USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1106 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 Single : A 9 GLN : amide:sc= -0.934 K(o=-0.93,f=-2.1!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00164 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc=-0.00982 X(o=-0.0098,f=-0.021) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.0806 USER MOD Single : A 30 MET CE :methyl 160:sc= 0 (180deg=-0.34) USER MOD Single : A 31 MET CE :methyl -114:sc= -2.77 (180deg=-8.67!) USER MOD Single : A 32 ASN : amide:sc=-0.00196 X(o=-0.002,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -107:sc= 0.49 (180deg=-0.09) USER MOD Single : A 38 MET CE :methyl -104:sc= -2.72 (180deg=-3.56) USER MOD Single : A 43 MET CE :methyl -127:sc= 0 (180deg=-0.754) USER MOD Single : A 44 LYS NZ :NH3+ 145:sc= -0.118 (180deg=-1.44!) USER MOD Single : A 45 LYS NZ :NH3+ -132:sc= -0.358 (180deg=-2.11!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.142 USER MOD Single : A 53 ASN : amide:sc= -0.0128 X(o=-0.013,f=-0.072) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.14) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.27 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot -164:sc= -3.37! USER MOD Single : A 92 MET CE :methyl -135:sc= -2.3 (180deg=-2.83!) USER MOD Single : A 94 GLN : amide:sc= -0.231 K(o=-0.23,f=-2.5!) USER MOD Single : A 100 SER OG : rot 101:sc= 0.035 USER MOD Single : A 103 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0369) USER MOD Single : A 107 CYS SG : rot 77:sc= -0.693 USER MOD Single : A 110 HIS : no HD1:sc= -0.0358 X(o=-0.036,f=-0.28) USER MOD Single : A 119 CYS SG : rot 50:sc= -1 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 125 TYR OH : rot 180:sc= -0.457 USER MOD Single : A 126 TYR OH : rot -49:sc= 0.387 USER MOD ----------------------------------------------------------------- ATOM 44 N ILE A 4 7.189 -3.468 -2.007 1.00 1.53 N ATOM 45 CA ILE A 4 7.888 -3.595 -0.734 1.00 63.11 C ATOM 46 C ILE A 4 8.980 -4.657 -0.811 1.00 33.34 C ATOM 47 O ILE A 4 8.907 -5.579 -1.624 1.00 21.15 O ATOM 48 CB ILE A 4 6.919 -3.953 0.408 1.00 53.23 C ATOM 49 CG1 ILE A 4 5.775 -4.823 -0.119 1.00 5.04 C ATOM 50 CG2 ILE A 4 6.374 -2.689 1.056 1.00 42.43 C ATOM 51 CD1 ILE A 4 6.239 -6.132 -0.717 1.00 62.52 C ATOM 0 HA ILE A 4 8.340 -2.626 -0.524 1.00 63.11 H new ATOM 0 HB ILE A 4 7.464 -4.519 1.163 1.00 53.23 H new ATOM 0 HG12 ILE A 4 5.082 -5.031 0.696 1.00 5.04 H new ATOM 0 HG13 ILE A 4 5.222 -4.264 -0.874 1.00 5.04 H new ATOM 0 HG21 ILE A 4 5.691 -2.959 1.861 1.00 42.43 H new ATOM 0 HG22 ILE A 4 7.199 -2.103 1.461 1.00 42.43 H new ATOM 0 HG23 ILE A 4 5.841 -2.099 0.311 1.00 42.43 H new ATOM 0 HD11 ILE A 4 5.376 -6.697 -1.070 1.00 62.52 H new ATOM 0 HD12 ILE A 4 6.909 -5.933 -1.553 1.00 62.52 H new ATOM 0 HD13 ILE A 4 6.767 -6.711 0.041 1.00 62.52 H new ATOM 63 N ARG A 5 9.990 -4.523 0.043 1.00 52.44 N ATOM 64 CA ARG A 5 11.096 -5.471 0.072 1.00 25.23 C ATOM 65 C ARG A 5 10.590 -6.890 0.314 1.00 30.11 C ATOM 66 O ARG A 5 9.604 -7.095 1.023 1.00 70.34 O ATOM 67 CB ARG A 5 12.099 -5.084 1.161 1.00 42.23 C ATOM 68 CG ARG A 5 13.086 -4.012 0.726 1.00 32.34 C ATOM 69 CD ARG A 5 12.378 -2.714 0.373 1.00 41.35 C ATOM 70 NE ARG A 5 13.249 -1.553 0.537 1.00 22.11 N ATOM 71 CZ ARG A 5 13.560 -1.029 1.717 1.00 22.25 C ATOM 72 NH1 ARG A 5 13.074 -1.560 2.831 1.00 40.01 N ATOM 73 NH2 ARG A 5 14.360 0.028 1.786 1.00 74.33 N ATOM 0 H ARG A 5 10.064 -3.767 0.724 1.00 52.44 H new ATOM 0 HA ARG A 5 11.592 -5.441 -0.898 1.00 25.23 H new ATOM 0 HB2 ARG A 5 11.554 -4.731 2.036 1.00 42.23 H new ATOM 0 HB3 ARG A 5 12.652 -5.972 1.467 1.00 42.23 H new ATOM 0 HG2 ARG A 5 13.804 -3.830 1.526 1.00 32.34 H new ATOM 0 HG3 ARG A 5 13.652 -4.365 -0.136 1.00 32.34 H new ATOM 0 HD2 ARG A 5 12.027 -2.761 -0.658 1.00 41.35 H new ATOM 0 HD3 ARG A 5 11.497 -2.598 1.004 1.00 41.35 H new ATOM 0 HE ARG A 5 13.640 -1.121 -0.300 1.00 22.11 H new ATOM 0 HH11 ARG A 5 12.460 -2.373 2.783 1.00 40.01 H new ATOM 0 HH12 ARG A 5 13.315 -1.156 3.736 1.00 40.01 H new ATOM 0 HH21 ARG A 5 14.737 0.439 0.932 1.00 74.33 H new ATOM 0 HH22 ARG A 5 14.598 0.429 2.693 1.00 74.33 H new ATOM 87 N ILE A 6 11.271 -7.865 -0.279 1.00 55.14 N ATOM 88 CA ILE A 6 10.890 -9.264 -0.128 1.00 13.31 C ATOM 89 C ILE A 6 11.713 -9.943 0.961 1.00 1.43 C ATOM 90 O ILE A 6 11.219 -10.816 1.675 1.00 41.22 O ATOM 91 CB ILE A 6 11.063 -10.040 -1.446 1.00 64.44 C ATOM 92 CG1 ILE A 6 10.637 -9.174 -2.634 1.00 24.53 C ATOM 93 CG2 ILE A 6 10.260 -11.332 -1.410 1.00 53.32 C ATOM 94 CD1 ILE A 6 11.772 -8.378 -3.239 1.00 22.04 C ATOM 0 H ILE A 6 12.089 -7.712 -0.868 1.00 55.14 H new ATOM 0 HA ILE A 6 9.837 -9.276 0.155 1.00 13.31 H new ATOM 0 HB ILE A 6 12.116 -10.293 -1.565 1.00 64.44 H new ATOM 0 HG12 ILE A 6 10.203 -9.814 -3.402 1.00 24.53 H new ATOM 0 HG13 ILE A 6 9.854 -8.488 -2.311 1.00 24.53 H new ATOM 0 HG21 ILE A 6 10.393 -11.869 -2.349 1.00 53.32 H new ATOM 0 HG22 ILE A 6 10.607 -11.953 -0.584 1.00 53.32 H new ATOM 0 HG23 ILE A 6 9.204 -11.100 -1.271 1.00 53.32 H new ATOM 0 HD11 ILE A 6 11.397 -7.788 -4.075 1.00 22.04 H new ATOM 0 HD12 ILE A 6 12.192 -7.713 -2.485 1.00 22.04 H new ATOM 0 HD13 ILE A 6 12.546 -9.059 -3.593 1.00 22.04 H new ATOM 106 N VAL A 7 12.972 -9.534 1.085 1.00 20.22 N ATOM 107 CA VAL A 7 13.864 -10.101 2.090 1.00 42.43 C ATOM 108 C VAL A 7 14.969 -9.118 2.460 1.00 3.20 C ATOM 109 O VAL A 7 15.965 -8.969 1.751 1.00 10.14 O ATOM 110 CB VAL A 7 14.503 -11.413 1.597 1.00 1.31 C ATOM 111 CG1 VAL A 7 13.501 -12.555 1.669 1.00 52.44 C ATOM 112 CG2 VAL A 7 15.035 -11.247 0.182 1.00 60.15 C ATOM 0 H VAL A 7 13.397 -8.813 0.502 1.00 20.22 H new ATOM 0 HA VAL A 7 13.257 -10.310 2.971 1.00 42.43 H new ATOM 0 HB VAL A 7 15.342 -11.656 2.249 1.00 1.31 H new ATOM 0 HG11 VAL A 7 13.970 -13.474 1.317 1.00 52.44 H new ATOM 0 HG12 VAL A 7 13.173 -12.687 2.700 1.00 52.44 H new ATOM 0 HG13 VAL A 7 12.640 -12.324 1.042 1.00 52.44 H new ATOM 0 HG21 VAL A 7 15.483 -12.183 -0.150 1.00 60.15 H new ATOM 0 HG22 VAL A 7 14.216 -10.979 -0.486 1.00 60.15 H new ATOM 0 HG23 VAL A 7 15.788 -10.459 0.166 1.00 60.15 H new ATOM 122 N PRO A 8 14.792 -8.430 3.598 1.00 43.22 N ATOM 123 CA PRO A 8 15.765 -7.449 4.089 1.00 31.44 C ATOM 124 C PRO A 8 17.055 -8.104 4.571 1.00 62.02 C ATOM 125 O PRO A 8 17.111 -9.318 4.763 1.00 33.24 O ATOM 126 CB PRO A 8 15.036 -6.782 5.258 1.00 52.30 C ATOM 127 CG PRO A 8 14.051 -7.799 5.721 1.00 71.01 C ATOM 128 CD PRO A 8 13.629 -8.557 4.492 1.00 4.52 C ATOM 0 HA PRO A 8 16.073 -6.754 3.308 1.00 31.44 H new ATOM 0 HB2 PRO A 8 15.729 -6.512 6.054 1.00 52.30 H new ATOM 0 HB3 PRO A 8 14.539 -5.865 4.943 1.00 52.30 H new ATOM 0 HG2 PRO A 8 14.497 -8.467 6.458 1.00 71.01 H new ATOM 0 HG3 PRO A 8 13.195 -7.323 6.199 1.00 71.01 H new ATOM 0 HD2 PRO A 8 13.408 -9.600 4.719 1.00 4.52 H new ATOM 0 HD3 PRO A 8 12.730 -8.131 4.046 1.00 4.52 H new ATOM 136 N GLN A 9 18.089 -7.292 4.763 1.00 4.34 N ATOM 137 CA GLN A 9 19.379 -7.794 5.222 1.00 3.43 C ATOM 138 C GLN A 9 19.244 -8.487 6.574 1.00 10.21 C ATOM 139 O GLN A 9 18.251 -8.304 7.279 1.00 21.42 O ATOM 140 CB GLN A 9 20.390 -6.649 5.322 1.00 75.35 C ATOM 141 CG GLN A 9 19.964 -5.543 6.274 1.00 65.31 C ATOM 142 CD GLN A 9 19.230 -4.419 5.571 1.00 11.54 C ATOM 143 OE1 GLN A 9 19.515 -4.102 4.416 1.00 74.11 O ATOM 144 NE2 GLN A 9 18.278 -3.807 6.267 1.00 60.51 N ATOM 0 H GLN A 9 18.059 -6.284 4.608 1.00 4.34 H new ATOM 0 HA GLN A 9 19.736 -8.523 4.494 1.00 3.43 H new ATOM 0 HB2 GLN A 9 21.349 -7.050 5.650 1.00 75.35 H new ATOM 0 HB3 GLN A 9 20.544 -6.224 4.330 1.00 75.35 H new ATOM 0 HG2 GLN A 9 19.322 -5.963 7.048 1.00 65.31 H new ATOM 0 HG3 GLN A 9 20.845 -5.140 6.774 1.00 65.31 H new ATOM 0 HE21 GLN A 9 18.075 -4.102 7.222 1.00 60.51 H new ATOM 0 HE22 GLN A 9 17.751 -3.042 5.846 1.00 60.51 H new ATOM 153 N ILE A 10 20.248 -9.282 6.929 1.00 74.04 N ATOM 154 CA ILE A 10 20.240 -10.002 8.196 1.00 3.32 C ATOM 155 C ILE A 10 21.399 -9.561 9.085 1.00 74.51 C ATOM 156 O ILE A 10 22.532 -9.420 8.623 1.00 15.34 O ATOM 157 CB ILE A 10 20.324 -11.524 7.980 1.00 71.24 C ATOM 158 CG1 ILE A 10 21.586 -11.881 7.192 1.00 41.32 C ATOM 159 CG2 ILE A 10 19.083 -12.025 7.257 1.00 75.32 C ATOM 160 CD1 ILE A 10 21.760 -13.367 6.970 1.00 44.21 C ATOM 0 H ILE A 10 21.077 -9.444 6.357 1.00 74.04 H new ATOM 0 HA ILE A 10 19.296 -9.765 8.688 1.00 3.32 H new ATOM 0 HB ILE A 10 20.376 -12.012 8.953 1.00 71.24 H new ATOM 0 HG12 ILE A 10 21.555 -11.379 6.225 1.00 41.32 H new ATOM 0 HG13 ILE A 10 22.457 -11.497 7.723 1.00 41.32 H new ATOM 0 HG21 ILE A 10 19.157 -13.103 7.111 1.00 75.32 H new ATOM 0 HG22 ILE A 10 18.199 -11.799 7.853 1.00 75.32 H new ATOM 0 HG23 ILE A 10 19.003 -11.533 6.288 1.00 75.32 H new ATOM 0 HD11 ILE A 10 22.675 -13.546 6.405 1.00 44.21 H new ATOM 0 HD12 ILE A 10 21.823 -13.874 7.933 1.00 44.21 H new ATOM 0 HD13 ILE A 10 20.907 -13.754 6.412 1.00 44.21 H new ATOM 172 N THR A 11 21.108 -9.348 10.364 1.00 13.25 N ATOM 173 CA THR A 11 22.124 -8.925 11.319 1.00 3.41 C ATOM 174 C THR A 11 22.603 -10.096 12.169 1.00 73.44 C ATOM 175 O THR A 11 22.212 -11.241 11.940 1.00 64.42 O ATOM 176 CB THR A 11 21.596 -7.814 12.247 1.00 21.41 C ATOM 177 OG1 THR A 11 20.306 -7.379 11.805 1.00 52.23 O ATOM 178 CG2 THR A 11 22.553 -6.632 12.276 1.00 24.52 C ATOM 0 H THR A 11 20.176 -9.462 10.763 1.00 13.25 H new ATOM 0 HA THR A 11 22.960 -8.536 10.738 1.00 3.41 H new ATOM 0 HB THR A 11 21.516 -8.221 13.255 1.00 21.41 H new ATOM 0 HG1 THR A 11 19.977 -6.674 12.401 1.00 52.23 H new ATOM 0 HG21 THR A 11 22.159 -5.861 12.938 1.00 24.52 H new ATOM 0 HG22 THR A 11 23.526 -6.961 12.641 1.00 24.52 H new ATOM 0 HG23 THR A 11 22.661 -6.226 11.270 1.00 24.52 H new ATOM 186 N ASP A 12 23.449 -9.803 13.150 1.00 71.13 N ATOM 187 CA ASP A 12 23.979 -10.833 14.035 1.00 23.14 C ATOM 188 C ASP A 12 22.850 -11.572 14.747 1.00 3.12 C ATOM 189 O ASP A 12 23.028 -12.698 15.210 1.00 62.11 O ATOM 190 CB ASP A 12 24.927 -10.213 15.063 1.00 25.41 C ATOM 191 CG ASP A 12 26.012 -11.176 15.505 1.00 32.31 C ATOM 192 OD1 ASP A 12 26.471 -11.978 14.665 1.00 2.22 O ATOM 193 OD2 ASP A 12 26.400 -11.129 16.691 1.00 23.13 O ATOM 0 H ASP A 12 23.782 -8.861 13.352 1.00 71.13 H new ATOM 0 HA ASP A 12 24.532 -11.550 13.428 1.00 23.14 H new ATOM 0 HB2 ASP A 12 25.388 -9.322 14.637 1.00 25.41 H new ATOM 0 HB3 ASP A 12 24.355 -9.891 15.933 1.00 25.41 H new ATOM 198 N GLU A 13 21.690 -10.929 14.831 1.00 13.03 N ATOM 199 CA GLU A 13 20.533 -11.525 15.489 1.00 72.32 C ATOM 200 C GLU A 13 20.005 -12.713 14.689 1.00 21.25 C ATOM 201 O GLU A 13 19.432 -13.646 15.251 1.00 54.11 O ATOM 202 CB GLU A 13 19.426 -10.484 15.666 1.00 0.31 C ATOM 203 CG GLU A 13 19.924 -9.150 16.198 1.00 64.44 C ATOM 204 CD GLU A 13 18.799 -8.168 16.457 1.00 53.04 C ATOM 205 OE1 GLU A 13 18.427 -7.430 15.520 1.00 23.14 O ATOM 206 OE2 GLU A 13 18.289 -8.138 17.596 1.00 1.25 O ATOM 0 H GLU A 13 21.526 -9.996 14.452 1.00 13.03 H new ATOM 0 HA GLU A 13 20.848 -11.880 16.470 1.00 72.32 H new ATOM 0 HB2 GLU A 13 18.934 -10.322 14.707 1.00 0.31 H new ATOM 0 HB3 GLU A 13 18.673 -10.879 16.348 1.00 0.31 H new ATOM 0 HG2 GLU A 13 20.477 -9.316 17.123 1.00 64.44 H new ATOM 0 HG3 GLU A 13 20.622 -8.716 15.483 1.00 64.44 H new ATOM 213 N GLU A 14 20.203 -12.670 13.376 1.00 43.14 N ATOM 214 CA GLU A 14 19.746 -13.742 12.499 1.00 1.21 C ATOM 215 C GLU A 14 20.917 -14.606 12.040 1.00 41.12 C ATOM 216 O GLU A 14 20.828 -15.834 12.022 1.00 12.34 O ATOM 217 CB GLU A 14 19.019 -13.162 11.284 1.00 34.03 C ATOM 218 CG GLU A 14 17.794 -12.338 11.644 1.00 34.44 C ATOM 219 CD GLU A 14 16.804 -13.107 12.499 1.00 44.02 C ATOM 220 OE1 GLU A 14 16.971 -13.118 13.736 1.00 3.12 O ATOM 221 OE2 GLU A 14 15.863 -13.697 11.929 1.00 33.51 O ATOM 0 H GLU A 14 20.677 -11.905 12.896 1.00 43.14 H new ATOM 0 HA GLU A 14 19.054 -14.368 13.063 1.00 1.21 H new ATOM 0 HB2 GLU A 14 19.713 -12.539 10.719 1.00 34.03 H new ATOM 0 HB3 GLU A 14 18.717 -13.978 10.628 1.00 34.03 H new ATOM 0 HG2 GLU A 14 18.108 -11.441 12.177 1.00 34.44 H new ATOM 0 HG3 GLU A 14 17.300 -12.009 10.730 1.00 34.44 H new ATOM 228 N PHE A 15 22.015 -13.955 11.668 1.00 74.31 N ATOM 229 CA PHE A 15 23.203 -14.663 11.207 1.00 44.13 C ATOM 230 C PHE A 15 23.686 -15.658 12.258 1.00 70.11 C ATOM 231 O PHE A 15 24.202 -16.726 11.928 1.00 5.01 O ATOM 232 CB PHE A 15 24.319 -13.669 10.879 1.00 44.21 C ATOM 233 CG PHE A 15 25.663 -14.315 10.698 1.00 43.43 C ATOM 234 CD1 PHE A 15 26.502 -14.516 11.782 1.00 12.12 C ATOM 235 CD2 PHE A 15 26.088 -14.720 9.443 1.00 42.23 C ATOM 236 CE1 PHE A 15 27.739 -15.110 11.619 1.00 20.20 C ATOM 237 CE2 PHE A 15 27.324 -15.315 9.274 1.00 60.05 C ATOM 238 CZ PHE A 15 28.151 -15.509 10.363 1.00 71.33 C ATOM 0 H PHE A 15 22.106 -12.939 11.677 1.00 74.31 H new ATOM 0 HA PHE A 15 22.939 -15.214 10.305 1.00 44.13 H new ATOM 0 HB2 PHE A 15 24.058 -13.130 9.968 1.00 44.21 H new ATOM 0 HB3 PHE A 15 24.384 -12.931 11.679 1.00 44.21 H new ATOM 0 HD1 PHE A 15 26.185 -14.205 12.766 1.00 12.12 H new ATOM 0 HD2 PHE A 15 25.446 -14.569 8.587 1.00 42.23 H new ATOM 0 HE1 PHE A 15 28.383 -15.262 12.473 1.00 20.20 H new ATOM 0 HE2 PHE A 15 27.643 -15.628 8.291 1.00 60.05 H new ATOM 0 HZ PHE A 15 29.118 -15.972 10.232 1.00 71.33 H new ATOM 248 N LYS A 16 23.514 -15.300 13.526 1.00 44.12 N ATOM 249 CA LYS A 16 23.931 -16.160 14.627 1.00 12.33 C ATOM 250 C LYS A 16 22.968 -17.331 14.797 1.00 5.11 C ATOM 251 O LYS A 16 23.232 -18.259 15.563 1.00 15.31 O ATOM 252 CB LYS A 16 24.008 -15.356 15.928 1.00 74.44 C ATOM 253 CG LYS A 16 22.661 -15.160 16.602 1.00 72.22 C ATOM 254 CD LYS A 16 22.479 -16.112 17.772 1.00 2.14 C ATOM 255 CE LYS A 16 23.185 -15.602 19.020 1.00 70.33 C ATOM 256 NZ LYS A 16 22.311 -14.702 19.823 1.00 65.44 N ATOM 0 H LYS A 16 23.088 -14.420 13.817 1.00 44.12 H new ATOM 0 HA LYS A 16 24.919 -16.556 14.392 1.00 12.33 H new ATOM 0 HB2 LYS A 16 24.681 -15.863 16.620 1.00 74.44 H new ATOM 0 HB3 LYS A 16 24.445 -14.380 15.717 1.00 74.44 H new ATOM 0 HG2 LYS A 16 22.575 -14.131 16.952 1.00 72.22 H new ATOM 0 HG3 LYS A 16 21.863 -15.318 15.876 1.00 72.22 H new ATOM 0 HD2 LYS A 16 21.416 -16.237 17.979 1.00 2.14 H new ATOM 0 HD3 LYS A 16 22.870 -17.095 17.507 1.00 2.14 H new ATOM 0 HE2 LYS A 16 23.496 -16.448 19.633 1.00 70.33 H new ATOM 0 HE3 LYS A 16 24.090 -15.067 18.732 1.00 70.33 H new ATOM 0 HZ1 LYS A 16 22.828 -14.376 20.664 1.00 65.44 H new ATOM 0 HZ2 LYS A 16 22.035 -13.881 19.247 1.00 65.44 H new ATOM 0 HZ3 LYS A 16 21.459 -15.219 20.119 1.00 65.44 H new ATOM 270 N THR A 17 21.852 -17.283 14.077 1.00 61.23 N ATOM 271 CA THR A 17 20.851 -18.340 14.147 1.00 0.04 C ATOM 272 C THR A 17 21.287 -19.564 13.351 1.00 72.33 C ATOM 273 O THR A 17 20.637 -20.609 13.396 1.00 73.23 O ATOM 274 CB THR A 17 19.487 -17.857 13.620 1.00 35.42 C ATOM 275 OG1 THR A 17 18.428 -18.480 14.358 1.00 45.34 O ATOM 276 CG2 THR A 17 19.335 -18.175 12.140 1.00 21.22 C ATOM 0 H THR A 17 21.618 -16.523 13.438 1.00 61.23 H new ATOM 0 HA THR A 17 20.751 -18.611 15.198 1.00 0.04 H new ATOM 0 HB THR A 17 19.434 -16.776 13.751 1.00 35.42 H new ATOM 0 HG1 THR A 17 17.564 -18.167 14.018 1.00 45.34 H new ATOM 0 HG21 THR A 17 18.364 -17.824 11.790 1.00 21.22 H new ATOM 0 HG22 THR A 17 20.125 -17.677 11.578 1.00 21.22 H new ATOM 0 HG23 THR A 17 19.407 -19.252 11.990 1.00 21.22 H new ATOM 284 N ILE A 18 22.390 -19.429 12.623 1.00 41.11 N ATOM 285 CA ILE A 18 22.913 -20.526 11.818 1.00 50.43 C ATOM 286 C ILE A 18 24.186 -21.099 12.430 1.00 2.04 C ATOM 287 O ILE A 18 25.098 -20.371 12.824 1.00 13.02 O ATOM 288 CB ILE A 18 23.209 -20.074 10.375 1.00 0.24 C ATOM 289 CG1 ILE A 18 21.936 -19.546 9.712 1.00 54.53 C ATOM 290 CG2 ILE A 18 23.795 -21.224 9.570 1.00 53.12 C ATOM 291 CD1 ILE A 18 21.908 -18.040 9.570 1.00 0.34 C ATOM 0 H ILE A 18 22.939 -18.571 12.574 1.00 41.11 H