0.66 N ATOM 1099 CA VAL A 75 1.043 22.389 -5.500 1.00 0.58 C ATOM 1100 C VAL A 75 1.018 23.254 -4.246 1.00 0.59 C ATOM 1101 O VAL A 75 0.215 24.182 -4.141 1.00 0.64 O ATOM 1102 CB VAL A 75 1.283 23.287 -6.731 1.00 0.56 C ATOM 1103 CG1 VAL A 75 2.680 23.899 -6.693 1.00 0.72 C ATOM 1104 CG2 VAL A 75 1.071 22.503 -8.018 1.00 0.80 C ATOM 0 H VAL A 75 -0.948 22.138 -6.099 1.00 0.66 H new ATOM 0 HA VAL A 75 1.856 21.666 -5.433 1.00 0.58 H new ATOM 0 HB VAL A 75 0.558 24.100 -6.704 1.00 0.56 H new ATOM 0 HG11 VAL A 75 2.826 24.528 -7.571 1.00 0.72 H new ATOM 0 HG12 VAL A 75 2.788 24.503 -5.792 1.00 0.72 H new ATOM 0 HG13 VAL A 75 3.426 23.104 -6.689 1.00 0.72 H new ATOM 0 HG21 VAL A 75 1.245 23.155 -8.874 1.00 0.80 H new ATOM 0 HG22 VAL A 75 1.767 21.665 -8.052 1.00 0.80 H new ATOM 0 HG23 VAL A 75 0.048 22.127 -8.051 1.00 0.80 H new ATOM 1114 N ARG A 76 1.888 22.937 -3.299 1.00 0.58 N ATOM 1115 CA ARG A 76 1.974 23.686 -2.047 1.00 0.62 C ATOM 1116 C ARG A 76 3.407 24.138 -1.801 1.00 0.55 C ATOM 1117 O ARG A 76 4.340 23.613 -2.404 1.00 0.52 O ATOM 1118 CB ARG A 76 1.495 22.843 -0.856 1.00 0.73 C ATOM 1119 CG ARG A 76 0.997 21.457 -1.227 1.00 1.28 C ATOM 1120 CD ARG A 76 0.686 20.636 0.015 1.00 1.58 C ATOM 1121 NE ARG A 76 0.025 19.371 -0.303 1.00 2.10 N ATOM 1122 CZ ARG A 76 0.461 18.173 0.092 1.00 2.75 C ATOM 1123 NH1 ARG A 76 1.631 18.044 0.712 1.00 3.11 N ATOM 1124 NH2 ARG A 76 -0.272 17.097 -0.154 1.00 3.51 N ATOM 0 H ARG A 76 2.549 22.163 -3.371 1.00 0.58 H new ATOM 0 HA ARG A 76 1.324 24.557 -2.139 1.00 0.62 H new ATOM 0 HB2 ARG A 76 2.315 22.743 -0.145 1.00 0.73 H new ATOM 0 HB3 ARG A 76 0.694 23.379 -0.346 1.00 0.73 H new ATOM 0 HG2 ARG A 76 0.102 21.542 -1.844 1.00 1.28 H new ATOM 0 HG3 ARG A 76 1.750 20.945 -1.826 1.00 1.28 H new ATOM 0 HD2 ARG A 76 1.611 20.434 0.554 1.00 1.58 H new ATOM 0 HD3 ARG A 76 0.049 21.218 0.682 1.00 1.58 H new ATOM 0 HE ARG A 76 -0.826 19.407 -0.864 1.00 2.10 H new ATOM 0 HH11 ARG A 76 2.207 18.867 0.891 1.00 3.11 H new ATOM 0 HH12 ARG A 76 1.952 17.122 1.009 1.00 3.11 H new ATOM 0 HH21 ARG A 76 -1.163 17.188 -0.642 1.00 3.51 H new ATOM 0 HH22 ARG A 76 0.055 16.178 0.145 1.00 3.51 H new ATOM 1138 N MET A 77 3.575 25.100 -0.904 1.00 0.63 N ATOM 1139 CA MET A 77 4.897 25.617 -0.568 1.00 0.60 C ATOM 1140 C MET A 77 5.624 24.694 0.398 1.00 0.70 C ATOM 1141 O MET A 77 5.003 23.973 1.179 1.00 0.91 O ATOM 1142 CB MET A 77 4.803 27.005 0.076 1.00 0.72 C ATOM 1143 CG MET A 77 4.435 28.137 -0.870 1.00 0.80 C ATOM 1144 SD MET A 77 4.359 29.720 0.004 1.00 1.12 S ATOM 1145 CE MET A 77 3.857 30.850 -1.294 1.00 0.86 C ATOM 0 H MET A 77 2.810 25.540 -0.393 1.00 0.63 H new ATOM 0 HA MET A 77 5.452 25.680 -1.504 1.00 0.60 H new ATOM 0 HB2 MET A 77 4.063 26.967 0.876 1.00 0.72 H new ATOM 0 HB3 MET A 77 5.762 27.238 0.539 1.00 0.72 H new ATOM 0 HG2 MET A 77 5.169 28.197 -1.673 1.00 0.80 H new ATOM 0 HG3 MET A 77 3.471 27.928 -1.334 1.00 0.80 H new ATOM 0 HE1 MET A 77 4.441 31.767 -1.224 1.00 0.86 H new ATOM 0 HE2 MET A 77 4.025 30.386 -2.266 1.00 0.86 H new ATOM 0 HE3 MET A 77 2.798 31.085 -1.183 1.00 0.86 H new ATOM 1155 N LEU A 78 6.941 24.739 0.336 1.00 0.65 N ATOM 1156 CA LEU A 78 7.791 24.049 1.288 1.00 0.83 C ATOM 1157 C LEU A 78 8.671 25.058 2.016 1.00 0.83 C ATOM 1158 O LEU A 78 8.867 26.174 1.526 1.00 0.93 O ATOM 1159 CB LEU A 78 8.670 23.016 0.581 1.00 0.99 C ATOM 1160 CG LEU A 78 8.009 21.668 0.298 1.00 1.05 C ATOM 1161 CD1 LEU A 78 8.968 20.769 -0.457 1.00 1.49 C ATOM 1162 CD2 LEU A 78 7.572 20.995 1.590 1.00 1.67 C ATOM 0 H LEU A 78 7.453 25.257 -0.378 1.00 0.65 H new ATOM 0 HA LEU A 78 7.156 23.531 2.006 1.00 0.83 H new ATOM 0 HB2 LEU A 78 9.008 23.440 -0.364 1.00 0.99 H new ATOM 0 HB3 LEU A 78 9.558 22.844 1.189 1.00 0.99 H new ATOM 0 HG LEU A 78 7.123 21.842 -0.313 1.00 1.05 H new ATOM 0 HD11 LEU A 78 8.489 19.810 -0.655 1.00 1.49 H new ATOM 0 HD12 LEU A 78 9.241 21.240 -1.401 1.00 1.49 H new ATOM 0 HD13 LEU A 78 9.865 20.610 0.141 1.00 1.49 H new ATOM 0 HD21 LEU A 78 7.104 20.037 1.361 1.00 1.67 H new ATOM 0 HD22 LEU A 78 8.441 20.832 2.227 1.00 1.67 H new ATOM 0 HD23 LEU A 78 6.857 21.633 2.109 1.00 1.67 H new ATOM 1174 N PRO A 79 9.187 24.699 3.202 1.00 1.15 N ATOM 1175 CA PRO A 79 10.121 25.554 3.935 1.00 1.27 C ATOM 1176 C PRO A 79 11.419 25.768 3.167 1.00 1.13 C ATOM 1177 O PRO A 79 11.815 24.936 2.349 1.00 1.59 O ATOM 1178 CB PRO A 79 10.380 24.792 5.241 1.00 1.97 C ATOM 1179 CG PRO A 79 9.267 23.807 5.346 1.00 2.15 C ATOM 1180 CD PRO A 79 8.889 23.458 3.936 1.00 1.65 C ATOM 0 HA PRO A 79 9.715 26.552 4.098 1.00 1.27 H new ATOM 0 HB2 PRO A 79 11.348 24.291 5.219 1.00 1.97 H new ATOM 0 HB3 PRO A 79 10.390 25.468 6.096 1.00 1.97 H new ATOM 0 HG2 PRO A 79 9.581 22.920 5.897 1.00 2.15 H new ATOM 0 HG3 PRO A 79 8.419 24.232 5.883 1.00 2.15 H new ATOM 0 HD2 PRO A 79 9.469 22.616 3.559 1.00 1.65 H new ATOM 0 HD3 PRO A 79 7.837 23.183 3.855 1.00 1.65 H new ATOM 1188 N LYS A 80 12.075 26.882 3.435 1.00 1.09 N ATOM 1189 CA LYS A 80 13.244 27.271 2.685 1.00 1.37 C ATOM 1190 C LYS A 80 14.470 26.498 3.153 1.00 1.18 C ATOM 1191 O LYS A 80 14.567 26.122 4.323 1.00 1.19 O ATOM 1192 CB LYS A 80 13.467 28.770 2.849 1.00 1.96 C ATOM 1193 CG LYS A 80 13.878 29.462 1.573 1.00 2.65 C ATOM 1194 CD LYS A 80 12.760 29.435 0.546 1.00 3.44 C ATOM 1195 CE LYS A 80 13.199 30.041 -0.773 1.00 4.04 C ATOM 1196 NZ LYS A 80 14.321 29.281 -1.386 1.00 4.61 N ATOM 0 H LYS A 80 11.812 27.535 4.173 1.00 1.09 H new ATOM 0 HA LYS A 80 13.085 27.039 1.632 1.00 1.37 H new ATOM 0 HB2 LYS A 80 12.550 29.227 3.221 1.00 1.96 H new ATOM 0 HB3 LYS A 80 14.235 28.934 3.605 1.00 1.96 H new ATOM 0 HG2 LYS A 80 14.152 30.495 1.789 1.00 2.65 H new ATOM 0 HG3 LYS A 80 14.764 28.977 1.163 1.00 2.65 H new ATOM 0 HD2 LYS A 80 12.438 28.406 0.385 1.00 3.44 H new ATOM 0 HD3 LYS A 80 11.899 29.982 0.930 1.00 3.44 H new ATOM 0 HE2 LYS A 80 12.355 30.061 -1.462 1.00 4.04 H new ATOM 0 HE3 LYS A 80 13.505 31.075 -0.614 1.00 4.04 H new ATOM 0 HZ1 LYS A 80 15.183 29.863 -1.372 1.00 4.61 H new ATOM 0 HZ2 LYS A 80 14.484 28.407 -0.846 1.00 4.61 H new ATOM 0 HZ3 LYS A 80 14.081 29.041 -2.369 1.00 4.61 H new ATOM 1210 N ASN A 81 15.383 26.257 2.218 1.00 1.26 N ATOM 1211 CA ASN A 81 16.647 25.571 2.490 1.00 1.35 C ATOM 1212 C ASN A 81 16.415 24.090 2.746 1.00 1.23 C ATOM 1213 O ASN A 81 17.177 23.443 3.467 1.00 1.43 O ATOM 1214 CB ASN A 81 17.404 26.203 3.671 1.00 1.57 C ATOM 1215 CG ASN A 81 17.835 27.631 3.394 1.00 2.26 C ATOM 1216 OD1 ASN A 81 18.865 27.868 2.764 1.00 2.84 O ATOM 1217 ND2 ASN A 81 17.070 28.591 3.889 1.00 2.81 N ATOM 0 H ASN A 81 15.269 26.533 1.243 1.00 1.26 H new ATOM 0 HA ASN A 81 17.268 25.683 1.601 1.00 1.35 H new ATOM 0 HB2 ASN A 81 16.768 26.185 4.556 1.00 1.57 H new ATOM 0 HB3 ASN A 81 18.283 25.600 3.898 1.00 1.57 H new ATOM 0 HD21 ASN A 81 17.327 29.569 3.754 1.00 2.81 H new ATOM 0 HD22 ASN A 81 16.223 28.353 4.406 1.00 2.81 H new ATOM 1224 N SER A 82 15.379 23.544 2.122 1.00 1.01 N ATOM 1225 CA SER A 82 15.067 22.129 2.242 1.00 1.03 C ATOM 1226 C SER A 82 15.833 21.336 1.186 1.00 0.96 C ATOM 1227 O SER A 82 15.885 20.104 1.220 1.00 1.12 O ATOM 1228 CB SER A 82 13.560 21.903 2.083 1.00 1.08 C ATOM 1229 OG SER A 82 13.112 22.296 0.795 1.00 1.70 O ATOM 0 H SER A 82 14.738 24.065 1.524 1.00 1.01 H new ATOM 0 HA SER A 82 15.368 21.784 3.231 1.00 1.03 H new ATOM 0 HB2 SER A 82 13.329 20.850 2.245 1.00 1.08 H new ATOM 0 HB3 SER A 82 13.023 22.468 2.845 1.00 1.08 H new ATOM 0 HG SER A 82 13.722 22.969 0.428 1.00 1.70 H new ATOM 1235 N ILE A 83 16.415 22.065 0.239 1.00 0.83 N ATOM 1236 CA ILE A 83 17.187 21.463 -0.839 1.00 0.77 C ATOM 1237 C ILE A 83 18.624 21.227 -0.372 1.00 0.76 C ATOM 1238 O ILE A 83 19.243 22.120 0.209 1.00 0.78 O ATOM 1239 CB ILE A 83 17.197 22.369 -2.099 1.00 0.76 C ATOM 1240 CG1 ILE A 83 15.794 22.929 -2.388 1.00 0.92 C ATOM 1241 CG2 ILE A 83 17.722 21.614 -3.313 1.00 0.79 C ATOM 1242 CD1 ILE A 83 14.704 21.883 -2.465 1.00 0.69 C ATOM 0 H ILE A 83 16.365 23.083 0.198 1.00 0.83 H new ATOM 0 HA ILE A 83 16.719 20.514 -1.102 1.00 0.77 H new ATOM 0 HB ILE A 83 17.867 23.204 -1.897 1.00 0.76 H new ATOM 0 HG12 ILE A 83 15.536 23.647 -1.610 1.00 0.92 H new ATOM 0 HG13 ILE A 83 15.822 23.476 -3.330 1.00 0.92 H new ATOM 0 HG21 ILE A 83 17.718 22.273 -4.181 1.00 0.79 H new ATOM 0 HG22 ILE A 83 18.740 21.276 -3.119 1.00 0.79 H new ATOM 0 HG23 ILE A 83 17.084 20.752 -3.509 1.00 0.79 H new ATOM 0 HD11 ILE A 83 13.749 22.367 -2.672 1.00 0.69 H new ATOM 0 HD12 ILE A 83 14.933 21.177 -3.263 1.00 0.69 H new ATOM 0 HD13 ILE A 83 14.643 21.351 -1.516 1.00 0.69 H new ATOM 1254 N PRO A 84 19.168 20.020 -0.595 1.00 0.82 N ATOM 1255 CA PRO A 84 20.528 19.678 -0.167 1.00 0.89 C ATOM 1256 C PRO A 84 21.595 20.410 -0.978 1.00 0.83 C ATOM 1257 O PRO A 84 21.387 20.734 -2.149 1.00 0.82 O ATOM 1258 CB PRO A 84 20.606 18.170 -0.419 1.00 1.03 C ATOM 1259 CG PRO A 84 19.651 17.941 -1.535 1.00 1.03 C ATOM 1260 CD PRO A 84 18.512 18.889 -1.280 1.00 0.91 C ATOM 0 HA PRO A 84 20.714 19.964 0.868 1.00 0.89 