USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 140 MET CE :methyl 180:sc= -0.045 (180deg=-0.045) USER MOD Set 1.2: A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 MET CE :methyl -140:sc= -0.228 (180deg=-0.184) USER MOD Set 2.2: A 120 MET CE :methyl 155:sc= -1.2 (180deg=-1.43) USER MOD Set 3.1: A 103 HIS : no HD1:sc= 0.202 K(o=-0.05,f=-2.1) USER MOD Set 3.2: A 107 ASN : amide:sc= -0.252! K(o=-0.05!,f=-1.3) USER MOD Set 4.1: A 73 LYS NZ :NH3+ 162:sc= 1.19 (180deg=0.853) USER MOD Set 4.2: A 75 THR OG1 : rot -90:sc= 0.104 USER MOD Set 5.1: A 56 ASN : amide:sc= 0.553 K(o=0.86,f=-5.3!) USER MOD Set 5.2: A 58 THR OG1 : rot 10:sc= 0.302 USER MOD Set 6.1: A 32 MET CE :methyl 179:sc= -0.053 (180deg=-0.00026) USER MOD Set 6.2: A 47 MET CE :methyl 180:sc= -0.145 (180deg=-0.0956) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 9 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0101) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -44:sc= 1.28 USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.679 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 71:sc= 0.999 USER MOD Single : A 34 SER OG : rot 75:sc= 1.27 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot -63:sc= 0.976 USER MOD Single : A 45 GLN : amide:sc= 0.446 X(o=0.45,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0225 K(o=-0.022,f=-1.5) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl -100:sc= -0.239 (180deg=-0.429) USER MOD Single : A 68 MET CE :methyl 175:sc=-0.00128 (180deg=-0.0874) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -151:sc= -0.36 (180deg=-3.35!) USER MOD Single : A 77 SER OG : rot 62:sc= 1.21 USER MOD Single : A 90 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.418) USER MOD Single : A 93 ASN : amide:sc= -0.362 K(o=-0.36,f=-4.7!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -80:sc= 1.21 USER MOD Single : A 106 THR OG1 : rot 79:sc= 0.11 USER MOD Single : A 111 LYS NZ :NH3+ 159:sc= 1.27 (180deg=1.27) USER MOD Single : A 113 THR OG1 : rot -87:sc= 1.22 USER MOD Single : A 131 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 133 ASN : amide:sc= 0.898 K(o=0.9,f=-5.7!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 ARG N :NH3+ -158:sc= 0.974 (180deg=0.662) USER MOD Single : B 3 LYS NZ :NH3+ 137:sc= 1.09 (180deg=-0.236) USER MOD Single : B 5 GLN : amide:sc= -0.341 K(o=-0.34,f=-3.2!) USER MOD Single : B 6 LYS NZ :NH3+ 150:sc= 0.501 (180deg=-1.85!) USER MOD Single : B 7 THR OG1 : rot -150:sc=-0.00673 USER MOD Single : B 9 HIS : no HE2:sc= 0.825 K(o=0.82,f=-6.6!) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 1.229 2.763 15.786 1.00 0.00 N ATOM 30 CA GLU A 3 0.293 2.167 14.883 1.00 0.00 C ATOM 31 C GLU A 3 0.798 1.790 13.533 1.00 0.00 C ATOM 32 O GLU A 3 0.485 0.741 12.973 1.00 0.00 O ATOM 33 CB GLU A 3 -0.712 3.295 14.596 1.00 0.00 C ATOM 34 CG GLU A 3 -1.463 3.853 15.807 1.00 0.00 C ATOM 35 CD GLU A 3 -0.752 5.095 16.326 1.00 0.00 C ATOM 36 OE1 GLU A 3 -0.972 6.215 15.793 1.00 0.00 O ATOM 37 OE2 GLU A 3 -0.070 5.018 17.383 1.00 0.00 O ATOM 0 HA GLU A 3 -0.055 1.248 15.356 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.179 4.115 14.115 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.445 2.927 13.878 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -2.488 4.099 15.529 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.517 3.099 16.592 1.00 0.00 H new ATOM 44 N GLN A 4 1.580 2.717 12.952 1.00 0.00 N ATOM 45 CA GLN A 4 2.140 2.505 11.653 1.00 0.00 C ATOM 46 C GLN A 4 3.276 1.541 11.674 1.00 0.00 C ATOM 47 O GLN A 4 3.410 0.717 10.771 1.00 0.00 O ATOM 48 CB GLN A 4 2.586 3.831 11.013 1.00 0.00 C ATOM 49 CG GLN A 4 1.500 4.884 10.783 1.00 0.00 C ATOM 50 CD GLN A 4 2.176 6.180 10.358 1.00 0.00 C ATOM 51 OE1 GLN A 4 3.068 6.741 10.993 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.569 6.834 9.332 1.00 0.00 N ATOM 0 H GLN A 4 1.824 3.610 13.379 1.00 0.00 H new ATOM 0 HA GLN A 4 1.347 2.069 11.045 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.358 4.271 11.645 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.050 3.606 10.053 1.00 0.00 H new ATOM 0 HG2 GLN A 4 0.803 4.549 10.015 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.921 5.038 11.694 1.00 0.00 H new ATOM 0 HE21 GLN A 4 0.829 6.375 8.801 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.854 7.784 9.093 1.00 0.00 H new ATOM 61 N ILE A 5 4.103 1.546 12.735 1.00 0.00 N ATOM 62 CA ILE A 5 5.076 0.508 12.883 1.00 0.00 C ATOM 63 C ILE A 5 4.560 -0.890 12.858 1.00 0.00 C ATOM 64 O ILE A 5 5.126 -1.753 12.189 1.00 0.00 O ATOM 65 CB ILE A 5 5.891 0.725 14.124 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.504 2.133 14.202 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.952 -0.387 14.168 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.605 2.479 13.201 1.00 0.00 C ATOM 0 H ILE A 5 4.101 2.250 13.474 1.00 0.00 H new ATOM 0 HA ILE A 5 5.689 0.594 11.986 1.00 0.00 H new ATOM 0 HB ILE A 5 5.249 0.669 15.003 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.699 2.858 14.080 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.907 2.269 15.206 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.569 -0.266 15.058 1.00 0.00 H new ATOM 0 HG22 ILE A 5 6.459 -1.359 14.197 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.581 -0.325 13.280 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.944 3.501 13.372 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.442 1.793 13.329 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.216 2.390 12.187 1.00 0.00 H new ATOM 80 N ALA A 6 3.444 -1.131 13.569 1.00 0.00 N ATOM 81 CA ALA A 6 2.622 -2.300 13.529 1.00 0.00 C ATOM 82 C ALA A 6 2.142 -2.655 12.164 1.00 0.00 C ATOM 83 O ALA A 6 2.146 -3.822 11.774 1.00 0.00 O ATOM 84 CB ALA A 6 1.355 -2.144 14.388 1.00 0.00 C ATOM 0 H ALA A 6 3.086 -0.443 14.232 1.00 0.00 H new ATOM 0 HA ALA A 6 3.278 -3.083 13.909 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.760 -3.056 14.328 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.638 -1.963 15.425 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.767 -1.303 14.020 1.00 0.00 H new ATOM 90 N GLU A 7 1.719 -1.681 11.338 1.00 0.00 N ATOM 91 CA GLU A 7 1.034 -1.693 10.083 1.00 0.00 C ATOM 92 C GLU A 7 1.962 -1.890 8.934 1.00 0.00 C ATOM 93 O GLU A 7 1.572 -2.531 7.959 1.00 0.00 O ATOM 94 CB GLU A 7 0.110 -0.466 10.003 1.00 0.00 C ATOM 95 CG GLU A 7 -0.871 -0.386 8.831 1.00 0.00 C ATOM 96 CD GLU A 7 -1.995 0.629 8.978 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.695 0.488 10.016 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.321 1.432 8.063 1.00 0.00 O ATOM 0 H GLU A 7 1.895 -0.714 11.609 1.00 0.00 H new ATOM 0 HA GLU A 7 0.385 -2.566 10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.467 -0.421 10.926 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.738 0.425 9.976 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.310 -0.150 7.927 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.313 -1.371 8.684 1.00 0.00 H new ATOM 105 N PHE A 8 3.231 -1.506 9.160 1.00 0.00 N ATOM 106 CA PHE A 8 4.288 -1.848 8.261 1.00 0.00 C ATOM 107 C PHE A 8 4.763 -3.196 8.683 1.00 0.00 C ATOM 108 O PHE A 8 5.036 -3.998 7.792 1.00 0.00 O ATOM 109 CB PHE A 8 5.329 -0.721 8.363 1.00 0.00 C ATOM 