new ATOM 0 HA ILE A 18 22.143 -21.297 11.798 1.00 50.43 H new ATOM 0 HB ILE A 18 23.941 -19.267 10.405 1.00 0.24 H new ATOM 0 HG12 ILE A 18 21.836 -19.998 8.725 1.00 54.53 H new ATOM 0 HG13 ILE A 18 21.073 -19.864 10.297 1.00 54.53 H new ATOM 0 HG21 ILE A 18 23.999 -20.889 8.553 1.00 53.12 H new ATOM 0 HG22 ILE A 18 24.723 -21.558 10.035 1.00 53.12 H new ATOM 0 HG23 ILE A 18 23.084 -22.050 9.545 1.00 53.12 H new ATOM 0 HD11 ILE A 18 20.977 -17.737 9.092 1.00 0.34 H new ATOM 0 HD12 ILE A 18 21.976 -17.580 10.556 1.00 0.34 H new ATOM 0 HD13 ILE A 18 22.751 -17.716 8.960 1.00 0.34 H new ATOM 303 N PRO A 19 24.253 -22.436 12.512 1.00 24.11 N ATOM 304 CA PRO A 19 25.412 -23.138 13.073 1.00 14.35 C ATOM 305 C PRO A 19 26.642 -23.033 12.179 1.00 4.44 C ATOM 306 O PRO A 19 26.532 -23.013 10.953 1.00 2.23 O ATOM 307 CB PRO A 19 24.938 -24.590 13.162 1.00 34.51 C ATOM 308 CG PRO A 19 23.880 -24.708 12.120 1.00 71.14 C ATOM 309 CD PRO A 19 23.204 -23.366 12.062 1.00 20.11 C ATOM 0 HA PRO A 19 25.720 -22.716 14.030 1.00 14.35 H new ATOM 0 HB2 PRO A 19 25.756 -25.286 12.976 1.00 34.51 H new ATOM 0 HB3 PRO A 19 24.545 -24.818 14.153 1.00 34.51 H new ATOM 0 HG2 PRO A 19 24.311 -24.970 11.154 1.00 71.14 H new ATOM 0 HG3 PRO A 19 23.168 -25.493 12.374 1.00 71.14 H new ATOM 0 HD2 PRO A 19 22.864 -23.131 11.054 1.00 20.11 H new ATOM 0 HD3 PRO A 19 22.329 -23.329 12.710 1.00 20.11 H new ATOM 317 N LYS A 20 27.815 -22.966 12.800 1.00 1.14 N ATOM 318 CA LYS A 20 29.068 -22.865 12.062 1.00 40.45 C ATOM 319 C LYS A 20 29.208 -24.013 11.068 1.00 71.24 C ATOM 320 O LYS A 20 29.923 -23.901 10.072 1.00 62.43 O ATOM 321 CB LYS A 20 30.255 -22.865 13.027 1.00 0.45 C ATOM 322 CG LYS A 20 30.524 -21.510 13.661 1.00 60.35 C ATOM 323 CD LYS A 20 29.568 -21.232 14.808 1.00 1.43 C ATOM 324 CE LYS A 20 30.074 -20.103 15.693 1.00 11.42 C ATOM 325 NZ LYS A 20 31.056 -20.586 16.702 1.00 24.32 N ATOM 0 H LYS A 20 27.924 -22.980 13.814 1.00 1.14 H new ATOM 0 HA LYS A 20 29.059 -21.926 11.508 1.00 40.45 H new ATOM 0 HB2 LYS A 20 30.072 -23.596 13.815 1.00 0.45 H new ATOM 0 HB3 LYS A 20 31.147 -23.190 12.492 1.00 0.45 H new ATOM 0 HG2 LYS A 20 31.551 -21.475 14.025 1.00 60.35 H new ATOM 0 HG3 LYS A 20 30.426 -20.729 12.907 1.00 60.35 H new ATOM 0 HD2 LYS A 20 28.587 -20.973 14.411 1.00 1.43 H new ATOM 0 HD3 LYS A 20 29.442 -22.135 15.405 1.00 1.43 H new ATOM 0 HE2 LYS A 20 30.538 -19.336 15.073 1.00 11.42 H new ATOM 0 HE3 LYS A 20 29.231 -19.635 16.202 1.00 11.42 H new ATOM 0 HZ1 LYS A 20 31.376 -19.787 17.285 1.00 24.32 H new ATOM 0 HZ2 LYS A 20 30.606 -21.300 17.310 1.00 24.32 H new ATOM 0 HZ3 LYS A 20 31.872 -21.010 16.217 1.00 24.32 H new ATOM 339 N TYR A 21 28.520 -25.115 11.344 1.00 71.33 N ATOM 340 CA TYR A 21 28.568 -26.285 10.474 1.00 5.41 C ATOM 341 C TYR A 21 28.017 -25.957 9.090 1.00 64.24 C ATOM 342 O TYR A 21 28.305 -26.652 8.116 1.00 71.34 O ATOM 343 CB TYR A 21 27.776 -27.438 11.091 1.00 71.31 C ATOM 344 CG TYR A 21 28.478 -28.101 12.255 1.00 73.24 C ATOM 345 CD1 TYR A 21 28.535 -27.486 13.499 1.00 41.21 C ATOM 346 CD2 TYR A 21 29.083 -29.344 12.110 1.00 52.33 C ATOM 347 CE1 TYR A 21 29.176 -28.088 14.564 1.00 10.44 C ATOM 348 CE2 TYR A 21 29.725 -29.954 13.170 1.00 14.42 C ATOM 349 CZ TYR A 21 29.769 -29.321 14.395 1.00 31.43 C ATOM 350 OH TYR A 21 30.407 -29.925 15.455 1.00 41.33 O ATOM 0 H TYR A 21 27.922 -25.223 12.163 1.00 71.33 H new ATOM 0 HA TYR A 21 29.610 -26.585 10.368 1.00 5.41 H new ATOM 0 HB2 TYR A 21 26.808 -27.065 11.426 1.00 71.31 H new ATOM 0 HB3 TYR A 21 27.580 -28.185 10.322 1.00 71.31 H new ATOM 0 HD1 TYR A 21 28.070 -26.521 13.636 1.00 41.21 H new ATOM 0 HD2 TYR A 21 29.051 -29.841 11.152 1.00 52.33 H new ATOM 0 HE1 TYR A 21 29.212 -27.595 15.524 1.00 10.44 H new ATOM 0 HE2 TYR A 21 30.190 -30.920 13.041 1.00 14.42 H new ATOM 0 HH TYR A 21 30.770 -30.789 15.169 1.00 41.33 H new ATOM 360 N GLN A 22 27.225 -24.893 9.012 1.00 74.30 N ATOM 361 CA GLN A 22 26.633 -24.473 7.747 1.00 12.24 C ATOM 362 C GLN A 22 27.387 -23.284 7.162 1.00 45.11 C ATOM 363 O GLN A 22 27.561 -23.182 5.947 1.00 74.45 O ATOM 364 CB GLN A 22 25.160 -24.110 7.945 1.00 70.00 C ATOM 365 CG GLN A 22 24.341 -25.219 8.585 1.00 32.02 C ATOM 366 CD GLN A 22 23.891 -26.264 7.584 1.00 75.41 C ATOM 367 OE1 GLN A 22 22.749 -26.247 7.121 1.00 4.15 O ATOM 368 NE2 GLN A 22 24.787 -27.183 7.243 1.00 51.20 N ATOM 0 H GLN A 22 26.978 -24.306 9.809 1.00 74.30 H new ATOM 0 HA GLN A 22 26.704 -25.306 7.047 1.00 12.24 H new ATOM 0 HB2 GLN A 22 25.095 -23.217 8.566 1.00 70.00 H new ATOM 0 HB3 GLN A 22 24.723 -23.859 6.978 1.00 70.00 H new ATOM 0 HG2 GLN A 22 24.933 -25.699 9.364 1.00 32.02 H new ATOM 0 HG3 GLN A 22 23.466 -24.786 9.070 1.00 32.02 H new ATOM 0 HE21 GLN A 22 25.722 -27.160 7.651 1.00 51.20 H new ATOM 0 HE22 GLN A 22 24.540 -27.912 6.573 1.00 51.20 H new ATOM 377 N LEU A 23 27.834 -22.386 8.033 1.00 24.10 N ATOM 378 CA LEU A 23 28.571 -21.203 7.602 1.00 11.24 C ATOM 379 C LEU A 23 29.972 -21.576 7.128 1.00 74.03 C ATOM 380 O LEU A 23 30.372 -21.237 6.015 1.00 51.01 O ATOM 381 CB LEU A 23 28.660 -20.190 8.745 1.00 4.31 C ATOM 382 CG LEU A 23 27.378 -19.968 9.547 1.00 13.13 C ATOM 383 CD1 LEU A 23 27.681 -19.241 10.848 1.00 31.24 C ATOM 384 CD2 LEU A 23 26.362 -19.190 8.724 1.00 14.20 C ATOM 0 H LEU A 23 27.699 -22.454 9.042 1.00 24.10 H new ATOM 0 HA LEU A 23 28.033 -20.754 6.767 1.00 11.24 H new ATOM 0 HB2 LEU A 23 29.442 -20.515 9.431 1.00 4.31 H new ATOM 0 HB3 LEU A 23 28.976 -19.232 8.331 1.00 4.31 H new ATOM 0 HG LEU A 23 26.951 -20.941 9.789 1.00 13.13 H new ATOM 0 HD11 LEU A 23 26.756 -19.092 11.405 1.00 31.24 H new ATOM 0 HD12 LEU A 23 28.372 -19.836 11.445 1.00 31.24 H new ATOM 0 HD13 LEU A 23 28.132 -18.273 10.628 1.00 31.24 H new ATOM 0 HD21 LEU A 23 25.456 -19.041 9.311 1.00 14.20 H new ATOM 0 HD22 LEU A 23 26.780 -18.221 8.451 1.00 14.20 H new ATOM 0 HD23 LEU A 23 26.121 -19.749 7.820 1.00 14.20 H new ATOM 396 N GLY A 24 30.712 -22.279 7.980 1.00 41.05 N ATOM 397 CA GLY A 24 32.059 -22.689 7.628 1.00 2.23 C ATOM 398 C GLY A 24 32.987 -21.509 7.415 1.00 71.25 C ATOM 399 O GLY A 24 33.616 -21.027 8.357 1.00 53.24 O ATOM 0 H GLY A 24 30.403 -22.572 8.907 1.00 41.05 H new ATOM 0 HA2 GLY A 24 32.460 -23.325 8.417 1.00 2.23 H new ATOM 0 HA3 GLY A 24 32.027 -23.291 6.720 1.00 2.23 H new ATOM 403 N ARG A 25 33.074 -21.044 6.173 1.00 70.45 N ATOM 404 CA ARG A 25 33.934 -19.916 5.838 1.00 41.13 C ATOM 405 C ARG A 25 33.104 -18.694 5.454 1.00 32.42 C ATOM 406 O ARG A 25 33.564 -17.825 4.713 1.00 62.23 O ATOM 407 CB ARG A 25 34.875 -20.287 4.690 1.00 72.11 C ATOM 408 CG ARG A 25 36.143 -20.991 5.145 1.00 0.51 C ATOM 409 CD ARG A 25 35.831 -22.303 5.847 1.00 12.22 C ATOM 410 NE ARG A 25 36.990 -23.189 5.891 1.00 24.52 N ATOM 411 CZ ARG A 25 37.423 -23.886 4.846 1.00 31.11 C ATOM 412 NH1 ARG A 25 36.795 -23.799 3.681 1.00 22.05 N ATOM 413 NH2 ARG A 25 38.486 -24.672 4.965 1.00 53.33 N ATOM 0 H ARG A 25 32.559 -21.431 5.382 1.00 70.45 H new ATOM 0 HA ARG A 25 34.526 -19.670 6.719 1.00 41.13 H new ATOM 0 HB2 ARG A 25 34.343 -20.931 3.989 1.00 72.11 H new ATOM 0 HB3 ARG A 25 35.147 -19.382 4.147 1.00 72.11 H new ATOM 0 HG2 ARG A 25 36.784 -21.181 4.284 1.00 0.51 H new ATOM 0 HG3 ARG A 25 36.700 -20.340 5.819 1.00 0.51 H new ATOM 0 HD2 ARG A 25 35.492 -22.099 6.863 1.00 12.22 H new ATOM 0 HD3 ARG A 25 35.011 -22.804 5.332 1.00 12.22 H new ATOM 0 HE ARG A 25 37.495 -23.278 6.773 1.00 24.52 H new ATOM 0 HH11 ARG A 25 35.978 -23.196 3.586 1.00 22.05 H new ATOM 0 HH12 ARG A 25 37.129 -24.335 2.880 1.00 22.05 H new ATOM 0 HH21 ARG A 25 38.971 -24.741 5.859 1.00 53.33 H new ATOM 0 HH22 ARG A 25 38.817 -25.207 4.162 1.00 53.33 H new ATOM 427 N LEU A 26 31.878 -18.635 5.963 1.00 22.32 N ATOM 428 CA LEU A 26 30.983 -17.521 5.674 1.00 54.30 C ATOM 429 C LEU A 26 30.982 -16.512 6.818 1.00 13.11 C ATOM 430 O LEU A 26 31.440 -16.808 7.922 1.00 11.22 O ATOM 431 CB LEU A 26 29.562 -18.033 5.429 1.00 10.51 C ATOM 432 CG LEU A 26 29.156 -18.212 3.966 1.00 41.32 C ATOM 433 CD1 LEU A 26 28.197 -19.382 3.817 1.00 33.35 C ATOM 434 CD2 LEU A 26 28.529 -16.934 3.426 1.00 63.40 C ATOM 0 H LEU A 26 31.482 -19.346 6.578 1.00 22.32 H new ATOM 0 HA LEU A 26 31.343 -17.022 4.774 1.00 54.30 H new ATOM 0 HB2 LEU A 26 29.450 -18.991 5.936 1.00 10.51 H new ATOM 0 HB3 LEU A 26 28.862 -17.341 5.897 1.00 10.51 H new ATOM 0 HG LEU A 26 30.052 -18.427 3.384 1.00 41.32 H new ATOM 0 HD11 LEU A 26 27.919 -19.494 2.769 1.00 33.35 H new ATOM 0 HD12 LEU A 26 28.681 -20.295 4.164 1.00 33.35 H new ATOM 0 HD13 LEU A 26 27.302 -19.197 4.412 1.00 33.35 H new ATOM 0 HD21 LEU A 26 28.246 -17.080 2.383 1.00 63.40 H new ATOM 0 HD22 LEU A 26 27.643 -16.688 4.011 1.00 63.40 H new ATOM 0 HD23 LEU A 26 29.248 -16.118 3.496 1.00 63.40 H new ATOM 446 N THR A 27 30.462 -15.319 6.548 1.00 53.52 N ATOM 447 CA THR A 27 30.400 -14.266 7.554 1.00 32.10 C ATOM 448 C THR A 27 29.178 -13.379 7.347 1.00 52.31 C ATOM 449 O THR A 27 28.582 -13.367 6.269 1.00 52.20 O ATOM 450 CB THR A 27 31.666 -13.390 7.529 1.00 5.04 C ATOM 451 OG1 THR A 27 32.822 -14.205 7.304 1.00 72.41 O ATOM 452 CG2 THR A 27 31.824 -12.629 8.837 1.00 32.23 C ATOM 0 H THR A 27 30.077 -15.058 5.640 1.00 53.52 H new ATOM 0 HA THR A 27 30.328 -14.759 8.523 1.00 32.10 H new ATOM 0 HB THR A 27 31.566 -12.670 6.717 1.00 5.04 H new ATOM 0 HG1 THR A 27 33.623 -13.640 7.288 1.00 72.41 H new ATOM 0 HG21 THR A 27 32.725 -12.017 8.795 1.00 32.23 H new ATOM 0 HG22 THR A 27 30.957 -11.987 8.992 1.00 32.23 H new ATOM 0 HG23 THR A 27 31.904 -13.337 9.662 1.00 32.23 H new ATOM 460 N LEU A 28 28.809 -12.636 8.385 1.00 42.02 N ATOM 461 CA LEU A 28 27.657 -11.744 8.316 1.00 2.54 C ATOM 462 C LEU A 28 27.736 -10.846 7.085 1.00 30.24 C ATOM 463 O LEU A 28 26.739 -10.633 6.397 1.00 53.30 O ATOM 464 CB LEU A 28 27.575 -10.887 9.581 1.00 33.33 C ATOM 465 CG LEU A 28 26.216 -10.856 10.283 1.00 44.42 C ATOM 466 CD1 LEU A 28 26.388 -11.013 11.786 1.00 40.13 C ATOM 467 CD2 LEU A 28 25.480 -9.564 9.961 1.00 52.54 C ATOM 0 H LEU A 28 29.291 -12.634 9.284 1.00 42.02 H new ATOM 0 HA LEU A 28 26.759 -12.356 8.239 1.00 2.54 H new ATOM 0 HB2 LEU A 28 28.320 -11.249 10.290 1.00 33.33 H new ATOM 0 HB3 LEU A 28 27.851 -9.865 9.322 1.00 33.33 H new ATOM 0 HG LEU A 28 25.620 -11.692 9.917 1.00 44.42 H new ATOM 0 HD11 LEU A 28 25.411 -10.989 12.269 1.00 40.13 H new ATOM 0 HD12 LEU A 28 26.874 -11.965 11.999 1.00 40.13 H new ATOM 0 HD13 LEU A 28 27.002 -10.198 12.169 1.00 40.13 H new ATOM 0 HD21 LEU A 28 24.515 -9.559 10.468 1.00 52.54 H new ATOM 0 HD22 LEU A 28 26.073 -8.714 10.299 1.00 52.54 H new ATOM 0 HD23 LEU A 28 25.324 -9.493 8.885 1.00 52.54 H new ATOM 479 N GLU A 29 28.929 -10.326 6.814 1.00 13.52 N ATOM 480 CA GLU A 29 29.137 -9.453 5.665 1.00 50.50 C ATOM 481 C GLU A 29 28.773 -10.166 4.366 1.00 32.43 C ATOM 482 O GLU A 29 28.181 -9.573 3.465 1.00 62.52 O ATOM 483 CB GLU A 29 30.592 -8.982 5.611 1.00 60.34 C ATOM 484 CG GLU A 29 30.900 -8.093 4.418 1.00 41.12 C ATOM 485 CD GLU A 29 31.319 -6.694 4.826 1.00 3.00 C ATOM 486 OE1 GLU A 29 30.476 -5.963 5.387 1.00 4.13 O ATOM 487 OE2 GLU A 29 32.489 -6.330 4.584 1.00 20.24 O ATOM 0 H GLU A 29 29.765 -10.494 7.374 1.00 13.52 H new ATOM 0 HA GLU A 29 28.486 -8.586 5.778 1.00 50.50 H new ATOM 0 HB2 GLU A 29 30.824 -8.439 6.527 1.00 60.34 H new ATOM 0 HB3 GLU A 29 31.246 -9.853 5.583 1.00 60.34 H new ATOM 0 HG2 GLU A 29 31.694 -8.548 3.826 1.00 41.12 H new ATOM 0 HG3 GLU A 29 30.020 -8.033 3.778 1.00 41.12 H new ATOM 494 N MET A 30 29.132 -11.443 4.279 1.00 34.12 N ATOM 495 CA MET A 30 28.842 -12.238 3.092 1.00 63.54 C ATOM 496 C MET A 30 27.338 -12.357 2.870 1.00 52.44 C ATOM 497 O MET A 30 26.850 -12.180 1.754 1.00 41.33 O ATOM 498 CB MET A 30 29.461 -13.631 3.221 1.00 24.53 C ATOM 499 CG MET A 30 30.845 -13.742 2.601 1.00 55.05 C ATOM 500 SD MET A 30 32.003 -12.531 3.265 1.00 11.51 S ATOM 501 CE MET A 30 33.556 -13.169 2.642 1.00 73.44 C ATOM 0 H MET A 30 29.624 -11.949 5.016 1.00 34.12 H new ATOM 0 HA MET A 30 29.279 -11.731 2.232 1.00 63.54 H new ATOM 0 HB2 MET A 30 29.523 -13.896 4.277 1.00 24.53 H new ATOM 0 HB3 MET A 30 28.801 -14.358 2.748 1.00 24.53 H new ATOM 0 HG2 MET A 30 31.236 -14.745 2.772 1.00 55.05 H new ATOM 0 HG3 MET A 30 30.767 -13.610 1.522 1.00 55.05 H new ATOM 0 HE1 MET A 30 34.305 -12.377 2.652 1.00 73.44 H new ATOM 0 HE2 MET A 30 33.890 -13.993 3.273 1.00 73.44 H new ATOM 0 HE3 MET A 30 33.419 -13.526 1.621 1.00 73.44 H new ATOM 511 N MET A 31 26.608 -12.657 3.939 1.00 1.21 N ATOM 512 CA MET A 31 25.159 -12.797 3.860 1.00 73.41 C ATOM 513 C MET A 31 24.486 -11.434 3.734 1.00 64.15 C ATOM 514 O MET A 31 23.453 -11.300 3.080 1.00 41.34 O ATOM 515 CB MET A 31 24.628 -13.529 5.094 1.00 13.43 C ATOM 516 CG MET A 31 24.949 -15.014 5.106 1.00 63.21 C ATOM 517 SD MET A 31 23.788 -15.968 6.102 1.00 71.52 S ATOM 518 CE MET A 31 24.906 -16.780 7.241 1.00 63.50 C ATOM 0 H MET A 31 26.996 -12.808 4.870 1.00 1.21 H new ATOM 0 HA MET A 31 24.924 -13.381 2.970 1.00 73.41 H new ATOM 0 HB2 MET A 31 25.048 -13.068 5.988 1.00 13.43 H new ATOM 0 HB3 MET A 31 23.547 -13.399 5.146 1.00 13.43 H new ATOM 0 HG2 MET A 31 24.940 -15.392 4.084 1.00 63.21 H new ATOM 0 HG3 MET A 31 25.958 -15.160 5.491 1.00 63.21 H new ATOM 0 HE1 MET A 31 24.891 -17.855 7.061 1.00 63.50 H new ATOM 0 HE2 MET A 31 25.917 -16.401 7.091 1.00 63.50 H new ATOM 0 HE3 MET A 31 24.591 -16.579 8.265 1.00 63.50 H new ATOM 528 N ASN A 32 25.080 -10.426 4.364 1.00 12.21 N ATOM 529 CA ASN A 32 24.537 -9.073 4.322 1.00 0.24 C ATOM 530 C ASN A 32 24.427 -8.575 2.884 1.00 11.15 C ATOM 531 O ASN A 32 23.430 -7.961 2.505 1.00 4.10 O ATOM 532 CB ASN A 32 25.417 -8.123 5.137 1.00 1.50 C ATOM 533 CG ASN A 32 25.009 -6.671 4.971 1.00 61.41 C ATOM 534 OD1 ASN A 32 24.065 -6.204 5.608 1.00 43.51 O ATOM 535 ND2 ASN A 32 25.721 -5.952 4.111 1.00 13.32 N ATOM 0 H ASN A 32 25.937 -10.520 4.909 1.00 12.21 H new ATOM 0 HA ASN A 32 23.538 -9.095 4.757 1.00 0.24 H new ATOM 0 HB2 ASN A 32 25.361 -8.395 6.191 1.00 1.50 H new ATOM 0 HB3 ASN A 32 26.456 -8.243 4.831 1.00 1.50 H new ATOM 0 HD21 ASN A 32 25.494 -4.970 3.956 1.00 13.32 H new ATOM 0 HD22 ASN A 32 26.495 -6.382 3.605 1.00 13.32 H new ATOM 542 N GLU A 33 25.458 -8.845 2.090 1.00 52.12 N ATOM 543 CA GLU A 33 25.476 -8.424 0.694 1.00 42.11 C ATOM 544 C GLU A 33 24.681 -9.392 -0.177 1.00 62.41 C ATOM 545 O GLU A 33 24.058 -8.991 -1.160 1.00 41.03 O ATOM 546 CB GLU A 33 26.916 -8.328 0.186 1.00 64.42 C ATOM 547 CG GLU A 33 27.714 -9.608 0.374 1.00 4.43 C ATOM 548 CD GLU A 33 29.211 -9.365 0.390 1.00 41.41 C ATOM 549 OE1 GLU A 33 29.764 -9.002 -0.670 1.00 15.22 O ATOM 550 OE2 GLU A 33 29.830 -9.537 1.461 1.00 73.33 O ATOM 0 H GLU A 33 26.291 -9.353 2.389 1.00 52.12 H new ATOM 0 HA GLU A 33 25.010 -7.441 0.632 1.00 42.11 H new ATOM 0 HB2 GLU A 33 26.902 -8.070 -0.873 1.00 64.42 H new ATOM 0 HB3 GLU A 33 27.422 -7.514 0.706 1.00 64.42 H new ATOM 0 HG2 GLU A 33 27.417 -10.083 1.309 1.00 4.43 H new ATOM 0 HG3 GLU A 33 27.471 -10.304 -0.429 1.00 4.43 H new ATOM 557 N ILE A 34 24.709 -10.669 0.191 1.00 14.22 N ATOM 558 CA ILE A 34 23.991 -11.694 -0.555 1.00 74.35 C ATOM 559 C ILE A 34 22.483 -11.490 -0.460 1.00 14.34 C ATOM 560 O ILE A 34 21.771 -11.560 -1.462 1.00 14.25 O ATOM 561 CB ILE A 34 24.339 -13.107 -0.050 1.00 11.44 C ATOM 562 CG1 ILE A 34 25.739 -13.509 -0.518 1.00 0.24 C ATOM 563 CG2 ILE A 34 23.304 -14.112 -0.532 1.00 21.21 C ATOM 564 CD1 ILE A 34 26.366 -14.601 0.320 1.00 34.34 C ATOM 0 H ILE A 34 25.221 -11.018 1.001 1.00 14.22 H new ATOM 0 HA ILE A 34 24.303 -11.602 -1.595 1.00 74.35 H new ATOM 0 HB ILE A 34 24.329 -13.100 1.040 1.00 11.44 H new ATOM 0 HG12 ILE A 34 25.685 -13.843 -1.554 1.00 0.24 H new ATOM 0 HG13 ILE A 34 26.385 -12.632 -0.499 1.00 0.24 H new ATOM 0 HG21 ILE A 34 23.564 -15.106 -0.167 1.00 