H new ATOM 0 HB2 PRO A 84 21.616 17.862 -0.689 1.00 1.03 H new ATOM 0 HB3 PRO A 84 20.326 17.602 0.468 1.00 1.03 H new ATOM 0 HG2 PRO A 84 20.118 18.138 -2.500 1.00 1.03 H new ATOM 0 HG3 PRO A 84 19.306 16.907 -1.553 1.00 1.03 H new ATOM 0 HD2 PRO A 84 18.032 19.202 -2.207 1.00 0.91 H new ATOM 0 HD3 PRO A 84 17.740 18.434 -0.659 1.00 0.91 H new ATOM 1268 N GLN A 85 22.734 20.666 -0.356 1.00 0.88 N ATOM 1269 CA GLN A 85 23.830 21.350 -1.022 1.00 0.88 C ATOM 1270 C GLN A 85 25.115 20.536 -0.894 1.00 0.77 C ATOM 1271 O GLN A 85 25.299 19.822 0.092 1.00 0.74 O ATOM 1272 CB GLN A 85 24.013 22.755 -0.439 1.00 1.06 C ATOM 1273 CG GLN A 85 24.166 22.777 1.073 1.00 1.73 C ATOM 1274 CD GLN A 85 24.043 24.174 1.643 1.00 2.21 C ATOM 1275 OE1 GLN A 85 25.031 24.891 1.795 1.00 2.76 O ATOM 1276 NE2 GLN A 85 22.821 24.573 1.954 1.00 2.65 N ATOM 0 H GLN A 85 22.924 20.409 0.613 1.00 0.88 H new ATOM 0 HA GLN A 85 23.592 21.450 -2.081 1.00 0.88 H new ATOM 0 HB2 GLN A 85 24.893 23.214 -0.890 1.00 1.06 H new ATOM 0 HB3 GLN A 85 23.156 23.368 -0.717 1.00 1.06 H new ATOM 0 HG2 GLN A 85 23.407 22.136 1.522 1.00 1.73 H new ATOM 0 HG3 GLN A 85 25.136 22.361 1.344 1.00 1.73 H new ATOM 0 HE21 GLN A 85 22.028 23.947 1.812 1.00 2.65 H new ATOM 0 HE22 GLN A 85 22.671 25.507 2.336 1.00 2.65 H new ATOM 1285 N PRO A 86 26.005 20.616 -1.899 1.00 0.81 N ATOM 1286 CA PRO A 86 27.231 19.806 -1.950 1.00 0.79 C ATOM 1287 C PRO A 86 28.281 20.220 -0.922 1.00 0.77 C ATOM 1288 O PRO A 86 28.664 21.391 -0.833 1.00 0.85 O ATOM 1289 CB PRO A 86 27.754 20.050 -3.367 1.00 0.88 C ATOM 1290 CG PRO A 86 27.228 21.390 -3.738 1.00 1.08 C ATOM 1291 CD PRO A 86 25.887 21.507 -3.069 1.00 0.95 C ATOM 0 HA PRO A 86 27.023 18.762 -1.718 1.00 0.79 H new ATOM 0 HB2 PRO A 86 28.843 20.030 -3.396 1.00 0.88 H new ATOM 0 HB3 PRO A 86 27.403 19.282 -4.056 1.00 0.88 H new ATOM 0 HG2 PRO A 86 27.901 22.180 -3.404 1.00 1.08 H new ATOM 0 HG3 PRO A 86 27.134 21.487 -4.820 1.00 1.08 H new ATOM 0 HD2 PRO A 86 25.676 22.534 -2.771 1.00 0.95 H new ATOM 0 HD3 PRO A 86 25.080 21.194 -3.731 1.00 0.95 H new ATOM 1299 N ALA A 87 28.749 19.246 -0.156 1.00 0.84 N ATOM 1300 CA ALA A 87 29.804 19.476 0.812 1.00 0.93 C ATOM 1301 C ALA A 87 31.165 19.546 0.127 1.00 0.90 C ATOM 1302 O ALA A 87 31.808 18.525 -0.122 1.00 0.98 O ATOM 1303 CB ALA A 87 29.803 18.375 1.860 1.00 1.10 C ATOM 0 H ALA A 87 28.411 18.284 -0.189 1.00 0.84 H new ATOM 0 HA ALA A 87 29.616 20.432 1.300 1.00 0.93 H new ATOM 0 HB1 ALA A 87 30.599 18.558 2.581 1.00 1.10 H new ATOM 0 HB2 ALA A 87 28.842 18.364 2.375 1.00 1.10 H new ATOM 0 HB3 ALA A 87 29.966 17.412 1.376 1.00 1.10 H new ATOM 1309 N VAL A 88 31.591 20.761 -0.187 1.00 0.87 N ATOM 1310 CA VAL A 88 32.899 20.993 -0.785 1.00 0.88 C ATOM 1311 C VAL A 88 33.556 22.182 -0.099 1.00 1.02 C ATOM 1312 O VAL A 88 33.007 23.283 -0.113 1.00 1.23 O ATOM 1313 CB VAL A 88 32.810 21.279 -2.300 1.00 0.81 C ATOM 1314 CG1 VAL A 88 34.199 21.398 -2.901 1.00 0.87 C ATOM 1315 CG2 VAL A 88 32.016 20.199 -3.016 1.00 0.94 C ATOM 0 H VAL A 88 31.044 21.609 -0.036 1.00 0.87 H new ATOM 0 HA VAL A 88 33.488 20.086 -0.650 1.00 0.88 H new ATOM 0 HB VAL A 88 32.288 22.227 -2.432 1.00 0.81 H new ATOM 0 HG11 VAL A 88 34.117 21.600 -3.969 1.00 0.87 H new ATOM 0 HG12 VAL A 88 34.736 22.214 -2.418 1.00 0.87 H new ATOM 0 HG13 VAL A 88 34.743 20.466 -2.748 1.00 0.87 H new ATOM 0 HG21 VAL A 88 31.970 20.427 -4.081 1.00 0.94 H new ATOM 0 HG22 VAL A 88 32.502 19.234 -2.872 1.00 0.94 H new ATOM 0 HG23 VAL A 88 31.005 20.160 -2.609 1.00 0.94 H new ATOM 1325 N LEU A 89 34.724 21.964 0.492 1.00 1.09 N ATOM 1326 CA LEU A 89 35.349 22.982 1.332 1.00 1.27 C ATOM 1327 C LEU A 89 35.805 24.188 0.508 1.00 1.15 C ATOM 1328 O LEU A 89 35.291 25.289 0.691 1.00 1.29 O ATOM 1329 CB LEU A 89 36.545 22.370 2.079 1.00 1.54 C ATOM 1330 CG LEU A 89 36.871 22.976 3.455 1.00 2.14 C ATOM 1331 CD1 LEU A 89 37.915 22.133 4.163 1.00 2.87 C ATOM 1332 CD2 LEU A 89 37.361 24.410 3.335 1.00 2.45 C ATOM 0 H LEU A 89 35.256 21.098 0.407 1.00 1.09 H new ATOM 0 HA LEU A 89 34.608 23.333 2.050 1.00 1.27 H new ATOM 0 HB2 LEU A 89 36.358 21.304 2.210 1.00 1.54 H new ATOM 0 HB3 LEU A 89 37.428 22.463 1.446 1.00 1.54 H new ATOM 0 HG LEU A 89 35.951 22.983 4.039 1.00 2.14 H new ATOM 0 HD11 LEU A 89 38.138 22.571 5.136 1.00 2.87 H new ATOM 0 HD12 LEU A 89 37.534 21.121 4.300 1.00 2.87 H new ATOM 0 HD13 LEU A 89 38.824 22.100 3.563 1.00 2.87 H new ATOM 0 HD21 LEU A 89 37.581 24.804 4.327 1.00 2.45 H new ATOM 0 HD22 LEU A 89 38.265 24.436 2.726 1.00 2.45 H new ATOM 0 HD23 LEU A 89 36.589 25.020 2.866 1.00 2.45 H new ATOM 1344 N GLU A 90 36.738 23.980 -0.417 1.00 1.05 N ATOM 1345 CA GLU A 90 37.303 25.093 -1.180 1.00 1.13 C ATOM 1346 C GLU A 90 36.557 25.315 -2.491 1.00 1.04 C ATOM 1347 O GLU A 90 36.040 26.402 -2.747 1.00 1.34 O ATOM 1348 CB GLU A 90 38.780 24.812 -1.470 1.00 1.30 C ATOM 1349 CG GLU A 90 39.631 24.671 -0.218 1.00 1.98 C ATOM 1350 CD GLU A 90 39.924 25.999 0.448 1.00 2.31 C ATOM 1351 OE1 GLU A 90 38.969 26.645 0.931 1.00 2.59 O ATOM 1352 OE2 GLU A 90 41.105 26.396 0.513 1.00 2.84 O ATOM 0 H GLU A 90 37.116 23.063 -0.656 1.00 1.05 H new ATOM 0 HA GLU A 90 37.202 25.999 -0.582 1.00 1.13 H new ATOM 0 HB2 GLU A 90 38.858 23.897 -2.057 1.00 1.30 H new ATOM 0 HB3 GLU A 90 39.181 25.619 -2.083 1.00 1.30 H new ATOM 0 HG2 GLU A 90 39.120 24.020 0.491 1.00 1.98 H new ATOM 0 HG3 GLU A 90 40.572 24.185 -0.477 1.00 1.98 H new ATOM 1359 N THR A 91 36.473 24.258 -3.290 1.00 0.84 N ATOM 1360 CA THR A 91 35.861 24.310 -4.613 1.00 0.77 C ATOM 1361 C THR A 91 36.181 23.014 -5.351 1.00 0.77 C ATOM 1362 O THR A 91 37.126 22.317 -4.981 1.00 0.95 O ATOM 1363 CB THR A 91 36.368 25.515 -5.441 1.00 0.81 C ATOM 1364 OG1 THR A 91 35.649 25.604 -6.678 1.00 1.42 O ATOM 1365 CG2 THR A 91 37.866 25.410 -5.724 1.00 1.41 C ATOM 0 H THR A 91 36.829 23.336 -3.038 1.00 0.84 H new ATOM 0 HA THR A 91 34.785 24.430 -4.487 1.00 0.77 H new ATOM 0 HB THR A 91 36.195 26.416 -4.852 1.00 0.81 H new ATOM 0 HG1 THR A 91 35.977 26.371 -7.193 1.00 1.42 H new ATOM 0 HG21 THR A 91 38.187 26.273 -6.307 1.00 1.41 H new ATOM 0 HG22 THR A 91 38.413 25.385 -4.782 1.00 1.41 H new ATOM 0 HG23 THR A 91 38.067 24.497 -6.285 1.00 1.41 H new ATOM 1373 N THR A 92 35.395 22.669 -6.358 1.00 0.69 N ATOM 1374 CA THR A 92 35.647 21.448 -7.104 1.00 0.73 C ATOM 1375 C THR A 92 36.233 21.752 -8.480 1.00 0.65 C ATOM 1376 O THR A 92 37.340 21.322 -8.804 1.00 0.69 O ATOM 1377 CB THR A 92 34.363 20.614 -7.274 1.00 0.81 C ATOM 1378 OG1 THR A 92 33.511 20.785 -6.133 1.00 1.30 O ATOM 1379 CG2 THR A 92 34.701 19.140 -7.433 1.00 0.82 C ATOM 0 H THR A 92 34.589 23.208 -6.674 1.00 0.69 H new ATOM 0 HA THR A 92 36.369 20.871 -6.526 1.00 0.73 H new ATOM 0 HB THR A 92 33.847 20.959 -8.170 1.00 0.81 H new ATOM 0 HG1 THR A 92 32.841 20.070 -6.115 1.00 1.30 H new ATOM 0 HG21 THR A 92 33.782 18.567 -7.552 1.00 0.82 H new ATOM 0 HG22 THR A 92 35.330 19.004 -8.313 1.00 0.82 H new ATOM 0 HG23 THR A 92 35.234 18.791 -6.548 1.00 0.82 H new ATOM 1387 N HIS A 93 35.496 22.516 -9.280 1.00 0.59 N ATOM 1388 CA HIS A 93 35.910 22.814 -10.646 1.00 0.54 C ATOM 1389 C HIS A 93 35.490 24.221 -11.043 1.00 0.49 C ATOM 1390 O HIS A 93 34.637 24.833 -10.399 1.00 0.63 O ATOM 1391 CB HIS A 93 35.292 21.822 -11.646 1.00 0.68 C ATOM 1392 CG HIS A 93 35.753 20.402 -11.498 1.00 0.62 C ATOM 1393 ND1 HIS A 93 36.960 19.931 -11.966 1.00 0.98 N ATOM 1394 CD2 HIS A 93 35.132 19.339 -10.925 1.00 0.72 C ATOM 1395 CE1 HIS A 93 37.034 18.627 -11.670 1.00 1.29 C ATOM 1396 NE2 HIS A 93 35.951 18.218 -11.039 1.00 1.10 N ATOM 0 H HIS A 93 34.610 22.940 -9.006 1.00 0.59 H new ATOM 0 HA HIS A 93 36.996 22.728 -10.675 1.00 0.54 H new ATOM 0 HB2 HIS A 93 34.208 21.849 -11.538 1.00 0.68 H new ATOM 0 HB3 HIS A 93 35.521 22.159 -12.657 1.00 0.68 H new ATOM 0 HD2 HIS A 93 34.159 19.359 -10.456 1.00 0.72 H new ATOM 0 HE1 HIS A 93 37.872 17.992 -11.916 1.00 1.29 H new ATOM 0 HE2 HIS A 93 35.754 17.275 -10.704 1.00 1.10 H new ATOM 1404 N ASN A 94 36.088 24.724 -12.109 1.00 0.45 N ATOM 1405 CA ASN A 94 35.670 25.985 -12.703 1.00 0.48 C ATOM 1406 C ASN A 94 35.266 25.727 -14.145 1.00 0.51 C ATOM 1407 O ASN A 94 35.410 24.607 -14.635 1.00 0.78 O ATOM 1408 CB ASN A 94 36.791 27.034 -12.644 1.00 0.57 C ATOM 1409 CG ASN A 94 37.965 26.720 -13.563 1.00 0.67 C ATOM 1410 OD1 ASN A 94 37.964 27.086 -14.737 1.00 1.36 O ATOM 1411 ND2 ASN A 94 38.985 26.066 -13.027 1.00 1.19 N ATOM 0 H ASN A 94 36.871 24.275 -12.585 1.00 0.45 H new ATOM 0 HA ASN A 94 34.826 26.382 -12.139 1.00 0.48 H new ATOM 0 HB2 ASN A 94 36.381 28.008 -12.911 1.00 0.57 H new ATOM 0 HB3 ASN A 94 37.153 27.111 -11.619 1.00 0.57 H new ATOM 0 HD21 ASN A 94 39.806 25.850 -13.592 1.00 1.19 H new ATOM 0 HD22 ASN A 94 38.949 25.779 -12.049 1.00 1.19 H new ATOM 1418 N GLY A 95 34.743 26.734 -14.814 1.00 0.45 N ATOM 1419 CA GLY A 95 34.420 26.582 -16.210 1.00 0.49 C ATOM 1420 C GLY A 95 33.778 27.820 -16.767 1.00 0.47 C ATOM 1421 O GLY A 95 33.699 28.842 -16.088 1.00 0.53 O ATOM 0 H GLY A 95 