110 CG PHE A 8 4.936 0.630 7.873 1.00 0.00 C ATOM 111 CD1 PHE A 8 3.835 0.977 7.126 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.706 1.651 8.377 1.00 0.00 C ATOM 113 CE1 PHE A 8 3.477 2.275 6.848 1.00 0.00 C ATOM 114 CE2 PHE A 8 5.392 2.972 8.160 1.00 0.00 C ATOM 115 CZ PHE A 8 4.278 3.245 7.402 1.00 0.00 C ATOM 0 H PHE A 8 3.525 -0.957 9.968 1.00 0.00 H new ATOM 0 HA PHE A 8 4.013 -1.921 7.209 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.620 -0.627 9.409 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.216 -1.033 7.812 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.215 0.184 6.735 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.582 1.409 8.960 1.00 0.00 H new ATOM 0 HE1 PHE A 8 2.622 2.517 6.234 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.998 3.766 8.570 1.00 0.00 H new ATOM 0 HZ PHE A 8 4.018 4.279 7.232 1.00 0.00 H new ATOM 125 N LYS A 9 4.843 -3.532 9.983 1.00 0.00 N ATOM 126 CA LYS A 9 5.334 -4.792 10.448 1.00 0.00 C ATOM 127 C LYS A 9 4.525 -5.941 9.954 1.00 0.00 C ATOM 128 O LYS A 9 5.111 -6.898 9.450 1.00 0.00 O ATOM 129 CB LYS A 9 5.640 -4.881 11.953 1.00 0.00 C ATOM 130 CG LYS A 9 6.649 -5.966 12.333 1.00 0.00 C ATOM 131 CD LYS A 9 6.875 -5.906 13.845 1.00 0.00 C ATOM 132 CE LYS A 9 8.224 -6.415 14.356 1.00 0.00 C ATOM 133 NZ LYS A 9 8.411 -7.828 13.956 1.00 0.00 N ATOM 0 H LYS A 9 4.556 -2.906 10.735 1.00 0.00 H new ATOM 0 HA LYS A 9 6.319 -4.866 9.987 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.018 -3.916 12.291 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.709 -5.064 12.490 1.00 0.00 H new ATOM 0 HG2 LYS A 9 6.276 -6.949 12.044 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.589 -5.813 11.803 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.757 -4.871 14.166 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.087 -6.482 14.330 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.031 -5.803 13.952 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.269 -6.326 15.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.297 -8.190 14.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.613 -8.396 14.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.455 -7.892 12.919 1.00 0.00 H new ATOM 147 N GLU A 10 3.183 -5.856 9.954 1.00 0.00 N ATOM 148 CA GLU A 10 2.310 -6.821 9.361 1.00 0.00 C ATOM 149 C GLU A 10 2.425 -6.956 7.882 1.00 0.00 C ATOM 150 O GLU A 10 2.265 -8.023 7.292 1.00 0.00 O ATOM 151 CB GLU A 10 0.868 -6.423 9.720 1.00 0.00 C ATOM 152 CG GLU A 10 0.606 -6.609 11.216 1.00 0.00 C ATOM 153 CD GLU A 10 0.273 -8.025 11.663 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.926 -8.410 11.675 1.00 0.00 O ATOM 155 OE2 GLU A 10 1.206 -8.709 12.163 1.00 0.00 O ATOM 0 H GLU A 10 2.684 -5.079 10.387 1.00 0.00 H new ATOM 0 HA GLU A 10 2.598 -7.794 9.759 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.694 -5.383 9.443 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.166 -7.028 9.146 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.487 -6.274 11.764 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.217 -5.955 11.505 1.00 0.00 H new ATOM 162 N ALA A 11 2.814 -5.924 7.112 1.00 0.00 N ATOM 163 CA ALA A 11 3.052 -6.038 5.707 1.00 0.00 C ATOM 164 C ALA A 11 4.339 -6.677 5.312 1.00 0.00 C ATOM 165 O ALA A 11 4.412 -7.469 4.373 1.00 0.00 O ATOM 166 CB ALA A 11 3.239 -4.614 5.158 1.00 0.00 C ATOM 0 H ALA A 11 2.967 -4.984 7.477 1.00 0.00 H new ATOM 0 HA ALA A 11 2.214 -6.629 5.338 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.424 -4.659 4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.338 -4.030 5.347 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.088 -4.142 5.653 1.00 0.00 H new ATOM 172 N PHE A 12 5.335 -6.458 6.189 1.00 0.00 N ATOM 173 CA PHE A 12 6.620 -7.083 6.138 1.00 0.00 C ATOM 174 C PHE A 12 6.593 -8.567 6.262 1.00 0.00 C ATOM 175 O PHE A 12 7.434 -9.289 5.728 1.00 0.00 O ATOM 176 CB PHE A 12 7.529 -6.447 7.204 1.00 0.00 C ATOM 177 CG PHE A 12 8.972 -6.679 6.915 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.679 -6.031 5.930 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.635 -7.529 7.768 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.021 -6.247 5.721 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.975 -7.760 7.561 1.00 0.00 C ATOM 182 CZ PHE A 12 11.671 -7.117 6.564 1.00 0.00 C ATOM 0 H PHE A 12 5.239 -5.812 6.973 1.00 0.00 H new ATOM 0 HA PHE A 12 7.021 -6.904 5.140 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.336 -5.375 7.253 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.284 -6.860 8.183 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.161 -5.326 5.297 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.114 -8.006 8.585 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.547 -5.749 4.920 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.493 -8.463 8.196 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.729 -7.296 6.443 1.00 0.00 H new ATOM 192 N SER A 13 5.629 -8.987 7.100 1.00 0.00 N ATOM 193 CA SER A 13 5.341 -10.305 7.575 1.00 0.00 C ATOM 194 C SER A 13 4.816 -11.190 6.498 1.00 0.00 C ATOM 195 O SER A 13 4.918 -12.416 6.504 1.00 0.00 O ATOM 196 CB SER A 13 4.278 -10.198 8.682 1.00 0.00 C ATOM 197 OG SER A 13 4.020 -11.457 9.285 1.00 0.00 O ATOM 0 H SER A 13 4.970 -8.314 7.492 1.00 0.00 H new ATOM 0 HA SER A 13 6.269 -10.742 7.945 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.614 -9.492 9.442 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.354 -9.799 8.262 1.00 0.00 H new ATOM 0 HG SER A 13 3.342 -11.352 9.984 1.00 0.00 H new ATOM 203 N LEU A 14 4.215 -10.628 5.433 1.00 0.00 N ATOM 204 CA LEU A 14 3.705 -11.344 4.305 1.00 0.00 C ATOM 205 C LEU A 14 4.900 -11.626 3.461 1.00 0.00 C ATOM 206 O LEU A 14 4.945 -12.747 2.958 1.00 0.00 O ATOM 207 CB LEU A 14 2.519 -10.656 3.607 1.00 0.00 C ATOM 208 CG LEU A 14 1.313 -10.517 4.551 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.155 -9.824 3.812 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.768 -11.902 4.939 1.00 0.00 C ATOM 0 H LEU A 14 4.078 -9.620 5.356 1.00 0.00 H new ATOM 0 HA LEU A 14 3.226 -12.281 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.824 -9.670 3.257 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.230 -11.231 2.727 1.00 0.00 H new ATOM 0 HG LEU A 14 1.648 -9.957 5.424 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.698 -9.727 4.483 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.473 -8.835 3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.131 -10.419 2.945 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.085 -11.783 5.607 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.454 -12.434 4.041 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.548 -12.472 5.444 1.00 0.00 H new ATOM 222 N PHE A 15 5.846 -10.686 3.281 1.00 0.00 N ATOM 223 CA PHE A 15 6.958 -10.984 2.432 1.00 0.00 C ATOM 224 C PHE A 15 7.975 -11.888 3.039 1.00 0.00 C ATOM 225 O PHE A 15 8.665 -12.613 2.324 1.00 0.00 O ATOM 226 CB PHE A 15 7.746 -9.668 2.319 1.00 0.00 C ATOM 227 CG PHE A 15 7.050 -8.626 1.513 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.992 -8.905 0.167 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.586 -7.457 2.067 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.209 -8.070 -0.594 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.956 -6.571 1.225 1.00 0.00 C ATOM 232 CZ PHE A 15 5.748 -6.872 -0.100 1.00 0.00 C ATOM 0 H PHE A 15 5.846 -9.757 3.703 1.00 0.00 H new ATOM 0 HA PHE A 15 6.550 -11.431 1.525 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.932 -9.278 3.320 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.718 -9.873 1.871 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.531 -9.734 -0.267 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.711 -7.243 3.118 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.950 -8.361 -1.601 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.618 -5.621 1.612 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.230 -6.177 -0.744 1.00 0.00 H new ATOM 242 N ASP A 16 8.100 -11.938 4.377 1.00 0.00 N ATOM 243 CA ASP A 16 9.072 -12.763 5.024 1.00 0.00 C ATOM 244 C ASP A 16 8.520 -14.134 5.215 1.00 0.00 C ATOM 245 O ASP A 16 7.764 -14.296 6.171 1.00 0.00 O ATOM 246 CB ASP A 16 9.630 -12.104 6.297 1.00 0.00 C ATOM 247 CG ASP A 16 10.788 -12.847 6.947 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.410 -13.756 6.334 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.103 -12.520 8.122 1.00 0.00 O ATOM 0 H ASP A 16 7.519 -11.399 5.019 1.00 0.00 H new ATOM 0 HA ASP A 16 9.947 -12.872 4.383 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.957 -11.093 6.052 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.823 -12.011 7.024 1.00 0.00 H new ATOM 254 N LYS A 17 9.086 -15.145 4.532 1.00 0.00 N ATOM 255 CA LYS A 17 8.705 -16.522 4.487 1.00 0.00 C ATOM 256 C LYS A 17 9.152 -17.226 5.722 1.00 0.00 C ATOM 257 O LYS A 17 8.371 -17.940 6.350 1.00 0.00 O ATOM 258 CB LYS A 17 9.281 -17.171 3.217 1.00 0.00 C ATOM 259 CG LYS A 17 8.646 -16.675 1.917 1.00 0.00 C ATOM 260 CD LYS A 17 7.336 -17.347 1.500 1.00 0.00 C ATOM 261 CE LYS A 17 6.493 -16.519 0.528 1.00 0.00 C ATOM 262 NZ LYS A 17 5.150 -17.111 0.336 1.00 0.00 N ATOM 0 H LYS A 17 9.903 -14.974 3.946 1.00 0.00 H new ATOM 0 HA LYS A 17 7.619 -16.602 4.447 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.354 -16.981 3.180 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.150 -18.251 3.283 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.466 -15.604 2.012 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.369 -16.806 1.112 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.563 -18.308 1.039 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.745 -17.553 2.393 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.393 -15.502 0.907 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.003 -16.453 -0.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.604 -16.526 -0.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.246 -18.073 -0.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.655 -17.151 1.250 1.00 0.00 H new ATOM 276 N ASP A 18 10.431 -17.020 6.082 1.00 0.00 N ATOM 277 CA ASP A 18 11.050 -17.533 7.265 1.00 0.00 C ATOM 278 C ASP A 18 10.507 -17.029 8.558 1.00 0.00 C ATOM 279 O ASP A 18 9.883 -17.777 9.309 1.00 0.00 O ATOM 280 CB ASP A 18 12.554 -17.214 7.263 1.00 0.00 C ATOM 281 CG ASP A 18 13.263 -17.690 6.002 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.300 -18.935 5.810 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.797 -16.817 5.268 1.00 0.00 O ATOM 0 H ASP A 18 11.070 -16.463 5.514 1.00 0.00 H new ATOM 0 HA ASP A 18 10.836 -18.601 7.219 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.691 -16.138 7.366 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.019 -17.679 8.132 1.00 0.00 H new ATOM 288 N GLY A 19 10.681 -15.714 8.780 1.00 0.00 N ATOM 289 CA GLY A 19 10.422 -15.124 10.056 1.00 0.00 C ATOM 290 C GLY A 19 11.661 -14.553 10.655 1.00 0.00 C ATOM 291 O GLY A 19 11.719 -14.428 11.878 1.00 0.00 O ATOM 0 H GLY A 19 11.003 -15.056 8.071 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.673 -14.339 9.950 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.005 -15.875 10.727 1.00 0.00 H new ATOM 295 N ASP A 20 12.710 -14.160 9.911 1.00 0.00 N ATOM 296 CA ASP A 20 13.919 -13.636 10.467 1.00 0.00 C ATOM 297 C ASP A 20 13.885 -12.156 10.629 1.00 0.00 C ATOM 298 O ASP A 20 14.343 -11.604 11.628 1.00 0.00 O ATOM 299 CB ASP A 20 15.136 -14.166 9.689 1.00 0.00 C ATOM 300 CG ASP A 20 15.018 -13.774 8.223 1.00 0.00 C ATOM 301 OD1 ASP A 20 13.993 -14.143 7.590 1.00 0.00 O ATOM 302 OD2 ASP A 20 15.914 -13.058 7.701 1.00 0.00 O ATOM 0 H ASP A 20 12.718 -14.208 8.892 1.00 0.00 H new ATOM 0 HA ASP A 20 14.019 -14.004 11.488 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.055 -13.759 10.111 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.195 -15.250 9.782 1.00 0.00 H new ATOM 307 N GLY A 21 13.133 -11.524 9.710 1.00 0.00 N ATOM 308 CA GLY A 21 13.198 -10.105 9.550 1.00 0.00 C ATOM 309 C GLY A 21 13.941 -9.556 8.381 1.00 0.00 C ATOM 310 O GLY A 21 14.147 -8.345 8.315 1.00 0.00 O ATOM 0 H GLY A 21 12.482 -11.994 9.080 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.176 -9.730 9.499 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.646 -9.690 10.453 1.00 0.00 H new ATOM 314 N THR A 22 14.350 -10.416 7.432 1.00 0.00 N ATOM 315 CA THR A 22 14.797 -9.999 6.139 1.00 0.00 C ATOM 316 C THR A 22 14.041 -10.626 5.018 1.00 0.00 C ATOM 317 O THR A 22 13.572 -11.760 5.091 1.00 0.00 O ATOM 318 CB THR A 22 16.253 -10.186 5.832 1.00 0.00 C ATOM 319 OG1 THR A 22 16.612 -11.555 5.721 1.00 0.00 O ATOM 320 CG2 THR A 22 17.042 -9.514 6.969 1.00 0.00 C ATOM 0 H THR A 22 14.371 -11.427 7.566 1.00 0.00 H new ATOM 0 HA THR A 22 14.604 -8.928 6.207 1.00 0.00 H new ATOM 0 HB THR A 22 16.482 -9.736 4.866 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.198 -12.062 6.451 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.111 -9.626 6.786 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.790 -8.454 7.010 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.785 -9.985 7.918 1.00 0.00 H new ATOM 328 N ILE A 23 13.959 -9.892 3.894 1.00 0.00 N ATOM 329 CA ILE A 23 13.399 -10.268 2.633 1.00 0.00 C ATOM 330 C ILE A 23 14.532 -10.514 1.698 1.00 0.00 C ATOM 331 O ILE A 23 15.238 -9.593 1.290 1.00 0.00 O ATOM 332 CB ILE A 23 12.490 -9.201 2.099 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.432 -8.733 3.113 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.928 -9.608 0.726 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.501 -7.635 2.600 1.00 0.00 C ATOM 0 H ILE A 23 14.322 -8.939 3.869 1.00 0.00 H new ATOM 0 HA ILE A 23 12.792 -11.166 2.746 1.00 0.00 H new ATOM 0 HB ILE A 23 13.087 -8.304 1.935 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.830 -9.591 3.412 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.940 -8.372 4.008 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.271 -8.822 0.354 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.750 -9.755 0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.364 -10.536 0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.789 -7.368 3.381 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.088 -6.758 2.329 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.961 -7.995 1.724 1.00 0.00 H new ATOM 347 N THR A 24 14.664 -11.800 1.326 1.00 0.00 N ATOM 348 CA THR A 24 15.450 -12.241 0.216 1.00 0.00 C ATOM 349 C