21.21 H new ATOM 0 HG22 ILE A 34 22.321 -13.832 -0.153 1.00 21.21 H new ATOM 0 HG23 ILE A 34 23.284 -14.120 -1.622 1.00 21.21 H new ATOM 0 HD11 ILE A 34 27.357 -14.835 -0.069 1.00 34.34 H new ATOM 0 HD12 ILE A 34 26.452 -14.263 1.353 1.00 34.34 H new ATOM 0 HD13 ILE A 34 25.741 -15.493 0.282 1.00 34.34 H new ATOM 576 N VAL A 35 22.001 -11.234 0.753 1.00 64.30 N ATOM 577 CA VAL A 35 20.578 -11.016 0.980 1.00 32.12 C ATOM 578 C VAL A 35 20.150 -9.635 0.497 1.00 13.13 C ATOM 579 O VAL A 35 19.028 -9.452 0.024 1.00 42.50 O ATOM 580 CB VAL A 35 20.219 -11.161 2.471 1.00 12.30 C ATOM 581 CG1 VAL A 35 18.710 -11.154 2.660 1.00 15.20 C ATOM 582 CG2 VAL A 35 20.831 -12.430 3.045 1.00 14.43 C ATOM 0 H VAL A 35 22.576 -11.173 1.593 1.00 64.30 H new ATOM 0 HA VAL A 35 20.046 -11.778 0.410 1.00 32.12 H new ATOM 0 HB VAL A 35 20.632 -10.309 3.011 1.00 12.30 H new ATOM 0 HG11 VAL A 35 18.476 -11.257 3.719 1.00 15.20 H new ATOM 0 HG12 VAL A 35 18.301 -10.215 2.288 1.00 15.20 H new ATOM 0 HG13 VAL A 35 18.270 -11.985 2.108 1.00 15.20 H new ATOM 0 HG21 VAL A 35 20.567 -12.517 4.099 1.00 14.43 H new ATOM 0 HG22 VAL A 35 20.449 -13.295 2.503 1.00 14.43 H new ATOM 0 HG23 VAL A 35 21.916 -12.389 2.945 1.00 14.43 H new ATOM 592 N SER A 36 21.051 -8.666 0.620 1.00 51.44 N ATOM 593 CA SER A 36 20.766 -7.299 0.199 1.00 54.15 C ATOM 594 C SER A 36 20.673 -7.207 -1.322 1.00 2.04 C ATOM 595 O SER A 36 19.755 -6.591 -1.864 1.00 21.42 O ATOM 596 CB SER A 36 21.847 -6.348 0.714 1.00 44.34 C ATOM 597 OG SER A 36 21.868 -5.145 -0.035 1.00 53.15 O ATOM 0 H SER A 36 21.985 -8.802 1.008 1.00 51.44 H new ATOM 0 HA SER A 36 19.805 -7.008 0.623 1.00 54.15 H new ATOM 0 HB2 SER A 36 21.666 -6.122 1.765 1.00 44.34 H new ATOM 0 HB3 SER A 36 22.821 -6.834 0.655 1.00 44.34 H new ATOM 0 HG SER A 36 22.567 -4.554 0.315 1.00 53.15 H new ATOM 603 N LYS A 37 21.632 -7.824 -2.005 1.00 14.25 N ATOM 604 CA LYS A 37 21.660 -7.814 -3.462 1.00 63.33 C ATOM 605 C LYS A 37 20.479 -8.590 -4.035 1.00 34.52 C ATOM 606 O LYS A 37 19.705 -8.062 -4.833 1.00 1.24 O ATOM 607 CB LYS A 37 22.973 -8.415 -3.971 1.00 10.41 C ATOM 608 CG LYS A 37 23.367 -7.931 -5.356 1.00 13.22 C ATOM 609 CD LYS A 37 23.739 -6.458 -5.347 1.00 11.40 C ATOM 610 CE LYS A 37 25.138 -6.240 -4.792 1.00 11.45 C ATOM 611 NZ LYS A 37 25.725 -4.953 -5.257 1.00 1.40 N ATOM 0 H LYS A 37 22.400 -8.337 -1.572 1.00 14.25 H new ATOM 0 HA LYS A 37 21.587 -6.778 -3.794 1.00 63.33 H new ATOM 0 HB2 LYS A 37 23.771 -8.171 -3.269 1.00 10.41 H new ATOM 0 HB3 LYS A 37 22.884 -9.501 -3.987 1.00 10.41 H new ATOM 0 HG2 LYS A 37 24.210 -8.518 -5.721 1.00 13.22 H new ATOM 0 HG3 LYS A 37 22.541 -8.094 -6.048 1.00 13.22 H new ATOM 0 HD2 LYS A 37 23.683 -6.061 -6.361 1.00 11.40 H new ATOM 0 HD3 LYS A 37 23.018 -5.903 -4.747 1.00 11.40 H new ATOM 0 HE2 LYS A 37 25.102 -6.250 -3.703 1.00 11.45 H new ATOM 0 HE3 LYS A 37 25.782 -7.064 -5.097 1.00 11.45 H new ATOM 0 HZ1 LYS A 37 26.464 -5.144 -5.963 1.00 1.40 H new ATOM 0 HZ2 LYS A 37 24.981 -4.366 -5.685 1.00 1.40 H new ATOM 0 HZ3 LYS A 37 26.141 -4.449 -4.448 1.00 1.40 H new ATOM 625 N MET A 38 20.345 -9.846 -3.621 1.00 60.30 N ATOM 626 CA MET A 38 19.255 -10.694 -4.091 1.00 43.34 C ATOM 627 C MET A 38 17.909 -10.001 -3.905 1.00 70.23 C ATOM 628 O MET A 38 17.032 -10.088 -4.764 1.00 75.35 O ATOM 629 CB MET A 38 19.262 -12.030 -3.347 1.00 31.03 C ATOM 630 CG MET A 38 18.683 -11.947 -1.944 1.00 12.33 C ATOM 631 SD MET A 38 18.645 -13.546 -1.112 1.00 5.14 S ATOM 632 CE MET A 38 17.463 -14.428 -2.127 1.00 32.31 C ATOM 0 H MET A 38 20.977 -10.299 -2.961 1.00 60.30 H new ATOM 0 HA MET A 38 19.404 -10.879 -5.155 1.00 43.34 H new ATOM 0 HB2 MET A 38 18.694 -12.760 -3.923 1.00 31.03 H new ATOM 0 HB3 MET A 38 20.286 -12.398 -3.287 1.00 31.03 H new ATOM 0 HG2 MET A 38 19.274 -11.248 -1.352 1.00 12.33 H new ATOM 0 HG3 MET A 38 17.671 -11.545 -1.996 1.00 12.33 H new ATOM 0 HE1 MET A 38 16.508 -14.487 -1.605 1.00 32.31 H new ATOM 0 HE2 MET A 38 17.329 -13.900 -3.071 1.00 32.31 H new ATOM 0 HE3 MET A 38 17.832 -15.435 -2.323 1.00 32.31 H new ATOM 642 N ASP A 39 17.753 -9.315 -2.779 1.00 13.42 N ATOM 643 CA ASP A 39 16.513 -8.607 -2.481 1.00 2.43 C ATOM 644 C ASP A 39 16.345 -7.397 -3.395 1.00 11.02 C ATOM 645 O ASP A 39 15.224 -6.989 -3.701 1.00 4.21 O ATOM 646 CB ASP A 39 16.494 -8.162 -1.017 1.00 61.13 C ATOM 647 CG ASP A 39 15.130 -7.663 -0.581 1.00 63.45 C ATOM 648 OD1 ASP A 39 14.117 -8.181 -1.096 1.00 53.22 O ATOM 649 OD2 ASP A 39 15.077 -6.756 0.275 1.00 73.41 O ATOM 0 H ASP A 39 18.469 -9.234 -2.057 1.00 13.42 H new ATOM 0 HA ASP A 39 15.682 -9.290 -2.656 1.00 2.43 H new ATOM 0 HB2 ASP A 39 16.792 -8.997 -0.383 1.00 61.13 H new ATOM 0 HB3 ASP A 39 17.230 -7.372 -0.871 1.00 61.13 H new ATOM 654 N ASP A 40 17.465 -6.828 -3.826 1.00 51.33 N ATOM 655 CA ASP A 40 17.442 -5.665 -4.706 1.00 11.54 C ATOM 656 C ASP A 40 16.830 -6.017 -6.058 1.00 34.34 C ATOM 657 O ASP A 40 15.871 -5.384 -6.501 1.00 23.30 O ATOM 658 CB ASP A 40 18.857 -5.117 -4.900 1.00 32.23 C ATOM 659 CG ASP A 40 18.883 -3.875 -5.768 1.00 12.30 C ATOM 660 OD1 ASP A 40 18.514 -2.792 -5.266 1.00 44.21 O ATOM 661 OD2 ASP A 40 19.273 -3.985 -6.949 1.00 55.21 O ATOM 0 H ASP A 40 18.400 -7.153 -3.581 1.00 51.33 H new ATOM 0 HA ASP A 40 16.825 -4.899 -4.237 1.00 11.54 H new ATOM 0 HB2 ASP A 40 19.290 -4.886 -3.927 1.00 32.23 H new ATOM 0 HB3 ASP A 40 19.482 -5.886 -5.353 1.00 32.23 H new ATOM 666 N PHE A 41 17.390 -7.031 -6.709 1.00 23.02 N ATOM 667 CA PHE A 41 16.901 -7.467 -8.012 1.00 10.15 C ATOM 668 C PHE A 41 15.455 -7.944 -7.917 1.00 73.15 C ATOM 669 O PHE A 41 14.609 -7.562 -8.727 1.00 72.14 O ATOM 670 CB PHE A 41 17.785 -8.588 -8.563 1.00 52.40 C ATOM 671 CG PHE A 41 18.216 -8.366 -9.985 1.00 32.52 C ATOM 672 CD1 PHE A 41 17.411 -7.661 -10.865 1.00 31.02 C ATOM 673 CD2 PHE A 41 19.426 -8.864 -10.441 1.00 51.51 C ATOM 674 CE1 PHE A 41 17.805 -7.457 -12.174 1.00 11.13 C ATOM 675 CE2 PHE A 41 19.825 -8.662 -11.749 1.00 24.21 C ATOM 676 CZ PHE A 41 19.014 -7.957 -12.616 1.00 1.00 C ATOM 0 H PHE A 41 18.183 -7.566 -6.356 1.00 23.02 H new ATOM 0 HA PHE A 41 16.941 -6.616 -8.691 1.00 10.15 H new ATOM 0 HB2 PHE A 41 18.670 -8.685 -7.934 1.00 52.40 H new ATOM 0 HB3 PHE A 41 17.244 -9.532 -8.499 1.00 52.40 H new ATOM 0 HD1 PHE A 41 16.465 -7.266 -10.524 1.00 31.02 H new ATOM 0 HD2 PHE A 41 20.064 -9.416 -9.767 1.00 51.51 H new ATOM 0 HE1 PHE A 41 17.168 -6.907 -12.851 1.00 11.13 H new ATOM 0 HE2 PHE A 41 20.770 -9.055 -12.092 1.00 24.21 H new ATOM 0 HZ PHE A 41 19.325 -7.797 -13.638 1.00 1.00 H new ATOM 686 N LEU A 42 15.178 -8.782 -6.924 1.00 51.42 N ATOM 687 CA LEU A 42 13.834 -9.313 -6.723 1.00 41.41 C ATOM 688 C LEU A 42 12.851 -8.195 -6.392 1.00 12.34 C ATOM 689 O LEU A 42 11.666 -8.282 -6.712 1.00 51.22 O ATOM 690 CB LEU A 42 13.838 -10.353 -5.602 1.00 21.12 C ATOM 691 CG LEU A 42 13.117 -11.667 -5.903 1.00 70.31 C ATOM 692 CD1 LEU A 42 11.610 -11.461 -5.906 1.00 43.15 C ATOM 693 CD2 LEU A 42 13.582 -12.238 -7.235 1.00 40.30 C ATOM 0 H LEU A 42 15.866 -9.108 -6.245 1.00 51.42 H new ATOM 0 HA LEU A 42 13.515 -9.789 -7.650 1.00 41.41 H new ATOM 0 HB2 LEU A 42 14.873 -10.580 -5.348 1.00 21.12 H new ATOM 0 HB3 LEU A 42 13.383 -9.907 -4.718 1.00 21.12 H new ATOM 0 HG LEU A 42 13.363 -12.382 -5.118 1.00 70.31 H new ATOM 0 HD11 LEU A 42 11.114 -12.407 -6.122 1.00 43.15 H new ATOM 0 HD12 LEU A 42 11.290 -11.098 -4.929 1.00 43.15 H new ATOM 0 HD13 LEU A 42 11.344 -10.729 -6.669 1.00 43.15 H new ATOM 0 HD21 LEU A 42 13.058 -13.173 -7.433 1.00 40.30 H new ATOM 0 HD22 LEU A 42 13.366 -11.526 -8.031 1.00 40.30 H new ATOM 0 HD23 LEU A 42 14.655 -12.425 -7.196 1.00 40.30 H new ATOM 705 N MET A 43 13.352 -7.144 -5.750 1.00 34.45 N ATOM 706 CA MET A 43 12.517 -6.007 -5.378 1.00 24.41 C ATOM 707 C MET A 43 12.046 -5.251 -6.616 1.00 21.21 C ATOM 708 O MET A 43 10.905 -4.794 -6.680 1.00 12.11 O ATOM 709 CB MET A 43 13.287 -5.064 -4.452 1.00 2.21 C ATOM 710 CG MET A 43 12.541 -3.777 -4.138 1.00 73.41 C ATOM 711 SD MET A 43 10.919 -4.076 -3.410 1.00 15.33 S ATOM 712 CE MET A 43 10.361 -2.397 -3.125 1.00 63.42 C ATOM 0 H MET A 43 14.331 -7.056 -5.477 1.00 34.45 H new ATOM 0 HA MET A 43 11.642 -6.387 -4.851 1.00 24.41 H new ATOM 0 HB2 MET A 43 13.507 -5.583 -3.519 1.00 2.21 H new ATOM 0 HB3 MET A 43 14.243 -4.817 -4.913 1.00 2.21 H new ATOM 0 HG2 MET A 43 13.137 -3.174 -3.453 1.00 73.41 H new ATOM 0 HG3 MET A 43 12.423 -3.197 -5.053 1.00 73.41 H new ATOM 0 HE1 MET A 43 10.056 -2.287 -2.084 1.00 63.42 H new ATOM 0 HE2 MET A 43 11.173 -1.702 -3.341 1.00 63.42 H new ATOM 0 HE3 MET A 43 9.514 -2.180 -3.776 1.00 63.42 H new ATOM 722 N LYS A 44 12.932 -5.123 -7.598 1.00 12.40 N ATOM 723 CA LYS A 44 12.607 -4.423 -8.835 1.00 51.32 C ATOM 724 C LYS A 44 11.630 -5.235 -9.679 1.00 54.41 C ATOM 725 O LYS A 44 10.739 -4.679 -10.323 1.00 33.55 O ATOM 726 CB LYS A 44 13.880 -4.144 -9.637 1.00 62.01 C ATOM 727 CG LYS A 44 14.119 -5.135 -10.763 1.00 24.44 C ATOM 728 CD LYS A 44 15.470 -4.914 -11.423 1.00 53.03 C ATOM 729 CE LYS A 44 15.386 -3.869 -12.526 1.00 23.43 C ATOM 730 NZ LYS A 44 15.454 -2.484 -11.983 1.00 61.14 N ATOM 0 H LYS A 44 13.881 -5.495 -7.561 1.00 12.40 H new ATOM 0 HA LYS A 44 12.135 -3.476 -8.574 1.00 51.32 H new ATOM 0 HB2 LYS A 44 13.823 -3.139 -10.055 1.00 62.01 H new ATOM 0 HB3 LYS A 44 14.736 -4.161 -8.962 1.00 62.01 H new ATOM 0 HG2 LYS A 44 14.066 -6.151 -10.372 1.00 24.44 H new ATOM 0 HG3 LYS A 44 13.329 -5.038 -11.508 1.00 24.44 H new ATOM 0 HD2 LYS A 44 16.195 -4.596 -10.674 1.00 53.03 H new ATOM 0 HD3 LYS A 44 15.832 -5.855 -11.838 1.00 53.03 H new ATOM 0 HE2 LYS A 44 16.200 -4.022 -13.234 1.00 23.43 H new ATOM 0 HE3 LYS A 44 14.455 -3.998 -13.078 1.00 23.43 H new ATOM 0 HZ1 LYS A 44 15.967 -1.874 -12.651 1.00 61.14 H new ATOM 0 HZ2 LYS A 44 14.491 -2.116 -11.849 1.00 61.14 H new ATOM 0 HZ3 LYS A 44 15.952 -2.493 -11.070 1.00 61.14 H new ATOM 744 N LYS A 45 11.801 -6.552 -9.671 1.00 71.20 N ATOM 745 CA LYS A 45 10.933 -7.442 -10.433 1.00 53.11 C ATOM 746 C LYS A 45 9.495 -7.363 -9.928 1.00 64.35 C ATOM 747 O LYS A 45 8.567 -7.134 -10.704 1.00 1.34 O ATOM 748 CB LYS A 45 11.439 -8.883 -10.342 1.00 35.34 C ATOM 749 CG LYS A 45 11.150 -9.709 -11.583 1.00 70.22 C ATOM 750 CD LYS A 45 11.636 -11.140 -11.427 1.00 25.13 C ATOM 751 CE LYS A 45 10.621 -12.136 -11.965 1.00 33.22 C ATOM 752 NZ LYS A 45 11.276 -13.356 -12.512 1.00 23.22 N ATOM 0 H LYS A 45 12.534 -7.028 -9.145 1.00 71.20 H new ATOM 0 HA LYS A 45 10.952 -7.123 -11.475 1.00 53.11 H new ATOM 0 HB2 LYS A 45 12.515 -8.871 -10.166 1.00 35.34 H new ATOM 0 HB3 LYS A 45 10.980 -9.366 -9.479 1.00 35.34 H new ATOM 0 HG2 LYS A 45 10.078 -9.708 -11.780 1.00 70.22 H new ATOM 0 HG3 LYS A 45 11.634 -9.252 -12.446 1.00 70.22 H new ATOM 0 HD2 LYS A 45 12.582 -11.263 -11.954 1.00 25.13 H new ATOM 0 HD3 LYS A 45 11.828 -11.347 -10.374 1.00 25.13 H new ATOM 0 HE2 LYS A 45 9.933 -12.420 -11.168 1.00 33.22 H new ATOM 0 HE3 LYS A 45 10.026 -11.662 -12.746 1.00 33.22 H new ATOM 0 HZ1 LYS A 45 10.879 -13.573 -13.449 1.00 23.22 H new ATOM 0 HZ2 LYS A 45 12.299 -13.191 -12.599 1.00 23.22 H new ATOM 0 HZ3 LYS A 45 11.108 -14.157 -11.871 1.00 23.22 H new ATOM 766 N SER A 46 9.319 -7.554 -8.625 1.00 4.12 N ATOM 767 CA SER A 46 7.995 -7.507 -8.017 1.00 54.24 C ATOM 768 C SER A 46 7.370 -6.124 -8.182 1.00 64.41 C ATOM 769 O SER A 46 6.148 -5.980 -8.199 1.00 12.13 O ATOM 770 CB SER A 46 8.078 -7.868 -6.533 1.00 52.30 C ATOM 771 OG SER A 46 6.839 -8.368 -6.060 1.00 24.13 O ATOM 0 H SER A 46 10.077 -7.743 -7.970 1.00 4.12 H new ATOM 0 HA SER A 46 7.363 -8.235 -8.525 1.00 54.24 H new ATOM 0 HB2 SER A 46 8.857 -8.615 -6.380 1.00 52.30 H new ATOM 0 HB3 SER A 46 8.362 -6.988 -5.957 1.00 52.30 H new ATOM 0 HG SER A 46 6.918 -8.593 -5.109 1.00 24.13 H new ATOM 777 N LYS A 47 8.219 -5.110 -8.303 1.00 43.44 N ATOM 778 CA LYS A 47 7.754 -3.738 -8.468 1.00 50.42 C ATOM 779 C LYS A 47 7.203 -3.515 -9.873 1.00 43.11 C ATOM 780 O LYS A 47 6.323 -2.679 -10.079 1.00 50.22 O ATOM 781 CB LYS A 47 8.894 -2.754 -8.194 1.00 20.20 C ATOM 782 CG LYS A 47 9.351 -1.993 -9.427 1.00 35.24 C ATOM 783 CD LYS A 47 8.445 -0.809 -9.718 1.00 14.41 C ATOM 784 CE LYS A 47 9.241 0.478 -9.873 1.00 24.32 C ATOM 785 NZ LYS A 47 9.621 1.057 -8.554 1.00 52.25 N ATOM 0 H LYS A 47 9.234 -5.212 -8.290 1.00 43.44 H new ATOM 0 HA LYS A 47 6.952 -3.565 -7.750 1.00 50.42 H new ATOM 0 HB2 LYS A 47 8.572 -2.040 -7.436 1.00 20.20 H new ATOM 0 HB3 LYS A 47 9.742 -3.299 -7.779 1.00 20.20 H new ATOM 0 HG2 LYS A 47 10.373 -1.643 -9.282 1.00 35.24 H new ATOM 0 HG3 LYS A 47 9.362 -2.664 -10.286 1.00 35.24 H new ATOM 0 HD2 LYS A 47 7.878 -0.999 -10.629 1.00 14.41 H new ATOM 0 HD3 LYS A 47 7.722 -0.696 -8.910 1.00 14.41 H new ATOM 0 HE2 LYS A 47 10.141 0.281 -10.456 1.00 24.32 H new ATOM 0 HE3 LYS A 47 8.652 1.205 -10.432 1.00 24.32 H new ATOM 0 HZ1 LYS A 47 10.162 1.933 -8.702 1.00 52.25 H new ATOM 0 HZ2 LYS A 47 8.762 1.269 -8.007 1.00 52.25 H new ATOM 0 HZ3 LYS A 47 10.205 0.374 -8.030 1.00 52.25 H new ATOM 799 N ILE A 48 7.726 -4.268 -10.835 1.00 33.32 N ATOM 800 CA ILE A 48 7.284 -4.154 -12.219 1.00 72.10 C ATOM 801 C ILE A 48 5.996 -4.936 -12.451 1.00 74.42 C ATOM 802 O ILE A 48 5.170 -4.561 -13.285 1.00 31.14 O ATOM 803 CB ILE A 48 8.361 -4.659 -13.197 1.00 50.33 C ATOM 804 CG1 ILE A 48 9.620 -3.796 -13.093 1.00 41.42 C ATOM 805 CG2 ILE A 48 7.826 -4.655 -14.622 1.00 23.44 C ATOM 806 CD1 ILE A 48 10.905 -4.591 -13.159 1.00 20.14 C ATOM 0 H ILE A 48 8.456 -4.963 -10.681 1.00 33.32 H new ATOM 0 HA ILE A 48 7.102 -3.096 -12.406 1.00 72.10 H new ATOM 0 HB ILE A 48 8.622 -5.683 -12.930 1.00 50.33 H new ATOM 0 HG12 ILE A 48 9.615 -3.062 -13.899 1.00 41.42 H new ATOM 0 HG13 ILE A 48 9.594 -3.241 -12.155 1.00 41.42 H new ATOM 0 HG21 ILE A 48 8.599 -5.014 -15.302 1.00 23.44 H new ATOM 0 HG22 ILE A 48 6.955 -5.307 -14.685 1.00 23.44 H new ATOM 0 HG23 ILE A 48 7.541 -3.641 -14.901 1.00 23.44 H new ATOM 0 HD11 ILE A 48 11.756 -3.914 -13.079 1.00 20.14 H new ATOM 0 HD12 ILE A 48 10.932 -5.307 -12.338 1.00 20.14 H new ATOM 0 HD13 ILE A 48 10.954 -5.125 -14.108 1.00 20.14 H new ATOM 818 N LEU A 49 5.829 -6.025 -11.708 1.00 0.31 N ATOM 819 CA LEU A 49 4.640 -6.860 -11.831 1.00 35.33 C ATOM 820 C LEU A 49 3.386 -6.083 -11.443 1.00 74.01 C ATOM 821 O LEU A 49 2.276 -6.439 -11.836 1.00 73.42 O ATOM 822 CB LEU A 49 4.774 -8.105 -10.952 1.00 33.12 C ATOM 823 CG LEU A 49 6.105 -8.852 -11.045 1.00 34.21 C ATOM 824 CD1 LEU A 49 5.947 -10.285 -10.561 1.00 23.31 C ATOM 825 CD2 LEU A 49 6.633 -8.824 -12.472 1.00 22.24 C ATOM 0 H LEU A 49 6.502 -6.350 -11.014 1.00 0.31 H new ATOM 0 HA LEU A 49 4.548 -7.166 -12.873 1.00 35.33 H new ATOM 0 HB2 LEU A 49 4.617 -7.811 -9.914 1.00 33.12 H new ATOM 0 HB3 LEU A 49 3.973 -8.797 -11.212 1.00 33.12 H new ATOM 0 HG LEU A 49 6.828 -8.350 -10.401 1.00 34.21 H new ATOM 0 HD11 LEU A 49 6.904 -10.801 -10.634 1.00 23.31 H new ATOM 0 HD12 LEU A 49 5.614 -10.284 -9.523 1.00 23.31 H new ATOM 0 HD13 LEU A 49 5.210 -10.798 -11.178 1.00 23.31 H new ATOM 0 HD21 LEU A 49 7.581 -9.360 -12.520 1.00 22.24 H new ATOM 0 HD22 LEU A 49 5.912 -9.301 -13.136 1.00 22.24 H new ATOM 0 HD23 LEU A 49 6.785 -7.791 -12.784 1.00 22.24 H new ATOM 837 N GLY A 50 3.571 -5.017 -10.671 1.00 4.14 N ATOM 838 CA GLY A 50 2.447 -4.204 -10.245 1.00 31.44 C ATOM 839 C GLY A 50 2.372 -2.884 -10.986 1.00 34.41 C ATOM 840 O GLY A 50 1.283 -2.383 -11.268 1.00 61.12 O ATOM 0 H GLY A 50 4.480 -4.702 -10.333 1.00 4.14 H new ATOM 0 HA2 GLY A 50 1.522 -4.758 -10.402 1.00 31.44 H new ATOM 0 HA3 GLY A 50 2.526 -4.012 -9.175 1.00 31.44 H new ATOM 844 N LYS A 51 3.531 -2.318 -11.301 1.00 43.31 N ATOM 845 CA LYS A 51 3.594 -1.047 -12.014 1.00 30.22 C ATOM 846 C LYS A 51 2.820 -1.121 -13.326 1.00 42.22 C ATOM 847 O LYS A 51 2.297 -2.174 -13.693 1.00 2.30 O ATOM 848 CB LYS A 51 5.050 -0.664 -12.289 1.00 30.34 C ATOM 849 CG LYS A 51 5.457 0.662 -11.670 1.00 62.13 C ATOM 850 CD LYS A 51 5.207 0.679 -10.172 1.00 30.23 C ATOM 851 CE LYS A 51 5.909 1.850 -9.503 1.00 10.55 C ATOM 852 NZ LYS A 51 5.321 2.162 -8.171 1.00 14.35 N ATOM 0 H LYS A 51 4.441 -2.719 -11.074 1.00 43.31 H new ATOM 0 HA LYS A 51 3.137 -0.283 -11.385 1.00 30.22 H new ATOM 0 HB2 LYS A 51 5.702 -1.449 -11.907 1.00 30.34 H new ATOM 0 HB3 LYS A 51 5.207 -0.616 -13.367 1.00 30.34 H new ATOM 0 HG2 LYS A 51 6.513 0.847 -11.865 1.00 62.13 H new ATOM 0 HG3 LYS A 51 4.899 1.471 -12.142 1.00 62.13 H new ATOM 0 HD2 LYS A 51 4.135 0.739 -9.982 1.00 30.23 H new ATOM 0 HD3 LYS A 51 5.557 -0.255 -9.733 1.00 30.23 H new ATOM 0 HE2 LYS A 51 6.968 1.620 -9.388 1.00 10.55 H new ATOM 0 HE3 LYS A 51 5.841 2.729 -10.145 1.00 10.55 H new ATOM 0 HZ1 LYS A 51 5.827 2.966 -7.748 1.00 14.35 H new ATOM 0 HZ2 LYS A 51 4.316 2.406 -8.284 1.00 14.35 H new ATOM 0 HZ3 LYS A 51 5.408 1.332 -7.550 1.00 14.35 H new ATOM 866 N THR A 52 2.752 0.004 -14.032 1.00 20.12 N ATOM 867 CA THR A 52 2.043 0.067 -15.303 1.00 72.45 C ATOM 868 C THR A 52 2.999 0.363 -16.453 1.00 5.45 C ATOM 869 O THR A 52 4.165 0.690 -16.233 1.00 40.24 O ATOM 870 CB THR A 52 0.939 1.141 -15.279 1.00 22.12 C ATOM 871 OG1 THR A 52 1.497 2.423 -15.588 1.00 13.22 O ATOM 872 CG2 THR A 52 0.263 1.191 -13.917 1.00 41.10 C ATOM 0 H THR A 52 3.180 0.884 -13.744 1.00 20.12 H new ATOM 0 HA THR A 52 1.585 -0.910 -15.457 1.00 72.45 H new ATOM 0 HB THR A 52 0.192 0.880 -16.028 1.00 22.12 H new ATOM 0 HG1 THR A 52 0.789 3.100 -15.572 1.00 13.22 H new ATOM 0 HG21 THR A 52 -0.513 1.957 -13.924 1.00 41.10 H new ATOM 0 HG22 THR A 52 -0.185 0.222 -13.697 1.00 41.10 H new ATOM 0 HG23 THR A 52 1.002 1.430 -13.153 1.00 41.10 H new ATOM 880 N ASN A 53 2.499 0.248 -17.678 1.00 74.12 N ATOM 881 CA ASN A 53 3.310 0.504 -18.863 1.00 10.33 C ATOM 882 C ASN A 53 3.789 1.952 -18.891 1.00 3.53 C ATOM 883 O ASN A 53 4.784 2.277 -19.540 1.00 73.22 O ATOM 884 CB ASN A 53 2.511 0.195 -20.130 1.00 40.24 C ATOM 885 CG ASN A 53 2.004 -1.234 -20.160 1.00 53.41 C ATOM 886 OD1 ASN A 53 0.888 -1.517 -19.723 1.00 23.21 O ATOM 887 ND2 ASN A 53 2.823 -2.142 -20.677 1.00 41.42 N ATOM 0 H ASN A 53 1.535 -0.021 -17.877 1.00 74.12 H new ATOM 0 HA ASN A 53 4.182 -0.148 -18.824 1.00 10.33 H new ATOM 0 HB2 ASN A 53 1.665 0.879 -20.199 1.00 40.24 H new ATOM 0 HB3 ASN A 53 3.137 0.374 -21.004 1.00 40.24 H new ATOM 0 HD21 ASN A 53 2.536 -3.120 -20.724 1.00 41.42 H new ATOM 0 HD22 ASN A 53 3.739 -1.862 -21.027 1.00 41.42 H new ATOM 894 N LYS A 54 3.076 2.820 -18.181 1.00 34.10 N ATOM 895 CA LYS A 54 3.427 4.234 -18.122 1.00 25.44 C ATOM 896 C LYS A 54 4.684 4.447 -17.283 1.00 71.23 C ATOM 897 O LYS A 54 5.516 5.295 -17.602 1.00 41.50 O ATOM 898 CB LYS A 54 2.268 5.045 -17.538 1.00 24.31 C ATOM 899 CG LYS A 54 0.974 4.906 -18.320 1.00 60.33 C ATOM 900 CD LYS A 54 0.697 6.139 -19.164 1.00 30.23 C ATOM 901 CE LYS A 54 -0.794 6.335 -19.392 1.00 30.25 C ATOM 902 NZ LYS A 54 -1.065 7.299 -20.493 1.00 43.43 N ATOM 0 H LYS A 54 2.250 2.568 -17.638 1.00 34.10 H new ATOM 0 HA LYS A 54 3.626 4.576 -19.138 1.00 25.44 H new ATOM 0 HB2 LYS A 54 2.097 4.729 -16.509 1.00 24.31 H new ATOM 0 HB3 LYS A 54 2.552 6.097 -17.505 1.00 24.31 H new ATOM 0 HG2 LYS A 54 1.029 4.028 -18.964 1.00 60.33 H new ATOM 0 HG3 LYS A 54 0.146 4.743 -17.630 1.00 60.33 H new ATOM 0 HD2 LYS A 54 1.109 7.019 -18.671 1.00 30.23 H new ATOM 0 HD3 LYS A 54 1.204 6.045 -20.124 1.00 30.23 H new ATOM 0 HE2 LYS A 54 -1.254 5.376 -19.628 1.00 30.25 H new ATOM 0 HE3 LYS A 54 -1.258 6.694 -18.473 1.00 30.25 H new ATOM 0 HZ1 LYS A 54 -2.092 7.405 -20.617 1.00 43.43 H new ATOM 0 HZ2 LYS A 54 -0.648 8.222 -20.257 1.00 43.43 H new ATOM 0 HZ3 LYS A 54 -0.645 6.945 -21.376 1.00 43.43 H new ATOM 916 N GLN A 55 4.814 3.670 -16.212 1.00 42.35 N ATOM 917 CA GLN A 55 5.970 3.775 -15.330 1.00 21.22 C ATOM 918 C GLN A 55 7.085 2.837 -15.780 1.00 44.11 C ATOM 919 O GLN A 55 8.268 3.130 -15.599 1.00 21.20 O ATOM 920 CB GLN A 55 5.569 3.454 -13.889 1.00 53.30 C ATOM 921 CG GLN A 55 4.553 4.426 -13.310 1.00 73.41 C ATOM 922 CD GLN A 55 5.040 5.861 -13.330 1.00 61.13 C ATOM 923 OE1 GLN A 55 4.519 6.695 -14.070 1.00 55.53 O ATOM 924 NE2 GLN A 55 6.046 6.156 -12.515 1.00 52.41 N ATOM 0 H GLN A 55 4.134 2.962 -15.935 1.00 42.35 H new ATOM 0 HA GLN A 55 6.340 4.799 -15.378 1.00 21.22 H new ATOM 0 HB2 GLN A 55 5.157 2.445 -13.851 1.00 53.30 H new ATOM 0 HB3 GLN A 55 6.461 3.458 -13.263 1.00 53.30 H new ATOM 0 HG2 GLN A 55 3.624 4.354 -13.875 1.00 73.41 H new ATOM 0 HG3 GLN A 55 4.325 4.138 -12.284 1.00 73.41 H new ATOM 0 HE21 GLN A 55 6.448 5.433 -11.918 1.00 52.41 H new ATOM 0 HE22 GLN A 55 6.417 7.106 -12.486 1.00 52.41 H new ATOM 933 N LEU A 56 6.702 1.709 -16.367 1.00 72.21 N ATOM 934 CA LEU A 56 7.670 0.727 -16.844 1.00 33.25 C ATOM 935 C LEU A 56 8.716 1.383 -17.738 1.00 4.42 C ATOM 936 O LEU A 56 8.382 2.126 -18.662 1.00 64.31 O ATOM 937 CB LEU A 56 6.958 -0.391 -17.608 1.00 12.30 C ATOM 938 CG LEU A 56 7.832 -1.226 -18.544 1.00 21.11 C ATOM 939 CD1 LEU A 56 7.352 -2.669 -18.576 1.00 44.11 C ATOM 940 CD2 LEU A 56 7.834 -0.631 -19.945 1.00 32.34 C ATOM 0 H LEU A 56 5.728 1.451 -16.524 1.00 72.21 H new ATOM 0 HA LEU A 56 8.176 0.301 -15.977 1.00 33.25 H new ATOM 0 HB2 LEU A 56 6.494 -1.060 -16.884 1.00 12.30 H new ATOM 0 HB3 LEU A 56 6.153 0.052 -18.194 1.00 12.30 H new ATOM 0 HG LEU A 56 8.854 -1.213 -18.164 1.00 21.11 H new ATOM 0 HD11 LEU A 56 7.986 -3.248 -19.247 1.00 44.11 H new ATOM 0 HD12 LEU A 56 7.404 -3.092 -17.573 1.00 44.11 H new ATOM 0 HD13 LEU A 56 6.322 -2.702 -18.931 1.00 44.11 H new ATOM 0 HD21 LEU A 56 8.461 -1.238 -20.597 1.00 32.34 H new ATOM 0 HD22 LEU A 56 6.816 -0.613 -20.334 1.00 32.34 H new ATOM 0 HD23 LEU A 56 8.226 0.385 -19.908 1.00 32.34 H new ATOM 952 N THR A 57 9.986 1.104 -17.458 1.00 73.34 N ATOM 953 CA THR A 57 11.082 1.666 -18.237 1.00 73.25 C ATOM 954 C THR A 57 11.852 0.574 -18.970 1.00 61.53 C ATOM 955 O THR A 57 11.462 -0.594 -18.952 1.00 15.24 O ATOM 956 CB THR A 57 12.057 2.456 -17.345 1.00 45.35 C ATOM 957 OG1 THR A 57 12.767 1.561 -16.482 1.00 62.24 O ATOM 958 CG2 THR A 57 11.313 3.489 -16.512 1.00 65.21 C ATOM 0 H THR A 57 10.280 0.492 -16.697 1.00 73.34 H new ATOM 0 HA THR A 57 10.637 2.344 -18.965 1.00 73.25 H new ATOM 0 HB THR A 57 12.765 2.975 -17.991 1.00 45.35 H new ATOM 0 HG1 THR A 57 13.386 2.071 -15.919 1.00 62.24 H new ATOM 0 HG21 THR A 57 12.023 4.034 -15.890 1.00 65.21 H new ATOM 0 HG22 THR A 57 10.798 4.187 -17.173 1.00 65.21 H new ATOM 0 HG23 THR A 57 10.584 2.987 -15.876 1.00 65.21 H new ATOM 966 N ARG A 58 12.948 0.960 -19.615 1.00 25.34 N ATOM 967 CA ARG A 58 13.774 0.012 -20.354 1.00 54.43 C ATOM 968 C ARG A 58 14.320 -1.071 -19.429 1.00 73.11 C ATOM 969 O ARG A 58 14.308 -2.254 -19.768 1.00 20.52 O ATOM 970 CB ARG A 58 14.930 0.740 -21.043 1.00 75.25 C ATOM 971 CG ARG A 58 15.954 -0.196 -21.665 1.00 13.31 C ATOM 972 CD ARG A 58 16.859 0.539 -22.641 1.00 71.14 C ATOM 973 NE ARG A 58 16.118 1.068 -23.783 1.00 75.42 N ATOM 974 CZ ARG A 58 15.704 0.320 -24.801 1.00 11.44 C ATOM 975 NH1 ARG A 58 15.958 -0.981 -24.818 1.00 14.11 N ATOM 976 NH2 ARG A 58 15.035 0.875 -25.803 1.00 75.44 N ATOM 0 H ARG A 58 13.285 1.922 -19.641 1.00 25.34 H new ATOM 0 HA ARG A 58 13.149 -0.463 -21.111 1.00 54.43 H new ATOM 0 HB2 ARG A 58 14.527 1.392 -21.819 1.00 75.25 H new ATOM 0 HB3 ARG A 58 15.430 1.381 -20.316 1.00 75.25 H new ATOM 0 HG2 ARG A 58 16.557 -0.651 -20.879 1.00 13.31 H new ATOM 0 HG3 ARG A 58 15.441 -1.007 -22.183 1.00 13.31 H new ATOM 0 HD2 ARG A 58 17.361 1.357 -22.124 1.00 71.14 H new ATOM 0 HD3 ARG A 58 17.636 -0.138 -22.995 1.00 71.14 H new ATOM 0 HE ARG A 58 15.907 2.066 -23.800 1.00 75.42 H new ATOM 0 HH11 ARG A 58 16.472 -1.410 -24.049 1.00 14.11 H new ATOM 0 HH12 ARG A 58 15.639 -1.553 -25.600 1.00 14.11 H new ATOM 0 HH21 ARG A 58 14.838 1.876 -25.792 1.00 75.44 H new ATOM 0 HH22 ARG A 58 14.717 0.301 -26.584 1.00 75.44 H new ATOM 990 N SER A 59 14.798 -0.658 -18.260 1.00 1.31 N ATOM 991 CA SER A 59 15.353 -1.592 -17.287 1.00 73.14 C ATOM 992 C SER A 59 14.344 -2.685 -16.947 1.00 53.32 C ATOM 993 O SER A 59 14.712 -3.839 -16.729 1.00 1.03 O ATOM 994 CB SER A 59 15.767 -0.851 -16.015 1.00 1.30 C ATOM 995 OG SER A 59 17.035 -0.237 -16.172 1.00 70.40 O ATOM 0 H SER A 59 14.812 0.318 -17.963 1.00 1.31 H new ATOM 0 HA SER A 59 16.233 -2.059 -17.729 1.00 73.14 H new ATOM 0 HB2 SER A 59 15.021 -0.095 -15.772 1.00 1.30 H new ATOM 0 HB3 SER A 59 15.798 -1.548 -15.178 1.00 1.30 H new ATOM 0 HG SER A 59 17.276 0.232 -15.346 1.00 70.40 H new ATOM 1001 N ASP A 60 13.070 -2.312 -16.904 1.00 55.32 N ATOM 1002 CA ASP A 60 12.006 -3.259 -16.592 1.00 14.22 C ATOM 1003 C ASP A 60 11.746 -4.193 -17.770 1.00 2.32 C ATOM 1004 O ASP A 60 11.377 -5.353 -17.585 1.00 41.45 O ATOM 1005 CB ASP A 60 10.722 -2.513 -16.224 1.00 31.45 C ATOM 1006 CG ASP A 60 10.958 -1.431 -15.188 1.00 55.05 C ATOM 1007 OD1 ASP A 60 11.973 -1.512 -14.466 1.00 73.41 O ATOM 1008 OD2 ASP A 60 10.126 -0.503 -15.100 1.00 43.12 O ATOM 0 H ASP A 60 12.749 -1.360 -17.081 1.00 55.32 H new ATOM 0 HA ASP A 60 12.326 -3.859 -15.740 1.00 14.22 H new ATOM 0 HB2 ASP A 60 10.295 -2.066 -17.122 1.00 31.45 H new ATOM 0 HB3 ASP A 60 9.989 -3.224 -15.842 1.00 31.45 H new ATOM 1013 N ARG A 61 11.941 -3.679 -18.980 1.00 14.42 N ATOM 1014 CA ARG A 61 11.725 -4.466 -20.188 1.00 4.21 C ATOM 1015 C ARG A 61 12.860 -5.464 -20.396 1.00 24.34 C ATOM 1016 O ARG A 61 12.624 -6.630 -20.710 1.00 33.23 O ATOM 1017 CB ARG A 61 11.610 -3.548 -21.406 1.00 70.04 C ATOM 1018 CG ARG A 61 10.308 -3.714 -22.173 1.00 30.12 C ATOM 1019 CD ARG A 61 9.738 -2.371 -22.601 1.00 1.34 C ATOM 1020 NE ARG A 61 8.639 -2.520 -23.551 1.00 44.12 N ATOM 1021 CZ ARG A 61 8.810 -2.863 -24.823 1.00 55.11 C ATOM 1022 NH1 ARG A 61 10.028 -3.091 -25.294 1.00 74.43 N ATOM 1023 NH2 ARG A 61 7.760 -2.978 -25.627 1.00 32.55 N ATOM 0 H ARG A 61 12.248 -2.721 -19.150 1.00 14.42 H new ATOM 0 HA ARG A 61 10.794 -5.020 -20.069 1.00 4.21 H new ATOM 0 HB2 ARG A 61 11.700 -2.512 -21.079 1.00 70.04 H new ATOM 0 HB3 ARG A 61 12.445 -3.744 -22.078 1.00 70.04 H new ATOM 0 HG2 ARG A 61 10.479 -4.335 -23.053 1.00 30.12 H new ATOM 0 HG3 ARG A 61 9.582 -4.237 -21.550 1.00 30.12 H new ATOM 0 HD2 ARG A 61 9.387 -1.830 -21.722 1.00 1.34 H new ATOM 0 HD3 ARG A 61 10.527 -1.769 -23.051 1.00 1.34 H new ATOM 0 HE ARG A 61 7.689 -2.352 -23.220 1.00 44.12 H new ATOM 0 HH11 ARG A 61 10.837 -3.003 -24.679 1.00 74.43 H new ATOM 0 HH12 ARG A 61 10.156 -3.354 -26.271 1.00 74.43 H new ATOM 0 HH21 ARG A 61 6.821 -2.803 -25.268 1.00 32.55 H new ATOM 0 HH22 ARG A 61 7.892 -3.241 -26.604 1.00 32.55 H new ATOM 1037 N GLU A 62 14.092 -4.997 -20.218 1.00 64.53 N ATOM 1038 CA GLU A 62 15.263 -5.850 -20.388 1.00 3.22 C ATOM 1039 C GLU A 62 15.265 -6.982 -19.365 1.00 34.21 C ATOM 1040 O GLU A 62 15.541 -8.135 -19.698 1.00 51.32 O ATOM 1041 CB GLU A 62 16.545 -5.026 -20.254 1.00 4.50 C ATOM 1042 CG GLU A 62 16.708 -4.370 -18.893 1.00 25.22 C ATOM 1043 CD GLU A 62 17.931 -3.476 -18.818 1.00 61.44 C ATOM 1044 OE1 GLU A 62 18.017 -2.522 -19.619 1.00 50.13 O ATOM 1045 OE2 GLU A 62 18.802 -3.731 -17.960 1.00 74.02 O ATOM 0 H GLU A 62 14.305 -4.034 -19.957 1.00 64.53 H new ATOM 0 HA GLU A 62 15.221 -6.285 -21.386 1.00 3.22 H new ATOM 0 HB2 GLU A 62 17.403 -5.672 -20.442 1.00 4.50 H new ATOM 0 HB3 GLU A 62 16.553 -4.254 -21.023 1.00 4.50 H new ATOM 0 HG2 GLU A 62 15.818 -3.782 -18.669 1.00 25.22 H new ATOM 0 HG3 GLU A 62 16.780 -5.143 -18.128 1.00 25.22 H new ATOM 1052 N VAL A 63 14.954 -6.645 -18.117 1.00 63.11 N ATOM 1053 CA VAL A 63 14.919 -7.632 -17.045 1.00 32.23 C ATOM 1054 C VAL A 63 13.811 -8.654 -17.275 1.00 63.31 C ATOM 1055 O VAL A 63 14.008 -9.854 -17.078 1.00 32.23 O ATOM 1056 CB VAL A 63 14.708 -6.964 -15.673 1.00 42.22 C ATOM 1057 CG1 VAL A 63 15.872 -6.042 -15.344 1.00 43.30 C ATOM 1058 CG2 VAL A 63 13.391 -6.203 -15.648 1.00 42.14 C ATOM 0 H VAL A 63 14.723 -5.696 -17.824 1.00 63.11 H new ATOM 0 HA VAL A 63 15.884 -8.138 -17.050 1.00 32.23 H new ATOM 0 HB VAL A 63 14.666 -7.743 -14.912 1.00 42.22 H new ATOM 0 HG11 VAL A 63 15.706 -5.579 -14.371 1.00 43.30 H new ATOM 0 HG12 VAL A 63 16.797 -6.618 -15.318 1.00 43.30 H new ATOM 0 HG13 VAL A 63 15.949 -5.267 -16.106 1.00 43.30 H new ATOM 0 HG21 VAL A 63 13.258 -5.737 -14.671 1.00 42.14 H new ATOM 0 HG22 VAL A 63 13.401 -5.432 -16.419 1.00 42.14 H new ATOM 0 HG23 VAL A 63 12.568 -6.893 -15.836 1.00 42.14 H new ATOM 1068 N LEU A 64 12.647 -8.172 -17.694 1.00 53.03 N ATOM 1069 CA LEU A 64 11.506 -9.044 -17.953 1.00 10.22 C ATOM 1070 C LEU A 64 11.859 -10.111 -18.984 1.00 52.33 C ATOM 1071 O LEU A 64 11.539 -11.287 -18.810 1.00 11.30 O ATOM 1072 CB LEU A 64 10.311 -8.222 -18.440 1.00 63.22 C ATOM 1073 CG LEU A 64 9.109 -8.161 -17.497 1.00 62.00 C ATOM 1074 CD1 LEU A 64 9.562 -7.885 -16.072 1.00 5.02 C ATOM 1075 CD2 LEU A 64 8.122 -7.100 -17.960 1.00 12.43 C ATOM 0 H LEU A 64 12.468 -7.182 -17.862 1.00 53.03 H new ATOM 0 HA LEU A 64 11.241 -9.541 -17.020 1.00 10.22 H new ATOM 0 HB2 LEU A 64 10.650 -7.204 -18.631 1.00 63.22 H new ATOM 0 HB3 LEU A 64 9.979 -8.631 -19.394 1.00 63.22 H new ATOM 0 HG LEU A 64 8.607 -9.128 -17.516 1.00 62.00 H new ATOM 0 HD11 LEU A 64 8.693 -7.845 -15.415 1.00 5.02 H new ATOM 0 HD12 LEU A 64 10.230 -8.681 -15.742 1.00 5.02 H new ATOM 0 HD13 LEU A 64 10.088 -6.931 -16.036 1.00 5.02 H new ATOM 0 HD21 LEU A 64 7.273 -7.070 -17.277 1.00 12.43 H new ATOM 0 HD22 LEU A 64 8.613 -6.127 -17.971 1.00 12.43 H new ATOM 0 HD23 LEU A 64 7.772 -7.342 -18.964 1.00 12.43 H new ATOM 1087 N ASP A 65 12.521 -9.693 -20.057 1.00 42.42 N ATOM 1088 CA ASP A 65 12.921 -10.613 -21.116 1.00 12.34 C ATOM 1089 C ASP A 65 13.957 -11.610 -20.606 1.00 41.44 C ATOM 1090 O ASP A 65 14.016 -12.749 -21.068 1.00 11.44 O ATOM 1091 CB ASP A 65 13.483 -9.838 -22.309 1.00 23.15 C ATOM 1092 CG ASP A 65 12.842 -10.248 -23.620 1.00 33.15 C ATOM 1093 OD1 ASP A 65 13.031 -11.410 -24.034 1.00 70.52 O ATOM 1094 OD2 ASP A 65 12.151 -9.406 -24.231 1.00 70.23 O ATOM 0 H ASP A 65 12.792 -8.723 -20.217 1.00 42.42 H new ATOM 0 HA ASP A 65 12.038 -11.166 -21.436 1.00 12.34 H new ATOM 0 HB2 ASP A 65 13.328 -8.771 -22.151 1.00 23.15 H new ATOM 0 HB3 ASP A 65 14.559 -9.999 -22.368 1.00 23.15 H new ATOM 1099 N ASN A 66 14.773 -11.172 -19.653 1.00 44.02 N ATOM 1100 CA ASN A 66 15.809 -12.026 -19.082 1.00 50.33 C ATOM 1101 C ASN A 66 15.202 -13.063 -18.143 1.00 31.22 C ATOM 1102 O ASN A 66 15.602 -14.227 -18.146 1.00 22.33 O ATOM 1103 CB ASN A 66 16.838 -11.180 -18.330 1.00 25.32 C ATOM 1104 CG ASN A 66 18.049 -11.988 -17.903 1.00 42.24 C ATOM 1105 OD1 ASN A 66 18.357 -13.024 -18.493 1.00 32.15 O ATOM 1106 ND2 ASN A 66 18.743 -11.515 -16.874 1.00 74.51 N ATOM 0 H ASN A 66 14.737 -10.231 -19.260 1.00 44.02 H new ATOM 0 HA ASN A 66 16.306 -12.549 -19.899 1.00 50.33 H new ATOM 0 HB2 ASN A 66 17.160 -10.355 -18.965 1.00 25.32 H new ATOM 0 HB3 ASN A 66 16.369 -10.740 -17.450 1.00 25.32 H new ATOM 0 HD21 ASN A 66 19.568 -12.015 -16.543 1.00 74.51 H new ATOM 0 HD22 ASN A 66 18.451 -10.652 -16.415 1.00 74.51 H new ATOM 1113 N TRP A 67 14.234 -12.633 -17.342 1.00 3.15 N ATOM 1114 CA TRP A 67 13.571 -13.525 -16.397 1.00 2.21 C ATOM 1115 C TRP A 67 12.845 -14.649 -17.127 1.00 51.34 C ATOM 1116 O TRP A 67 12.862 -15.799 -16.689 1.00 60.01 O ATOM 1117 CB TRP A 67 12.584 -12.741 -15.531 1.00 13.11 C ATOM 1118 CG TRP A 67 13.232 -11.657 -14.724 1.00 11.02 C ATOM 1119 CD1 TRP A 67 12.811 -10.363 -14.602 1.00 24.44 C ATOM 1120 CD2 TRP A 67 14.417 -11.773 -13.929 1.00 1.50 C ATOM 1121 NE1 TRP A 67 13.664 -9.668 -13.779 1.00 10.24 N ATOM 1122 CE2 TRP A 67 14.657 -10.510 -13.352 1.00 54.12 C ATOM 1123 CE3 TRP A 67 15.298 -12.820 -13.647 1.00 10.14 C ATOM 1124 CZ2 TRP A 67 15.741 -10.269 -12.512 1.00 74.13 C ATOM 1125 CZ3 TRP A 67 16.374 -12.579 -12.813 1.00 75.30 C ATOM 1126 CH2 TRP A 67 16.587 -11.313 -12.253 1.00 41.31 C ATOM 0 H TRP A 67 13.891 -11.673 -17.328 1.00 3.15 H new ATOM 0 HA TRP A 67 14.334 -13.967 -15.756 1.00 2.21 H new ATOM 0 HB2 TRP A 67 11.820 -12.300 -16.172 1.00 13.11 H new ATOM 0 HB3 TRP A 67 12.075 -13.431 -14.857 1.00 13.11 H new ATOM 0 HD1 TRP A 67 11.937 -9.948 -15.082 1.00 24.44 H new ATOM 0 HE1 TRP A 67 13.573 -8.684 -13.527 1.00 10.24 H new ATOM 0 HE3 TRP A 67 15.141 -13.800 -14.073 1.00 10.14 H new ATOM 0 HZ2 TRP A 67 15.908 -9.293 -12.080 1.00 74.13 H new ATOM 0 HZ3 TRP A 67 17.062 -13.381 -12.589 1.00 75.30 H new ATOM 0 HH2 TRP A 67 17.436 -11.158 -11.604 1.00 41.31 H new ATOM 1137 N ARG A 68 12.208 -14.309 -18.243 1.00 53.21 N ATOM 1138 CA ARG A 68 11.475 -15.290 -19.034 1.00 35.25 C ATOM 1139 C ARG A 68 12.432 -16.170 -19.832 1.00 51.34 C ATOM 1140 O ARG A 68 12.096 -17.295 -20.198 1.00 60.52 O ATOM 1141 CB ARG A 68 10.500 -14.588 -19.981 1.00 35.25 C ATOM 1142 CG ARG A 68 10.179 -15.392 -21.230 1.00 41.22 C ATOM 1143 CD ARG A 68 11.164 -15.096 -22.351 1.00 31.05 C ATOM 1144 NE ARG A 68 10.491 -14.653 -23.568 1.00 74.25 N ATOM 1145 CZ ARG A 68 10.076 -13.407 -23.767 1.00 41.05 C ATOM 1146 NH1 ARG A 68 10.266 -12.485 -22.834 1.00 14.21 N ATOM 1147 NH2 ARG A 68 9.471 -13.081 -24.903 1.00 1.15 N ATOM 0 H ARG A 68 12.185 -13.361 -18.620 1.00 53.21 H new ATOM 0 HA ARG A 68 10.912 -15.924 -18.349 1.00 35.25 H new ATOM 0 HB2 ARG A 68 9.574 -14.379 -19.446 1.00 35.25 H new ATOM 0 HB3 ARG A 68 10.922 -13.627 -20.276 1.00 35.25 H new ATOM 0 HG2 ARG A 68 10.202 -16.456 -20.995 1.00 41.22 H new ATOM 0 HG3 ARG A 68 9.167 -15.161 -21.563 1.00 41.22 H new ATOM 0 HD2 ARG A 68 11.865 -14.328 -22.024 1.00 31.05 H new ATOM 0 HD3 ARG A 68 11.749 -15.991 -22.565 1.00 31.05 H new ATOM 0 HE ARG A 68 10.330 -15.338 -24.306 1.00 74.25 H new ATOM 0 HH11 ARG A 68 10.732 -12.732 -21.961 1.00 14.21 H new ATOM 0 HH12 ARG A 68 9.946 -11.529 -22.989 1.00 14.21 H new ATOM 0 HH21 ARG A 68 9.325 -13.788 -25.624 1.00 1.15 H new ATOM 0 HH22 ARG A 68 9.153 -12.124 -25.055 1.00 1.15 H new ATOM 1161 N GLU A 69 13.625 -15.647 -20.099 1.00 52.11 N ATOM 1162 CA GLU A 69 14.630 -16.385 -20.856 1.00 15.33 C ATOM 1163 C GLU A 69 15.214 -17.520 -20.021 1.00 24.15 C ATOM 1164 O GLU A 69 15.399 -18.635 -20.510 1.00 75.32 O ATOM 1165 CB GLU A 69 15.747 -15.445 -21.313 1.00 63.20 C ATOM 1166 CG GLU A 69 16.944 -16.168 -21.910 1.00 14.45 C ATOM 1167 CD GLU A 69 16.587 -16.957 -23.154 1.00 62.30 C ATOM 1168 OE1 GLU A 69 15.809 -17.927 -23.039 1.00 63.25 O ATOM 1169 OE2 GLU A 69 17.087 -16.604 -24.243 1.00 73.40 O ATOM 0 H GLU A 69 13.919 -14.716 -19.803 1.00 52.11 H new ATOM 0 HA GLU A 69 14.146 -16.815 -21.733 1.00 15.33 H new ATOM 0 HB2 GLU A 69 15.347 -14.751 -22.052 1.00 63.20 H new ATOM 0 HB3 GLU A 69 16.080 -14.849 -20.463 1.00 63.20 H new ATOM 0 HG2 GLU A 69 17.718 -15.441 -22.155 1.00 14.45 H new ATOM 0 HG3 GLU A 69 17.365 -16.843 -21.165 1.00 14.45 H new ATOM 1176 N LEU A 70 15.505 -17.228 -18.758 1.00 31.45 N ATOM 1177 CA LEU A 70 16.070 -18.224 -17.853 1.00 14.32 C ATOM 1178 C LEU A 70 15.004 -19.217 -17.402 1.00 75.33 C ATOM 1179 O LEU A 70 15.278 -20.406 -17.241 1.00 44.30 O ATOM 1180 CB LEU A 70 16.692 -17.539 -16.635 1.00 25.43 C ATOM 1181 CG LEU A 70 15.835 -16.472 -15.953 1.00 23.51 C ATOM 1182 CD1 LEU A 70 15.049 -17.076 -14.799 1.00 63.14 C ATOM 1183 CD2 LEU A 70 16.704 -15.322 -15.465 1.00 32.33 C ATOM 0 H LEU A 70 15.359 -16.310 -18.337 1.00 31.45 H new ATOM 0 HA LEU A 70 16.845 -18.770 -18.391 1.00 14.32 H new ATOM 0 HB2 LEU A 70 16.937 -18.304 -15.899 1.00 25.43 H new ATOM 0 HB3 LEU A 70 17.632 -17.080 -16.942 1.00 25.43 H new ATOM 0 HG LEU A 70 15.126 -16.081 -16.683 1.00 23.51 H new ATOM 0 HD11 LEU A 70 14.445 -16.302 -14.326 1.00 63.14 H new ATOM 0 HD12 LEU A 70 14.398 -17.865 -15.176 1.00 63.14 H new ATOM 0 HD13 LEU A 70 15.740 -17.495 -14.068 1.00 63.14 H new ATOM 0 HD21 LEU A 70 16.077 -14.572 -14.982 1.00 32.33 H new ATOM 0 HD22 LEU A 70 17.437 -15.697 -14.750 1.00 32.33 H new ATOM 0 HD23 LEU A 70 17.221 -14.872 -16.312 1.00 32.33 H new ATOM 1195 N GLU A 71 13.786 -18.722 -17.203 1.00 42.53 N ATOM 1196 CA GLU A 71 12.679 -19.567 -16.773 1.00 32.01 C ATOM 1197 C GLU A 71 12.304 -20.568 -17.862 1.00 34.12 C ATOM 1198 O GLU A 71 11.901 -21.694 -17.572 1.00 22.40 O ATOM 1199 CB GLU A 71 11.464 -18.710 -16.412 1.00 52.22 C ATOM 1200 CG GLU A 71 10.198 -19.517 -16.178 1.00 12.44 C ATOM 1201 CD GLU A 71 9.012 -18.647 -15.806 1.00 63.02 C ATOM 1202 OE1 GLU A 71 9.214 -17.436 -15.579 1.00 2.34 O ATOM 1203 OE2 GLU A 71 7.884 -19.177 -15.743 1.00 34.22 O ATOM 0 H GLU A 71 13.542 -17.740 -17.333 1.00 42.53 H new ATOM 0 HA GLU A 71 12.999 -20.120 -15.890 1.00 32.01 H new ATOM 0 HB2 GLU A 71 11.689 -18.135 -15.514 1.00 52.22 H new ATOM 0 HB3 GLU A 71 11.285 -17.993 -17.213 1.00 52.22 H new ATOM 0 HG2 GLU A 71 9.960 -20.083 -17.079 1.00 12.44 H new ATOM 0 HG3 GLU A 71 10.375 -20.242 -15.384 1.00 12.44 H new ATOM 1210 N MET A 72 12.438 -20.148 -19.115 1.00 40.14 N ATOM 1211 CA MET A 72 12.114 -21.007 -20.248 1.00 72.40 C ATOM 1212 C MET A 72 13.325 -21.834 -20.667 1.00 62.24 C ATOM 1213 O MET A 72 13.200 -22.801 -21.419 1.00 32.31 O ATOM 1214 CB MET A 72 11.621 -20.168 -21.428 1.00 44.24 C ATOM 1215 CG MET A 72 12.744 -19.543 -22.240 1.00 45.11 C ATOM 1216 SD MET A 72 12.137 -18.552 -23.618 1.00 50.14 S ATOM 1217 CE MET A 72 11.865 -19.820 -24.853 1.00 62.35 C ATOM 0 H MET A 72 12.769 -19.218 -19.372 1.00 40.14 H new ATOM 0 HA MET A 72 11.320 -21.688 -19.940 1.00 72.40 H new ATOM 0 HB2 MET A 72 11.016 -20.796 -22.082 1.00 44.24 H new ATOM 0 HB3 MET A 72 10.970 -19.377 -21.054 1.00 44.24 H new ATOM 0 HG2 MET A 72 13.353 -18.917 -21.588 1.00 45.11 H new ATOM 0 HG3 MET A 72 13.393 -20.331 -22.622 1.00 45.11 H new ATOM 0 HE1 MET A 72 11.487 -19.362 -25.767 1.00 62.35 H new ATOM 0 HE2 MET A 72 12.805 -20.330 -25.064 1.00 62.35 H new ATOM 0 HE3 MET A 72 11.137 -20.540 -24.480 1.00 62.35 H new ATOM 1227 N LYS A 73 14.498 -21.447 -20.177 1.00 61.44 N ATOM 1228 CA LYS A 73 15.733 -22.153 -20.500 1.00 12.10 C ATOM 1229 C LYS A 73 15.931 -23.352 -19.578 1.00 71.14 C ATOM 1230 O LYS A 73 16.660 -24.287 -19.909 1.00 1.32 O ATOM 1231 CB LYS A 73 16.930 -21.206 -20.387 1.00 32.11 C ATOM 1232 CG LYS A 73 17.363 -20.612 -21.716 1.00 63.41 C ATOM 1233 CD LYS A 73 18.864 -20.737 -21.919 1.00 40.33 C ATOM 1234 CE LYS A 73 19.249 -20.524 -23.375 1.00 52.14 C ATOM 1235 NZ LYS A 73 20.377 -21.405 -23.786 1.00 32.45 N ATOM 0 H LYS A 73 14.620 -20.648 -19.555 1.00 61.44 H new ATOM 0 HA LYS A 73 15.659 -22.514 -21.526 1.00 12.10 H new ATOM 0 HB2 LYS A 73 16.679 -20.397 -19.701 1.00 32.11 H new ATOM 0 HB3 LYS A 73 17.770 -21.746 -19.949 1.00 32.11 H new ATOM 0 HG2 LYS A 73 16.841 -21.117 -22.529 1.00 63.41 H new ATOM 0 HG3 LYS A 73 17.075 -19.561 -21.757 1.00 63.41 H new ATOM 0 HD2 LYS A 73 19.379 -20.007 -21.295 1.00 40.33 H new ATOM 0 HD3 LYS A 73 19.195 -21.723 -21.594 1.00 40.33 H new ATOM 0 HE2 LYS A 73 18.386 -20.719 -24.011 1.00 52.14 H new ATOM 0 HE3 LYS A 73 19.528 -19.482 -23.528 1.00 52.14 H new ATOM 0 HZ1 LYS A 73 20.609 -21.229 -24.784 1.00 32.45 H new ATOM 0 HZ2 LYS A 73 21.209 -21.201 -23.196 1.00 32.45 H new ATOM 0 HZ3 LYS A 73 20.102 -22.401 -23.665 1.00 32.45 H new ATOM 1249 N ALA A 74 15.276 -23.319 -18.422 1.00 50.15 N ATOM 1250 CA ALA A 74 15.378 -24.405 -17.455 1.00 52.34 C ATOM 1251 C ALA A 74 14.558 -25.612 -17.897 1.00 72.12 C ATOM 1252 O ALA A 74 14.502 -26.625 -17.200 1.00 63.31 O ATOM 1253 CB ALA A 74 14.926 -23.932 -16.081 1.00 43.25 C ATOM 0 H ALA A 74 14.669 -22.552 -18.132 1.00 50.15 H new ATOM 0 HA ALA A 74 16.423 -24.710 -17.397 1.00 52.34 H new ATOM 0 HB1 ALA A 74 15.007 -24.753 -15.369 1.00 43.25 H new ATOM 0 HB2 ALA A 74 15.557 -23.105 -15.755 1.00 43.25 H new ATOM 0 HB3 ALA A 74 13.890 -23.599 -16.134 1.00 43.25 H new ATOM 1259 N ARG A 75 13.922 -25.497 -19.059 1.00 1.14 N ATOM 1260 CA ARG A 75 13.103 -26.579 -19.592 1.00 43.21 C ATOM 1261 C ARG A 75 12.230 -27.189 -18.500 1.00 13.22 C ATOM 1262 O ARG A 75 11.974 -28.393 -18.494 1.00 61.10 O ATOM 1263 CB ARG A 75 13.990 -27.659 -20.214 1.00 21.45 C ATOM 1264 CG ARG A 75 14.832 -28.414 -19.198 1.00 63.42 C ATOM 1265 CD ARG A 75 15.373 -29.712 -19.778 1.00 35.44 C ATOM 1266 NE ARG A 75 14.312 -30.687 -20.021 1.00 10.44 N ATOM 1267 CZ ARG A 75 13.715 -31.378 -19.057 1.00 34.44 C ATOM 1268 NH1 ARG A 75 14.072 -31.203 -17.792 1.00 35.52 N ATOM 1269 NH2 ARG A 75 12.757 -32.247 -19.357 1.00 45.11 N ATOM 0 H ARG A 75 13.958 -24.666 -19.649 1.00 1.14 H new ATOM 0 HA ARG A 75 12.453 -26.164 -20.362 1.00 43.21 H new ATOM 0 HB2 ARG A 75 13.361 -28.369 -20.752 1.00 21.45 H new ATOM 0 HB3 ARG A 75 14.650 -27.197 -20.949 1.00 21.45 H new ATOM 0 HG2 ARG A 75 15.661 -27.786 -18.872 1.00 63.42 H new ATOM 0 HG3 ARG A 75 14.231 -28.631 -18.315 1.00 63.42 H new ATOM 0 HD2 ARG A 75 15.894 -29.502 -20.712 1.00 35.44 H new ATOM 0 HD3 ARG A 75 16.106 -30.137 -19.093 1.00 35.44 H new ATOM 0 HE ARG A 75 14.014 -30.845 -20.983 1.00 10.44 H new ATOM 0 HH11 ARG A 75 14.807 -30.536 -17.557 1.00 35.52 H new ATOM 0 HH12 ARG A 75 13.611 -31.735 -17.054 1.00 35.52 H new ATOM 0 HH21 ARG A 75 12.479 -32.384 -20.329 1.00 45.11 H new ATOM 0 HH22 ARG A 75 12.299 -32.777 -18.616 1.00 45.11 H new ATOM 1283 N LYS A 76 11.775 -26.349 -17.576 1.00 34.42 N ATOM 1284 CA LYS A 76 10.929 -26.804 -16.478 1.00 41.13 C ATOM 1285 C LYS A 76 10.018 -25.681 -15.992 1.00 61.23 C ATOM 1286 O LYS A 76 10.479 -24.578 -15.699 1.00 23.11 O ATOM 1287 CB LYS A 76 11.791 -27.313 -15.321 1.00 33.34 C ATOM 1288 CG LYS A 76 12.229 -28.759 -15.479 1.00 1.11 C ATOM 1289 CD LYS A 76 12.290 -29.473 -14.139 1.00 42.10 C ATOM 1290 CE LYS A 76 11.940 -30.947 -14.276 1.00 42.34 C ATOM 1291 NZ LYS A 76 10.468 -31.171 -14.261 1.00 41.14 N ATOM 0 H LYS A 76 11.978 -25.349 -17.566 1.00 34.42 H new ATOM 0 HA LYS A 76 10.306 -27.620 -16.845 1.00 41.13 H new ATOM 0 HB2 LYS A 76 12.675 -26.682 -15.233 1.00 33.34 H new ATOM 0 HB3 LYS A 76 11.232 -27.211 -14.391 1.00 33.34 H new ATOM 0 HG2 LYS A 76 11.535 -29.280 -16.139 1.00 1.11 H new ATOM 0 HG3 LYS A 76 13.209 -28.793 -15.955 1.00 1.11 H new ATOM 0 HD2 LYS A 76 13.290 -29.373 -13.718 1.00 42.10 H new ATOM 0 HD3 LYS A 76 11.601 -28.998 -13.441 1.00 42.10 H new ATOM 0 HE2 LYS A 76 12.357 -31.334 -15.206 1.00 42.34 H new ATOM 0 HE3 LYS A 76 12.401 -31.507 -13.462 1.00 42.34 H new ATOM 0 HZ1 LYS A 76 10.271 -32.188 -14.357 1.00 41.14 H new ATOM 0 HZ2 LYS A 76 10.073 -30.825 -13.363 1.00 41.14 H new ATOM 0 HZ3 LYS A 76 10.031 -30.657 -15.053 1.00 41.14 H new ATOM 1305 N ARG A 77 8.724 -25.970 -15.908 1.00 74.22 N ATOM 1306 CA ARG A 77 7.748 -24.985 -15.457 1.00 45.43 C ATOM 1307 C ARG A 77 7.733 -24.892 -13.934 1.00 63.32 C ATOM 1308 O ARG A 77 6.998 -25.619 -13.265 1.00 31.22 O ATOM 1309 CB ARG A 77 6.353 -25.344 -15.971 1.00 62.21 C ATOM 1310 CG ARG A 77 6.142 -25.017 -17.440 1.00 62.44 C ATOM 1311 CD ARG A 77 6.479 -26.205 -18.329 1.00 52.40 C ATOM 1312 NE ARG A 77 5.624 -27.356 -18.052 1.00 13.43 N ATOM 1313 CZ ARG A 77 5.721 -28.515 -18.693 1.00 54.33 C ATOM 1314 NH1 ARG A 77 6.631 -28.676 -19.644 1.00 12.02 N ATOM 1315 NH2 ARG A 77 4.906 -29.516 -18.384 1.00 43.31 N ATOM 0 H ARG A 77 8.327 -26.879 -16.146 1.00 74.22 H new ATOM 0 HA ARG A 77 8.037 -24.014 -15.860 1.00 45.43 H new ATOM 0 HB2 ARG A 77 6.181 -26.409 -15.816 1.00 62.21 H new ATOM 0 HB3 ARG A 77 5.609 -24.812 -15.379 1.00 62.21 H new ATOM 0 HG2 ARG A 77 5.106 -24.722 -17.603 1.00 62.44 H new ATOM 0 HG3 ARG A 77 6.764 -24.166 -17.717 1.00 62.44 H new ATOM 0 HD2 ARG A 77 6.372 -25.917 -19.375 1.00 52.40 H new ATOM 0 HD3 ARG A 77 7.522 -26.484 -18.181 1.00 52.40 H new ATOM 0 HE ARG A 77 4.913 -27.265 -17.326 1.00 13.43 H new ATOM 0 HH11 ARG A 77 7.258 -27.909 -19.885 1.00 12.02 H new ATOM 0 HH12 ARG A 77 6.704 -29.567 -20.135 1.00 12.02 H new ATOM 0 HH21 ARG A 77 4.204 -29.395 -17.654 1.00 43.31 H new ATOM 0 HH22 ARG A 77 4.981 -30.406 -18.877 1.00 43.31 H new ATOM 1329 N LEU A 78 8.550 -23.995 -13.393 1.00 54.00 N ATOM 1330 CA LEU A 78 8.631 -23.807 -11.949 1.00 31.44 C ATOM 1331 C LEU A 78 7.289 -23.356 -11.382 1.00 12.42 C ATOM 1332 O LEU A 78 6.427 -22.841 -12.095 1.00 64.13 O ATOM 1333 CB LEU A 78 9.713 -22.781 -11.608 1.00 31.22 C ATOM 1334 CG LEU A 78 11.132 -23.329 -11.454 1.00 3.54 C ATOM 1335 CD1 LEU A 78 11.449 -24.312 -12.569 1.00 44.15 C ATOM 1336 CD2 LEU A 78 12.144 -22.192 -11.439 1.00 14.51 C ATOM 0 H LEU A 78 9.166 -23.387 -13.933 1.00 54.00 H new ATOM 0 HA LEU A 78 8.892 -24.764 -11.497 1.00 31.44 H new ATOM 0 HB2 LEU A 78 9.722 -22.019 -12.387 1.00 31.22 H new ATOM 0 HB3 LEU A 78 9.434 -22.284 -10.679 1.00 31.22 H new ATOM 0 HG LEU A 78 11.195 -23.858 -10.503 1.00 3.54 H new ATOM 0 HD11 LEU A 78 12.463 -24.691 -12.442 1.00 44.15 H new ATOM 0 HD12 LEU A 78 10.744 -25.142 -12.533 1.00 44.15 H new ATOM 0 HD13 LEU A 78 11.368 -23.808 -13.532 1.00 44.15 H new ATOM 0 HD21 LEU A 78 13.149 -22.600 -11.329 1.00 14.51 H new ATOM 0 HD22 LEU A 78 12.079 -21.635 -12.374 1.00 14.51 H new ATOM 0 HD23 LEU A 78 11.930 -21.525 -10.604 1.00 14.51 H new ATOM 1348 N PRO A 79 7.106 -23.549 -10.067 1.00 71.43 N ATOM 1349 CA PRO A 79 5.872 -23.166 -9.375 1.00 30.32 C ATOM 1350 C PRO A 79 5.710 -21.653 -9.274 1.00 33.42 C ATOM 1351 O PRO A 79 4.652 -21.109 -9.594 1.00 5.32 O ATOM 1352 CB PRO A 79 6.041 -23.780 -7.983 1.00 3.13 C ATOM 1353 CG PRO A 79 7.515 -23.887 -7.793 1.00 31.04 C ATOM 1354 CD PRO A 79 8.090 -24.157 -9.156 1.00 32.14 C ATOM 0 HA PRO A 79 4.984 -23.512 -9.904 1.00 30.32 H new ATOM 0 HB2 PRO A 79 5.587 -23.153 -7.216 1.00 3.13 H new ATOM 0 HB3 PRO A 79 5.562 -24.757 -7.920 1.00 3.13 H new ATOM 0 HG2 PRO A 79 7.922 -22.967 -7.373 1.00 31.04 H new ATOM 0 HG3 PRO A 79 7.762 -24.691 -7.099 1.00 31.04 H new ATOM 0 HD2 PRO A 79 9.076 -23.708 -9.272 1.00 32.14 H new ATOM 0 HD3 PRO A 79 8.202 -25.225 -9.341 1.00 32.14 H new ATOM 1362 N THR A 80 6.764 -20.978 -8.827 1.00 62.12 N ATOM 1363 CA THR A 80 6.738 -19.528 -8.684 1.00 23.04 C ATOM 1364 C THR A 80 7.394 -18.845 -9.878 1.00 71.35 C ATOM 1365 O THR A 80 8.055 -19.492 -10.691 1.00 60.44 O ATOM 1366 CB THR A 80 7.452 -19.078 -7.395 1.00 32.33 C ATOM 1367 OG1 THR A 80 7.363 -17.656 -7.256 1.00 50.13 O ATOM 1368 CG2 THR A 80 8.913 -19.501 -7.409 1.00 60.23 C ATOM 0 H THR A 80 7.647 -21.413 -8.558 1.00 62.12 H new ATOM 0 HA THR A 80 5.689 -19.235 -8.632 1.00 23.04 H new ATOM 0 HB THR A 80 6.960 -19.557 -6.548 1.00 32.33 H new ATOM 0 HG1 THR A 80 7.818 -17.379 -6.433 1.00 50.13 H new ATOM 0 HG21 THR A 80 9.396 -19.172 -6.489 1.00 60.23 H new ATOM 0 HG22 THR A 80 8.977 -20.587 -7.484 1.00 60.23 H new ATOM 0 HG23 THR A 80 9.415 -19.048 -8.264 1.00 60.23 H new ATOM 1376 N THR A 81 7.208 -17.533 -9.980 1.00 52.20 N ATOM 1377 CA THR A 81 7.781 -16.762 -11.076 1.00 71.12 C ATOM 1378 C THR A 81 8.680 -15.648 -10.553 1.00 50.45 C ATOM 1379 O THR A 81 9.547 -15.148 -11.271 1.00 43.51 O ATOM 1380 CB THR A 81 6.683 -16.147 -11.964 1.00 42.24 C ATOM 1381 OG1 THR A 81 5.876 -17.183 -12.534 1.00 33.10 O ATOM 1382 CG2 THR A 81 7.294 -15.305 -13.074 1.00 50.15 C ATOM 0 H THR A 81 6.664 -16.982 -9.316 1.00 52.20 H new ATOM 0 HA THR A 81 8.375 -17.454 -11.673 1.00 71.12 H new ATOM 0 HB THR A 81 6.061 -15.504 -11.341 1.00 42.24 H new ATOM 0 HG1 THR A 81 5.179 -16.783 -13.096 1.00 33.10 H new ATOM 0 HG21 THR A 81 6.500 -14.881 -13.688 1.00 50.15 H new ATOM 0 HG22 THR A 81 7.884 -14.499 -12.637 1.00 50.15 H new ATOM 0 HG23 THR A 81 7.937 -15.931 -13.693 1.00 50.15 H new ATOM 1390 N LEU A 82 8.469 -15.262 -9.300 1.00 33.42 N ATOM 1391 CA LEU A 82 9.261 -14.206 -8.680 1.00 24.20 C ATOM 1392 C LEU A 82 10.602 -14.746 -8.193 1.00 64.14 