34.537 27.651 -14.418 1.00 0.45 H new ATOM 0 HA2 GLY A 95 35.327 26.358 -16.772 1.00 0.49 H new ATOM 0 HA3 GLY A 95 33.748 25.734 -16.338 1.00 0.49 H new ATOM 1425 N VAL A 96 33.339 27.743 -18.004 1.00 0.47 N ATOM 1426 CA VAL A 96 32.638 28.834 -18.622 1.00 0.48 C ATOM 1427 C VAL A 96 31.242 28.397 -19.016 1.00 0.45 C ATOM 1428 O VAL A 96 30.953 27.206 -19.105 1.00 0.43 O ATOM 1429 CB VAL A 96 33.370 29.341 -19.872 1.00 0.55 C ATOM 1430 CG1 VAL A 96 34.744 29.879 -19.514 1.00 1.21 C ATOM 1431 CG2 VAL A 96 33.469 28.251 -20.930 1.00 1.37 C ATOM 0 H VAL A 96 33.459 26.926 -18.602 1.00 0.47 H new ATOM 0 HA VAL A 96 32.589 29.644 -17.894 1.00 0.48 H new ATOM 0 HB VAL A 96 32.787 30.160 -20.292 1.00 0.55 H new ATOM 0 HG11 VAL A 96 35.243 30.232 -20.416 1.00 1.21 H new ATOM 0 HG12 VAL A 96 34.639 30.705 -18.810 1.00 1.21 H new ATOM 0 HG13 VAL A 96 35.337 29.087 -19.058 1.00 1.21 H new ATOM 0 HG21 VAL A 96 33.992 28.639 -21.804 1.00 1.37 H new ATOM 0 HG22 VAL A 96 34.018 27.401 -20.526 1.00 1.37 H new ATOM 0 HG23 VAL A 96 32.467 27.932 -21.219 1.00 1.37 H new ATOM 1441 N VAL A 97 30.384 29.362 -19.255 1.00 0.50 N ATOM 1442 CA VAL A 97 29.034 29.081 -19.705 1.00 0.53 C ATOM 1443 C VAL A 97 29.070 28.468 -21.103 1.00 0.60 C ATOM 1444 O VAL A 97 29.619 29.062 -22.032 1.00 0.67 O ATOM 1445 CB VAL A 97 28.184 30.360 -19.699 1.00 0.60 C ATOM 1446 CG1 VAL A 97 26.810 30.119 -20.302 1.00 0.69 C ATOM 1447 CG2 VAL A 97 28.065 30.891 -18.281 1.00 0.57 C ATOM 0 H VAL A 97 30.595 30.354 -19.146 1.00 0.50 H new ATOM 0 HA VAL A 97 28.577 28.368 -19.019 1.00 0.53 H new ATOM 0 HB VAL A 97 28.682 31.106 -20.318 1.00 0.60 H new ATOM 0 HG11 VAL A 97 26.236 31.045 -20.281 1.00 0.69 H new ATOM 0 HG12 VAL A 97 26.919 29.783 -21.333 1.00 0.69 H new ATOM 0 HG13 VAL A 97 26.288 29.356 -19.725 1.00 0.69 H new ATOM 0 HG21 VAL A 97 27.461 31.798 -18.282 1.00 0.57 H new ATOM 0 HG22 VAL A 97 27.590 30.140 -17.650 1.00 0.57 H new ATOM 0 HG23 VAL A 97 29.058 31.116 -17.892 1.00 0.57 H new ATOM 1457 N ALA A 98 28.503 27.273 -21.240 1.00 0.61 N ATOM 1458 CA ALA A 98 28.580 26.526 -22.490 1.00 0.70 C ATOM 1459 C ALA A 98 27.588 27.050 -23.518 1.00 0.83 C ATOM 1460 O ALA A 98 27.945 27.233 -24.677 1.00 0.89 O ATOM 1461 CB ALA A 98 28.353 25.042 -22.240 1.00 0.76 C ATOM 0 H ALA A 98 27.985 26.801 -20.499 1.00 0.61 H new ATOM 0 HA ALA A 98 29.582 26.665 -22.896 1.00 0.70 H new ATOM 0 HB1 ALA A 98 28.414 24.500 -23.184 1.00 0.76 H new ATOM 0 HB2 ALA A 98 29.115 24.667 -21.557 1.00 0.76 H new ATOM 0 HB3 ALA A 98 27.367 24.894 -21.800 1.00 0.76 H new ATOM 1467 N ARG A 99 26.349 27.287 -23.102 1.00 0.97 N ATOM 1468 CA ARG A 99 25.340 27.801 -24.020 1.00 1.17 C ATOM 1469 C ARG A 99 24.058 28.152 -23.275 1.00 1.38 C ATOM 1470 O ARG A 99 23.508 27.320 -22.551 1.00 1.41 O ATOM 1471 CB ARG A 99 25.036 26.772 -25.114 1.00 1.25 C ATOM 1472 CG ARG A 99 24.377 27.373 -26.343 1.00 1.85 C ATOM 1473 CD ARG A 99 24.138 26.321 -27.410 1.00 2.04 C ATOM 1474 NE ARG A 99 23.785 26.916 -28.698 1.00 2.61 N ATOM 1475 CZ ARG A 99 23.443 26.210 -29.775 1.00 2.99 C ATOM 1476 NH1 ARG A 99 23.371 24.884 -29.711 1.00 2.82 N ATOM 1477 NH2 ARG A 99 23.174 26.828 -30.917 1.00 3.92 N ATOM 0 H ARG A 99 26.022 27.134 -22.148 1.00 0.97 H new ATOM 0 HA ARG A 99 25.736 28.706 -24.481 1.00 1.17 H new ATOM 0 HB2 ARG A 99 25.964 26.284 -25.411 1.00 1.25 H new ATOM 0 HB3 ARG A 99 24.386 25.999 -24.704 1.00 1.25 H new ATOM 0 HG2 ARG A 99 23.429 27.831 -26.062 1.00 1.85 H new ATOM 0 HG3 ARG A 99 25.008 28.166 -26.746 1.00 1.85 H new ATOM 0 HD2 ARG A 99 25.035 25.712 -27.526 1.00 2.04 H new ATOM 0 HD3 ARG A 99 23.339 25.653 -27.088 1.00 2.04 H new ATOM 0 HE ARG A 99 23.802 27.933 -28.777 1.00 2.61 H new ATOM 0 HH11 ARG A 99 23.578 24.404 -28.835 1.00 2.82 H new ATOM 0 HH12 ARG A 99 23.109 24.347 -30.538 1.00 2.82 H new ATOM 0 HH21 ARG A 99 23.229 27.845 -30.972 1.00 3.92 H new ATOM 0 HH22 ARG A 99 22.912 26.286 -31.741 1.00 3.92 H new ATOM 1688 N ALA A 112 17.677 23.630 -18.797 1.00 1.24 N ATOM 1689 CA ALA A 112 18.313 24.147 -17.590 1.00 1.02 C ATOM 1690 C ALA A 112 19.641 24.849 -17.888 1.00 0.97 C ATOM 1691 O ALA A 112 20.196 25.529 -17.027 1.00 1.15 O ATOM 1692 CB ALA A 112 18.493 23.027 -16.578 1.00 1.06 C ATOM 0 HA ALA A 112 17.655 24.904 -17.164 1.00 1.02 H new ATOM 0 HB1 ALA A 112 18.968 23.421 -15.680 1.00 1.06 H new ATOM 0 HB2 ALA A 112 17.520 22.610 -16.320 1.00 1.06 H new ATOM 0 HB3 ALA A 112 19.120 22.246 -17.008 1.00 1.06 H new ATOM 1698 N GLY A 113 20.140 24.696 -19.110 1.00 0.94 N ATOM 1699 CA GLY A 113 21.365 25.374 -19.500 1.00 0.89 C ATOM 1700 C GLY A 113 22.607 24.629 -19.041 1.00 0.79 C ATOM 1701 O GLY A 113 22.592 23.965 -18.009 1.00 0.83 O ATOM 0 H GLY A 113 19.720 24.116 -19.837 1.00 0.94 H new ATOM 0 HA2 GLY A 113 21.389 25.482 -20.584 1.00 0.89 H new ATOM 0 HA3 GLY A 113 21.371 26.380 -19.079 1.00 0.89 H new ATOM 1705 N LEU A 114 23.701 24.761 -19.779 1.00 0.73 N ATOM 1706 CA LEU A 114 24.884 23.955 -19.505 1.00 0.66 C ATOM 1707 C LEU A 114 26.146 24.801 -19.342 1.00 0.58 C ATOM 1708 O LEU A 114 26.302 25.852 -19.967 1.00 0.63 O ATOM 1709 CB LEU A 114 25.080 22.924 -20.622 1.00 0.74 C ATOM 1710 CG LEU A 114 24.020 21.822 -20.669 1.00 0.83 C ATOM 1711 CD1 LEU A 114 24.070 21.068 -21.987 1.00 0.93 C ATOM 1712 CD2 LEU A 114 24.202 20.850 -19.520 1.00 0.80 C ATOM 0 H LEU A 114 23.795 25.409 -20.561 1.00 0.73 H new ATOM 0 HA LEU A 114 24.717 23.446 -18.555 1.00 0.66 H new ATOM 0 HB2 LEU A 114 25.087 23.444 -21.580 1.00 0.74 H new ATOM 0 HB3 LEU A 114 26.060 22.462 -20.503 1.00 0.74 H new ATOM 0 HG LEU A 114 23.046 22.302 -20.578 1.00 0.83 H new ATOM 0 HD11 LEU A 114 23.305 20.291 -21.991 1.00 0.93 H new ATOM 0 HD12 LEU A 114 23.889 21.760 -22.809 1.00 0.93 H new ATOM 0 HD13 LEU A 114 25.052 20.611 -22.108 1.00 0.93 H new ATOM 0 HD21 LEU A 114 23.437 20.075 -19.574 1.00 0.80 H new ATOM 0 HD22 LEU A 114 25.189 20.391 -19.585 1.00 0.80 H new ATOM 0 HD23 LEU A 114 24.111 21.384 -18.574 1.00 0.80 H new ATOM 1724 N ILE A 115 27.035 24.319 -18.482 1.00 0.49 N ATOM 1725 CA ILE A 115 28.339 24.923 -18.259 1.00 0.42 C ATOM 1726 C ILE A 115 29.425 23.996 -18.803 1.00 0.43 C ATOM 1727 O ILE A 115 29.316 22.772 -18.694 1.00 0.47 O ATOM 1728 CB ILE A 115 28.580 25.186 -16.751 1.00 0.34 C ATOM 1729 CG1 ILE A 115 27.500 26.121 -16.208 1.00 0.36 C ATOM 1730 CG2 ILE A 115 29.963 25.782 -16.510 1.00 0.31 C ATOM 1731 CD1 ILE A 115 27.554 26.323 -14.710 1.00 0.28 C ATOM 0 H ILE A 115 26.867 23.488 -17.914 1.00 0.49 H new ATOM 0 HA ILE A 115 28.373 25.880 -18.780 1.00 0.42 H new ATOM 0 HB ILE A 115 28.529 24.233 -16.225 1.00 0.34 H new ATOM 0 HG12 ILE A 115 27.594 27.090 -16.698 1.00 0.36 H new ATOM 0 HG13 ILE A 115 26.521 25.722 -16.475 1.00 0.36 H new ATOM 0 HG21 ILE A 115 30.103 25.956 -15.443 1.00 0.31 H new ATOM 0 HG22 ILE A 115 30.725 25.090 -16.868 1.00 0.31 H new ATOM 0 HG23 ILE A 115 30.050 26.727 -17.046 1.00 0.31 H new ATOM 0 HD11 ILE A 115 26.755 26.999 -14.405 1.00 0.28 H new ATOM 0 HD12 ILE A 115 27.429 25.363 -14.209 1.00 0.28 H new ATOM 0 HD13 ILE A 115 28.517 26.753 -14.435 1.00 0.28 H new ATOM 1743 N GLU A 116 30.453 24.580 -19.392 1.00 0.43 N ATOM 1744 CA GLU A 116 31.529 23.827 -20.023 1.00 0.47 C ATOM 1745 C GLU A 116 32.667 23.611 -19.029 1.00 0.45 C ATOM 1746 O GLU A 116 33.369 24.550 -18.650 1.00 0.49 O ATOM 1747 CB GLU A 116 31.999 24.593 -21.266 1.00 0.54 C ATOM 1748 CG GLU A 116 33.077 23.897 -22.078 1.00 0.84 C ATOM 1749 CD GLU A 116 33.247 24.503 -23.458 1.00 1.03 C ATOM 1750 OE1 GLU A 116 33.884 25.569 -23.573 1.00 1.14 O ATOM 1751 OE2 GLU A 116 32.739 23.912 -24.439 1.00 1.40 O ATOM 0 H GLU A 116 30.568 25.592 -19.448 1.00 0.43 H new ATOM 0 HA GLU A 116 31.176 22.843 -20.331 1.00 0.47 H new ATOM 0 HB2 GLU A 116 31.139 24.773 -21.911 1.00 0.54 H new ATOM 0 HB3 GLU A 116 32.373 25.568 -20.954 1.00 0.54 H new ATOM 0 HG2 GLU A 116 34.024 23.952 -21.541 1.00 0.84 H new ATOM 0 HG3 GLU A 116 32.828 22.841 -22.177 1.00 0.84 H new ATOM 1758 N ILE A 117 32.820 22.365 -18.592 1.00 0.47 N ATOM 1759 CA ILE A 117 33.793 22.013 -17.567 1.00 0.50 C ATOM 1760 C ILE A 117 35.110 21.611 -18.211 1.00 0.56 C ATOM 1761 O ILE A 117 35.126 20.821 -19.157 1.00 0.63 O ATOM 1762 CB ILE A 117 33.275 20.842 -16.705 1.00 0.53 C ATOM 1763 CG1 ILE A 117 31.799 21.048 -16.378 1.00 0.48 C ATOM 1764 CG2 ILE A 117 34.086 20.711 -15.422 1.00 0.60 C ATOM 1765 CD1 ILE A 117 31.515 22.326 -15.633 1.00 0.41 C ATOM 0 H ILE A 117 32.275 21.575 -18.937 1.00 0.47 H new ATOM 0 HA ILE A 117 33.946 22.885 -16.932 1.00 0.50 H new ATOM 0 HB ILE A 117 33.389 19.919 -17.274 1.00 0.53 H new ATOM 0 HG12 ILE A 117 31.227 21.044 -17.306 1.00 0.48 H new ATOM 0 HG13 ILE A 117 31.447 20.205 -15.783 1.00 0.48 H new ATOM 0 HG21 ILE A 117 33.702 19.879 -14.832 1.00 0.60 H new ATOM 0 HG22 ILE A 117 35.132 20.528 -15.670 1.00 0.60 H new ATOM 0 HG23 ILE A 117 34.006 21.632 -14.845 1.00 0.60 H new ATOM 0 HD11 ILE A 117 30.446 22.402 -15.436 1.00 0.41 H new ATOM 0 HD12 ILE A 117 32.059 22.325 -14.688 