THR A 24 14.910 -12.124 -1.168 1.00 0.00 C ATOM 350 O THR A 24 13.728 -11.829 -1.340 1.00 0.00 O ATOM 351 CB THR A 24 16.021 -13.622 0.346 1.00 0.00 C ATOM 352 OG1 THR A 24 15.109 -14.710 0.334 1.00 0.00 O ATOM 353 CG2 THR A 24 16.898 -13.718 1.606 1.00 0.00 C ATOM 0 H THR A 24 14.203 -12.564 1.820 1.00 0.00 H new ATOM 0 HA THR A 24 16.216 -11.472 0.311 1.00 0.00 H new ATOM 0 HB THR A 24 16.596 -13.739 -0.573 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.603 -15.552 0.424 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.307 -14.725 1.689 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.715 -13.000 1.536 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.295 -13.497 2.487 1.00 0.00 H new ATOM 361 N THR A 25 15.735 -12.406 -2.191 1.00 0.00 N ATOM 362 CA THR A 25 15.300 -12.526 -3.548 1.00 0.00 C ATOM 363 C THR A 25 14.388 -13.694 -3.697 1.00 0.00 C ATOM 364 O THR A 25 13.377 -13.548 -4.383 1.00 0.00 O ATOM 365 CB THR A 25 16.386 -12.689 -4.570 1.00 0.00 C ATOM 366 OG1 THR A 25 17.250 -13.768 -4.243 1.00 0.00 O ATOM 367 CG2 THR A 25 17.188 -11.399 -4.809 1.00 0.00 C ATOM 0 H THR A 25 16.737 -12.555 -2.071 1.00 0.00 H new ATOM 0 HA THR A 25 14.810 -11.573 -3.746 1.00 0.00 H new ATOM 0 HB THR A 25 15.882 -12.922 -5.508 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.946 -13.849 -4.929 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.958 -11.583 -5.558 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.518 -10.614 -5.161 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.657 -11.084 -3.877 1.00 0.00 H new ATOM 375 N LYS A 26 14.693 -14.851 -3.083 1.00 0.00 N ATOM 376 CA LYS A 26 13.990 -16.095 -3.131 1.00 0.00 C ATOM 377 C LYS A 26 12.590 -15.892 -2.665 1.00 0.00 C ATOM 378 O LYS A 26 11.591 -16.456 -3.110 1.00 0.00 O ATOM 379 CB LYS A 26 14.628 -17.180 -2.247 1.00 0.00 C ATOM 380 CG LYS A 26 15.827 -17.851 -2.919 1.00 0.00 C ATOM 381 CD LYS A 26 16.479 -18.731 -1.851 1.00 0.00 C ATOM 382 CE LYS A 26 17.664 -19.594 -2.291 1.00 0.00 C ATOM 383 NZ LYS A 26 18.857 -18.800 -2.659 1.00 0.00 N ATOM 0 H LYS A 26 15.521 -14.919 -2.491 1.00 0.00 H new ATOM 0 HA LYS A 26 14.028 -16.433 -4.166 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.946 -16.736 -1.304 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.880 -17.936 -2.007 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.510 -18.448 -3.774 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.530 -17.107 -3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.813 -18.086 -1.038 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.714 -19.390 -1.441 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.926 -20.279 -1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.364 -20.204 -3.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.624 -19.440 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.621 -18.164 -3.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 19.165 -18.237 -1.841 1.00 0.00 H new ATOM 397 N GLU A 27 12.362 -15.091 -1.609 1.00 0.00 N ATOM 398 CA GLU A 27 11.119 -14.884 -0.932 1.00 0.00 C ATOM 399 C GLU A 27 10.186 -13.936 -1.603 1.00 0.00 C ATOM 400 O GLU A 27 8.983 -14.187 -1.547 1.00 0.00 O ATOM 401 CB GLU A 27 11.391 -14.294 0.462 1.00 0.00 C ATOM 402 CG GLU A 27 12.159 -15.264 1.361 1.00 0.00 C ATOM 403 CD GLU A 27 12.531 -14.594 2.676 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.522 -13.832 2.830 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.929 -15.066 3.678 1.00 0.00 O ATOM 0 H GLU A 27 13.114 -14.541 -1.194 1.00 0.00 H new ATOM 0 HA GLU A 27 10.648 -15.867 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.960 -13.370 0.359 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.444 -14.035 0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.551 -16.147 1.556 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.061 -15.604 0.852 1.00 0.00 H new ATOM 412 N LEU A 28 10.746 -12.855 -2.176 1.00 0.00 N ATOM 413 CA LEU A 28 10.066 -11.776 -2.823 1.00 0.00 C ATOM 414 C LEU A 28 9.637 -12.239 -4.173 1.00 0.00 C ATOM 415 O LEU A 28 8.457 -12.149 -4.510 1.00 0.00 O ATOM 416 CB LEU A 28 11.102 -10.650 -2.978 1.00 0.00 C ATOM 417 CG LEU A 28 10.662 -9.311 -3.593 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.459 -8.616 -2.933 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.699 -8.179 -3.689 1.00 0.00 C ATOM 0 H LEU A 28 11.758 -12.727 -2.186 1.00 0.00 H new ATOM 0 HA LEU A 28 9.194 -11.439 -2.262 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.510 -10.440 -1.989 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.921 -11.037 -3.585 1.00 0.00 H new ATOM 0 HG LEU A 28 10.433 -9.718 -4.578 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.246 -7.683 -3.455 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.588 -9.269 -2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.690 -8.403 -1.889 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.239 -7.302 -4.144 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.055 -7.926 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.539 -8.506 -4.301 1.00 0.00 H new ATOM 431 N GLY A 29 10.536 -12.925 -4.901 1.00 0.00 N ATOM 432 CA GLY A 29 10.236 -13.667 -6.086 1.00 0.00 C ATOM 433 C GLY A 29 9.190 -14.727 -6.041 1.00 0.00 C ATOM 434 O GLY A 29 8.354 -14.794 -6.940 1.00 0.00 O ATOM 0 H GLY A 29 11.524 -12.964 -4.649 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.943 -12.951 -6.854 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.161 -14.135 -6.422 1.00 0.00 H new ATOM 438 N THR A 30 9.088 -15.380 -4.869 1.00 0.00 N ATOM 439 CA THR A 30 8.001 -16.266 -4.587 1.00 0.00 C ATOM 440 C THR A 30 6.677 -15.587 -4.512 1.00 0.00 C ATOM 441 O THR A 30 5.724 -16.094 -5.102 1.00 0.00 O ATOM 442 CB THR A 30 8.165 -17.175 -3.405 1.00 0.00 C ATOM 443 OG1 THR A 30 9.280 -18.052 -3.451 1.00 0.00 O ATOM 444 CG2 THR A 30 6.914 -18.035 -3.160 1.00 0.00 C ATOM 0 H THR A 30 9.765 -15.293 -4.111 1.00 0.00 H new ATOM 0 HA THR A 30 8.028 -16.910 -5.466 1.00 0.00 H new ATOM 0 HB THR A 30 8.334 -16.471 -2.590 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.106 -17.537 -3.338 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.078 -18.677 -2.295 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.058 -17.387 -2.974 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.718 -18.651 -4.038 1.00 0.00 H new ATOM 452 N VAL A 31 6.626 -14.430 -3.828 1.00 0.00 N ATOM 453 CA VAL A 31 5.459 -13.607 -3.753 1.00 0.00 C ATOM 454 C VAL A 31 4.938 -13.176 -5.081 1.00 0.00 C ATOM 455 O VAL A 31 3.756 -13.279 -5.406 1.00 0.00 O ATOM 456 CB VAL A 31 5.661 -12.381 -2.912 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.526 -11.355 -3.065 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.832 -12.869 -1.463 1.00 0.00 C ATOM 0 H VAL A 31 7.422 -14.056 -3.311 1.00 0.00 H new ATOM 0 HA VAL A 31 4.722 -14.258 -3.283 1.00 0.00 H new ATOM 0 HB VAL A 31 6.547 -11.838 -3.240 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.729 -10.491 -2.432 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.462 -11.036 -4.105 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.582 -11.810 -2.766 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.983 -12.012 -0.806 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.938 -13.411 -1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.696 -13.530 -1.401 1.00 0.00 H new ATOM 468 N MET A 32 5.793 -12.628 -5.962 1.00 0.00 N ATOM 469 CA MET A 32 5.523 -12.319 -7.332 1.00 0.00 C ATOM 470 C MET A 32 4.923 -13.391 -8.176 1.00 0.00 C ATOM 471 O MET A 32 3.919 -13.256 -8.873 1.00 0.00 O ATOM 472 CB MET A 32 6.835 -11.967 -8.054 1.00 0.00 C ATOM 473 CG MET A 32 7.225 -10.521 -7.743 1.00 0.00 C ATOM 474 SD MET A 32 6.408 -9.166 -8.638 1.00 0.00 S ATOM 475 CE MET A 32 7.796 -8.018 -8.408 1.00 0.00 C ATOM 0 H MET A 32 6.746 -12.382 -5.695 1.00 0.00 H new ATOM 0 HA MET A 32 4.794 -11.513 -7.243 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.628 -12.644 -7.737 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.716 -12.098 -9.129 1.00 0.00 H new ATOM 0 HG2 MET A 32 7.057 -10.358 -6.678 1.00 0.00 H new ATOM 0 HG3 MET A 32 8.297 -10.427 -7.914 1.00 0.00 H new ATOM 0 HE1 MET A 32 7.567 -7.069 -8.893 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.958 -7.852 -7.343 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.697 -8.443 -8.850 1.00 0.00 H new ATOM 485 N ARG A 33 5.542 -14.585 -8.200 1.00 0.00 N ATOM 486 CA ARG A 33 5.020 -15.680 -8.957 1.00 0.00 C ATOM 487 C ARG A 33 3.847 -16.386 -8.369 1.00 0.00 C ATOM 488 O ARG A 33 2.986 -16.919 -9.068 1.00 0.00 O ATOM 489 CB ARG A 33 6.242 -16.615 -8.962 1.00 0.00 C ATOM 490 CG ARG A 33 7.421 -16.213 -9.850 1.00 0.00 C ATOM 491 CD ARG A 33 8.720 -16.995 -9.646 1.00 0.00 C ATOM 492 NE ARG A 33 9.828 -16.344 -10.401 1.00 0.00 N ATOM 493 CZ ARG A 33 11.065 -16.129 -9.865 1.00 0.00 C ATOM 494 NH1 ARG A 33 11.531 -16.435 -8.619 1.00 0.00 N ATOM 495 NH2 ARG A 33 11.944 -15.293 -10.491 1.00 0.00 N ATOM 0 H ARG A 33 6.404 -14.792 -7.695 1.00 0.00 H new ATOM 0 HA ARG A 33 4.631 -15.350 -9.920 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.604 -16.704 -7.938 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.909 -17.606 -9.270 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.117 -16.320 -10.891 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.629 -15.156 -9.685 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.967 -17.037 -8.585 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.593 -18.023 -9.984 1.00 0.00 H new ATOM 0 HE ARG A 33 9.654 -16.046 -11.361 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.918 -16.891 -7.943 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.492 -16.208 -8.364 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.677 -14.829 -11.359 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.868 -15.132 -10.091 1.00 0.00 H new ATOM 509 N SER A 34 3.520 -16.182 -7.081 1.00 0.00 N ATOM 510 CA SER A 34 2.276 -16.548 -6.478 1.00 0.00 C ATOM 511 C SER A 34 1.078 -15.851 -7.025 1.00 0.00 C ATOM 512 O SER A 34 -0.042 -16.321 -7.216 1.00 0.00 O ATOM 513 CB SER A 34 2.357 -16.399 -4.949 1.00 0.00 C ATOM 514 OG SER A 34 3.369 -17.276 -4.479 1.00 0.00 O ATOM 0 H SER A 34 4.160 -15.736 -6.423 1.00 0.00 H new ATOM 0 HA SER A 34 2.125 -17.595 -6.740 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.588 -15.369 -4.678 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.398 -16.642 -4.491 1.00 0.00 H new ATOM 0 HG SER A 34 4.250 -16.904 -4.695 1.00 0.00 H new ATOM 520 N LEU A 35 1.282 -14.554 -7.318 1.00 0.00 N ATOM 521 CA LEU A 35 0.302 -13.645 -7.826 1.00 0.00 C ATOM 522 C LEU A 35 0.044 -13.854 -9.278 1.00 0.00 C ATOM 523 O LEU A 35 -1.091 -14.074 -9.698 1.00 0.00 O ATOM 524 CB LEU A 35 0.664 -12.153 -7.732 1.00 0.00 C ATOM 525 CG LEU A 35 0.694 -11.529 -6.326 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.069 -10.038 -6.332 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.642 -11.646 -5.573 1.00 0.00 C ATOM 0 H LEU A 35 2.193 -14.112 -7.191 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.553 -13.867 -7.187 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.645 -12.013 -8.186 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.049 -11.593 -8.336 1.00 0.00 H new ATOM 0 HG LEU A 35 1.462 -12.111 -5.816 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.072 -9.659 -5.310 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.060 -9.914 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.341 -9.482 -6.923 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.547 -11.185 -4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.424 -11.138 -6.138 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.903 -12.698 -5.457 1.00 0.00 H new ATOM 539 N GLY A 36 1.114 -13.820 -10.093 1.00 0.00 N ATOM 540 CA GLY A 36 0.968 -14.001 -11.504 1.00 0.00 C ATOM 541 C GLY A 36 1.976 -13.173 -12.225 1.00 0.00 C ATOM 542 O GLY A 36 1.650 -12.481 -13.188 1.00 0.00 O ATOM 0 H GLY A 36 2.072 -13.669 -9.778 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.097 -15.053 -11.760 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.038 -13.718 -11.814 1.00 0.00 H new ATOM 546 N GLN A 37 3.259 -13.262 -11.830 1.00 0.00 N ATOM 547 CA GLN A 37 4.218 -12.545 -12.611 1.00 0.00 C ATOM 548 C GLN A 37 5.520 -13.269 -12.567 1.00 0.00 C ATOM 549 O GLN A 37 5.893 -13.637 -11.455 1.00 0.00 O ATOM 550 CB GLN A 37 4.421 -11.140 -12.018 1.00 0.00 C ATOM 551 CG GLN A 37 5.578 -10.378 -12.666 1.00 0.00 C ATOM 552 CD GLN A 37 5.494 -8.871 -12.468 1.00 0.00 C ATOM 553 OE1 GLN A 37 4.848 -8.369 -11.550 1.00 0.00 O ATOM 554 NE2 GLN A 37 6.218 -8.131 -13.351 1.00 0.00 N ATOM 0 H GLN A 37 3.615 -13.788 -11.032 1.00 0.00 H new ATOM 0 HA GLN A 37 3.861 -12.466 -13.638 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.503 -10.565 -12.138 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.605 -11.227 -10.947 1.00 0.00 H new ATOM 0 HG2 GLN A 37 6.519 -10.740 -12.252 1.00 0.00 H new ATOM 0 HG3 GLN A 37 5.595 -10.597 -13.734 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.738 -8.593 -14.097 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.240 -7.115 -13.267 1.00 0.00 H new ATOM 563 N ASN A 38 6.227 -13.451 -13.697 1.00 0.00 N ATOM 564 CA ASN A 38 7.550 -13.996 -13.695 1.00 0.00 C ATOM 565 C ASN A 38 8.565 -12.910 -13.797 1.00 0.00 C ATOM 566 O ASN A 38 8.877 -12.567 -14.937 1.00 0.00 O ATOM 567 CB ASN A 38 7.578 -14.938 -14.910 1.00 0.00 C ATOM 568 CG ASN A 38 6.653 -16.110 -14.614 1.00 0.00 C ATOM 569 OD1 ASN A 38 7.110 -16.998 -13.896 1.00 0.00 O ATOM 570 ND2 ASN A 38 5.383 -16.058 -15.099 1.00 0.00 N ATOM 0 H ASN A 38 5.876 -13.217 -14.625 1.00 0.00 H new ATOM 0 HA ASN A 38 7.791 -14.528 -12.775 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.253 -14.412 -15.808 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.593 -15.290 -15.097 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.720 -16.799 -14.872 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.094 -15.278 -15.689 1.00 0.00 H new ATOM 577 N PRO A 39 9.205 -12.414 -12.780 1.00 0.00 N ATOM 578 CA PRO A 39 10.320 -11.535 -12.981 1.00 0.00 C ATOM 579 C PRO A 39 11.587 -12.319 -12.997 1.00 0.00 C ATOM 580 O PRO A 39 11.510 -13.491 -12.630 1.00 0.00 O ATOM 581 CB PRO A 39 10.172 -10.592 -11.790 1.00 0.00 C ATOM 582 CG PRO A 39 9.598 -11.398 -10.614 1.00 0.00 C ATOM 583 CD PRO A 39 8.707 -12.361 -11.414 1.00 0.00 C ATOM 0 HA PRO A 39 10.345 -10.993 -13.926 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.137 -10.162 -11.522 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.512 -9.762 -12.041 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.367 -11.913 -10.038 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.034 -10.782 -9.914 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.722 -13.354 -10.965 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.672 -12.021 -11.400 1.00 0.00 H new ATOM 591 N THR A 40 12.714 -11.720 -13.422 1.00 0.00 N ATOM 592 CA THR A 40 14.015 -12.289 -13.253 1.00 0.00 C ATOM 593 C THR A 40 14.772 -11.947 -12.017 1.00 0.00 C ATOM 594 O THR A 40 14.333 -11.121 -11.218 1.00 0.00 O ATOM 595 CB THR A 40 14.923 -12.155 -14.439 1.00 0.00 C ATOM 596 OG1 THR A 40 15.126 -10.767 -14.663 1.00 0.00 O ATOM 597 CG2 THR A 40 14.220 -12.754 -15.669 1.00 0.00 C ATOM 0 H THR A 40 12.721 -10.817 -13.895 1.00 0.00 H new ATOM 0 HA THR A 40 13.718 -13.332 -13.138 1.00 0.00 H new ATOM 0 HB THR A 40 15.869 -12.668 -14.268 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.272 -10.344 -14.892 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.870 -12.663 -16.540 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.002 -13.806 -15.487 1.00 0.00 H new ATOM 0 HG23 THR A 40 13.289 -12.217 -15.853 1.00 0.00 H new ATOM 605 N GLU A 41 15.831 -12.737 -11.768 1.00 0.00 N ATOM 606 CA GLU A 41 16.574 -12.608 -10.552 1.00 0.00 C ATOM 607 C GLU A 41 17.401 -11.370 -10.486 1.00 0.00 C ATOM 608 O GLU A 41 17.486 -10.697 -9.460 1.00 0.00 O ATOM 609 CB GLU A 41 17.447 -13.850 -10.308 1.00 0.00 C ATOM 610 CG GLU A 41 16.771 -15.209 -10.114 1.00 0.00 C ATOM 611 CD GLU A 41 15.518 -15.164 -9.250 1.00 0.00 C ATOM 612 OE1 GLU A 41 15.695 -14.639 -8.119 1.00 0.00 O ATOM 613 OE2 GLU A 41 14.427 -15.622 -9.683 1.00 0.00 O ATOM 0 H GLU A 41 16.171 -13.460 -12.402 1.00 0.00 H new ATOM 0 HA GLU A 41 15.833 -12.525 -9.757 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.132 -13.941 -11.151 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.054 -13.656 -9.424 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.511 -15.616 -11.091 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.486 -15.897 -9.662 1.00 0.00 H new ATOM 620 N ALA A 42 17.846 -10.935 -11.678 1.00 0.00 N ATOM 621 CA ALA A 42 18.351 -9.621 -11.931 1.00 0.00 C ATOM 622 C ALA A 42 17.465 -8.475 -11.586 1.00 0.00 C ATOM 623 O ALA A 42 17.762 -7.740 -10.646 1.00 0.00 O ATOM 624 CB ALA A 42 18.869 -9.496 -13.374 1.00 0.00 C ATOM 0 H ALA A 42 17.854 -11.529 -12.507 1.00 0.00 H new ATOM 0 HA ALA A 42 19.172 -9.530 -11.220 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.247 -8.487 -13.539 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.672 -10.215 -13.536 1.00 0.00 H new ATOM 0 HB3 ALA A 42 18.056 -9.697 -14.071 1.00 0.00 H new ATOM 630 N GLU A 43 16.231 -8.457 -12.121 1.00 0.00 N ATOM 631 CA GLU A 43 15.217 -7.599 -11.592 1.00 0.00 C ATOM 632 C GLU A 43 14.843 -7.597 -10.149 1.00 0.00 C ATOM 633 O GLU A 43 14.717 -6.534 -9.543 1.00 0.00 O ATOM 634 CB GLU A 43 13.942 -7.824 -12.422 1.00 0.00 C ATOM 635 CG GLU A 43 14.074 -7.596 -13.929 1.00 0.00 C ATOM 636 CD GLU A 43 12.808 -8.086 -14.617 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.767 -9.291 -14.981 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.930 -7.241 -14.938 1.00 0.00 O ATOM 0 H GLU A 43 15.937 -9.030 -12.912 1.00 0.00 H new ATOM 0 HA GLU A 43 15.701 -6.626 -11.668 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.601 -8.846 -12.258 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.163 -7.163 -12.041 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.230 -6.538 -14.137 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.943 -8.129 -14.316 1.00 0.00 H new ATOM 645 N LEU A 44 14.638 -8.813 -9.614 1.00 0.00 N ATOM 646 CA LEU A 44 14.445 -8.990 -8.209 1.00 0.00 C ATOM 647 C LEU A 44 15.489 -8.398 -7.326 1.00 0.00 C ATOM 648 O LEU A 44 15.253 -7.746 -6.310 1.00 0.00 O ATOM 649 CB LEU A 44 14.325 -10.493 -7.906 1.00 0.00 C ATOM 650 CG LEU A 44 12.977 -11.076 -8.363 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.929 -12.612 -8.410 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.770 -10.470 -7.627 1.00 0.00 C ATOM 0 H LEU A 44 14.606 -9.676 -10.156 1.00 0.00 H new ATOM 0 HA LEU A 44 13.533 -8.441 -7.976 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.136 -11.027 -8.402 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.444 -10.656 -6.835 1.00 0.00 H new ATOM 0 HG LEU A 44 12.893 -10.761 -9.403 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.942 -12.935 -8.742 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.684 -12.979 -9.105 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.126 -13.013 -7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.852 -10.925 -7.998 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.863 -10.660 -6.558 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.739 -9.395 -7.803 1.00 0.00 H new ATOM 664 N GLN A 45 16.784 -8.592 -7.631 1.00 0.00 N ATOM 665 CA GLN A 45 17.835 -8.064 -6.818 1.00 0.00 C ATOM 666 C GLN A 45 18.073 -6.617 -7.079 1.00 0.00 C ATOM 667 O GLN A 45 18.385 -5.833 -6.184 1.00 0.00 O ATOM 668 CB GLN A 45 19.162 -8.808 -7.044 1.00 0.00 C ATOM 669 CG GLN A 45 20.343 -8.544 -6.107 1.00 0.00 C ATOM 670 CD GLN A 45 20.031 -9.196 -4.768 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.305 -10.393 -4.702 1.00 0.00 O ATOM 672 NE2 GLN A 45 19.464 -8.437 -3.792 1.00 0.00 N ATOM 0 H GLN A 45 17.104 -9.117 -8.445 1.00 0.00 H new ATOM 0 HA GLN A 45 17.503 -8.201 -5.789 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.948 -9.876 -7.007 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.493 -8.584 -8.058 1.00 0.00 H new ATOM 0 HG2 GLN A 45 21.262 -8.954 -6.526 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.500 -7.472 -5.983 1.00 0.00 H new ATOM 0 HE21 GLN A 45 19.280 -7.447 -3.957 1.00 0.00 H new ATOM 0 HE22 GLN A 45 19.222 -8.857 -2.895 1.00 0.00 H new ATOM 681 N ASP A 46 17.793 -6.138 -8.304 1.00 0.00 N ATOM 682 CA ASP A 46 17.857 -4.731 -8.553 1.00 0.00 C ATOM 683 C ASP A 46 16.838 -3.918 -7.829 1.00 0.00 C ATOM 684 O ASP A 46 17.124 -2.872 -7.249 1.00 0.00 O ATOM 685 CB ASP A 46 17.666 -4.563 -10.070 1.00 0.00 C ATOM 686 CG ASP A 46 18.125 -3.238 -10.663 1.00 0.00 C ATOM 687 OD1 ASP A 46 18.702 -2.280 -10.083 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.961 -3.099 -11.905 1.00 0.00 O ATOM 0 H ASP A 46 17.528 -6.710 -9.106 1.00 0.00 H new ATOM 0 HA ASP A 46 18.814 -4.361 -8.186 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.202 -5.368 -10.574 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.608 -4.692 -10.298 1.00 0.00 H new ATOM 693 N MET A 47 15.652 -4.528 -7.654 1.00 0.00 N ATOM 694 CA MET A 47 14.609 -4.090 -6.780 1.00 0.00 C ATOM 695 C MET A 47 15.111 -3.945 -5.384 1.00 0.00 C ATOM 696 O MET A 47 14.959 -2.884 -4.781 1.00 0.00 O ATOM 697 CB MET A 47 13.409 -5.050 -6.852 1.00 0.00 C ATOM 698 CG MET A 47 12.313 -4.645 -7.839 1.00 0.00 C ATOM 699 SD MET A 47 10.833 -5.700 -7.783 1.00 0.00 S ATOM 700 CE MET A 47 11.280 -6.550 -9.324 1.00 0.00 C ATOM 0 H MET A 47 15.407 -5.382 -8.156 1.00 0.00 H new ATOM 0 HA MET A 47 14.271 -3.107 -7.108 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.772 -6.041 -7.123 