C ATOM 1393 O LEU A 82 10.829 -14.883 -6.991 1.00 42.30 O ATOM 1394 CB LEU A 82 8.494 -13.585 -7.511 1.00 45.03 C ATOM 1395 CG LEU A 82 7.637 -12.364 -7.845 1.00 1.53 C ATOM 1396 CD1 LEU A 82 6.940 -11.844 -6.597 1.00 2.11 C ATOM 1397 CD2 LEU A 82 8.488 -11.271 -8.477 1.00 33.43 C ATOM 0 H LEU A 82 7.755 -15.665 -8.693 1.00 33.42 H new ATOM 0 HA LEU A 82 9.450 -13.439 -9.431 1.00 24.20 H new ATOM 0 HB2 LEU A 82 7.849 -14.350 -7.079 1.00 45.03 H new ATOM 0 HB3 LEU A 82 9.212 -13.301 -6.741 1.00 45.03 H new ATOM 0 HG LEU A 82 6.875 -12.665 -8.564 1.00 1.53 H new ATOM 0 HD11 LEU A 82 6.335 -10.975 -6.854 1.00 2.11 H new ATOM 0 HD12 LEU A 82 6.299 -12.624 -6.186 1.00 2.11 H new ATOM 0 HD13 LEU A 82 7.686 -11.560 -5.855 1.00 2.11 H new ATOM 0 HD21 LEU A 82 7.861 -10.410 -8.708 1.00 33.43 H new ATOM 0 HD22 LEU A 82 9.272 -10.973 -7.781 1.00 33.43 H new ATOM 0 HD23 LEU A 82 8.940 -11.647 -9.395 1.00 33.43 H new ATOM 1409 N PHE A 83 11.489 -15.050 -9.136 1.00 1.25 N ATOM 1410 CA PHE A 83 12.809 -15.574 -8.803 1.00 12.50 C ATOM 1411 C PHE A 83 13.886 -14.920 -9.663 1.00 41.25 C ATOM 1412 O PHE A 83 13.607 -14.003 -10.437 1.00 24.31 O ATOM 1413 CB PHE A 83 12.841 -17.092 -8.992 1.00 12.41 C ATOM 1414 CG PHE A 83 12.270 -17.544 -10.305 1.00 75.41 C ATOM 1415 CD1 PHE A 83 12.650 -16.933 -11.489 1.00 12.42 C ATOM 1416 CD2 PHE A 83 11.353 -18.582 -10.356 1.00 52.00 C ATOM 1417 CE1 PHE A 83 12.125 -17.347 -12.698 1.00 51.14 C ATOM 1418 CE2 PHE A 83 10.825 -19.001 -11.563 1.00 12.12 C ATOM 1419 CZ PHE A 83 11.212 -18.383 -12.736 1.00 23.14 C ATOM 0 H PHE A 83 11.318 -14.943 -10.136 1.00 1.25 H new ATOM 0 HA PHE A 83 13.012 -15.341 -7.758 1.00 12.50 H new ATOM 0 HB2 PHE A 83 13.872 -17.438 -8.915 1.00 12.41 H new ATOM 0 HB3 PHE A 83 12.285 -17.563 -8.181 1.00 12.41 H new ATOM 0 HD1 PHE A 83 13.365 -16.124 -11.467 1.00 12.42 H new ATOM 0 HD2 PHE A 83 11.047 -19.069 -9.442 1.00 52.00 H new ATOM 0 HE1 PHE A 83 12.428 -16.861 -13.613 1.00 51.14 H new ATOM 0 HE2 PHE A 83 10.111 -19.811 -11.589 1.00 12.12 H new ATOM 0 HZ PHE A 83 10.802 -18.709 -13.680 1.00 23.14 H new ATOM 1429 N PHE A 84 15.118 -15.397 -9.522 1.00 62.44 N ATOM 1430 CA PHE A 84 16.239 -14.859 -10.285 1.00 33.21 C ATOM 1431 C PHE A 84 17.316 -15.920 -10.490 1.00 4.22 C ATOM 1432 O PHE A 84 17.226 -17.024 -9.952 1.00 0.44 O ATOM 1433 CB PHE A 84 16.833 -13.644 -9.570 1.00 53.20 C ATOM 1434 CG PHE A 84 17.352 -13.952 -8.195 1.00 3.01 C ATOM 1435 CD1 PHE A 84 18.390 -14.853 -8.018 1.00 3.41 C ATOM 1436 CD2 PHE A 84 16.803 -13.341 -7.079 1.00 42.33 C ATOM 1437 CE1 PHE A 84 18.870 -15.138 -6.754 1.00 34.44 C ATOM 1438 CE2 PHE A 84 17.279 -13.622 -5.812 1.00 73.34 C ATOM 1439 CZ PHE A 84 18.314 -14.522 -5.650 1.00 1.44 C ATOM 0 H PHE A 84 15.366 -16.155 -8.886 1.00 62.44 H new ATOM 0 HA PHE A 84 15.867 -14.551 -11.262 1.00 33.21 H new ATOM 0 HB2 PHE A 84 17.645 -13.238 -10.174 1.00 53.20 H new ATOM 0 HB3 PHE A 84 16.072 -12.867 -9.497 1.00 53.20 H new ATOM 0 HD1 PHE A 84 18.829 -15.338 -8.878 1.00 3.41 H new ATOM 0 HD2 PHE A 84 15.993 -12.637 -7.201 1.00 42.33 H new ATOM 0 HE1 PHE A 84 19.679 -15.842 -6.629 1.00 34.44 H new ATOM 0 HE2 PHE A 84 16.842 -13.139 -4.950 1.00 73.34 H new ATOM 0 HZ PHE A 84 18.688 -14.744 -4.661 1.00 1.44 H new ATOM 1449 N ILE A 85 18.334 -15.577 -11.272 1.00 4.33 N ATOM 1450 CA ILE A 85 19.430 -16.498 -11.548 1.00 35.34 C ATOM 1451 C ILE A 85 20.739 -15.989 -10.956 1.00 2.42 C ATOM 1452 O ILE A 85 21.012 -14.789 -10.970 1.00 0.24 O ATOM 1453 CB ILE A 85 19.614 -16.717 -13.061 1.00 13.11 C ATOM 1454 CG1 ILE A 85 19.974 -15.398 -13.749 1.00 20.44 C ATOM 1455 CG2 ILE A 85 18.351 -17.309 -13.668 1.00 72.40 C ATOM 1456 CD1 ILE A 85 20.389 -15.564 -15.194 1.00 21.43 C ATOM 0 H ILE A 85 18.423 -14.668 -11.726 1.00 4.33 H new ATOM 0 HA ILE A 85 19.169 -17.448 -11.081 1.00 35.34 H new ATOM 0 HB ILE A 85 20.432 -17.421 -13.214 1.00 13.11 H new ATOM 0 HG12 ILE A 85 19.117 -14.726 -13.700 1.00 20.44 H new ATOM 0 HG13 ILE A 85 20.785 -14.920 -13.199 1.00 20.44 H new ATOM 0 HG21 ILE A 85 18.497 -17.458 -14.738 1.00 72.40 H new ATOM 0 HG22 ILE A 85 18.134 -18.267 -13.195 1.00 72.40 H new ATOM 0 HG23 ILE A 85 17.516 -16.627 -13.507 1.00 72.40 H new ATOM 0 HD11 ILE A 85 20.630 -14.589 -15.618 1.00 21.43 H new ATOM 0 HD12 ILE A 85 21.265 -16.210 -15.249 1.00 21.43 H new ATOM 0 HD13 ILE A 85 19.571 -16.013 -15.758 1.00 21.43 H new ATOM 1468 N GLU A 86 21.547 -16.909 -10.438 1.00 75.33 N ATOM 1469 CA GLU A 86 22.829 -16.552 -9.843 1.00 33.35 C ATOM 1470 C GLU A 86 23.698 -15.791 -10.839 1.00 24.20 C ATOM 1471 O GLU A 86 24.606 -15.054 -10.453 1.00 2.12 O ATOM 1472 CB GLU A 86 23.561 -17.808 -9.364 1.00 42.43 C ATOM 1473 CG GLU A 86 24.859 -17.513 -8.631 1.00 12.24 C ATOM 1474 CD GLU A 86 24.883 -18.095 -7.231 1.00 14.13 C ATOM 1475 OE1 GLU A 86 24.184 -17.552 -6.350 1.00 11.03 O ATOM 1476 OE2 GLU A 86 25.601 -19.094 -7.017 1.00 35.34 O ATOM 0 H GLU A 86 21.336 -17.907 -10.419 1.00 75.33 H new ATOM 0 HA GLU A 86 22.636 -15.904 -8.988 1.00 33.35 H new ATOM 0 HB2 GLU A 86 22.902 -18.374 -8.705 1.00 42.43 H new ATOM 0 HB3 GLU A 86 23.775 -18.444 -10.223 1.00 42.43 H new ATOM 0 HG2 GLU A 86 25.695 -17.917 -9.203 1.00 12.24 H new ATOM 0 HG3 GLU A 86 25.003 -16.434 -8.575 1.00 12.24 H new ATOM 1483 N THR A 87 23.415 -15.976 -12.125 1.00 11.53 N ATOM 1484 CA THR A 87 24.171 -15.309 -13.177 1.00 40.13 C ATOM 1485 C THR A 87 23.882 -13.812 -13.199 1.00 33.34 C ATOM 1486 O THR A 87 24.559 -13.049 -13.888 1.00 75.31 O ATOM 1487 CB THR A 87 23.849 -15.902 -14.562 1.00 23.10 C ATOM 1488 OG1 THR A 87 22.838 -16.909 -14.441 1.00 1.32 O ATOM 1489 CG2 THR A 87 25.095 -16.502 -15.197 1.00 2.45 C ATOM 0 H THR A 87 22.668 -16.582 -12.462 1.00 11.53 H new ATOM 0 HA THR A 87 25.226 -15.469 -12.957 1.00 40.13 H new ATOM 0 HB THR A 87 23.486 -15.097 -15.201 1.00 23.10 H new ATOM 0 HG1 THR A 87 22.817 -17.451 -15.257 1.00 1.32 H new ATOM 0 HG21 THR A 87 24.843 -16.914 -16.174 1.00 2.45 H new ATOM 0 HG22 THR A 87 25.852 -15.727 -15.315 1.00 2.45 H new ATOM 0 HG23 THR A 87 25.483 -17.295 -14.558 1.00 2.45 H new ATOM 1497 N ASP A 88 22.873 -13.399 -12.439 1.00 42.23 N ATOM 1498 CA ASP A 88 22.495 -11.992 -12.370 1.00 4.14 C ATOM 1499 C ASP A 88 22.646 -11.459 -10.948 1.00 41.54 C ATOM 1500 O ASP A 88 22.284 -10.317 -10.662 1.00 1.10 O ATOM 1501 CB ASP A 88 21.055 -11.804 -12.848 1.00 71.40 C ATOM 1502 CG ASP A 88 20.039 -12.228 -11.806 1.00 31.43 C ATOM 1503 OD1 ASP A 88 19.975 -11.579 -10.741 1.00 43.12 O ATOM 1504 OD2 ASP A 88 19.308 -13.210 -12.054 1.00 71.31 O ATOM 0 H ASP A 88 22.303 -14.018 -11.863 1.00 42.23 H new ATOM 0 HA ASP A 88 23.162 -11.429 -13.023 1.00 4.14 H new ATOM 0 HB2 ASP A 88 20.894 -10.757 -13.103 1.00 71.40 H new ATOM 0 HB3 ASP A 88 20.899 -12.382 -13.759 1.00 71.40 H new ATOM 1509 N ILE A 89 23.181 -12.292 -10.063 1.00 22.03 N ATOM 1510 CA ILE A 89 23.379 -11.904 -8.672 1.00 3.12 C ATOM 1511 C ILE A 89 24.837 -12.071 -8.257 1.00 30.34 C ATOM 1512 O ILE A 89 25.358 -11.295 -7.456 1.00 31.14 O ATOM 1513 CB ILE A 89 22.489 -12.730 -7.725 1.00 2.05 C ATOM 1514 CG1 ILE A 89 21.029 -12.666 -8.176 1.00 52.32 C ATOM 1515 CG2 ILE A 89 22.630 -12.229 -6.295 1.00 33.32 C ATOM 1516 CD1 ILE A 89 20.384 -11.317 -7.945 1.00 73.14 C ATOM 0 H ILE A 89 23.485 -13.240 -10.284 1.00 22.03 H new ATOM 0 HA ILE A 89 23.100 -10.853 -8.595 1.00 3.12 H new ATOM 0 HB ILE A 89 22.814 -13.770 -7.759 1.00 2.05 H new ATOM 0 HG12 ILE A 89 20.974 -12.909 -9.237 1.00 52.32 H new ATOM 0 HG13 ILE A 89 20.459 -13.428 -7.644 1.00 52.32 H new ATOM 0 HG21 ILE A 89 21.995 -12.823 -5.637 1.00 33.32 H new ATOM 0 HG22 ILE A 89 23.669 -12.322 -5.978 1.00 33.32 H new ATOM 0 HG23 ILE A 89 22.328 -11.183 -6.244 1.00 33.32 H new ATOM 0 HD11 ILE A 89 19.350 -11.345 -8.288 1.00 73.14 H new ATOM 0 HD12 ILE A 89 20.407 -11.080 -6.881 1.00 73.14 H new ATOM 0 HD13 ILE A 89 20.930 -10.553 -8.499 1.00 73.14 H new ATOM 1528 N ARG A 90 25.490 -13.089 -8.808 1.00 45.43 N ATOM 1529 CA ARG A 90 26.889 -13.358 -8.496 1.00 11.22 C ATOM 1530 C ARG A 90 27.768 -12.169 -8.871 1.00 44.22 C ATOM 1531 O ARG A 90 28.490 -11.613 -8.043 1.00 12.23 O ATOM 1532 CB ARG A 90 27.366 -14.611 -9.232 1.00 31.21 C ATOM 1533 CG ARG A 90 28.849 -14.596 -9.562 1.00 44.12 C ATOM 1534 CD ARG A 90 29.390 -16.003 -9.763 1.00 30.13 C ATOM 1535 NE ARG A 90 29.209 -16.468 -11.135 1.00 64.51 N ATOM 1536 CZ ARG A 90 29.803 -17.549 -11.629 1.00 23.22 C ATOM 1537 NH1 ARG A 90 30.611 -18.272 -10.866 1.00 64.40 N ATOM 1538 NH2 ARG A 90 29.589 -17.909 -12.888 1.00 11.11 N ATOM 0 H ARG A 90 25.073 -13.741 -9.472 1.00 45.43 H new ATOM 0 HA ARG A 90 26.970 -13.523 -7.422 1.00 11.22 H new ATOM 0 HB2 ARG A 90 27.147 -15.486 -8.621 1.00 31.21 H new ATOM 0 HB3 ARG A 90 26.798 -14.718 -10.156 1.00 31.21 H new ATOM 0 HG2 ARG A 90 29.016 -14.009 -10.465 1.00 44.12 H new ATOM 0 HG3 ARG A 90 29.397 -14.106 -8.757 1.00 44.12 H new ATOM 0 HD2 ARG A 90 30.450 -16.023 -9.510 1.00 30.13 H new ATOM 0 HD3 ARG A 90 28.886 -16.686 -9.079 1.00 30.13 H new ATOM 0 HE ARG A 90 28.593 -15.934 -11.748 1.00 64.51 H new ATOM 0 HH11 ARG A 90 30.778 -17.999 -9.898 1.00 64.40 H new ATOM 0 HH12 ARG A 90 31.066 -19.101 -11.247 1.00 64.40 H new ATOM 0 HH21 ARG A 90 28.968 -17.356 -13.478 1.00 11.11 H new ATOM 0 HH22 ARG A 90 30.046 -18.739 -13.266 1.00 11.11 H new ATOM 1552 N PRO A 91 27.709 -11.769 -10.150 1.00 41.21 N ATOM 1553 CA PRO A 91 28.493 -10.642 -10.664 1.00 65.34 C ATOM 1554 C PRO A 91 28.009 -9.303 -10.121 1.00 3.53 C ATOM 1555 O PRO A 91 28.509 -8.247 -10.509 1.00 61.33 O ATOM 1556 CB PRO A 91 28.272 -10.717 -12.177 1.00 73.12 C ATOM 1557 CG PRO A 91 26.963 -11.411 -12.334 1.00 60.34 C ATOM 1558 CD PRO A 91 26.871 -12.385 -11.192 1.00 61.34 C ATOM 0 HA PRO A 91 29.540 -10.706 -10.368 1.00 65.34 H new ATOM 0 HB2 PRO A 91 28.249 -9.723 -12.624 1.00 73.12 H new ATOM 0 HB3 PRO A 91 29.074 -11.269 -12.668 1.00 73.12 H new ATOM 0 HG2 PRO A 91 26.138 -10.699 -12.307 1.00 60.34 H new ATOM 0 HG3 PRO A 91 26.907 -11.927 -13.292 1.00 60.34 H new ATOM 0 HD2 PRO A 91 25.842 -12.514 -10.856 1.00 61.34 H new ATOM 0 HD3 PRO A 91 27.240 -13.371 -11.474 1.00 61.34 H new ATOM 1566 N MET A 92 27.034 -9.353 -9.219 1.00 51.43 N ATOM 1567 CA MET A 92 26.484 -8.142 -8.621 1.00 52.31 C ATOM 1568 C MET A 92 27.055 -7.918 -7.224 1.00 53.34 C ATOM 1569 O MET A 92 27.277 -6.780 -6.809 1.00 3.41 O ATOM 1570 CB MET A 92 24.958 -8.229 -8.553 1.00 51.41 C ATOM 1571 CG MET A 92 24.256 -7.495 -9.685 1.00 5.14 C ATOM 1572 SD MET A 92 23.167 -6.185 -9.093 1.00 62.31 S ATOM 1573 CE MET A 92 21.639 -6.615 -9.923 1.00 64.12 C ATOM 0 H MET A 92 26.609 -10.218 -8.886 1.00 51.43 H new ATOM 0 HA MET A 92 26.765 -7.297 -9.249 1.00 52.31 H new ATOM 0 HB2 MET A 92 24.661 -9.278 -8.572 1.00 51.41 H new ATOM 0 HB3 MET A 92 24.621 -7.819 -7.601 1.00 51.41 H new ATOM 0 HG2 MET A 92 25.003 -7.067 -10.354 1.00 5.14 H new ATOM 0 HG3 MET A 92 23.675 -8.208 -10.270 1.00 5.14 H new ATOM 0 HE1 MET A 92 21.192 -5.717 -10.350 1.00 64.12 H new ATOM 0 HE2 MET A 92 21.846 -7.331 -10.719 1.00 64.12 H new ATOM 0 HE3 MET A 92 20.948 -7.059 -9.206 1.00 64.12 H new ATOM 1583 N LEU A 93 27.289 -9.009 -6.504 1.00 45.11 N ATOM 1584 CA LEU A 93 27.835 -8.931 -5.153 1.00 74.32 C ATOM 1585 C LEU A 93 29.237 -8.332 -5.165 1.00 51.55 C ATOM 1586 O LEU A 93 29.405 -7.129 -5.363 1.00 4.41 O ATOM 1587 CB LEU A 93 27.867 -10.321 -4.515 1.00 4.03 C ATOM 1588 CG LEU A 93 26.516 -11.017 -4.352 1.00 13.00 C ATOM 1589 CD1 LEU A 93 26.708 -12.462 -3.920 1.00 61.53 C ATOM 1590 CD2 LEU A 93 25.648 -10.270 -3.349 1.00 45.12 C ATOM 0 H LEU A 93 27.110 -9.958 -6.832 1.00 45.11 H new ATOM 0 HA LEU A 93 27.188 -8.281 -4.563 1.00 74.32 H new ATOM 0 HB2 LEU A 93 28.512 -10.960 -5.118 1.00 4.03 H new ATOM 0 HB3 LEU A 93 28.330 -10.237 -3.532 1.00 4.03 H new ATOM 0 HG LEU A 93 26.009 -11.012 -5.317 1.00 13.00 H new ATOM 0 HD11 LEU A 93 25.735 -12.941 -3.809 1.00 61.53 H new ATOM 0 HD12 LEU A 93 27.290 -12.993 -4.673 1.00 61.53 H new ATOM 0 HD13 LEU A 93 27.237 -12.490 -2.967 1.00 61.53 H new ATOM 0 HD21 LEU A 93 24.690 -10.780 -3.246 1.00 45.12 H new ATOM 0 HD22 LEU A 93 26.151 -10.243 -2.382 1.00 45.12 H new ATOM 0 HD23 LEU A 93 25.481 -9.252 -3.700 1.00 45.12 H new ATOM 1602 N GLN A 94 30.239 -9.179 -4.955 1.00 42.23 N ATOM 1603 CA GLN A 94 31.627 -8.732 -4.944 1.00 0.21 C ATOM 1604 C GLN A 94 32.537 -9.765 -5.601 1.00 0.45 C ATOM 1605 O GLN A 94 32.430 -10.961 -5.331 1.00 24.13 O ATOM 1606 CB GLN A 94 32.088 -8.467 -3.509 1.00 71.15 C ATOM 1607 CG GLN A 94 32.224 -6.990 -3.177 1.00 65.11 C ATOM 1608 CD GLN A 94 33.451 -6.692 -2.338 1.00 44.32 C ATOM 1609 OE1 GLN A 94 34.333 -5.938 -2.752 1.00 54.15 O ATOM 1610 NE2 GLN A 94 33.515 -7.283 -1.151 1.00 1.22 N ATOM 0 H GLN A 94 30.116 -10.178 -4.790 1.00 42.23 H new ATOM 0 HA GLN A 94 31.689 -7.806 -5.515 1.00 0.21 H new ATOM 0 HB2 GLN A 94 31.378 -8.922 -2.818 1.00 71.15 H new ATOM 0 HB3 GLN A 94 33.048 -8.957 -3.348 1.00 71.15 H new ATOM 0 HG2 GLN A 94 32.273 -6.416 -4.103 1.00 65.11 H new ATOM 0 HG3 GLN A 94 31.334 -6.658 -2.643 1.00 65.11 H new ATOM 0 HE21 GLN A 94 32.762 -7.900 -0.847 1.00 1.22 H new ATOM 0 HE22 GLN A 94 34.317 -7.120 -0.543 1.00 1.22 H new ATOM 1619 N ASP A 95 33.431 -9.294 -6.463 1.00 71.54 N ATOM 1620 CA ASP A 95 34.360 -10.177 -7.159 1.00 25.45 C ATOM 1621 C ASP A 95 35.317 -10.843 -6.174 1.00 44.51 C ATOM 1622 O ASP A 95 35.910 -11.879 -6.473 1.00 72.35 O ATOM 1623 CB ASP A 95 35.151 -9.396 -8.208 1.00 44.55 C ATOM 1624 CG ASP A 95 35.678 -10.285 -9.317 1.00 64.12 C ATOM 1625 OD1 ASP A 95 35.349 -11.490 -9.318 1.00 3.50 O ATOM 1626 OD2 ASP A 95 36.421 -9.777 -10.184 1.00 13.02 O ATOM 0 H ASP A 95 33.532 -8.306 -6.697 1.00 71.54 H new ATOM 0 HA ASP A 95 33.780 -10.954 -7.657 1.00 25.45 H new ATOM 0 HB2 ASP A 95 34.514 -8.623 -8.638 1.00 44.55 H new ATOM 0 HB3 ASP A 95 35.986 -8.889 -7.725 1.00 44.55 H new ATOM 1631 N ARG A 96 35.464 -10.238 -4.999 1.00 60.44 N ATOM 1632 CA ARG A 96 36.351 -10.771 -3.972 1.00 12.11 C ATOM 1633 C ARG A 96 35.558 -11.516 -2.902 1.00 73.55 C ATOM 1634 O ARG A 96 36.132 -12.096 -1.980 1.00 31.42 O ATOM 1635 CB ARG A 96 37.158 -9.641 -3.329 1.00 75.30 C ATOM 1636 CG ARG A 96 36.313 -8.444 -2.923 1.00 62.34 C ATOM 1637 CD ARG A 96 37.136 -7.412 -2.169 1.00 43.10 C ATOM 1638 NE ARG A 96 37.724 -7.964 -0.951 1.00 52.12 N ATOM 1639 CZ ARG A 96 38.566 -7.294 -0.172 1.00 55.22 C ATOM 1640 NH1 ARG A 96 38.916 -6.053 -0.482 1.00 63.43 N ATOM 1641 NH2 ARG A 96 39.058 -7.864 0.920 1.00 71.41 N ATOM 0 H ARG A 96 34.981 -9.379 -4.735 1.00 60.44 H new ATOM 0 HA ARG A 96 37.036 -11.473 -4.447 1.00 12.11 H new ATOM 0 HB2 ARG A 96 37.671 -10.028 -2.449 1.00 75.30 H new ATOM 0 HB3 ARG A 96 37.927 -9.312 -4.028 1.00 75.30 H new ATOM 0 HG2 ARG A 96 35.878 -7.986 -3.811 1.00 62.34 H new ATOM 0 HG3 ARG A 96 35.484 -8.777 -2.298 1.00 62.34 H new ATOM 0 HD2 ARG A 96 37.929 -7.037 -2.817 1.00 43.10 H new ATOM 0 HD3 ARG A 96 36.504 -6.561 -1.913 1.00 43.10 H new ATOM 0 HE ARG A 96 37.474 -8.916 -0.684 1.00 52.12 H new ATOM 0 HH11 ARG A 96 38.539 -5.611 -1.320 1.00 63.43 H new ATOM 0 HH12 ARG A 96 39.563 -5.541 0.118 1.00 63.43 H new ATOM 0 HH21 ARG A 96 38.790 -8.818 1.162 1.00 71.41 H new ATOM 0 HH22 ARG A 96 39.704 -7.349 1.517 1.00 71.41 H new ATOM 1655 N LEU A 97 34.236 -11.497 -3.032 1.00 51.43 N ATOM 1656 CA LEU A 97 33.363 -12.170 -2.077 1.00 61.30 C ATOM 1657 C LEU A 97 33.564 -13.681 -2.127 1.00 61.54 C ATOM 1658 O LEU A 97 33.285 -14.387 -1.158 1.00 72.43 O ATOM 1659 CB LEU A 97 31.900 -11.829 -2.364 1.00 71.15 C ATOM 1660 CG LEU A 97 30.901 -12.172 -1.259 1.00 0.55 C ATOM 1661 CD1 LEU A 97 31.329 -11.546 0.060 1.00 50.42 C ATOM 1662 CD2 LEU A 97 29.503 -11.710 -1.641 1.00 55.32 C ATOM 0 H LEU A 97 33.745 -11.023 -3.790 1.00 51.43 H new ATOM 0 HA LEU A 97 33.621 -11.820 -1.078 1.00 61.30 H new ATOM 0 HB2 LEU A 97 31.831 -10.761 -2.570 1.00 71.15 H new ATOM 0 HB3 LEU A 97 31.598 -12.349 -3.273 1.00 71.15 H new ATOM 0 HG LEU A 97 30.883 -13.255 -1.136 1.00 0.55 H new ATOM 0 HD11 LEU A 97 30.606 -11.801 0.835 1.00 50.42 H new ATOM 0 HD12 LEU A 97 32.311 -11.926 0.341 1.00 50.42 H new ATOM 0 HD13 LEU A 97 31.377 -10.463 -0.050 1.00 50.42 H new ATOM 0 HD21 LEU A 97 28.805 -11.963 -0.842 1.00 55.32 H new ATOM 0 HD22 LEU A 97 29.505 -10.631 -1.793 1.00 55.32 H new ATOM 0 HD23 LEU A 97 29.195 -12.205 -2.562 1.00 55.32 H new ATOM 1674 N ARG A 98 34.052 -14.171 -3.263 1.00 0.33 N ATOM 1675 CA ARG A 98 34.292 -15.598 -3.439 1.00 13.01 C ATOM 1676 C ARG A 98 32.975 -16.368 -3.487 1.00 64.34 C ATOM 1677 O ARG A 98 31.935 -15.897 -3.028 1.00 31.54 O ATOM 1678 CB ARG A 98 35.167 -16.134 -2.305 1.00 0.25 C ATOM 1679 CG ARG A 98 36.234 -15.154 -1.844 1.00 62.31 C ATOM 1680 CD ARG A 98 37.529 -15.868 -1.488 1.00 41.13 C ATOM 1681 NE ARG A 98 38.249 -16.321 -2.676 1.00 14.23 N ATOM 1682 CZ ARG A 98 39.275 -17.163 -2.636 1.00 70.14 C ATOM 1683 NH1 ARG A 98 39.700 -17.642 -1.475 1.00 52.12 N ATOM 1684 NH2 ARG A 98 39.878 -17.529 -3.760 1.00 44.42 N ATOM 0 H ARG A 98 34.289 -13.600 -4.075 1.00 0.33 H new ATOM 0 HA ARG A 98 34.811 -15.739 -4.387 1.00 13.01 H new ATOM 0 HB2 ARG A 98 34.532 -16.391 -1.458 1.00 0.25 H new ATOM 0 HB3 ARG A 98 35.649 -17.055 -2.633 1.00 0.25 H new ATOM 0 HG2 ARG A 98 36.424 -14.424 -2.631 1.00 62.31 H new ATOM 0 HG3 ARG A 98 35.872 -14.601 -0.977 1.00 62.31 H new ATOM 0 HD2 ARG A 98 38.166 -15.197 -0.912 1.00 41.13 H new ATOM 0 HD3 ARG A 98 37.308 -16.724 -0.850 1.00 41.13 H new ATOM 0 HE ARG A 98 37.947 -15.971 -3.585 1.00 14.23 H new ATOM 0 HH11 ARG A 98 39.239 -17.364 -0.609 1.00 52.12 H new ATOM 0 HH12 ARG A 98 40.488 -18.289 -1.448 1.00 52.12 H new ATOM 0 HH21 ARG A 98 39.553 -17.163 -4.655 1.00 44.42 H new ATOM 0 HH22 ARG A 98 40.666 -18.176 -3.729 1.00 44.42 H new ATOM 1698 N PRO A 99 33.020 -17.581 -4.058 1.00 20.41 N ATOM 1699 CA PRO A 99 31.840 -18.443 -4.180 1.00 41.42 C ATOM 1700 C PRO A 99 31.377 -18.986 -2.833 1.00 14.43 C ATOM 1701 O PRO A 99 31.507 -20.178 -2.555 1.00 3.41 O ATOM 1702 CB PRO A 99 32.325 -19.583 -5.078 1.00 61.51 C ATOM 1703 CG PRO A 99 33.800 -19.627 -4.872 1.00 31.11 C ATOM 1704 CD PRO A 99 34.226 -18.206 -4.627 1.00 40.12 C ATOM 0 HA PRO A 99 30.981 -17.904 -4.579 1.00 41.42 H new ATOM 0 HB2 PRO A 99 31.859 -20.529 -4.803 1.00 61.51 H new ATOM 0 HB3 PRO A 99 32.077 -19.397 -6.123 1.00 61.51 H new ATOM 0 HG2 PRO A 99 34.057 -20.263 -4.025 1.00 31.11 H new ATOM 0 HG3 PRO A 99 34.304 -20.040 -5.746 1.00 31.11 H new ATOM 0 HD2 PRO A 99 35.069 -18.152 -3.938 1.00 40.12 H new ATOM 0 HD3 PRO A 99 34.536 -17.715 -5.549 1.00 40.12 H new ATOM 1712 N SER A 100 30.834 -18.103 -1.999 1.00 63.53 N ATOM 1713 CA SER A 100 30.354 -18.494 -0.679 1.00 23.30 C ATOM 1714 C SER A 100 28.844 -18.713 -0.693 1.00 25.42 C ATOM 1715 O SER A 100 28.289 -19.344 0.207 1.00 71.54 O ATOM 1716 CB SER A 100 30.717 -17.427 0.355 1.00 14.33 C ATOM 1717 OG SER A 100 32.050 -16.980 0.181 1.00 0.31 O ATOM 0 H SER A 100 30.716 -17.113 -2.215 1.00 63.53 H new ATOM 0 HA SER A 100 30.837 -19.433 -0.407 1.00 23.30 H new ATOM 0 HB2 SER A 100 30.033 -16.583 0.267 1.00 14.33 H new ATOM 0 HB3 SER A 100 30.595 -17.833 1.359 1.00 14.33 H new ATOM 0 HG SER A 100 32.048 -16.119 -0.287 1.00 0.31 H new ATOM 1723 N PHE A 101 28.186 -18.187 -1.720 1.00 60.22 N ATOM 1724 CA PHE A 101 26.740 -18.323 -1.852 1.00 62.52 C ATOM 1725 C PHE A 101 26.316 -19.782 -1.707 1.00 71.04 C ATOM 1726 O PHE A 101 25.399 -20.101 -0.951 1.00 4.35 O ATOM 1727 CB PHE A 101 26.276 -17.778 -3.204 1.00 45.43 C ATOM 1728 CG PHE A 101 24.926 -17.121 -3.155 1.00 25.04 C ATOM 1729 CD1 PHE A 101 23.847 -17.770 -2.578 1.00 13.23 C ATOM 1730 CD2 PHE A 101 24.737 -15.855 -3.685 1.00 62.24 C ATOM 1731 CE1 PHE A 101 22.603 -17.168 -2.530 1.00 21.31 C ATOM 1732 CE2 PHE A 101 23.496 -15.249 -3.640 1.00 42.42 C ATOM 1733 CZ PHE A 101 22.428 -15.906 -3.063 1.00 34.41 C ATOM 0 H PHE A 101 28.631 -17.662 -2.473 1.00 60.22 H new ATOM 0 HA PHE A 101 26.272 -17.745 -1.055 1.00 62.52 H new ATOM 0 HB2 PHE A 101 27.009 -17.057 -3.567 1.00 45.43 H new ATOM 0 HB3 PHE A 101 26.248 -18.595 -3.925 1.00 45.43 H new ATOM 0 HD1 PHE A 101 23.979 -18.757 -2.161 1.00 13.23 H new ATOM 0 HD2 PHE A 101 25.569 -15.336 -4.138 1.00 62.24 H new ATOM 0 HE1 PHE A 101 21.770 -17.684 -2.076 1.00 21.31 H new ATOM 0 HE2 PHE A 101 23.362 -14.262 -4.056 1.00 42.42 H new ATOM 0 HZ PHE A 101 21.457 -15.434 -3.028 1.00 34.41 H new ATOM 1743 N ALA A 102 26.989 -20.663 -2.439 1.00 65.44 N ATOM 1744 CA ALA A 102 26.684 -22.088 -2.392 1.00 41.11 C ATOM 1745 C ALA A 102 26.741 -22.614 -0.962 1.00 61.41 C ATOM 1746 O ALA A 102 26.145 -23.644 -0.644 1.00 1.41 O ATOM 1747 CB ALA A 102 27.645 -22.863 -3.281 1.00 23.43 C ATOM 0 H ALA A 102 27.749 -20.415 -3.072 1.00 65.44 H new ATOM 0 HA ALA A 102 25.669 -22.230 -2.763 1.00 41.11 H new ATOM 0 HB1 ALA A 102 27.406 -23.925 -3.236 1.00 23.43 H new ATOM 0 HB2 ALA A 102 27.552 -22.513 -4.309 1.00 23.43 H new ATOM 0 HB3 ALA A 102 28.667 -22.706 -2.935 1.00 23.43 H new ATOM 1753 N LYS A 103 27.462 -21.902 -0.103 1.00 24.52 N ATOM 1754 CA LYS A 103 27.598 -22.297 1.294 1.00 15.14 C ATOM 1755 C LYS A 103 26.564 -21.587 2.163 1.00 53.14 C ATOM 1756 O LYS A 103 26.265 -22.026 3.273 1.00 73.24 O ATOM 1757 CB LYS A 103 29.007 -21.982 1.801 1.00 50.03 C ATOM 1758 CG LYS A 103 29.963 -23.159 1.709 1.00 1.42 C ATOM 1759 CD LYS A 103 30.228 -23.551 0.265 1.00 35.34 C ATOM 1760 CE LYS A 103 31.414 -24.496 0.153 1.00 31.52 C ATOM 1761 NZ LYS A 103 32.710 -23.782 0.322 1.00 72.41 N ATOM 0 H LYS A 103 27.962 -21.048 -0.350 1.00 24.52 H new ATOM 0 HA LYS A 103 27.427 -23.372 1.359 1.00 15.14 H new ATOM 0 HB2 LYS A 103 29.413 -21.149 1.227 1.00 50.03 H new ATOM 0 HB3 LYS A 103 28.946 -21.654 2.839 1.00 50.03 H new ATOM 0 HG2 LYS A 103 30.904 -22.903 2.196 1.00 1.42 H new ATOM 0 HG3 LYS A 103 29.546 -24.010 2.247 1.00 1.42 H new ATOM 0 HD2 LYS A 103 29.341 -24.028 -0.152 1.00 35.34 H new ATOM 0 HD3 LYS A 103 30.417 -22.656 -0.327 1.00 35.34 H new ATOM 0 HE2 LYS A 103 31.329 -25.277 0.908 1.00 31.52 H new ATOM 0 HE3 LYS A 103 31.395 -24.989 -0.819 1.00 31.52 H new ATOM 0 HZ1 LYS A 103 33.495 -24.439 0.139 1.00 72.41 H new ATOM 0 HZ2 LYS A 103 32.759 -22.988 -0.348 1.00 72.41 H new ATOM 0 HZ3 LYS A 103 32.782 -23.419 1.294 1.00 72.41 H new ATOM 1775 N ALA A 104 26.020 -20.488 1.649 1.00 63.32 N ATOM 1776 CA ALA A 104 25.017 -19.720 2.376 1.00 64.20 C ATOM 1777 C ALA A 104 23.608 -20.173 2.011 1.00 32.20 C ATOM 1778 O ALA A 104 22.648 -19.886 2.727 1.00 5.35 O ATOM 1779 CB ALA A 104 25.185 -18.234 2.096 1.00 63.12 C ATOM 0 H ALA A 104 26.257 -20.110 0.732 1.00 63.32 H new ATOM 0 HA ALA A 104 25.162 -19.896 3.442 1.00 64.20 H new ATOM 0 HB1 ALA A 104 24.429 -17.673 2.645 1.00 63.12 H new ATOM 0 HB2 ALA A 104 26.177 -17.914 2.414 1.00 63.12 H new ATOM 0 HB3 ALA A 104 25.069 -18.050 1.028 1.00 63.12 H new ATOM 1785 N ILE A 105 23.490 -20.882 0.893 1.00 10.32 N ATOM 1786 CA ILE A 105 22.197 -21.374 0.434 1.00 22.32 C ATOM 1787 C ILE A 105 21.419 -22.022 1.575 1.00 41.42 C ATOM 1788 O ILE A 105 20.264 -21.688 1.839 1.00 10.34 O ATOM 1789 CB ILE A 105 22.357 -22.395 -0.708 1.00 32.43 C ATOM 1790 CG1 ILE A 105 22.824 -21.695 -1.985 1.00 63.44 C ATOM 1791 CG2 ILE A 105 21.046 -23.130 -0.949 1.00 4.34 C ATOM 1792 CD1 ILE A 105 22.024 -20.457 -2.323 1.00 41.02 C ATOM 0 H ILE A 105 24.274 -21.128 0.289 1.00 10.32 H new ATOM 0 HA ILE A 105 21.644 -20.511 0.064 1.00 22.32 H new ATOM 0 HB ILE A 105 23.113 -23.126 -0.419 1.00 32.43 H new ATOM 0 HG12 ILE A 105 23.873 -21.421 -1.876 1.00 63.44 H new ATOM 0 HG13 ILE A 105 22.762 -22.396 -2.817 1.00 63.44 H new ATOM 0 HG21 ILE A 105 21.175 -23.848 -1.759 1.00 4.34 H new ATOM 0 HG22 ILE A 105 20.752 -23.656 -0.041 1.00 4.34 H new ATOM 0 HG23 ILE A 105 20.271 -22.413 -1.220 1.00 4.34 H new ATOM 0 HD11 ILE A 105 22.411 -20.013 -3.240 1.00 41.02 H new ATOM 0 HD12 ILE A 105 20.978 -20.727 -2.464 1.00 41.02 H new ATOM 0 HD13 ILE A 105 22.106 -19.737 -1.509 1.00 41.02 H new ATOM 1804 N PRO A 106 22.066 -22.970 2.269 1.00 10.52 N ATOM 1805 CA PRO A 106 21.455 -23.682 3.395 1.00 74.31 C ATOM 1806 C PRO A 106 21.260 -22.785 4.612 1.00 4.04 C ATOM 1807 O PRO A 106 20.326 -22.975 5.392 1.00 4.14 O ATOM 1808 CB PRO A 106 22.464 -24.791 3.703 1.00 2.22 C ATOM 1809 CG PRO A 106 23.767 -24.264 3.209 1.00 24.34 C ATOM 1810 CD PRO A 106 23.444 -23.418 2.009 1.00 22.21 C ATOM 0 HA PRO A 106 20.458 -24.050 3.152 1.00 74.31 H new ATOM 0 HB2 PRO A 106 22.503 -25.006 4.771 1.00 2.22 H new ATOM 0 HB3 PRO A 106 22.197 -25.721 3.201 1.00 2.22 H new ATOM 0 HG2 PRO A 106 24.267 -23.675 3.978 1.00 24.34 H new ATOM 0 HG3 PRO A 106 24.441 -25.078 2.942 1.00 24.34 H new ATOM 0 HD2 PRO A 106 24.129 -22.576 1.915 1.00 22.21 H new ATOM 0 HD3 PRO A 106 23.513 -23.990 1.084 1.00 22.21 H new ATOM 1818 N CYS A 107 22.147 -21.808 4.769 1.00 73.02 N ATOM 1819 CA CYS A 107 22.072 -20.881 5.892 1.00 4.05 C ATOM 1820 C CYS A 107 20.981 -19.840 5.667 1.00 1.30 C ATOM 1821 O CYS A 107 20.570 -19.144 6.597 1.00 73.31 O ATOM 1822 CB CYS A 107 23.420 -20.188 6.099 1.00 22.40 C ATOM 1823 SG CYS A 107 24.847 -21.289 5.946 1.00 52.20 S ATOM 0 H CYS A 107 22.926 -21.638 4.133 1.00 73.02 H new ATOM 0 HA CYS A 107 21.824 -21.453 6.786 1.00 4.05 H new ATOM 0 HB2 CYS A 107 23.517 -19.381 5.372 1.00 22.40 H new ATOM 0 HB3 CYS A 107 23.433 -19.729 7.088 1.00 22.40 H new ATOM 0 HG CYS A 107 25.072 -21.536 4.690 1.00 52.20 H new ATOM 1829 N LEU A 108 20.517 -19.736 4.427 1.00 51.03 N ATOM 1830 CA LEU A 108 19.474 -18.778 4.078 1.00 53.22 C ATOM 1831 C LEU A 108 18.098 -19.435 4.109 1.00 33.34 C ATOM 1832 O LEU A 108 17.103 -18.799 4.457 1.00 33.10 O ATOM 1833 CB LEU A 108 19.738 -18.188 2.691 1.00 22.52 C ATOM 1834 CG LEU A 108 20.449 -16.835 2.662 1.00 63.15 C ATOM 1835 CD1 LEU A 108 19.532 -15.738 3.179 1.00 34.52 C ATOM 1836 CD2 LEU A 108 21.732 -16.889 3.478 1.00 44.12 C ATOM 0 H LEU A 108 20.847 -20.303 3.646 1.00 51.03 H new ATOM 0 HA LEU A 108 19.491 -17.976 4.816 1.00 53.22 H new ATOM 0 HB2 LEU A 108 20.334 -18.901 2.122 1.00 22.52 H new ATOM 0 HB3 LEU A 108 18.784 -18.086 2.174 1.00 22.52 H new ATOM 0 HG LEU A 108 20.709 -16.605 1.629 1.00 63.15 H new ATOM 0 HD11 LEU A 108 20.056 -14.783 3.151 1.00 34.52 H new ATOM 0 HD12 LEU A 108 18.642 -15.683 2.552 1.00 34.52 H new ATOM 0 HD13 LEU A 108 19.240 -15.961 4.205 1.00 34.52 H new ATOM 0 HD21 LEU A 108 22.225 -15.917 3.446 1.00 44.12 H new ATOM 0 HD22 LEU A 108 21.496 -17.142 4.511 1.00 44.12 H new ATOM 0 HD23 LEU A 108 22.396 -17.646 3.062 1.00 44.12 H new ATOM 1848 N ARG A 109 18.050 -20.713 3.746 1.00 14.23 N ATOM 1849 CA ARG A 109 16.796 -21.457 3.734 1.00 11.11 C ATOM 1850 C ARG A 109 16.494 -22.036 5.113 1.00 21.31 C ATOM 1851 O ARG A 109 15.333 -22.201 5.488 1.00 11.35 O ATOM 1852 CB ARG A 109 16.856 -22.581 2.699 1.00 74.44 C ATOM 1853 CG ARG A 109 17.971 -23.583 2.951 1.00 75.10 C ATOM 1854 CD ARG A 109 18.363 -24.313 1.676 1.00 73.11 C ATOM 1855 NE ARG A 109 18.366 -25.763 1.854 1.00 53.41 N ATOM 1856 CZ ARG A 109 17.261 -26.499 1.906 1.00 3.12 C ATOM 1857 NH1 ARG A 109 16.072 -25.924 1.794 1.00 34.34 N ATOM 1858 NH2 ARG A 109 17.346 -27.813 2.070 1.00 14.13 N ATOM 0 H ARG A 109 18.865 -21.254 3.457 1.00 14.23 H new ATOM 0 HA ARG A 109 15.996 -20.767 3.466 1.00 11.11 H new ATOM 0 HB2 ARG A 109 15.901 -23.107 2.691 1.00 74.44 H new ATOM 0 HB3 ARG A 109 16.988 -22.145 1.709 1.00 74.44 H new ATOM 0 HG2 ARG A 109 18.840 -23.067 3.358 1.00 75.10 H new ATOM 0 HG3 ARG A 109 17.650 -24.306 3.701 1.00 75.10 H new ATOM 0 HD2 ARG A 109 17.669 -24.047 0.878 1.00 73.11 H new ATOM 0 HD3 ARG A 109 19.353 -23.985 1.360 1.00 73.11 H new ATOM 0 HE ARG A 109 19.265 -26.236 1.943 1.00 53.41 H new ATOM 0 HH11 ARG A 109 16.004 -24.914 1.668 1.00 34.34 H new ATOM 0 HH12 ARG A 109 15.225 -26.491 1.834 1.00 34.34 H new ATOM 0 HH21 ARG A 109 18.260 -28.258 2.156 1.00 14.13 H new ATOM 0 HH22 ARG A 109 16.498 -28.378 2.110 1.00 14.13 H new ATOM 1872 N HIS A 110 17.547 -22.345 5.863 1.00 4.52 N ATOM 1873 CA HIS A 110 17.395 -22.906 7.201 1.00 42.31 C ATOM 1874 C HIS A 110 16.549 -21.990 8.081 1.00 25.41 C ATOM 1875 O HIS A 110 15.976 -22.429 9.079 1.00 61.24 O ATOM 1876 CB HIS A 110 18.765 -23.127 7.843 1.00 1.20 C ATOM 1877 CG HIS A 110 18.692 -23.606 9.260 1.00 21.11 C ATOM 1878 ND1 HIS A 110 18.718 -22.755 10.345 1.00 52.03 N ATOM 1879 CD2 HIS A 110 18.592 -24.857 9.768 1.00 52.14 C ATOM 1880 CE1 HIS A 110 18.638 -23.462 11.458 1.00 3.40 C ATOM 1881 NE2 HIS A 110 18.560 -24.740 11.135 1.00 24.14 N ATOM 0 H HIS A 110 18.515 -22.216 5.567 1.00 4.52 H new ATOM 0 HA HIS A 110 16.886 -23.866 7.110 1.00 42.31 H new ATOM 0 HB2 HIS A 110 19.322 -23.853 7.251 1.00 1.20 H new ATOM 0 HB3 HIS A 110 19.326 -22.193 7.812 1.00 1.20 H new ATOM 0 HD2 HIS A 110 18.546 -25.776 9.203 1.00 52.14 H new ATOM 0 HE1 HIS A 110 18.637 -23.063 12.461 1.00 3.40 H new ATOM 0 HE2 HIS A 110 18.488 -25.515 11.795 1.00 24.14 H new ATOM 1889 N ILE A 111 16.477 -20.718 7.706 1.00 44.13 N ATOM 1890 CA ILE A 111 15.702 -19.742 8.461 1.00 53.11 C ATOM 1891 C ILE A 111 14.330 -19.524 7.831 1.00 0.13 C ATOM 1892 O ILE A 111 13.458 -18.889 8.424 1.00 53.32 O ATOM 1893 CB ILE A 111 16.433 -18.390 8.551 1.00 3.35 C ATOM 1894 CG1 ILE A 111 16.910 -17.949 7.166 1.00 61.31 C ATOM 1895 CG2 ILE A 111 17.606 -18.486 9.516 1.00 43.35 C ATOM 1896 CD1 ILE A 111 17.482 -16.549 7.141 1.00 61.25 C ATOM 0 H ILE A 111 16.946 -20.339 6.883 1.00 44.13 H new ATOM 0 HA ILE A 111 15.579 -20.146 9.466 1.00 53.11 H new ATOM 0 HB ILE A 111 15.736 -17.642 8.929 1.00 3.35 H new ATOM 0 HG12 ILE A 111 17.667 -18.648 6.812 1.00 61.31 H new ATOM 0 HG13 ILE A 111 16.074 -18.004 6.468 1.00 61.31 H new ATOM 0 HG21 ILE A 111 18.113 -17.523 9.569 1.00 43.35 H new ATOM 0 HG22 ILE A 111 17.241 -18.759 10.506 1.00 43.35 H new ATOM 0 HG23 ILE A 111 18.305 -19.245 9.165 1.00 43.35 H new ATOM 0 HD11 ILE A 111 17.800 -16.304 6.128 1.00 61.25 H new ATOM 0 HD12 ILE A 111 16.721 -15.839 7.464 1.00 61.25 H new ATOM 0 HD13 ILE A 111 18.338 -16.494 7.813 1.00 61.25 H new ATOM 1908 N ARG A 112 14.146 -20.056 6.628 1.00 61.54 N ATOM 1909 CA ARG A 112 12.880 -19.921 5.917 1.00 1.25 C ATOM 1910 C ARG A 112 12.697 -18.497 5.399 1.00 24.31 C ATOM 1911 O ARG A 112 11.724 -17.824 5.736 1.00 12.55 O ATOM 1912 CB ARG A 112 11.714 -20.295 6.834 1.00 0.33 C ATOM 1913 CG ARG A 112 11.959 -21.555 7.649 1.00 42.55 C ATOM 1914 CD ARG A 112 11.983 -21.258 9.140 1.00 74.21 C ATOM 1915 NE ARG A 112 11.409 -22.349 9.924 1.00 42.13 N ATOM 1916 CZ ARG A 112 11.150 -22.262 11.224 1.00 60.53 C ATOM 1917 NH1 ARG A 112 11.411 -21.142 11.882 1.00 3.40 N ATOM 1918 NH2 ARG A 112 10.628 -23.298 11.868 1.00 72.53 N ATOM 0 H ARG A 112 14.858 -20.585 6.124 1.00 61.54 H new ATOM 0 HA ARG A 112 12.896 -20.600 5.065 1.00 1.25 H new ATOM 0 HB2 ARG A 112 11.517 -19.466 7.513 1.00 0.33 H new ATOM 0 HB3 ARG A 112 10.817 -20.432 6.230 1.00 0.33 H new ATOM 0 HG2 ARG A 112 11.179 -22.286 7.435 1.00 42.55 H new ATOM 0 HG3 ARG A 112 12.907 -22.004 7.351 1.00 42.55 H new ATOM 0 HD2 ARG A 112 13.011 -21.084 9.459 1.00 74.21 H new ATOM 0 HD3 ARG A 112 11.429 -20.340 9.336 1.00 74.21 H new ATOM 0 HE ARG A 112 11.196 -23.225 9.447 1.00 42.13 H new ATOM 0 HH11 ARG A 112 11.812 -20.343 11.390 1.00 3.40 H new ATOM 0 HH12 ARG A 112 11.211 -21.078 12.880 1.00 3.40 H new ATOM 0 HH21 ARG A 112 10.425 -24.162 11.365 1.00 72.53 H new ATOM 0 HH22 ARG A 112 10.429 -23.231 12.866 1.00 72.53 H new ATOM 1932 N ARG A 113 13.640 -18.047 4.578 1.00 2.51 N ATOM 1933 CA ARG A 113 13.584 -16.703 4.015 1.00 61.03 C ATOM 1934 C ARG A 113 13.650 -16.749 