1.00 0.41 H new ATOM 0 HD13 ILE A 117 31.835 23.177 -16.235 1.00 0.41 H new ATOM 1777 N LEU A 118 36.206 22.150 -17.714 1.00 0.61 N ATOM 1778 CA LEU A 118 37.511 21.861 -18.286 1.00 0.70 C ATOM 1779 C LEU A 118 38.164 20.674 -17.586 1.00 0.79 C ATOM 1780 O LEU A 118 37.867 20.375 -16.427 1.00 0.88 O ATOM 1781 CB LEU A 118 38.437 23.089 -18.208 1.00 0.84 C ATOM 1782 CG LEU A 118 39.100 23.368 -16.847 1.00 0.96 C ATOM 1783 CD1 LEU A 118 40.089 24.516 -16.966 1.00 1.15 C ATOM 1784 CD2 LEU A 118 38.071 23.680 -15.768 1.00 1.21 C ATOM 0 H LEU A 118 36.222 22.788 -16.919 1.00 0.61 H new ATOM 0 HA LEU A 118 37.358 21.608 -19.335 1.00 0.70 H new ATOM 0 HB2 LEU A 118 39.224 22.970 -18.952 1.00 0.84 H new ATOM 0 HB3 LEU A 118 37.860 23.969 -18.493 1.00 0.84 H new ATOM 0 HG LEU A 118 39.630 22.462 -16.552 1.00 0.96 H new ATOM 0 HD11 LEU A 118 40.550 24.701 -15.996 1.00 1.15 H new ATOM 0 HD12 LEU A 118 40.861 24.257 -17.691 1.00 1.15 H new ATOM 0 HD13 LEU A 118 39.567 25.414 -17.297 1.00 1.15 H new ATOM 0 HD21 LEU A 118 38.581 23.871 -14.824 1.00 1.21 H new ATOM 0 HD22 LEU A 118 37.498 24.562 -16.056 1.00 1.21 H new ATOM 0 HD23 LEU A 118 37.397 22.831 -15.652 1.00 1.21 H new ATOM 1796 N ASP A 119 39.041 19.997 -18.316 1.00 0.83 N ATOM 1797 CA ASP A 119 39.921 18.981 -17.749 1.00 0.95 C ATOM 1798 C ASP A 119 40.712 19.594 -16.594 1.00 1.01 C ATOM 1799 O ASP A 119 41.030 20.782 -16.633 1.00 0.98 O ATOM 1800 CB ASP A 119 40.843 18.478 -18.868 1.00 1.05 C ATOM 1801 CG ASP A 119 42.024 17.659 -18.388 1.00 1.65 C ATOM 1802 OD1 ASP A 119 43.058 18.263 -18.034 1.00 2.29 O ATOM 1803 OD2 ASP A 119 41.949 16.418 -18.425 1.00 2.22 O ATOM 0 H ASP A 119 39.163 20.136 -19.319 1.00 0.83 H new ATOM 0 HA ASP A 119 39.356 18.137 -17.352 1.00 0.95 H new ATOM 0 HB2 ASP A 119 40.257 17.875 -19.561 1.00 1.05 H new ATOM 0 HB3 ASP A 119 41.215 19.336 -19.428 1.00 1.05 H new ATOM 1808 N GLU A 120 41.019 18.804 -15.571 1.00 1.17 N ATOM 1809 CA GLU A 120 41.598 19.337 -14.333 1.00 1.32 C ATOM 1810 C GLU A 120 42.965 19.986 -14.559 1.00 1.33 C ATOM 1811 O GLU A 120 43.419 20.791 -13.743 1.00 1.44 O ATOM 1812 CB GLU A 120 41.709 18.252 -13.252 1.00 1.55 C ATOM 1813 CG GLU A 120 42.452 17.004 -13.696 1.00 1.63 C ATOM 1814 CD GLU A 120 41.535 15.952 -14.294 1.00 1.96 C ATOM 1815 OE1 GLU A 120 41.302 14.915 -13.644 1.00 1.89 O ATOM 1816 OE2 GLU A 120 41.032 16.166 -15.415 1.00 2.78 O ATOM 0 H GLU A 120 40.879 17.794 -15.570 1.00 1.17 H new ATOM 0 HA GLU A 120 40.913 20.112 -13.988 1.00 1.32 H new ATOM 0 HB2 GLU A 120 42.214 18.672 -12.382 1.00 1.55 H new ATOM 0 HB3 GLU A 120 40.706 17.970 -12.932 1.00 1.55 H new ATOM 0 HG2 GLU A 120 43.208 17.280 -14.431 1.00 1.63 H new ATOM 0 HG3 GLU A 120 42.978 16.577 -12.842 1.00 1.63 H new ATOM 1823 N LEU A 121 43.620 19.646 -15.659 1.00 1.28 N ATOM 1824 CA LEU A 121 44.902 20.250 -15.992 1.00 1.34 C ATOM 1825 C LEU A 121 44.712 21.313 -17.073 1.00 1.21 C ATOM 1826 O LEU A 121 45.679 21.783 -17.674 1.00 1.27 O ATOM 1827 CB LEU A 121 45.908 19.195 -16.485 1.00 1.45 C ATOM 1828 CG LEU A 121 46.244 18.049 -15.516 1.00 1.65 C ATOM 1829 CD1 LEU A 121 46.211 18.511 -14.067 1.00 1.77 C ATOM 1830 CD2 LEU A 121 45.304 16.876 -15.741 1.00 1.65 C ATOM 0 H LEU A 121 43.287 18.958 -16.334 1.00 1.28 H new ATOM 0 HA LEU A 121 45.300 20.709 -15.087 1.00 1.34 H new ATOM 0 HB2 LEU A 121 45.519 18.759 -17.405 1.00 1.45 H new ATOM 0 HB3 LEU A 121 46.836 19.705 -16.742 1.00 1.45 H new ATOM 0 HG LEU A 121 47.262 17.720 -15.723 1.00 1.65 H new ATOM 0 HD11 LEU A 121 46.453 17.674 -13.413 1.00 1.77 H new ATOM 0 HD12 LEU A 121 46.941 19.308 -13.922 1.00 1.77 H new ATOM 0 HD13 LEU A 121 45.215 18.883 -13.826 1.00 1.77 H new ATOM 0 HD21 LEU A 121 45.553 16.072 -15.048 1.00 1.65 H new ATOM 0 HD22 LEU A 121 44.276 17.196 -15.571 1.00 1.65 H new ATOM 0 HD23 LEU A 121 45.408 16.518 -16.765 1.00 1.65 H new ATOM 1842 N ARG A 122 43.454 21.687 -17.299 1.00 1.11 N ATOM 1843 CA ARG A 122 43.069 22.606 -18.369 1.00 1.08 C ATOM 1844 C ARG A 122 43.508 22.060 -19.720 1.00 1.13 C ATOM 1845 O ARG A 122 44.555 22.430 -20.254 1.00 1.46 O ATOM 1846 CB ARG A 122 43.626 24.023 -18.151 1.00 1.24 C ATOM 1847 CG ARG A 122 43.180 25.017 -19.219 1.00 1.80 C ATOM 1848 CD ARG A 122 43.804 26.388 -19.017 1.00 2.04 C ATOM 1849 NE ARG A 122 43.503 27.291 -20.130 1.00 2.50 N ATOM 1850 CZ ARG A 122 44.421 27.819 -20.939 1.00 3.32 C ATOM 1851 NH1 ARG A 122 45.708 27.516 -20.782 1.00 3.73 N ATOM 1852 NH2 ARG A 122 44.045 28.640 -21.913 1.00 4.14 N ATOM 0 H ARG A 122 42.667 21.358 -16.740 1.00 1.11 H new ATOM 0 HA ARG A 122 41.982 22.685 -18.352 1.00 1.08 H new ATOM 0 HB2 ARG A 122 43.309 24.384 -17.173 1.00 1.24 H new ATOM 0 HB3 ARG A 122 44.715 23.980 -18.137 1.00 1.24 H new ATOM 0 HG2 ARG A 122 43.451 24.637 -20.204 1.00 1.80 H new ATOM 0 HG3 ARG A 122 42.094 25.107 -19.200 1.00 1.80 H new ATOM 0 HD2 ARG A 122 43.436 26.822 -18.087 1.00 2.04 H new ATOM 0 HD3 ARG A 122 44.884 26.284 -18.915 1.00 2.04 H new ATOM 0 HE ARG A 122 42.526 27.532 -20.297 1.00 2.50 H new ATOM 0 HH11 ARG A 122 45.995 26.877 -20.040 1.00 3.73 H new ATOM 0 HH12 ARG A 122 46.407 27.922 -21.404 1.00 3.73 H new ATOM 0 HH21 ARG A 122 43.058 28.864 -22.039 1.00 4.14 H new ATOM 0 HH22 ARG A 122 44.743 29.047 -22.535 1.00 4.14 H new ATOM 1866 N THR A 123 42.717 21.149 -20.246 1.00 1.08 N ATOM 1867 CA THR A 123 42.975 20.585 -21.553 1.00 1.20 C ATOM 1868 C THR A 123 41.838 20.948 -22.502 1.00 1.15 C ATOM 1869 O THR A 123 41.995 21.798 -23.376 1.00 1.38 O ATOM 1870 CB THR A 123 43.140 19.049 -21.475 1.00 1.40 C ATOM 1871 OG1 THR A 123 44.136 18.710 -20.495 1.00 1.86 O ATOM 1872 CG2 THR A 123 43.545 18.471 -22.822 1.00 1.87 C ATOM 0 H THR A 123 41.885 20.782 -19.785 1.00 1.08 H new ATOM 0 HA THR A 123 43.908 21.002 -21.932 1.00 1.20 H new ATOM 0 HB THR A 123 42.178 18.624 -21.188 1.00 1.40 H new ATOM 0 HG1 THR A 123 43.728 18.701 -19.604 1.00 1.86 H new ATOM 0 HG21 THR A 123 43.653 17.390 -22.736 1.00 1.87 H new ATOM 0 HG22 THR A 123 42.779 18.701 -23.562 1.00 1.87 H new ATOM 0 HG23 THR A 123 44.494 18.907 -23.135 1.00 1.87 H new ATOM 1880 N THR A 124 40.686 20.323 -22.290 1.00 1.01 N ATOM 1881 CA THR A 124 39.499 20.565 -23.093 1.00 1.03 C ATOM 1882 C THR A 124 38.249 20.431 -22.236 1.00 0.89 C ATOM 1883 O THR A 124 38.343 20.233 -21.020 1.00 0.85 O ATOM 1884 CB THR A 124 39.428 19.571 -24.268 1.00 1.26 C ATOM 1885 OG1 THR A 124 39.900 18.284 -23.845 1.00 1.54 O ATOM 1886 CG2 THR A 124 40.257 20.067 -25.443 1.00 1.53 C ATOM 0 H THR A 124 40.551 19.632 -21.552 1.00 1.01 H new ATOM 0 HA THR A 124 39.556 21.578 -23.491 1.00 1.03 H new ATOM 0 HB THR A 124 38.390 19.487 -24.590 1.00 1.26 H new ATOM 0 HG1 THR A 124 39.851 17.655 -24.595 1.00 1.54 H new ATOM 0 HG21 THR A 124 40.193 19.350 -26.262 1.00 1.53 H new ATOM 0 HG22 THR A 124 39.876 21.033 -25.775 1.00 1.53 H new ATOM 0 HG23 THR A 124 41.297 20.174 -25.135 1.00 1.53 H new ATOM 1894 N VAL A 125 37.090 20.559 -22.865 1.00 0.90 N ATOM 1895 CA VAL A 125 35.821 20.351 -22.181 1.00 0.82 C ATOM 1896 C VAL A 125 35.613 18.868 -21.903 1.00 0.86 C ATOM 1897 O VAL A 125 35.905 18.028 -22.754 1.00 0.96 O ATOM 1898 CB VAL A 125 34.626 20.890 -23.006 1.00 0.82 C ATOM 1899 CG1 VAL A 125 34.644 20.337 -24.420 1.00 1.17 C ATOM 1900 CG2 VAL A 125 33.302 20.547 -22.344 1.00 1.29 C ATOM 0 H VAL A 125 37.002 20.807 -23.851 1.00 0.90 H new ATOM 0 HA VAL A 125 35.863 20.904 -21.243 1.00 0.82 H new ATOM 0 HB VAL A 125 34.728 21.974 -23.049 1.00 0.82 H new ATOM 0 HG11 VAL A 125 33.794 20.732 -24.976 1.00 1.17 H new ATOM 0 HG12 VAL A 125 35.570 20.632 -24.914 1.00 1.17 H new ATOM 0 HG13 VAL A 125 34.581 19.249 -24.386 1.00 1.17 H new ATOM 0 HG21 VAL A 125 32.482 20.938 -22.946 1.00 1.29 H new ATOM 0 HG22 VAL A 125 33.207 19.464 -22.261 1.00 1.29 H new ATOM 0 HG23 VAL A 125 33.266 20.992 -21.350 1.00 1.29 H new ATOM 1910 N ILE A 126 35.125 18.542 -20.712 1.00 0.82 N ATOM 1911 CA ILE A 126 34.876 17.153 -20.375 1.00 0.90 C ATOM 1912 C ILE A 126 33.571 16.693 -20.994 1.00 0.93 C ATOM 1913 O ILE A 126 33.569 15.903 -21.935 1.00 1.03 O ATOM 1914 CB ILE A 126 34.774 16.954 -18.851 1.00 0.89 C ATOM 1915 CG1 ILE A 126 35.962 17.592 -18.139 1.00 0.87 C ATOM 1916 CG2 ILE A 126 34.696 15.472 -18.514 1.00 1.00 C ATOM 1917 CD1 ILE A 126 35.784 17.672 -16.641 1.00 0.87 C ATOM 0 H ILE A 126 34.898 19.211 -19.976 1.00 0.82 H new ATOM 0 HA ILE A 126 35.713 16.572 -20.761 1.00 0.90 H new ATOM 0 HB ILE A 126 33.863 17.443 -18.506 1.00 0.89 H new ATOM 0 HG12 ILE A 126 36.862 17.018 -18.362 1.00 0.87 H new ATOM 0 HG13 ILE A 126 36.118 18.596 -18.534 1.00 0.87 H new ATOM 0 HG21 ILE A 126 34.624 15.348 -17.433 1.00 1.00 H new ATOM 0 HG22 ILE A 126 33.816 15.037 -18.988 1.00 1.00 H new ATOM 0 HG23 ILE A 126 35.591 14.968 -18.878 1.00 1.00 H new ATOM 0 HD11 ILE A 126 36.664 18.136 -16.194 1.00 0.87 H new ATOM 0 HD12 ILE A 126 34.902 18.270 -16.411 1.00 0.87 H new ATOM 0 HD13 ILE A 126 35.658 16.668 -16.236 1.00 0.87 H new ATOM 1929 N SER A 127 32.459 17.198 -20.475 1.00 0.87 N