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.969 -5.132 -5.858 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.019 -3.615 -7.636 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.723 -4.666 -8.849 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.521 -7.295 -9.562 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.342 -5.824 -10.135 1.00 0.00 H new ATOM 0 HE3 MET A 47 12.245 -7.041 -9.202 1.00 0.00 H new ATOM 710 N ILE A 48 15.705 -5.005 -4.807 1.00 0.00 N ATOM 711 CA ILE A 48 16.159 -5.050 -3.452 1.00 0.00 C ATOM 712 C ILE A 48 17.311 -4.120 -3.284 1.00 0.00 C ATOM 713 O ILE A 48 17.291 -3.285 -2.381 1.00 0.00 O ATOM 714 CB ILE A 48 16.476 -6.437 -2.976 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.166 -7.231 -2.844 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.226 -6.362 -1.635 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.498 -8.721 -2.920 1.00 0.00 C ATOM 0 H ILE A 48 15.877 -5.875 -5.312 1.00 0.00 H new ATOM 0 HA ILE A 48 15.339 -4.719 -2.815 1.00 0.00 H new ATOM 0 HB ILE A 48 17.120 -6.948 -3.692 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.675 -6.999 -1.899 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.473 -6.955 -3.639 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.456 -7.370 -1.290 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.153 -5.803 -1.767 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.602 -5.859 -0.896 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.581 -9.303 -2.828 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.973 -8.940 -3.877 1.00 0.00 H new ATOM 0 HD13 ILE A 48 16.178 -8.984 -2.109 1.00 0.00 H new ATOM 729 N ASN A 49 18.348 -4.180 -4.140 1.00 0.00 N ATOM 730 CA ASN A 49 19.434 -3.251 -4.127 1.00 0.00 C ATOM 731 C ASN A 49 19.103 -1.798 -4.170 1.00 0.00 C ATOM 732 O ASN A 49 19.852 -1.045 -3.550 1.00 0.00 O ATOM 733 CB ASN A 49 20.496 -3.493 -5.213 1.00 0.00 C ATOM 734 CG ASN A 49 21.224 -4.785 -4.871 1.00 0.00 C ATOM 735 OD1 ASN A 49 20.898 -5.555 -3.969 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.127 -5.198 -5.800 1.00 0.00 N ATOM 0 H ASN A 49 18.432 -4.896 -4.862 1.00 0.00 H new ATOM 0 HA ASN A 49 19.823 -3.474 -3.134 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.029 -3.566 -6.195 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.197 -2.659 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.525 -6.136 -5.743 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.407 -4.570 -6.554 1.00 0.00 H new ATOM 743 N GLU A 50 18.090 -1.326 -4.918 1.00 0.00 N ATOM 744 CA GLU A 50 17.546 -0.005 -4.856 1.00 0.00 C ATOM 745 C GLU A 50 17.394 0.521 -3.470 1.00 0.00 C ATOM 746 O GLU A 50 17.857 1.623 -3.179 1.00 0.00 O ATOM 747 CB GLU A 50 16.214 0.157 -5.609 1.00 0.00 C ATOM 748 CG GLU A 50 15.448 1.482 -5.580 1.00 0.00 C ATOM 749 CD GLU A 50 16.193 2.762 -5.928 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.204 2.734 -6.680 1.00 0.00 O ATOM 751 OE2 GLU A 50 15.683 3.840 -5.519 1.00 0.00 O ATOM 0 H GLU A 50 17.620 -1.907 -5.612 1.00 0.00 H new ATOM 0 HA GLU A 50 18.301 0.593 -5.367 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.409 -0.076 -6.656 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.538 -0.611 -5.232 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.606 1.392 -6.266 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.033 1.602 -4.579 1.00 0.00 H new ATOM 758 N VAL A 51 16.628 -0.212 -2.643 1.00 0.00 N ATOM 759 CA VAL A 51 16.240 0.295 -1.363 1.00 0.00 C ATOM 760 C VAL A 51 17.283 -0.027 -0.349 1.00 0.00 C ATOM 761 O VAL A 51 17.305 0.679 0.659 1.00 0.00 O ATOM 762 CB VAL A 51 14.883 -0.252 -1.036 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.826 0.231 -2.043 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.795 -1.787 -1.004 1.00 0.00 C ATOM 0 H VAL A 51 16.280 -1.147 -2.857 1.00 0.00 H new ATOM 0 HA VAL A 51 16.163 1.382 -1.367 1.00 0.00 H new ATOM 0 HB VAL A 51 14.694 0.125 -0.031 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.854 -0.184 -1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.774 1.320 -2.022 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.100 -0.100 -3.045 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.776 -2.088 -0.759 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.067 -2.187 -1.981 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.479 -2.175 -0.249 1.00 0.00 H new ATOM 774 N ASP A 52 18.020 -1.139 -0.516 1.00 0.00 N ATOM 775 CA ASP A 52 19.110 -1.571 0.303 1.00 0.00 C ATOM 776 C ASP A 52 20.074 -0.508 0.704 1.00 0.00 C ATOM 777 O ASP A 52 20.755 0.143 -0.087 1.00 0.00 O ATOM 778 CB ASP A 52 19.701 -2.807 -0.395 1.00 0.00 C ATOM 779 CG ASP A 52 20.645 -3.545 0.543 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.151 -3.844 1.663 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.802 -3.922 0.216 1.00 0.00 O ATOM 0 H ASP A 52 17.839 -1.786 -1.284 1.00 0.00 H new ATOM 0 HA ASP A 52 18.757 -1.848 1.296 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.898 -3.473 -0.711 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.236 -2.503 -1.295 1.00 0.00 H new ATOM 786 N ALA A 53 20.146 -0.225 2.017 1.00 0.00 N ATOM 787 CA ALA A 53 21.155 0.615 2.584 1.00 0.00 C ATOM 788 C ALA A 53 22.476 0.047 2.977 1.00 0.00 C ATOM 789 O ALA A 53 23.500 0.329 2.357 1.00 0.00 O ATOM 790 CB ALA A 53 20.510 1.436 3.713 1.00 0.00 C ATOM 0 H ALA A 53 19.485 -0.590 2.703 1.00 0.00 H new ATOM 0 HA ALA A 53 21.489 1.223 1.743 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.259 2.087 4.164 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.701 2.042 3.306 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.112 0.762 4.471 1.00 0.00 H new ATOM 796 N ASP A 54 22.546 -0.889 3.939 1.00 0.00 N ATOM 797 CA ASP A 54 23.695 -1.480 4.552 1.00 0.00 C ATOM 798 C ASP A 54 24.745 -2.004 3.634 1.00 0.00 C ATOM 799 O ASP A 54 25.866 -1.499 3.633 1.00 0.00 O ATOM 800 CB ASP A 54 23.217 -2.453 5.643 1.00 0.00 C ATOM 801 CG ASP A 54 21.983 -3.234 5.214 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.932 -3.832 4.106 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.946 -3.278 5.929 1.00 0.00 O ATOM 0 H ASP A 54 21.689 -1.277 4.333 1.00 0.00 H new ATOM 0 HA ASP A 54 24.268 -0.681 5.022 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.020 -3.149 5.884 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.994 -1.896 6.553 1.00 0.00 H new ATOM 808 N GLY A 55 24.377 -2.969 2.772 1.00 0.00 N ATOM 809 CA GLY A 55 25.259 -3.805 2.018 1.00 0.00 C ATOM 810 C GLY A 55 24.772 -5.214 2.008 1.00 0.00 C ATOM 811 O GLY A 55 25.262 -6.062 1.264 1.00 0.00 O ATOM 0 H GLY A 55 23.395 -3.179 2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 55 25.334 -3.434 0.996 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.261 -3.765 2.446 1.00 0.00 H new ATOM 815 N ASN A 56 23.768 -5.619 2.806 1.00 0.00 N ATOM 816 CA ASN A 56 23.481 -7.012 2.953 1.00 0.00 C ATOM 817 C ASN A 56 22.762 -7.644 1.810 1.00 0.00 C ATOM 818 O ASN A 56 23.023 -8.808 1.514 1.00 0.00 O ATOM 819 CB ASN A 56 22.789 -7.397 4.271 1.00 0.00 C ATOM 820 CG ASN A 56 21.415 -6.795 4.527 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.614 -6.472 3.651 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.143 -6.775 