2.491 1.00 73.31 C ATOM 1935 O ARG A 113 13.018 -15.943 1.808 1.00 13.20 O ATOM 1936 CB ARG A 113 14.731 -15.850 4.560 1.00 64.24 C ATOM 1937 CG ARG A 113 14.591 -15.512 6.035 1.00 44.12 C ATOM 1938 CD ARG A 113 15.385 -14.267 6.398 1.00 13.44 C ATOM 1939 NE ARG A 113 14.592 -13.049 6.246 1.00 25.22 N ATOM 1940 CZ ARG A 113 13.641 -12.681 7.096 1.00 13.44 C ATOM 1941 NH1 ARG A 113 13.365 -13.431 8.154 1.00 73.32 N ATOM 1942 NH2 ARG A 113 12.963 -11.559 6.890 1.00 42.50 N ATOM 0 H ARG A 113 14.451 -18.593 4.288 1.00 2.51 H new ATOM 0 HA ARG A 113 12.635 -16.253 4.307 1.00 61.03 H new ATOM 0 HB2 ARG A 113 15.671 -16.379 4.405 1.00 64.24 H new ATOM 0 HB3 ARG A 113 14.788 -14.924 3.988 1.00 64.24 H new ATOM 0 HG2 ARG A 113 13.539 -15.357 6.276 1.00 44.12 H new ATOM 0 HG3 ARG A 113 14.936 -16.353 6.637 1.00 44.12 H new ATOM 0 HD2 ARG A 113 15.734 -14.347 7.428 1.00 13.44 H new ATOM 0 HD3 ARG A 113 16.271 -14.204 5.766 1.00 13.44 H new ATOM 0 HE ARG A 113 14.779 -12.449 5.443 1.00 25.22 H new ATOM 0 HH11 ARG A 113 13.884 -14.294 8.317 1.00 73.32 H new ATOM 0 HH12 ARG A 113 12.634 -13.145 8.805 1.00 73.32 H new ATOM 0 HH21 ARG A 113 13.172 -10.978 6.078 1.00 42.50 H new ATOM 0 HH22 ARG A 113 12.232 -11.277 7.544 1.00 42.50 H new ATOM 1956 N ILE A 114 14.418 -17.697 1.966 1.00 63.35 N ATOM 1957 CA ILE A 114 14.566 -17.848 0.523 1.00 33.53 C ATOM 1958 C ILE A 114 14.630 -19.320 0.129 1.00 70.04 C ATOM 1959 O ILE A 114 14.726 -20.199 0.985 1.00 61.30 O ATOM 1960 CB ILE A 114 15.830 -17.135 0.009 1.00 53.24 C ATOM 1961 CG1 ILE A 114 17.073 -17.975 0.307 1.00 42.03 C ATOM 1962 CG2 ILE A 114 15.952 -15.755 0.638 1.00 25.32 C ATOM 1963 CD1 ILE A 114 17.514 -18.836 -0.856 1.00 74.23 C ATOM 0 H ILE A 114 14.948 -18.372 2.517 1.00 63.35 H new ATOM 0 HA ILE A 114 13.689 -17.389 0.066 1.00 33.53 H new ATOM 0 HB ILE A 114 15.748 -17.014 -1.071 1.00 53.24 H new ATOM 0 HG12 ILE A 114 17.891 -17.312 0.588 1.00 42.03 H new ATOM 0 HG13 ILE A 114 16.872 -18.615 1.166 1.00 42.03 H new ATOM 0 HG21 ILE A 114 16.850 -15.263 0.265 1.00 25.32 H new ATOM 0 HG22 ILE A 114 15.077 -15.158 0.379 1.00 25.32 H new ATOM 0 HG23 ILE A 114 16.016 -15.853 1.722 1.00 25.32 H new ATOM 0 HD11 ILE A 114 18.400 -19.404 -0.573 1.00 74.23 H new ATOM 0 HD12 ILE A 114 16.712 -19.524 -1.124 1.00 74.23 H new ATOM 0 HD13 ILE A 114 17.747 -18.201 -1.711 1.00 74.23 H new ATOM 1975 N ARG A 115 14.578 -19.581 -1.174 1.00 1.54 N ATOM 1976 CA ARG A 115 14.631 -20.946 -1.682 1.00 41.33 C ATOM 1977 C ARG A 115 15.508 -21.028 -2.928 1.00 40.14 C ATOM 1978 O ARG A 115 15.980 -20.010 -3.434 1.00 70.55 O ATOM 1979 CB ARG A 115 13.222 -21.448 -2.003 1.00 63.21 C ATOM 1980 CG ARG A 115 12.568 -22.200 -0.856 1.00 13.14 C ATOM 1981 CD ARG A 115 11.844 -23.444 -1.346 1.00 22.43 C ATOM 1982 NE ARG A 115 11.905 -24.532 -0.372 1.00 53.44 N ATOM 1983 CZ ARG A 115 11.197 -24.552 0.752 1.00 44.22 C ATOM 1984 NH1 ARG A 115 10.380 -23.549 1.043 1.00 71.33 N ATOM 1985 NH2 ARG A 115 11.307 -25.577 1.587 1.00 13.35 N ATOM 0 H ARG A 115 14.499 -18.865 -1.896 1.00 1.54 H new ATOM 0 HA ARG A 115 15.067 -21.579 -0.909 1.00 41.33 H new ATOM 0 HB2 ARG A 115 12.595 -20.598 -2.273 1.00 63.21 H new ATOM 0 HB3 ARG A 115 13.268 -22.100 -2.875 1.00 63.21 H new ATOM 0 HG2 ARG A 115 13.326 -22.483 -0.126 1.00 13.14 H new ATOM 0 HG3 ARG A 115 11.863 -21.545 -0.345 1.00 13.14 H new ATOM 0 HD2 ARG A 115 10.802 -23.200 -1.552 1.00 22.43 H new ATOM 0 HD3 ARG A 115 12.286 -23.774 -2.286 1.00 22.43 H new ATOM 0 HE ARG A 115 12.525 -25.319 -0.566 1.00 53.44 H new ATOM 0 HH11 ARG A 115 10.294 -22.759 0.403 1.00 71.33 H new ATOM 0 HH12 ARG A 115 9.838 -23.567 1.907 1.00 71.33 H new ATOM 0 HH21 ARG A 115 11.935 -26.350 1.366 1.00 13.35 H new ATOM 0 HH22 ARG A 115 10.763 -25.592 2.450 1.00 13.35 H new ATOM 1999 N GLU A 116 15.721 -22.246 -3.416 1.00 45.04 N ATOM 2000 CA GLU A 116 16.543 -22.460 -4.602 1.00 72.01 C ATOM 2001 C GLU A 116 16.032 -23.649 -5.410 1.00 72.15 C ATOM 2002 O GLU A 116 15.819 -24.734 -4.870 1.00 51.12 O ATOM 2003 CB GLU A 116 18.002 -22.689 -4.204 1.00 63.31 C ATOM 2004 CG GLU A 116 18.167 -23.555 -2.966 1.00 11.40 C ATOM 2005 CD GLU A 116 19.217 -24.634 -3.144 1.00 74.21 C ATOM 2006 OE1 GLU A 116 20.176 -24.409 -3.912 1.00 34.45 O ATOM 2007 OE2 GLU A 116 19.079 -25.704 -2.515 1.00 73.41 O ATOM 0 H GLU A 116 15.336 -23.099 -3.009 1.00 45.04 H new ATOM 0 HA GLU A 116 16.480 -21.566 -5.223 1.00 72.01 H new ATOM 0 HB2 GLU A 116 18.528 -23.156 -5.037 1.00 63.31 H new ATOM 0 HB3 GLU A 116 18.477 -21.724 -4.028 1.00 63.31 H new ATOM 0 HG2 GLU A 116 18.440 -22.924 -2.120 1.00 11.40 H new ATOM 0 HG3 GLU A 116 17.212 -24.020 -2.722 1.00 11.40 H new ATOM 2014 N GLU A 117 15.837 -23.435 -6.708 1.00 70.30 N ATOM 2015 CA GLU A 117 15.350 -24.489 -7.590 1.00 54.15 C ATOM 2016 C GLU A 117 16.420 -24.890 -8.601 1.00 71.43 C ATOM 2017 O GLU A 117 16.702 -24.155 -9.547 1.00 44.13 O ATOM 2018 CB GLU A 117 14.088 -24.028 -8.323 1.00 72.01 C ATOM 2019 CG GLU A 117 13.492 -25.088 -9.235 1.00 2.50 C ATOM 2020 CD GLU A 117 12.137 -25.573 -8.758 1.00 22.12 C ATOM 2021 OE1 GLU A 117 11.320 -24.730 -8.332 1.00 64.12 O ATOM 2022 OE2 GLU A 117 11.894 -26.797 -8.811 1.00 21.04 O ATOM 0 H GLU A 117 16.009 -22.543 -7.171 1.00 70.30 H new ATOM 0 HA GLU A 117 15.109 -25.358 -6.977 1.00 54.15 H new ATOM 0 HB2 GLU A 117 13.340 -23.730 -7.588 1.00 72.01 H new ATOM 0 HB3 GLU A 117 14.324 -23.143 -8.914 1.00 72.01 H new ATOM 0 HG2 GLU A 117 13.395 -24.682 -10.242 1.00 2.50 H new ATOM 0 HG3 GLU A 117 14.176 -25.935 -9.297 1.00 2.50 H new ATOM 2029 N ARG A 118 17.012 -26.062 -8.393 1.00 42.22 N ATOM 2030 CA ARG A 118 18.053 -26.561 -9.284 1.00 55.24 C ATOM 2031 C ARG A 118 17.443 -27.186 -10.535 1.00 73.44 C ATOM 2032 O ARG A 118 16.946 -28.313 -10.499 1.00 52.21 O ATOM 2033 CB ARG A 118 18.924 -27.589 -8.560 1.00 42.44 C ATOM 2034 CG ARG A 118 19.689 -28.507 -9.499 1.00 23.32 C ATOM 2035 CD ARG A 118 20.524 -27.717 -10.494 1.00 42.12 C ATOM 2036 NE ARG A 118 21.526 -26.887 -9.831 1.00 23.01 N ATOM 2037 CZ ARG A 118 22.613 -26.422 -10.436 1.00 64.45 C ATOM 2038 NH1 ARG A 118 22.837 -26.705 -11.712 1.00 43.34 N ATOM 2039 NH2 ARG A 118 23.479 -25.673 -9.766 1.00 21.23 N ATOM 0 H ARG A 118 16.789 -26.683 -7.616 1.00 42.22 H new ATOM 0 HA ARG A 118 18.674 -25.717 -9.586 1.00 55.24 H new ATOM 0 HB2 ARG A 118 19.634 -27.065 -7.920 1.00 42.44 H new ATOM 0 HB3 ARG A 118 18.293 -28.193 -7.909 1.00 42.44 H new ATOM 0 HG2 ARG A 118 20.337 -29.164 -8.919 1.00 23.32 H new ATOM 0 HG3 ARG A 118 18.988 -29.145 -10.037 1.00 23.32 H new ATOM 0 HD2 ARG A 118 21.019 -28.405 -11.179 1.00 42.12 H new ATOM 0 HD3 ARG A 118 19.870 -27.085 -11.095 1.00 42.12 H new ATOM 0 HE ARG A 118 21.383 -26.651 -8.849 1.00 23.01 H new ATOM 0 HH11 ARG A 118 22.174 -27.281 -12.231 1.00 43.34 H new ATOM 0 HH12 ARG A 118 23.672 -26.347 -12.175 1.00 43.34 H new ATOM 0 HH21 ARG A 118 23.311 -25.453 -8.784 1.00 21.23 H new ATOM 0 HH22 ARG A 118 24.313 -25.317 -10.233 1.00 21.23 H new ATOM 2053 N CYS A 119 17.484 -26.449 -11.639 1.00 52.24 N ATOM 2054 CA CYS A 119 16.934 -26.931 -12.902 1.00 0.53 C ATOM 2055 C CYS A 119 17.972 -26.843 -14.015 1.00 64.44 C ATOM 2056 O CYS A 119 18.138 -25.798 -14.643 1.00 25.31 O ATOM 2057 CB CYS A 119 15.692 -26.124 -13.282 1.00 13.32 C ATOM 2058 SG CYS A 119 14.162 -26.726 -12.530 1.00 13.24 S ATOM 0 H CYS A 119 17.892 -25.515 -11.686 1.00 52.24 H new ATOM 0 HA CYS A 119 16.654 -27.976 -12.773 1.00 0.53 H new ATOM 0 HB2 CYS A 119 15.844 -25.085 -12.990 1.00 13.32 H new ATOM 0 HB3 CYS A 119 15.581 -26.137 -14.366 1.00 13.32 H new ATOM 0 HG CYS A 119 14.339 -26.882 -11.252 1.00 13.24 H new ATOM 2064 N GLY A 120 18.671 -27.949 -14.254 1.00 72.35 N ATOM 2065 CA GLY A 120 19.686 -27.976 -15.291 1.00 72.13 C ATOM 2066 C GLY A 120 20.773 -26.944 -15.065 1.00 54.15 C ATOM 2067 O GLY A 120 21.099 -26.593 -13.931 1.00 40.35 O ATOM 0 H GLY A 120 18.552 -28.827 -13.748 1.00 72.35 H new ATOM 0 HA2 GLY A 120 20.134 -28.969 -15.331 1.00 72.13 H new ATOM 0 HA3 GLY A 120 19.217 -27.799 -16.259 1.00 72.13 H new ATOM 2071 N PRO A 121 21.354 -26.441 -16.165 1.00 1.14 N ATOM 2072 CA PRO A 121 22.420 -25.437 -16.107 1.00 42.50 C ATOM 2073 C PRO A 121 21.912 -24.078 -15.635 1.00 63.42 C ATOM 2074 O PRO A 121 22.308 -23.038 -16.163 1.00 60.34 O ATOM 2075 CB PRO A 121 22.906 -25.352 -17.556 1.00 43.31 C ATOM 2076 CG PRO A 121 21.739 -25.786 -18.373 1.00 53.33 C ATOM 2077 CD PRO A 121 21.015 -26.814 -17.548 1.00 40.33 C ATOM 0 HA PRO A 121 23.200 -25.711 -15.396 1.00 42.50 H new ATOM 0 HB2 PRO A 121 23.213 -24.338 -17.812 1.00 43.31 H new ATOM 0 HB3 PRO A 121 23.768 -25.998 -17.723 1.00 43.31 H new ATOM 0 HG2 PRO A 121 21.089 -24.942 -18.604 1.00 53.33 H new ATOM 0 HG3 PRO A 121 22.064 -26.207 -19.324 1.00 53.33 H new ATOM 0 HD2 PRO A 121 19.939 -26.783 -17.721 1.00 40.33 H new ATOM 0 HD3 PRO A 121 21.346 -27.825 -17.784 1.00 40.33 H new ATOM 2085 N LEU A 122 21.035 -24.094 -14.638 1.00 74.12 N ATOM 2086 CA LEU A 122 20.472 -22.863 -14.094 1.00 45.32 C ATOM 2087 C LEU A 122 20.123 -23.029 -12.619 1.00 4.23 C ATOM 2088 O LEU A 122 20.108 -24.143 -12.094 1.00 51.12 O ATOM 2089 CB LEU A 122 19.226 -22.456 -14.882 1.00 61.03 C ATOM 2090 CG LEU A 122 19.456 -22.044 -16.337 1.00 24.22 C ATOM 2091 CD1 LEU A 122 18.143 -22.032 -17.103 1.00 35.15 C ATOM 2092 CD2 LEU A 122 20.128 -20.680 -16.405 1.00 21.41 C ATOM 0 H LEU A 122 20.698 -24.946 -14.189 1.00 74.12 H new ATOM 0 HA LEU A 122 21.223 -22.079 -14.185 1.00 45.32 H new ATOM 0 HB2 LEU A 122 18.524 -23.289 -14.868 1.00 61.03 H new ATOM 0 HB3 LEU A 122 18.747 -21.627 -14.362 1.00 61.03 H new ATOM 0 HG LEU A 122 20.117 -22.776 -16.801 1.00 24.22 H new ATOM 0 HD11 LEU A 122 18.327 -21.737 -18.136 1.00 35.15 H new ATOM 0 HD12 LEU A 122 17.701 -23.028 -17.084 1.00 35.15 H new ATOM 0 HD13 LEU A 122 17.458 -21.322 -16.639 1.00 35.15 H new ATOM 0 HD21 LEU A 122 20.284 -20.403 -17.448 1.00 21.41 H new ATOM 0 HD22 LEU A 122 19.493 -19.937 -15.923 1.00 21.41 H new ATOM 0 HD23 LEU A 122 21.089 -20.722 -15.893 1.00 21.41 H new ATOM 2104 N THR A 123 19.841 -21.913 -11.953 1.00 42.13 N ATOM 2105 CA THR A 123 19.491 -21.934 -10.539 1.00 30.32 C ATOM 2106 C THR A 123 18.590 -20.759 -10.178 1.00 34.34 C ATOM 2107 O THR A 123 19.009 -19.603 -10.230 1.00 3.03 O ATOM 2108 CB THR A 123 20.747 -21.896 -9.648 1.00 43.43 C ATOM 2109 OG1 THR A 123 21.871 -22.421 -10.363 1.00 60.25 O ATOM 2110 CG2 THR A 123 20.532 -22.696 -8.373 1.00 74.41 C ATOM 0 H THR A 123 19.848 -20.983 -12.371 1.00 42.13 H new ATOM 0 HA THR A 123 18.956 -22.867 -10.360 1.00 30.32 H new ATOM 0 HB THR A 123 20.941 -20.858 -9.377 1.00 43.43 H new ATOM 0 HG1 THR A 123 22.666 -22.392 -9.790 1.00 60.25 H new ATOM 0 HG21 THR A 123 21.433 -22.654 -7.761 1.00 74.41 H new ATOM 0 HG22 THR A 123 19.695 -22.275 -7.816 1.00 74.41 H new ATOM 0 HG23 THR A 123 20.314 -23.733 -8.627 1.00 74.41 H new ATOM 2118 N PHE A 124 17.349 -21.062 -9.811 1.00 32.23 N ATOM 2119 CA PHE A 124 16.387 -20.030 -9.441 1.00 24.13 C ATOM 2120 C PHE A 124 16.344 -19.844 -7.927 1.00 25.32 C ATOM 2121 O PHE A 124 16.821 -20.693 -7.173 1.00 10.25 O ATOM 2122 CB PHE A 124 14.994 -20.391 -9.961 1.00 45.44 C ATOM 2123 CG PHE A 124 14.968 -20.717 -11.427 1.00 64.51 C ATOM 2124 CD1 PHE A 124 15.430 -21.941 -11.886 1.00 13.12 C ATOM 2125 CD2 PHE A 124 14.482 -19.802 -12.346 1.00 43.32 C ATOM 2126 CE1 PHE A 124 15.408 -22.244 -13.234 1.00 55.20 C ATOM 2127 CE2 PHE A 124 14.457 -20.099 -13.696 1.00 22.22 C ATOM 2128 CZ PHE A 124 14.920 -21.322 -14.140 1.00 74.40 C ATOM 0 H PHE A 124 16.986 -22.014 -9.762 1.00 32.23 H new ATOM 0 HA PHE A 124 16.706 -19.092 -9.896 1.00 24.13 H new ATOM 0 HB2 PHE A 124 14.616 -21.246 -9.400 1.00 45.44 H new ATOM 0 HB3 PHE A 124 14.316 -19.559 -9.770 1.00 45.44 H new ATOM 0 HD1 PHE A 124 15.811 -22.666 -11.182 1.00 13.12 H new ATOM 0 HD2 PHE A 124 14.118 -18.845 -12.004 1.00 43.32 H new ATOM 0 HE1 PHE A 124 15.772 -23.201 -13.579 1.00 55.20 H new ATOM 0 HE2 PHE A 124 14.076 -19.376 -14.402 1.00 22.22 H new ATOM 0 HZ PHE A 124 14.901 -21.557 -15.194 1.00 74.40 H new ATOM 2138 N TYR A 125 15.771 -18.729 -7.490 1.00 11.30 N ATOM 2139 CA TYR A 125 15.668 -18.429 -6.067 1.00 11.12 C ATOM 2140 C TYR A 125 14.440 -17.570 -5.778 1.00 64.23 C ATOM 2141 O TYR A 125 14.322 -16.450 -6.275 1.00 12.22 O ATOM 2142 CB TYR A 125 16.930 -17.713 -5.582 1.00 60.33 C ATOM 2143 CG TYR A 125 18.207 -18.459 -5.897 1.00 3.22 C ATOM 2144 CD1 TYR A 125 18.852 -18.288 -7.115 1.00 65.44 C ATOM 2145 CD2 TYR A 125 18.770 -19.333 -4.975 1.00 14.15 C ATOM 2146 CE1 TYR A 125 20.019 -18.968 -7.407 1.00 61.11 C ATOM 2147 CE2 TYR A 125 19.937 -20.016 -5.257 1.00 52.31 C ATOM 2148 CZ TYR A 125 20.558 -19.830 -6.475 1.00 35.32 C ATOM 2149 OH TYR A 125 21.720 -20.508 -6.761 1.00 64.21 O ATOM 0 H TYR A 125 15.370 -18.017 -8.101 1.00 11.30 H new ATOM 0 HA TYR A 125 15.564 -19.372 -5.530 1.00 11.12 H new ATOM 0 HB2 TYR A 125 16.975 -16.724 -6.038 1.00 60.33 H new ATOM 0 HB3 TYR A 125 16.862 -17.564 -4.504 1.00 60.33 H new ATOM 0 HD1 TYR A 125 18.434 -17.612 -7.846 1.00 65.44 H new ATOM 0 HD2 TYR A 125 18.286 -19.481 -4.021 1.00 14.15 H new ATOM 0 HE1 TYR A 125 20.506 -18.825 -8.360 1.00 61.11 H new ATOM 0 HE2 TYR A 125 20.361 -20.691 -4.529 1.00 52.31 H new ATOM 0 HH TYR A 125 21.965 -21.073 -5.999 1.00 64.21 H new ATOM 2159 N TYR A 126 13.530 -18.104 -4.972 1.00 13.11 N ATOM 2160 CA TYR A 126 12.310 -17.389 -4.617 1.00 54.44 C ATOM 2161 C TYR A 126 12.205 -17.206 -3.106 1.00 75.04 C ATOM 2162 O TYR A 126 12.798 -17.947 -2.323 1.00 32.52 O ATOM 2163 CB TYR A 126 11.083 -18.140 -5.138 1.00 63.30 C ATOM 2164 CG TYR A 126 11.301 -19.630 -5.280 1.00 2.22 C ATOM 2165 CD1 TYR A 126 11.868 -20.162 -6.431 1.00 63.13 C ATOM 2166 CD2 TYR A 126 10.939 -20.505 -4.263 1.00 43.22 C ATOM 2167 CE1 TYR A 126 12.069 -21.522 -6.566 1.00 33.32 C ATOM 2168 CE2 TYR A 126 11.137 -21.866 -4.388 1.00 63.24 C ATOM 2169 CZ TYR A 126 11.702 -22.370 -5.541 1.00 61.14 C ATOM 2170 OH TYR A 126 11.900 -23.726 -5.671 1.00 13.25 O ATOM 0 H TYR A 126 13.614 -19.030 -4.552 1.00 13.11 H new ATOM 0 HA TYR A 126 12.349 -16.404 -5.082 1.00 54.44 H new ATOM 0 HB2 TYR A 126 10.247 -17.966 -4.461 1.00 63.30 H new ATOM 0 HB3 TYR A 126 10.800 -17.729 -6.107 1.00 63.30 H new ATOM 0 HD1 TYR A 126 12.157 -19.501 -7.235 1.00 63.13 H new ATOM 0 HD2 TYR A 126 10.495 -20.114 -3.359 1.00 43.22 H new ATOM 0 HE1 TYR A 126 12.511 -21.919 -7.468 1.00 33.32 H new ATOM 0 HE2 TYR A 126 10.851 -22.532 -3.587 1.00 63.24 H new ATOM 0 HH TYR A 126 11.553 -24.026 -6.537 1.00 13.25 H new ATOM 2180 N PRO A 127 11.430 -16.195 -2.686 1.00 42.42 N ATOM 2181 CA PRO A 127 11.227 -15.890 -1.267 1.00 32.22 C ATOM 2182 C PRO A 127 10.392 -16.953 -0.560 1.00 11.51 C ATOM 2183 O PRO A 127 9.191 -16.779 -0.359 1.00 33.53 O ATOM 2184 CB PRO A 127 10.480 -14.554 -1.294 1.00 24.11 C ATOM 2185 CG PRO A 127 9.791 -14.532 -2.615 1.00 5.24 C ATOM 2186 CD PRO A 127 10.693 -15.271 -3.565 1.00 1.35 C ATOM 0 HA PRO A 127 12.168 -15.856 -0.719 1.00 32.22 H new ATOM 0 HB2 PRO A 127 9.766 -14.483 -0.474 1.00 24.11 H new ATOM 0 HB3 PRO A 127 11.167 -13.714 -1.192 1.00 24.11 H new ATOM 0 HG2 PRO A 127 8.813 -15.010 -2.553 1.00 5.24 H new ATOM 0 HG3 PRO A 127 9.625 -13.509 -2.951 1.00 5.24 H new ATOM 0 HD2 PRO A 127 10.124 -15.807 -4.325 1.00 1.35 H new ATOM 0 HD3 PRO A 127 11.366 -14.593 -4.090 1.00 1.35 H new ATOM 2194 N GLY A 128 11.037 -18.053 -0.184 1.00 40.14 N ATOM 2195 CA GLY A 128 10.338 -19.127 0.496 1.00 12.14 C ATOM 2196 C GLY A 128 9.043 -19.505 -0.195 1.00 33.24 C ATOM 2197 O GLY A 128 7.977 -18.993 0.147 1.00 74.04 O ATOM 0 H GLY A 128 12.031 -18.219 -0.338 1.00 40.14 H new ATOM 0 HA2 GLY A 128 10.986 -20.002 0.550 1.00 12.14 H new ATOM 0 HA3 GLY A 128 10.124 -18.825 1.521 1.00 12.14 H new