ATOM 1930 CA SER A 127 31.175 16.909 -21.071 1.00 0.92 C ATOM 1931 C SER A 127 30.291 18.155 -21.110 1.00 0.84 C ATOM 1932 O SER A 127 30.292 18.912 -22.080 1.00 0.85 O ATOM 1933 CB SER A 127 30.505 15.774 -20.288 1.00 0.99 C ATOM 1934 OG SER A 127 30.465 16.063 -18.898 1.00 1.56 O ATOM 0 H SER A 127 32.426 17.801 -19.653 1.00 0.87 H new ATOM 0 HA SER A 127 31.321 16.593 -22.104 1.00 0.92 H new ATOM 0 HB2 SER A 127 29.492 15.621 -20.660 1.00 0.99 H new ATOM 0 HB3 SER A 127 31.049 14.844 -20.453 1.00 0.99 H new ATOM 0 HG SER A 127 30.031 15.324 -18.423 1.00 1.56 H new ATOM 1940 N GLN A 128 29.561 18.352 -20.015 1.00 0.79 N ATOM 1941 CA GLN A 128 28.718 19.514 -19.793 1.00 0.74 C ATOM 1942 C GLN A 128 28.091 19.391 -18.407 1.00 0.69 C ATOM 1943 O GLN A 128 27.701 18.294 -18.007 1.00 0.73 O ATOM 1944 CB GLN A 128 27.613 19.642 -20.862 1.00 0.86 C ATOM 1945 CG GLN A 128 26.575 18.518 -20.849 1.00 1.02 C ATOM 1946 CD GLN A 128 26.992 17.288 -21.639 1.00 1.43 C ATOM 1947 OE1 GLN A 128 27.705 17.491 -22.738 1.00 2.08 O flip ATOM 1948 NE2 GLN A 128 26.652 16.165 -21.281 1.00 1.88 N flip ATOM 0 H GLN A 128 29.542 17.689 -19.240 1.00 0.79 H new ATOM 0 HA GLN A 128 29.333 20.411 -19.863 1.00 0.74 H new ATOM 0 HB2 GLN A 128 27.100 20.593 -20.722 1.00 0.86 H new ATOM 0 HB3 GLN A 128 28.081 19.674 -21.846 1.00 0.86 H new ATOM 0 HG2 GLN A 128 26.382 18.227 -19.817 1.00 1.02 H new ATOM 0 HG3 GLN A 128 25.637 18.898 -21.254 1.00 1.02 H new ATOM 0 HE21 GLN A 128 26.103 16.045 -20.429 1.00 1.88 H new ATOM 0 HE22 GLN A 128 26.918 15.351 -21.835 1.00 1.88 H new ATOM 1957 N HIS A 129 28.011 20.480 -17.664 1.00 0.63 N ATOM 1958 CA HIS A 129 27.305 20.454 -16.387 1.00 0.60 C ATOM 1959 C HIS A 129 26.121 21.393 -16.419 1.00 0.58 C ATOM 1960 O HIS A 129 26.272 22.588 -16.647 1.00 0.54 O ATOM 1961 CB HIS A 129 28.214 20.825 -15.212 1.00 0.54 C ATOM 1962 CG HIS A 129 29.179 19.751 -14.804 1.00 0.58 C ATOM 1963 ND1 HIS A 129 29.580 18.634 -15.462 1.00 0.58 N flip ATOM 1964 CD2 HIS A 129 29.869 19.755 -13.614 1.00 0.65 C flip ATOM 1965 CE1 HIS A 129 30.509 17.951 -14.684 1.00 0.65 C flip ATOM 1966 NE2 HIS A 129 30.650 18.666 -13.586 1.00 0.68 N flip ATOM 0 H HIS A 129 28.417 21.382 -17.913 1.00 0.63 H new ATOM 0 HA HIS A 129 26.963 19.430 -16.237 1.00 0.60 H new ATOM 0 HB2 HIS A 129 28.777 21.720 -15.474 1.00 0.54 H new ATOM 0 HB3 HIS A 129 27.591 21.080 -14.355 1.00 0.54 H new ATOM 0 HD2 HIS A 129 29.795 20.504 -12.839 1.00 0.65 H new ATOM 0 HE1 HIS A 129 31.011 17.027 -14.929 1.00 0.65 H new ATOM 0 HE2 HIS A 129 31.272 18.422 -12.815 1.00 0.68 H new ATOM 1974 N GLU A 130 24.948 20.841 -16.196 1.00 0.64 N ATOM 1975 CA GLU A 130 23.724 21.618 -16.195 1.00 0.64 C ATOM 1976 C GLU A 130 23.585 22.365 -14.870 1.00 0.56 C ATOM 1977 O GLU A 130 24.067 21.894 -13.835 1.00 0.54 O ATOM 1978 CB GLU A 130 22.546 20.675 -16.427 1.00 0.77 C ATOM 1979 CG GLU A 130 21.390 21.312 -17.166 1.00 0.82 C ATOM 1980 CD GLU A 130 20.322 20.308 -17.535 1.00 0.98 C ATOM 1981 OE1 GLU A 130 20.014 20.187 -18.741 1.00 1.18 O ATOM 1982 OE2 GLU A 130 19.791 19.644 -16.622 1.00 1.19 O ATOM 0 H GLU A 130 24.814 19.847 -16.011 1.00 0.64 H new ATOM 0 HA GLU A 130 23.744 22.360 -16.993 1.00 0.64 H new ATOM 0 HB2 GLU A 130 22.892 19.808 -16.991 1.00 0.77 H new ATOM 0 HB3 GLU A 130 22.191 20.308 -15.464 1.00 0.77 H new ATOM 0 HG2 GLU A 130 20.952 22.094 -16.546 1.00 0.82 H new ATOM 0 HG3 GLU A 130 21.761 21.793 -18.071 1.00 0.82 H new ATOM 1989 N PHE A 131 22.948 23.531 -14.899 1.00 0.53 N ATOM 1990 CA PHE A 131 22.794 24.330 -13.689 1.00 0.46 C ATOM 1991 C PHE A 131 21.322 24.503 -13.332 1.00 0.51 C ATOM 1992 O PHE A 131 20.440 24.061 -14.061 1.00 0.74 O ATOM 1993 CB PHE A 131 23.495 25.696 -13.817 1.00 0.42 C ATOM 1994 CG PHE A 131 23.044 26.553 -14.974 1.00 0.48 C ATOM 1995 CD1 PHE A 131 21.915 27.353 -14.871 1.00 0.60 C ATOM 1996 CD2 PHE A 131 23.766 26.577 -16.155 1.00 0.46 C ATOM 1997 CE1 PHE A 131 21.519 28.155 -15.925 1.00 0.70 C ATOM 1998 CE2 PHE A 131 23.373 27.374 -17.211 1.00 0.56 C ATOM 1999 CZ PHE A 131 22.249 28.165 -17.097 1.00 0.68 C ATOM 0 H PHE A 131 22.534 23.940 -15.737 1.00 0.53 H new ATOM 0 HA PHE A 131 23.279 23.789 -12.877 1.00 0.46 H new ATOM 0 HB2 PHE A 131 23.339 26.253 -12.893 1.00 0.42 H new ATOM 0 HB3 PHE A 131 24.568 25.527 -13.910 1.00 0.42 H new ATOM 0 HD1 PHE A 131 21.339 27.349 -13.957 1.00 0.60 H new ATOM 0 HD2 PHE A 131 24.649 25.963 -16.251 1.00 0.46 H new ATOM 0 HE1 PHE A 131 20.639 28.774 -15.832 1.00 0.70 H new ATOM 0 HE2 PHE A 131 23.946 27.378 -18.127 1.00 0.56 H new ATOM 0 HZ PHE A 131 21.941 28.790 -17.922 1.00 0.68 H new ATOM 2009 N GLY A 132 21.075 25.136 -12.194 1.00 0.48 N ATOM 2010 CA GLY A 132 19.724 25.297 -11.697 1.00 0.51 C ATOM 2011 C GLY A 132 19.485 26.697 -11.176 1.00 0.50 C ATOM 2012 O GLY A 132 20.432 27.369 -10.774 1.00 0.47 O ATOM 0 H GLY A 132 21.796 25.545 -11.600 1.00 0.48 H new ATOM 0 HA2 GLY A 132 19.014 25.079 -12.495 1.00 0.51 H new ATOM 0 HA3 GLY A 132 19.540 24.576 -10.901 1.00 0.51 H new ATOM 2016 N ILE A 133 18.232 27.150 -11.210 1.00 0.54 N ATOM 2017 CA ILE A 133 17.864 28.477 -10.699 1.00 0.55 C ATOM 2018 C ILE A 133 18.394 28.699 -9.275 1.00 0.54 C ATOM 2019 O ILE A 133 18.714 29.823 -8.888 1.00 0.56 O ATOM 2020 CB ILE A 133 16.328 28.677 -10.717 1.00 0.60 C ATOM 2021 CG1 ILE A 133 15.950 30.119 -10.350 1.00 0.64 C ATOM 2022 CG2 ILE A 133 15.634 27.694 -9.787 1.00 0.61 C ATOM 2023 CD1 ILE A 133 16.296 31.126 -11.425 1.00 0.67 C ATOM 0 H ILE A 133 17.449 26.617 -11.587 1.00 0.54 H new ATOM 0 HA ILE A 133 18.325 29.211 -11.360 1.00 0.55 H new ATOM 0 HB ILE A 133 15.987 28.484 -11.734 1.00 0.60 H new ATOM 0 HG12 ILE A 133 14.879 30.166 -10.150 1.00 0.64 H new ATOM 0 HG13 ILE A 133 16.459 30.396 -9.427 1.00 0.64 H new ATOM 0 HG21 ILE A 133 14.557 27.859 -9.821 1.00 0.61 H new ATOM 0 HG22 ILE A 133 15.855 26.675 -10.104 1.00 0.61 H new ATOM 0 HG23 ILE A 133 15.992 27.843 -8.768 1.00 0.61 H new ATOM 0 HD11 ILE A 133 16.001 32.123 -11.098 1.00 0.67 H new ATOM 0 HD12 ILE A 133 17.370 31.107 -11.609 1.00 0.67 H new ATOM 0 HD13 ILE A 133 15.766 30.874 -12.344 1.00 0.67 H new ATOM 2035 N THR A 134 18.500 27.617 -8.513 1.00 0.57 N ATOM 2036 CA THR A 134 19.017 27.672 -7.155 1.00 0.61 C ATOM 2037 C THR A 134 20.531 27.860 -7.155 1.00 0.57 C ATOM 2038 O THR A 134 21.080 28.564 -6.310 1.00 0.61 O ATOM 2039 CB THR A 134 18.652 26.386 -6.397 1.00 0.71 C ATOM 2040 OG1 THR A 134 18.941 25.245 -7.221 1.00 1.35 O ATOM 2041 CG2 THR A 134 17.181 26.381 -6.020 1.00 0.86 C ATOM 0 H THR A 134 18.231 26.682 -8.819 1.00 0.57 H new ATOM 0 HA THR A 134 18.563 28.527 -6.654 1.00 0.61 H new ATOM 0 HB THR A 134 19.244 26.342 -5.483 1.00 0.71 H new ATOM 0 HG1 THR A 134 18.103 24.863 -7.557 1.00 1.35 H new ATOM 0 HG21 THR A 134 16.946 25.461 -5.484 1.00 0.86 H new ATOM 0 HG22 THR A 134 16.966 27.238 -5.381 1.00 0.86 H new ATOM 0 HG23 THR A 134 16.574 26.440 -6.923 1.00 0.86 H new ATOM 2049 N SER A 135 21.196 27.226 -8.115 1.00 0.54 N ATOM 2050 CA SER A 135 22.631 27.378 -8.293 1.00 0.57 C ATOM 2051 C SER A 135 22.951 28.777 -8.807 1.00 0.46 C ATOM 2052 O SER A 135 24.061 29.278 -8.634 1.00 0.44 O ATOM 2053 CB SER A 135 23.145 26.334 -9.284 1.00 0.72 C ATOM 2054 OG SER A 135 22.743 25.026 -8.910 1.00 1.10 O ATOM 0 H SER A 135 20.756 26.597 -8.787 1.00 0.54 H new ATOM 0 HA SER A 135 23.122 27.233 -7.331 1.00 0.57 H new ATOM 0 HB2 SER A 135 22.769 26.561 -10.282 1.00 0.72 H new ATOM 0 HB3 SER A 135 24.233 26.382 -9.334 1.00 0.72 H new ATOM 0 HG SER A 135 23.249 24.367 -9.430 1.00 1.10 H new ATOM 2060 N LEU A 136 21.959 29.394 -9.435 1.00 0.45 N ATOM 2061 CA LEU A 136 22.093 30.732 -9.989 1.00 0.43 C ATOM 2062 C LEU A 136 22.051 31.805 -8.901 1.00 0.47 C ATOM 2063 O LEU A 136 21.137 32.628 -8.861 1.00 0.53 O ATOM 2064 CB LEU A 136 21.027 30.996 -11.054 1.00 0.48 C ATOM 2065 CG LEU A 136 21.174 30.177 -12.339 1.00 0.81 C ATOM 2066 CD1 LEU A 136 20.080 30.549 -13.329 1.00 1.46 C ATOM 2067 CD2 LEU A 136 22.554 30.382 -12.960 1.00 1.24 C ATOM 0 H LEU A 136 21.038 28.979 -9.574 1.00 0.45 H new ATOM 0 HA LEU A 136 23.072 30.787 -10.465 1.00 0.43 H new ATOM 0 HB2 LEU A 136 20.047 30.793 -10.623 1.00 0.48 H new ATOM 0 HB3 LEU A 136 21.048 32.055 -11.312 1.00 0.48 H new ATOM 0 HG LEU A 136 21.072 29.121 -12.087 1.00 0.81 H new ATOM 0 HD11 LEU A 136 20.196 29.959 -14.238 1.00 1.46 H new ATOM 0 HD12 LEU A 136 19.105 30.346 -12.887 1.00 1.46 H new ATOM 0 HD13 LEU A 136 20.154 31.609 -13.572 1.00 1.46 H new ATOM 0 HD21 LEU A 136 22.634 29.790 -13.872 1.00 1.24 H new ATOM 0 HD22 LEU A 136 22.693 31.436 -13.199 1.00 1.24 H new ATOM 0 HD23 LEU A 136 23.322 30.066 -12.253 1.00 1.24 H new ATOM 2079 N VAL A 137 22.989 31.733 -7.966 1.00 0.49 N ATOM 2080 CA VAL A 137 23.156 32.771 -6.952 1.00 0.60 C ATOM 2081 C VAL A 137 23.170 34.161 -7.601 1.00 0.65 C ATOM 2082 O VAL A 137 22.554 35.101 -7.106 1.00 0.77 O ATOM 2083 CB VAL A 137 24.470 32.568 -6.168 1.00 0.63 C ATOM 2084 CG1 VAL A 137 24.637 33.626 -5.088 1.00 0.82 C ATOM 2085 CG2 VAL A 137 24.526 31.170 -5.572 1.00 0.59 C ATOM 0 H VAL A 137 23.651 30.961 -7.887 1.00 0.49 H new ATOM 0 HA VAL A 137 22.314 32.699 -6.264 1.00 0.60 H new ATOM 0 HB VAL A 137 25.299 32.676 -6.867 1.00 0.63 H new ATOM 0 HG11 VAL A 137 25.572 33.456 -4.554 1.00 0.82 H new ATOM 0 HG12 VAL A 137 24.656 34.615 -5.547 1.00 0.82 H new ATOM 0 HG13 VAL A 137 23.803 33.567 -4.389 1.00 0.82 H new ATOM 0 HG21 VAL A 137 25.459 31.046 -5.023 1.00 0.59 H new ATOM 0 HG22 VAL A 137 23.685 31.030 -4.893 1.00 0.59 H new ATOM 0 HG23 VAL A 137 24.474 30.431 -6.372 1.00 0.59 H new ATOM 2095 N ASN A 138 23.853 34.259 -8.733 1.00 0.59 N ATOM 2096 CA ASN A 138 23.969 35.511 -9.482 1.00 0.66 C ATOM 2097 C ASN A 138 22.920 35.574 -10.600 1.00 0.58 C ATOM 2098 O ASN A 138 23.152 36.167 -11.646 1.00 0.60 O ATOM 2099 CB ASN A 138 25.386 35.645 -10.070 1.00 0.76 C ATOM 2100 CG ASN A 138 25.736 34.531 -11.049 1.00 1.36 C ATOM 2101 OD1 ASN A 138 26.276 33.432 -10.543 1.00 2.08 O flip ATOM 2102 ND2 ASN A 138 25.525 34.653 -12.251 1.00 2.17 N flip ATOM 0 H ASN A 138 24.344 33.474 -9.162 1.00 0.59 H new ATOM 0 HA ASN A 138 23.790 36.341 -8.799 1.00 0.66 H new ATOM 0 HB2 ASN A 138 25.473 36.606 -10.577 1.00 0.76 H new ATOM 0 HB3 ASN A 138 26.112 35.647 -9.257 1.00 0.76 H new ATOM 0 HD21 ASN A 138 25.108 35.511 -12.611 1.00 2.17 H new ATOM 0 HD22 ASN A 138 25.767 33.896 -12.891 1.00 2.17 H new ATOM 2109 N LYS A 139 21.748 34.994 -10.335 1.00 0.55 N ATOM 2110 CA LYS A 139 20.680 34.827 -11.339 1.00 0.56 C ATOM 2111 C LYS A 139 20.292 36.127 -12.051 1.00 0.66 C ATOM 2112 O LYS A 139 19.779 36.092 -13.171 1.00 0.76 O ATOM 2113 CB LYS A 139 19.429 34.223 -10.684 1.00 0.62 C ATOM 2114 CG LYS A 139 18.900 35.024 -9.501 1.00 0.75 C ATOM 2115 CD LYS A 139 17.599 34.440 -8.962 1.00 0.96 C ATOM 2116 CE LYS A 139 17.780 33.033 -8.399 1.00 0.74 C ATOM 2117 NZ LYS A 139 18.707 33.003 -7.237 1.00 1.39 N ATOM 0 H LYS A 139 21.506 34.623 -9.416 1.00 0.55 H new ATOM 0 HA LYS A 139 21.086 34.157 -12.097 1.00 0.56 H new ATOM 0 HB2 LYS A 139 18.643 34.141 -11.434 1.00 0.62 H new ATOM 0 HB3 LYS A 139 19.659 33.211 -10.351 1.00 0.62 H new ATOM 0 HG2 LYS A 139 19.648 35.040 -8.708 1.00 0.75 H new ATOM 0 HG3 LYS A 139 18.736 36.058 -9.805 1.00 0.75 H new ATOM 0 HD2 LYS A 139 17.207 35.093 -8.182 1.00 0.96 H new ATOM 0 HD3 LYS A 139 16.857 34.416 -9.760 1.00 0.96 H new ATOM 0 HE2 LYS A 139 16.810 32.638 -8.097 1.00 0.74 H new ATOM 0 HE3 LYS A 139 18.162 32.378 -9.182 1.00 0.74 H new ATOM 0 HZ1 LYS A 139 18.447 32.219 -6.605 1.00 1.39 H new ATOM 0 HZ2 LYS A 139 19.682 32.867 -7.574 1.00 1.39 H new ATOM 0 HZ3 LYS A 139 18.642 33.902 -6.718 1.00 1.39 H new ATOM 2131 N ARG A 140 20.516 37.267 -11.414 1.00 0.73 N ATOM 2132 CA ARG A 140 20.102 38.535 -11.997 1.00 0.87 C ATOM 2133 C ARG A 140 21.145 39.062 -12.981 1.00 0.86 C ATOM 2134 O ARG A 140 20.846 39.928 -13.802 1.00 1.01 O ATOM 2135 CB ARG A 140 19.835 39.581 -10.910 1.00 1.03 C ATOM 2136 CG ARG A 140 21.086 40.268 -10.387 1.00 1.11 C ATOM 2137 CD ARG A 140 20.745 41.336 -9.364 1.00 1.39 C ATOM 2138 NE ARG A 140 21.878 42.220 -9.090 1.00 1.65 N ATOM 2139 CZ ARG A 140 22.064 42.859 -7.933 1.00 2.04 C ATOM 2140 NH1 ARG A 140 21.231 42.661 -6.918 1.00 2.31 N ATOM 2141 NH2 ARG A 140 23.093 43.683 -7.788 1.00 2.46 N ATOM 0 H ARG A 140 20.975 37.341 -10.506 1.00 0.73 H new ATOM 0 HA ARG A 140 19.176 38.352 -12.541 1.00 0.87 H new ATOM 0 HB2 ARG A 140 19.158 40.337 -11.307 1.00 1.03 H new ATOM 0 HB3 ARG A 140 19.322 39.100 -10.077 1.00 1.03 H new ATOM 0 HG2 ARG A 140 21.748 39.528 -9.936 1.00 1.11 H new ATOM 0 HG3 ARG A 140 21.630 40.718 -11.217 1.00 1.11 H new ATOM 0 HD2 ARG A 140 19.904 41.928 -9.725 1.00 1.39 H new ATOM 0 HD3 ARG A 140 20.425 40.860 -8.437 1.00 1.39 H new ATOM 0 HE ARG A 140 22.568 42.356 -9.829 1.00 1.65 H new ATOM 0 HH11 ARG A 140 20.445 42.019 -7.021 1.00 2.31 H new ATOM 0 HH12 ARG A 140 21.377 43.151 -6.036 1.00 2.31 H new ATOM 0 HH21 ARG A 140 23.743 43.829 -8.561 1.00 2.46 H new ATOM 0 HH22 ARG A 140 23.235 44.171 -6.904 1.00 2.46 H new ATOM 2155 N ASP A 141 22.359 38.533 -12.911 1.00 0.73 N ATOM 2156 CA ASP A 141 23.445 39.022 -13.759 1.00 0.75 C ATOM 2157 C ASP A 141 23.284 38.510 -15.186 1.00 0.72 C ATOM 2158 O ASP A 141 22.730 37.433 -15.418 1.00 0.75 O ATOM 2159 CB ASP A 141 24.817 38.598 -13.219 1.00 0.74 C ATOM 2160 CG ASP A 141 25.955 39.412 -13.817 1.00 1.24 C ATOM 2161 OD1 ASP A 141 25.677 40.390 -14.540 1.00 1.89 O ATOM 2162 OD2 ASP A 141 27.135 39.067 -13.579 1.00 1.57 O ATOM 0 H ASP A 141 22.618 37.772 -12.283 1.00 0.73 H new ATOM 0 HA ASP A 141 23.392 40.111 -13.754 1.00 0.75 H new ATOM 0 HB2 ASP A 141 24.827 38.708 -12.135 1.00 0.74 H new ATOM 0 HB3 ASP A 141 24.978 37.542 -13.434 1.00 0.74 H new ATOM 2167 N LEU A 142 23.760 39.295 -16.140 1.00 0.85 N ATOM 2168 CA LEU A 142 23.718 38.924 -17.538 1.00 0.92 C ATOM 2169 C LEU A 142 24.930 38.059 -17.879 1.00 0.80 C ATOM 2170 O LEU A 142 25.865 38.509 -18.546 1.00 1.03 O ATOM 2171 CB LEU A 142 23.693 40.179 -18.424 1.00 1.16 C ATOM 2172 CG LEU A 142 22.522 41.145 -18.198 1.00 2.05 C ATOM 2173 CD1 LEU A 142 21.194 40.412 -18.222 1.00 2.56 C ATOM 2174 CD2 LEU A 142 22.675 41.932 -16.907 1.00 2.88 C ATOM 0 H LEU A 142 24.185 40.205 -15.963 1.00 0.85 H new ATOM 0 HA LEU A 142 22.809 38.352 -17.725 1.00 0.92 H new ATOM 0 HB2 LEU A 142 24.623 40.726 -18.269 1.00 1.16 H new ATOM 0 HB3 LEU A 142 23.679 39.862 -19.467 1.00 1.16 H new ATOM 0 HG LEU A 142 22.536 41.859 -19.022 1.00 2.05 H new ATOM 0 HD11 LEU A 142 20.383 41.122 -18.059 1.00 2.56 H new ATOM 0 HD12 LEU A 142 21.063 39.928 -19.190 1.00 2.56 H new ATOM 0 HD13 LEU A 142 21.180 39.659 -17.434 1.00 2.56 H new ATOM 0 HD21 LEU A 142 21.825 42.603 -16.787 1.00 2.88 H new ATOM 0 HD22 LEU A 142 22.715 41.243 -16.063 1.00 2.88 H new ATOM 0 HD23 LEU A 142 23.595 42.515 -16.943 1.00 2.88 H new ATOM 2186 N LEU A 143 24.919 36.831 -17.383 1.00 0.90 N ATOM 2187 CA LEU A 143 26.019 35.901 -17.596 1.00 0.81 C ATOM 2188 C LEU A 143 25.970 35.350 -19.020 1.00 0.88 C ATOM 2189 O LEU A 143 24.964 34.774 -19.437 1.00 0.97 O ATOM 2190 CB LEU A 143 25.938 34.768 -16.565 1.00 0.70 C ATOM 2191 CG LEU A 143 27.234 33.984 -16.329 1.00 0.60 C ATOM 2192 CD1 LEU A 143 28.344 34.914 -15.874 1.00 0.65 C ATOM 2193 CD2 LEU A 143 27.019 32.890 -15.294 1.00 0.58 C ATOM 0 H LEU A 143 24.153 36.452 -16.825 1.00 0.90 H new ATOM 0 HA LEU A 143 26.968 36.421 -17.467 1.00 0.81 H new ATOM 0 HB2 LEU A 143 25.613 35.191 -15.614 1.00 0.70 H new ATOM 0 HB3 LEU A 143 25.165 34.068 -16.883 1.00 0.70 H new ATOM 0 HG LEU A 143 27.526 33.522 -17.272 1.00 0.60 H new ATOM 0 HD11 LEU A 143 29.256 34.340 -15.711 1.00 0.65 H new ATOM 0 HD12 LEU A 143 28.522 35.669 -16.639 1.00 0.65 H new ATOM 0 HD13 LEU A 143 28.052 35.402 -14.944 1.00 0.65 H new ATOM 0 HD21 LEU A 143 27.951 32.345 -15.141 1.00 0.58 H new ATOM 0 HD22 LEU A 143 26.702 33.337 -14.352 1.00 0.58 H new ATOM 0 HD23 LEU A 143 26.250 32.202 -15.646 1.00 0.58 H new ATOM 2205 N GLN A 144 27.051 35.534 -19.766 1.00 0.90 N ATOM 2206 CA GLN A 144 27.070 35.178 -21.179 1.00 1.00 C ATOM 2207 C GLN A 144 27.929 33.943 -21.440 1.00 0.92 C ATOM 2208 O GLN A 144 28.630 33.457 -20.550 1.00 0.84 O ATOM 2209 CB GLN A 144 27.566 36.363 -22.010 1.00 1.21 C ATOM 2210 CG GLN A 144 28.910 36.913 -21.557 1.00 1.27 C ATOM 2211 CD GLN A 144 29.344 38.124 -22.359 1.00 1.47 C ATOM 2212 OE1 GLN A 144 29.027 39.262 -22.009 1.00 1.71 O ATOM 2213 NE2 GLN A 144 30.074 37.889 -23.437 1.00 1.77 N ATOM 0 H GLN A 144 27.925 35.927 -19.417 1.00 0.90 H new ATOM 0 HA GLN A 144 26.051 34.933 -21.477 1.00 1.00 H new ATOM 0 HB2 GLN A 144 27.643 36.056 -23.053 1.00 1.21 H new ATOM 0 HB3 GLN A 144 26.824 37.161 -21.966 1.00 1.21 H new ATOM 0 HG2 GLN A 144 28.852 37.182 -20.502 1.00 1.27 H new ATOM 0 HG3 GLN A 144 29.666 36.133 -21.646 1.00 1.27 H new ATOM 0 HE21 GLN A 144 30.314 36.931 -23.691 1.00 1.77 H new ATOM 0 HE22 GLN A 144 30.397 38.666 -24.014 1.00 1.77 H new ATOM 2222 N LYS A 145 27.875 33.449 -22.672 1.00 0.97 N ATOM 2223 CA LYS A 145 28.583 32.233 -23.043 1.00 0.98 C ATOM 2224 C LYS A 145 30.082 32.485 -23.084 1.00 1.01 C ATOM 2225 O LYS A 145 30.548 33.472 -23.660 1.00 1.11 O ATOM 2226 CB LYS A 145 28.087 31.722 -24.405 1.00 1.06 C ATOM 2227 CG LYS A 145 28.524 30.300 -24.747 1.00 1.17 C ATOM 2228 CD LYS A 145 29.948 30.227 -25.283 1.00 1.25 C ATOM 2229 CE LYS A 145 30.372 28.788 -25.512 1.00 1.41 C ATOM 2230 NZ LYS A 145 31.771 28.678 -26.001 1.00 1.43 N ATOM 0 H LYS A 145 27.345 33.875 -23.432 1.00 0.97 H new ATOM 0 HA LYS A 145 28.381 31.469 -22.292 1.00 0.98 H new ATOM 0 HB2 LYS A 145 26.998 31.767 -24.421 1.00 1.06 H new ATOM 0 HB3 LYS A 145 28.445 32.395 -25.184 1.00 1.06 H new ATOM 0 HG2 LYS A 145 28.445 29.677 -23.856 1.00 1.17 H new ATOM 0 HG3 LYS A 145 27.841 29.884 -25.488 1.00 1.17 H new ATOM 0 HD2 LYS A 145 30.017 30.783 -26.218 1.00 1.25 H new ATOM 0 HD3 LYS A 145 30.630 30.703 -24.578 1.00 1.25 H new ATOM 0 HE2 LYS A 145 30.271 28.230 -24.581 1.00 1.41 H new ATOM 0 HE3 LYS A 145 29.700 28.325 -26.235 1.00 1.41 H new ATOM 0 HZ1 LYS A 145 32.012 27.676 -26.142 1.00 1.43 H new ATOM 0 HZ2 LYS A 145 31.864 29.187 -26.903 1.00 1.43 H new ATOM 0 HZ3 LYS A 145 32.417 29.094 -25.301 1.00 1.43 H new ATOM 2244 N GLY A 146 30.831 31.587 -22.469 1.00 0.97 N ATOM 2245 CA GLY A 146 32.269 31.692 -22.496 1.00 1.06 C ATOM 2246 C GLY A 146 32.821 32.550 -21.380 1.00 1.00 C ATOM 2247 O GLY A 146 34.024 32.799 -21.334 1.00 1.07 O ATOM 0 H GLY A 146 30.467 30.787 -21.951 1.00 0.97 H new ATOM 0 HA2 GLY A 146 32.702 30.694 -22.427 1.00 1.06 H new ATOM 0 HA3 GLY A 146 32.579 32.109 -23.454 1.00 1.06 H new ATOM 2251 N ASP A 147 31.954 33.017 -20.490 1.00 0.90 N ATOM 2252 CA ASP A 147 32.420 33.818 -19.365 1.00 0.87 C ATOM 2253 C ASP A 147 32.796 32.914 -18.202 1.00 0.72 C ATOM 2254 O ASP A 147 32.255 31.815 -18.058 1.00 0.63 O ATOM 2255 CB ASP A 147 31.375 34.844 -18.926 1.00 0.89 C ATOM 2256 CG ASP A 147 31.940 35.802 -17.898 1.00 1.35 C ATOM 2257 OD1 ASP A 147 31.541 35.721 -16.723 1.00 1.94 O ATOM 2258 OD2 ASP A 147 32.811 36.620 -18.263 1.00 1.60 O ATOM 0 H ASP A 147 30.947 32.860 -20.522 1.00 0.90 H new ATOM 0 HA ASP A 147 33.301 34.370 -19.692 1.00 0.87 H new ATOM 0 HB2 ASP A 147 31.025 35.404 -19.794 1.00 0.89 H new ATOM 0 HB3 ASP A 147 30.510 34.329 -18.509 1.00 0.89 H new ATOM 2263 N LEU A 148 33.724 33.382 -17.385 1.00 0.75 N ATOM 2264 CA LEU A 148 34.300 32.570 -16.324 1.00 0.66 C ATOM 2265 C LEU A 148 33.361 32.456 -15.139 1.00 0.60 C ATOM 2266 O LEU A 148 32.944 33.453 -14.550 1.00 0.63 O ATOM 2267 CB LEU A 148 35.653 33.143 -15.873 1.00 0.75 C ATOM 2268 CG LEU A 148 36.816 33.034 -16.877 1.00 0.93 C ATOM 2269 CD1 LEU A 148 37.057 31.586 -17.276 1.00 1.46 C ATOM 2270 CD2 LEU A 148 36.583 33.901 -18.107 1.00 1.79 C ATOM 0 H LEU A 148 34.098 34.329 -17.437 1.00 0.75 H new ATOM 0 HA LEU A 148 34.458 31.570 -16.728 1.00 0.66 H new ATOM 0 HB2 LEU A 148 35.513 34.196 -15.627 1.00 0.75 H new ATOM 0 HB3 LEU A 148 35.948 32.637 -14.953 1.00 0.75 H new ATOM 0 HG LEU A 148 37.711 33.406 -16.378 1.00 0.93 H new ATOM 0 HD11 LEU A 148 37.883 31.537 -17.985 1.00 1.46 H new ATOM 0 HD12 LEU A 148 37.304 31.001 -16.390 1.00 1.46 H new ATOM 0 HD13 LEU A 148 36.157 31.181 -17.739 1.00 1.46 H new ATOM 0 HD21 LEU A 148 37.425 33.796 -18.791 1.00 1.79 H new ATOM 0 HD22 LEU A 148 35.668 33.584 -18.607 1.00 1.79 H new ATOM 0 HD23 LEU A 148 36.489 34.944 -17.804 1.00 1.79 H new ATOM 2282 N VAL A 149 33.046 31.223 -14.789 1.00 0.53 N ATOM 2283 CA VAL A 149 32.163 30.957 -13.682 1.00 0.48 C ATOM 2284 C VAL A 149 32.756 29.878 -12.777 1.00 0.46 C ATOM 2285 O VAL A 149 33.493 28.999 -13.229 1.00 0.49 O ATOM 2286 CB VAL A 149 30.766 30.541 -14.192 1.00 0.50 C ATOM 2287 CG1 VAL A 149 30.722 29.092 -14.639 1.00 1.16 C ATOM 2288 CG2 VAL A 149 29.710 30.827 -13.154 1.00 1.10 C ATOM 0 H VAL A 149 33.394 30.389 -15.262 1.00 0.53 H new ATOM 0 HA VAL A 149 32.052 31.870 -13.097 1.00 0.48 H new ATOM 0 HB VAL A 149 30.552 31.145 -15.074 1.00 0.50 H new ATOM 0 HG11 VAL A 149 29.718 28.849 -14.988 1.00 1.16 H new ATOM 0 HG12 VAL A 149 31.435 28.939 -15.449 1.00 1.16 H new ATOM 0 HG13 VAL A 149 30.981 28.445 -13.801 1.00 1.16 H new ATOM 0 HG21 VAL A 149 28.734 30.526 -13.535 1.00 1.10 H new ATOM 0 HG22 VAL A 149 29.933 30.268 -12.245 1.00 1.10 H new ATOM 0 HG23 VAL A 149 29.699 31.894 -12.931 1.00 1.10 H new ATOM 2298 N SER A 150 32.461 29.971 -11.494 1.00 0.46 N ATOM 2299 CA SER A 150 32.929 28.988 -10.531 1.00 0.47 C ATOM 2300 C SER A 150 31.752 28.341 -9.812 1.00 0.41 C ATOM 2301 O SER A 150 30.686 28.941 -9.690 1.00 0.49 O ATOM 2302 CB SER A 150 33.893 29.630 -9.533 1.00 0.59 C ATOM 2303 OG SER A 150 35.069 30.074 -10.187 1.00 1.44 O ATOM 0 H SER A 150 31.897 30.720 -11.092 1.00 0.46 H new ATOM 0 HA SER A 150 33.468 28.208 -11.068 1.00 0.47 H new ATOM 0 HB2 SER A 150 33.406 30.471 -9.039 1.00 0.59 H new ATOM 0 HB3 SER A 150 34.152 28.911 -8.756 1.00 0.59 H new ATOM 0 HG SER A 150 35.673 30.483 -9.532 1.00 1.44 H new ATOM 2309 N PHE A 151 31.957 27.110 -9.360 1.00 0.34 N ATOM 2310 CA PHE A 151 30.894 26.299 -8.778 1.00 0.34 C ATOM 2311 C PHE A 151 31.496 25.111 -8.041 1.00 0.41 C ATOM 2312 O PHE A 151 32.684 24.826 -8.182 1.00 0.49 O ATOM 2313 CB PHE A 151 29.952 25.802 -9.885 1.00 0.30 C ATOM 2314 CG PHE A 151 30.674 25.393 -11.145 1.00 0.35 C ATOM 2315 CD1 PHE A 151 30.851 26.305 -12.177 1.00 0.39 C ATOM 2316 CD2 PHE A 151 31.199 24.116 -11.290 1.00 0.47 C ATOM 2317 CE1 PHE A 151 31.533 25.954 -13.324 1.00 0.53 C ATOM 2318 CE2 PHE A 151 31.879 23.760 -12.442 1.00 0.59 C ATOM 2319 CZ PHE A 151 32.047 24.683 -13.456 1.00 0.61 C ATOM 0 H PHE A 151 32.865 26.645 -9.386 1.00 0.34 H new ATOM 0 HA PHE A 151 30.327 26.907 -8.073 1.00 0.34 H new ATOM 0 HB2 PHE A 151 29.379 24.953 -9.511 1.00 0.30 H new ATOM 0 HB3 PHE A 151 29.237 26.589 -10.124 1.00 0.30 H new ATOM 0 HD1 PHE A 151 30.449 27.303 -12.081 1.00 0.39 H new ATOM 0 HD2 PHE A 151 31.076 23.394 -10.497 1.00 0.47 H new ATOM 0 HE1 PHE A 151 31.664 26.675 -14.117 1.00 0.53 H new ATOM 0 HE2 PHE A 151 32.278 22.762 -12.548 1.00 0.59 H new ATOM 0 HZ PHE A 151 32.582 24.408 -14.353 1.00 0.61 H new ATOM 2329 N ARG A 152 30.688 24.410 -7.258 1.00 0.44 N ATOM 2330 CA ARG A 152 31.160 23.194 -6.619 1.00 0.51 C ATOM 2331 C ARG A 152 30.190 22.042 -6.863 1.00 0.50 C ATOM 2332 O ARG A 152 28.997 22.132 -6.567 1.00 0.54 O ATOM 2333 CB ARG A 152 31.377 23.423 -5.111 1.00 0.69 C ATOM 2334 CG ARG A 152 30.157 23.957 -4.372 1.00 0.94 C ATOM 2335 CD ARG A 152 30.447 25.287 -3.688 1.00 1.05 C ATOM 2336 NE ARG A 152 31.418 25.165 -2.596 1.00 1.29 N ATOM 2337 CZ ARG A 152 31.840 26.195 -1.857 1.00 1.57 C ATOM 2338 NH1 ARG A 152 31.378 27.418 -2.094 1.00 2.03 N ATOM 2339 NH2 ARG A 152 32.709 26.002 -0.870 1.00 2.20 N ATOM 0 H ARG A 152 29.720 24.658 -7.053 1.00 0.44 H new ATOM 0 HA ARG A 152 32.119 22.924 -7.062 1.00 0.51 H new ATOM 0 HB2 ARG A 152 31.680 22.481 -4.653 1.00 0.69 H new ATOM 0 HB3 ARG A 152 32.202 24.123 -4.977 1.00 0.69 H new ATOM 0 HG2 ARG A 152 29.333 24.082 -5.074 1.00 0.94 H new ATOM 0 HG3 ARG A 152 29.835 23.228 -3.628 1.00 0.94 H new ATOM 0 HD2 ARG A 152 30.824 25.995 -4.426 1.00 1.05 H new ATOM 0 HD3 ARG A 152 29.517 25.699 -3.297 1.00 1.05 H new ATOM 0 HE ARG A 152 31.793 24.240 -2.388 1.00 1.29 H new ATOM 0 HH11 ARG A 152 30.700 27.571 -2.841 1.00 2.03 H new ATOM 0 HH12 ARG A 152 31.701 28.204 -1.529 1.00 2.03 H new ATOM 0 HH21 ARG A 152 33.057 25.064 -0.673 1.00 2.20 H new ATOM 0 HH22 ARG A 152 33.028 26.792 -0.309 1.00 2.20 H new ATOM 2353 N ILE A 153 30.714 20.977 -7.451 1.00 0.51 N ATOM 2354 CA ILE A 153 29.964 19.747 -7.657 1.00 0.56 C ATOM 2355 C ILE A 153 30.336 18.708 -6.599 1.00 0.65 C ATOM 2356 O ILE A 153 31.511 18.566 -6.254 1.00 0.75 O ATOM 2357 CB ILE A 153 30.183 19.177 -9.083 1.00 0.58 C ATOM 2358 CG1 ILE A 153 29.536 17.799 -9.243 1.00 1.23 C ATOM 2359 CG2 ILE A 153 31.659 19.090 -9.411 1.00 0.93 C ATOM 2360 CD1 ILE A 153 29.705 17.212 -10.628 1.00 1.24 C ATOM 0 H ILE A 153 31.672 20.941 -7.799 1.00 0.51 H new ATOM 0 HA ILE A 153 28.905 19.985 -7.556 1.00 0.56 H new ATOM 0 HB ILE A 153 29.704 19.865 -9.780 1.00 0.58 H new ATOM 0 HG12 ILE A 153 29.968 17.116 -8.512 1.00 1.23 H new ATOM 0 HG13 ILE A 153 28.473 17.877 -9.017 1.00 1.23 H new ATOM 0 HG21 ILE A 153 31.785 18.687 -10.416 1.00 0.93 H new ATOM 0 HG22 ILE A 153 32.102 20.085 -9.360 1.00 0.93 H new ATOM 0 HG23 ILE A 153 32.153 18.435 -8.693 1.00 0.93 H new ATOM 0 HD11 ILE A 153 29.223 16.235 -10.671 1.00 1.24 H new ATOM 0 HD12 ILE A 153 29.248 17.875 -11.362 1.00 1.24 H new ATOM 0 HD13 ILE A 153 30.767 17.102 -10.850 1.00 1.24 H new ATOM 2372 N ASP A 154 29.337 18.008 -6.076 1.00 0.71 N ATOM 2373 CA ASP A 154 29.570 16.887 -5.160 1.00 0.82 C ATOM 2374 C ASP A 154 28.270 16.118 -4.926 1.00 0.96 C ATOM 2375 O ASP A 154 27.945 15.197 -5.675 1.00 1.09 O ATOM 2376 CB ASP A 154 30.158 17.375 -3.827 1.00 0.84 C ATOM 2377 CG ASP A 154 30.441 16.244 -2.857 1.00 1.45 C ATOM 2378 OD1 ASP A 154 31.440 15.519 -3.046 1.00 1.92 O ATOM 2379 OD2 ASP A 154 29.671 16.084 -1.891 1.00 1.73 O ATOM 0 H ASP A 154 28.353 18.194 -6.268 1.00 0.71 H new ATOM 0 HA ASP A 154 30.296 16.216 -5.619 1.00 0.82 H new ATOM 0 HB2 ASP A 154 31.082 17.920 -4.021 1.00 0.84 H new ATOM 0 HB3 ASP A 154 29.464 18.078 -3.365 1.00 0.84 H new ATOM 2384 N GLU A 155 27.509 16.531 -3.917 1.00 1.00 N ATOM 2385 CA GLU A 155 26.216 15.917 -3.620 1.00 1.17 C ATOM 2386 C GLU A 155 25.171 16.401 -4.609 1.00 1.23 C ATOM 2387 O GLU A 155 24.115 15.791 -4.776 1.00 1.46 O ATOM 2388 CB GLU A 155 25.769 16.256 -2.196 1.00 1.25 C ATOM 2389 CG GLU A 155 26.713 15.752 -1.120 1.00 1.32 C ATOM 2390 CD GLU A 155 26.333 16.234 0.264 1.00 2.00 C ATOM 2391 OE1 GLU A 155 25.489 15.589 0.910 1.00 2.28 O ATOM 2392 OE2 GLU A 155 26.884 17.263 0.716 1.00 2.76 O ATOM 0 H GLU A 155 27.766 17.292 -3.288 1.00 1.00 H new ATOM 0 HA GLU A 155 26.324 14.836 -3.705 1.00 1.17 H new ATOM 0 HB2 GLU A 155 25.673 17.338 -2.104 1.00 1.25 H new ATOM 0 HB3 GLU A 155 24.779 15.832 -2.025 1.00 1.25 H new ATOM 0 HG2 GLU A 155 26.721 14.662 -1.131 1.00 1.32 H new ATOM 0 HG3 GLU A 155 27.727 16.081 -1.349 1.00 1.32 H new ATOM 2399 N SER A 156 25.474 17.508 -5.261 1.00 1.10 N ATOM 2400 CA SER A 156 24.582 18.076 -6.252 1.00 1.19 C ATOM 2401 C SER A 156 24.718 17.342 -7.581 1.00 1.14 C ATOM 2402 O SER A 156 23.838 17.422 -8.436 1.00 1.27 O ATOM 2403 CB SER A 156 24.925 19.551 -6.433 1.00 1.17 C ATOM 2404 OG SER A 156 26.326 19.713 -6.605 1.00 1.98 O ATOM 0 H SER A 156 26.337 18.034 -5.120 1.00 1.10 H new ATOM 0 HA SER A 156 23.552 17.972 -5.912 1.00 1.19 H new ATOM 0 HB2 SER A 156 24.397 19.951 -7.298 1.00 1.17 H new ATOM 0 HB3 SER A 156 24.590 20.119 -5.565 1.00 1.17 H new ATOM 0 HG SER A 156 26.517 19.941 -7.539 1.00 1.98 H new ATOM 2410 N GLY A 157 25.834 16.626 -7.733 1.00 1.04 N ATOM 2411 CA GLY A 157 26.109 15.881 -8.957 1.00 1.09 C ATOM 2412 C GLY A 157 26.197 16.749 -10.207 1.00 1.02 C ATOM 2413 O GLY A 157 26.390 16.239 -11.308 1.00 1.27 O ATOM 0 H GLY A 157 26.561 16.548 -7.021 1.00 1.04 H new ATOM 0 HA2 GLY A 157 27.047 15.339 -8.837 1.00 1.09 H new ATOM 0 HA3 GLY A 157 25.327 15.136 -9.100 1.00 1.09 H new ATOM 2417 N ARG A 158 26.074 18.055 -10.039 1.00 0.79 N ATOM 2418 CA ARG A 158 26.189 18.990 -11.143 1.00 0.72 C ATOM 2419 C ARG A 158 26.621 20.348 -10.608 1.00 0.56 C ATOM 2420 O ARG A 158 27.117 20.439 -9.483 1.00 0.57 O ATOM 2421 CB ARG A 158 24.876 19.086 -11.946 1.00 0.85 C ATOM 2422 CG ARG A 158 23.664 19.633 -11.189 1.00 1.47 C ATOM 2423 CD ARG A 158 22.463 19.772 -12.128 1.00 1.52 C ATOM 2424 NE ARG A 158 21.267 20.316 -11.468 1.00 2.12 N ATOM 2425 CZ ARG A 158 20.192 20.779 -12.132 1.00 2.75 C ATOM 2426 NH1 ARG A 158 20.175 20.794 -13.460 1.00 3.00 N ATOM 2427 NH2 ARG A 158 19.128 21.218 -11.469 1.00 3.61 N ATOM 0 H ARG A 158 25.892 18.495 -9.137 1.00 0.79 H new ATOM 0 HA ARG A 158 26.947 18.626 -11.836 1.00 0.72 H new ATOM 0 HB2 ARG A 158 25.051 19.718 -12.816 1.00 0.85 H new ATOM 0 HB3 ARG A 158 24.628 18.092 -12.319 1.00 0.85 H new ATOM 0 HG2 ARG A 158 23.413 18.967 -10.364 1.00 1.47 H new ATOM 0 HG3 ARG A 158 23.907 20.602 -10.754 1.00 1.47 H new ATOM 0 HD2 ARG A 158 22.736 20.420 -12.961 1.00 1.52 H new ATOM 0 HD3 ARG A 158 22.225 18.795 -12.548 1.00 1.52 H new ATOM 0 HE ARG A 158 21.251 20.344 -10.449 1.00 2.12 H new ATOM 0 HH11 ARG A 158 20.981 20.453 -13.984 1.00 3.00 H new ATOM 0 HH12 ARG A 158 19.356 21.147 -13.956 1.00 3.00 H new ATOM 0 HH21 ARG A 158 19.122 21.206 -10.449 1.00 3.61 H new ATOM 0 HH22 ARG A 158 18.317 21.567 -11.980 1.00 3.61 H new ATOM 2441 N ALA A 159 26.413 21.402 -11.382 1.00 0.48 N ATOM 2442 CA ALA A 159 26.925 22.710 -11.011 1.00 0.39 C ATOM 2443 C ALA A 159 25.976 23.410 -10.048 1.00 0.39 C ATOM 2444 O ALA A 159 24.830 23.719 -10.387 1.00 0.48 O ATOM 2445 CB ALA A 159 27.157 23.556 -12.252 1.00 0.37 C ATOM 0 H ALA A 159 25.898 21.378 -12.262 1.00 0.48 H new ATOM 0 HA ALA A 159 27.879 22.575 -10.502 1.00 0.39 H new ATOM 0 HB1 ALA A 159 27.541 24.533 -11.960 1.00 0.37 H new ATOM 0 HB2 ALA A 159 27.881 23.061 -12.900 1.00 0.37 H new ATOM 0 HB3 ALA A 159 26.216 23.681 -12.788 1.00 0.37 H new ATOM 2451 N ALA A 160 26.459 23.638 -8.837 1.00 0.38 N ATOM 2452 CA ALA A 160 25.670 24.274 -7.804 1.00 0.41 C ATOM 2453 C ALA A 160 26.444 25.432 -7.204 1.00 0.41 C ATOM 2454 O ALA A 160 27.678 25.389 -7.147 1.00 0.42 O ATOM 2455 CB ALA A 160 25.293 23.268 -6.729 1.00 0.49 C ATOM 0 H ALA A 160 27.404 23.387 -8.547 1.00 0.38 H new ATOM 0 HA ALA A 160 24.751 24.658 -8.247 1.00 0.41 H new ATOM 0 HB1 ALA A 160 24.700 23.763 -5.960 1.00 0.49 H new ATOM 0 HB2 ALA A 160 24.710 22.461 -7.174 1.00 0.49 H new ATOM 0 HB3 ALA A 160 26.198 22.858 -6.281 1.00 0.49 H new ATOM 2461 N CYS A 161 25.714 26.453 -6.766 1.00 0.47 N ATOM 2462 CA CYS A 161 26.312 27.666 -6.219 1.00 0.51 C ATOM 2463 C CYS A 161 27.297 28.284 -7.211 1.00 0.42 C ATOM 2464 O CYS A 161 28.462 28.507 -6.885 1.00 0.49 O ATOM 2465 CB CYS A 161 27.008 27.367 -4.888 1.00 0.63 C ATOM 2466 SG CYS A 161 25.918 26.663 -3.629 1.00 1.55 S ATOM 0 H CYS A 161 24.694 26.463 -6.780 1.00 0.47 H new ATOM 0 HA CYS A 161 25.514 28.387 -6.040 1.00 0.51 H new ATOM 0 HB2 CYS A 161 27.832 26.676 -5.068 1.00 0.63 H new ATOM 0 HB3 CYS A 161 27.443 28.289 -4.502 1.00 0.63 H new ATOM 0 HG CYS A 161 26.596 26.443 -2.542 1.00 1.55 H new ATOM 2472 N VAL A 162 26.826 28.555 -8.425 1.00 0.37 N ATOM 2473 CA VAL A 162 27.682 29.142 -9.444 1.00 0.35 C ATOM 2474 C VAL A 162 27.868 30.636 -9.183 1.00 0.39 C ATOM 2475 O VAL A 162 26.943 31.332 -8.748 1.00 0.48 O ATOM 2476 CB VAL A 162 27.149 28.920 -10.888 1.00 0.45 C ATOM 2477 CG1 VAL A 162 26.746 27.468 -11.106 1.00 1.15 C ATOM 2478 CG2 VAL A 162 25.996 29.855 -11.223 1.00 1.26 C ATOM 0 H VAL A 162 25.866 28.379 -8.722 1.00 0.37 H new ATOM 0 HA VAL A 162 28.642 28.630 -9.376 1.00 0.35 H new ATOM 0 HB VAL A 162 27.967 29.157 -11.568 1.00 0.45 H new ATOM 0 HG11 VAL A 162 26.377 27.342 -12.124 1.00 1.15 H new ATOM 0 HG12 VAL A 162 27.611 26.823 -10.951 1.00 1.15 H new ATOM 0 HG13 VAL A 162 25.961 27.198 -10.400 1.00 1.15 H new ATOM 0 HG21 VAL A 162 25.656 29.664 -12.241 1.00 1.26 H new ATOM 0 HG22 VAL A 162 25.174 29.683 -10.528 1.00 1.26 H new ATOM 0 HG23 VAL A 162 26.330 30.889 -11.140 1.00 1.26 H new ATOM 2488 N ASN A 163 29.071 31.115 -9.425 1.00 0.43 N ATOM 2489 CA ASN A 163 29.388 32.518 -9.226 1.00 0.53 C ATOM 2490 C ASN A 163 30.255 33.030 -10.367 1.00 0.52 C ATOM 2491 O ASN A 163 31.336 32.494 -10.617 1.00 0.53 O ATOM 2492 CB ASN A 163 30.111 32.720 -7.889 1.00 0.67 C ATOM 2493 CG ASN A 163 30.448 34.178 -7.616 1.00 1.29 C ATOM 2494 OD1 ASN A 163 29.553 35.088 -7.986 1.00 1.96 O flip ATOM 2495 ND2 ASN A 163 31.497 34.487 -7.051 1.00 2.05 N flip ATOM 0 H ASN A 163 29.851 30.551 -9.762 1.00 0.43 H new ATOM 0 HA ASN A 163 28.456 33.082 -9.209 1.00 0.53 H new ATOM 0 HB2 ASN A 163 29.486 32.339 -7.082 1.00 0.67 H new ATOM 0 HB3 ASN A 163 31.029 32.133 -7.885 1.00 0.67 H new ATOM 0 HD21 ASN A 163 32.163 33.763 -6.780 1.00 2.05 H new ATOM 0 HD22 ASN A 163 31.700 35.467 -6.854 1.00 2.05 H new ATOM 2502 N ALA A 164 29.753 34.031 -11.078 1.00 0.53 N ATOM 2503 CA ALA A 164 30.516 34.691 -12.129 1.00 0.56 C ATOM 2504 C ALA A 164 31.737 35.398 -11.554 1.00 0.63 C ATOM 2505 O ALA A 164 31.620 36.456 -10.933 1.00 0.75 O ATOM 2506 CB ALA A 164 29.637 35.684 -12.864 1.00 0.60 C ATOM 0 H ALA A 164 28.814 34.406 -10.944 1.00 0.53 H new ATOM 0 HA ALA A 164 30.861 33.931 -12.830 1.00 0.56 H new ATOM 0 HB1 ALA A 164 30.216 36.172 -13.648 1.00 0.60 H new ATOM 0 HB2 ALA A 164 28.791 35.161 -13.310 1.00 0.60 H new ATOM 0 HB3 ALA A 164 29.270 36.434 -12.163 1.00 0.60 H new ATOM 2512 N VAL A 165 32.897 34.795 -11.734 1.00 0.62 N ATOM 2513 CA VAL A 165 34.133 35.370 -11.250 1.00 0.70 C ATOM 2514 C VAL A 165 35.237 35.239 -12.299 1.00 0.71 C ATOM 2515 O VAL A 165 35.604 34.137 -12.710 1.00 0.95 O ATOM 2516 CB VAL A 165 34.561 34.728 -9.906 1.00 1.07 C ATOM 2517 CG1 VAL A 165 34.750 33.227 -10.038 1.00 1.43 C ATOM 2518 CG2 VAL A 165 35.822 35.388 -9.363 1.00 1.56 C ATOM 0 H VAL A 165 33.007 33.902 -12.215 1.00 0.62 H new ATOM 0 HA VAL A 165 33.963 36.431 -11.068 1.00 0.70 H new ATOM 0 HB VAL A 165 33.754 34.896 -9.193 1.00 1.07 H new ATOM 0 HG11 VAL A 165 35.050 32.812 -9.076 1.00 1.43 H new ATOM 0 HG12 VAL A 165 33.813 32.769 -10.355 1.00 1.43 H new ATOM 0 HG13 VAL A 165 35.523 33.021 -10.779 1.00 1.43 H new ATOM 0 HG21 VAL A 165 36.101 34.919 -8.419 1.00 1.56 H new ATOM 0 HG22 VAL A 165 36.633 35.269 -10.081 1.00 1.56 H new ATOM 0 HG23 VAL A 165 35.636 36.449 -9.199 1.00 1.56 H new ATOM 2528 N ARG A 166 35.745 36.371 -12.751 1.00 0.84 N ATOM 2529 CA ARG A 166 36.793 36.381 -13.755 1.00 1.15 C ATOM 2530 C ARG A 166 38.159 36.553 -13.108 1.00 1.13 C ATOM 2531 O ARG A 166 38.420 37.550 -12.439 1.00 1.05 O ATOM 2532 CB ARG A 166 36.558 37.492 -14.789 1.00 1.51 C ATOM 2533 CG ARG A 166 35.527 37.150 -15.861 1.00 1.76 C ATOM 2534 CD ARG A 166 34.101 37.211 -15.339 1.00 1.58 C ATOM 2535 NE ARG A 166 33.633 38.586 -15.158 1.00 1.94 N ATOM 2536 CZ ARG A 166 32.352 38.951 -15.233 1.00 2.24 C ATOM 2537 NH1 ARG A 166 31.420 38.065 -15.553 1.00 2.45 N ATOM 2538 NH2 ARG A 166 32.003 40.212 -15.025 1.00 2.94 N ATOM 0 H ARG A 166 35.449 37.296 -12.439 1.00 0.84 H new ATOM 0 HA ARG A 166 36.767 35.420 -14.269 1.00 1.15 H new ATOM 0 HB2 ARG A 166 36.237 38.394 -14.268 1.00 1.51 H new ATOM 0 HB3 ARG A 166 37.505 37.725 -15.275 1.00 1.51 H new ATOM 0 HG2 ARG A 166 35.634 37.841 -16.697 1.00 1.76 H new ATOM 0 HG3 ARG A 166 35.727 36.150 -16.247 1.00 1.76 H new ATOM 0 HD2 ARG A 166 33.440 36.693 -16.034 1.00 1.58 H new ATOM 0 HD3 ARG A 166 34.042 36.681 -14.388 1.00 1.58 H new ATOM 0 HE ARG A 166 34.327 39.308 -14.963 1.00 1.94 H new ATOM 0 HH11 ARG A 166 31.680 37.097 -15.744 1.00 2.45 H new ATOM 0 HH12 ARG A 166 30.442 38.351 -15.609 1.00 2.45 H new ATOM 0 HH21 ARG A 166 32.715 40.909 -14.806 1.00 2.94 H new ATOM 0 HH22 ARG A 166 31.022 40.486 -15.084 1.00 2.94 H new