5.860 1.00 0.00 N ATOM 0 H ASN A 56 23.164 -4.995 3.341 1.00 0.00 H new ATOM 0 HA ASN A 56 24.489 -7.425 2.970 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.695 -8.483 4.301 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.444 -7.111 5.094 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.224 -6.478 6.189 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.858 -7.057 6.531 1.00 0.00 H new ATOM 829 N GLY A 57 21.973 -6.936 0.982 1.00 0.00 N ATOM 830 CA GLY A 57 21.466 -7.579 -0.190 1.00 0.00 C ATOM 831 C GLY A 57 20.035 -7.955 -0.023 1.00 0.00 C ATOM 832 O GLY A 57 19.380 -8.529 -0.893 1.00 0.00 O ATOM 0 H GLY A 57 21.696 -5.963 1.113 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.572 -6.914 -1.047 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.056 -8.470 -0.403 1.00 0.00 H new ATOM 836 N THR A 58 19.480 -7.733 1.182 1.00 0.00 N ATOM 837 CA THR A 58 18.198 -8.145 1.663 1.00 0.00 C ATOM 838 C THR A 58 17.501 -6.940 2.195 1.00 0.00 C ATOM 839 O THR A 58 18.117 -5.969 2.632 1.00 0.00 O ATOM 840 CB THR A 58 18.164 -9.229 2.700 1.00 0.00 C ATOM 841 OG1 THR A 58 19.061 -8.999 3.777 1.00 0.00 O ATOM 842 CG2 THR A 58 18.414 -10.618 2.089 1.00 0.00 C ATOM 0 H THR A 58 19.987 -7.208 1.894 1.00 0.00 H new ATOM 0 HA THR A 58 17.707 -8.598 0.802 1.00 0.00 H new ATOM 0 HB THR A 58 17.154 -9.206 3.108 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.427 -8.093 3.710 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.381 -11.373 2.875 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.645 -10.833 1.347 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.394 -10.634 1.612 1.00 0.00 H new ATOM 850 N ILE A 59 16.159 -6.885 2.142 1.00 0.00 N ATOM 851 CA ILE A 59 15.426 -5.751 2.614 1.00 0.00 C ATOM 852 C ILE A 59 15.093 -6.086 4.027 1.00 0.00 C ATOM 853 O ILE A 59 14.356 -7.016 4.351 1.00 0.00 O ATOM 854 CB ILE A 59 14.188 -5.376 1.855 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.350 -5.430 0.327 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.867 -3.933 2.279 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.120 -5.015 -0.480 1.00 0.00 C ATOM 0 H ILE A 59 15.576 -7.634 1.768 1.00 0.00 H new ATOM 0 HA ILE A 59 16.046 -4.864 2.484 1.00 0.00 H new ATOM 0 HB ILE A 59 13.398 -6.090 2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 59 15.183 -4.786 0.044 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.623 -6.447 0.044 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.970 -3.592 1.761 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.699 -3.899 3.355 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.704 -3.283 2.021 1.00 0.00 H new ATOM 0 HD11 ILE A 59 13.341 -5.089 -1.545 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.286 -5.673 -0.236 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.854 -3.987 -0.235 1.00 0.00 H new ATOM 869 N ASP A 60 15.722 -5.304 4.923 1.00 0.00 N ATOM 870 CA ASP A 60 15.453 -5.401 6.324 1.00 0.00 C ATOM 871 C ASP A 60 14.321 -4.475 6.605 1.00 0.00 C ATOM 872 O ASP A 60 13.945 -3.621 5.804 1.00 0.00 O ATOM 873 CB ASP A 60 16.718 -4.954 7.076 1.00 0.00 C ATOM 874 CG ASP A 60 17.989 -5.705 6.704 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.486 -5.475 5.570 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.568 -6.364 7.609 1.00 0.00 O ATOM 0 H ASP A 60 16.419 -4.602 4.676 1.00 0.00 H new ATOM 0 HA ASP A 60 15.194 -6.413 6.636 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.875 -3.891 6.892 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.546 -5.070 8.146 1.00 0.00 H new ATOM 881 N PHE A 61 13.706 -4.581 7.797 1.00 0.00 N ATOM 882 CA PHE A 61 12.590 -3.816 8.260 1.00 0.00 C ATOM 883 C PHE A 61 12.889 -2.357 8.296 1.00 0.00 C ATOM 884 O PHE A 61 12.023 -1.550 7.961 1.00 0.00 O ATOM 885 CB PHE A 61 11.983 -4.390 9.552 1.00 0.00 C ATOM 886 CG PHE A 61 10.719 -3.685 9.906 1.00 0.00 C ATOM 887 CD1 PHE A 61 9.621 -3.842 9.092 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.610 -2.894 11.025 1.00 0.00 C ATOM 889 CE1 PHE A 61 8.552 -3.018 9.352 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.590 -1.991 11.212 1.00 0.00 C ATOM 891 CZ PHE A 61 8.522 -2.073 10.350 1.00 0.00 C ATOM 0 H PHE A 61 14.017 -5.259 8.493 1.00 0.00 H new ATOM 0 HA PHE A 61 11.791 -3.913 7.525 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.787 -5.455 9.424 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.699 -4.294 10.369 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.600 -4.570 8.295 1.00 0.00 H new ATOM 0 HD2 PHE A 61 11.362 -2.986 11.795 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.675 -3.120 8.729 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.626 -1.252 11.999 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.677 -1.409 10.455 1.00 0.00 H new ATOM 901 N PRO A 62 13.972 -1.773 8.716 1.00 0.00 N ATOM 902 CA PRO A 62 14.203 -0.364 8.581 1.00 0.00 C ATOM 903 C PRO A 62 14.238 0.157 7.185 1.00 0.00 C ATOM 904 O PRO A 62 14.155 1.372 7.015 1.00 0.00 O ATOM 905 CB PRO A 62 15.534 -0.072 9.269 1.00 0.00 C ATOM 906 CG PRO A 62 15.472 -1.013 10.482 1.00 0.00 C ATOM 907 CD PRO A 62 14.747 -2.220 9.864 1.00 0.00 C ATOM 0 HA PRO A 62 13.353 0.147 9.034 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.385 -0.292 8.624 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.620 0.973 9.566 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.462 -1.272 10.857 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.919 -0.579 11.315 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.470 -2.977 9.558 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.093 -2.684 10.602 1.00 0.00 H new ATOM 915 N GLU A 63 14.379 -0.629 6.103 1.00 0.00 N ATOM 916 CA GLU A 63 14.307 -0.157 4.755 1.00 0.00 C ATOM 917 C GLU A 63 12.873 -0.120 4.353 1.00 0.00 C ATOM 918 O GLU A 63 12.389 0.870 3.806 1.00 0.00 O ATOM 919 CB GLU A 63 15.298 -0.879 3.827 1.00 0.00 C ATOM 920 CG GLU A 63 16.803 -0.716 4.048 1.00 0.00 C ATOM 921 CD GLU A 63 17.742 -1.913 4.091 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.287 -3.087 4.047 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.993 -1.762 4.115 1.00 0.00 O ATOM 0 H GLU A 63 14.550 -1.632 6.170 1.00 0.00 H new ATOM 0 HA GLU A 63 14.662 0.870 4.663 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.075 -1.945 3.879 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.082 -0.558 2.808 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.168 -0.057 3.260 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.927 -0.184 4.991 1.00 0.00 H new ATOM 930 N PHE A 64 12.091 -1.164 4.683 1.00 0.00 N ATOM 931 CA PHE A 64 10.667 -1.245 4.588 1.00 0.00 C ATOM 932 C PHE A 64 10.039 0.012 5.082 1.00 0.00 C ATOM 933 O PHE A 64 9.359 0.793 4.418 1.00 0.00 O ATOM 934 CB PHE A 64 10.127 -2.450 5.376 1.00 0.00 C ATOM 935 CG PHE A 64 8.730 -2.684 4.913 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.484 -3.273 3.695 1.00 0.00 C ATOM 937 CD2 PHE A 64 7.677 -2.134 5.607 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.213 -3.358 3.177 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.402 -2.238 5.103 1.00 0.00 C ATOM 940 CZ PHE A 64 6.153 -2.931 3.942 1.00 0.00 C ATOM 0 H PHE A 64 12.494 -2.027 5.049 1.00 0.00 H new ATOM 0 HA PHE A 64 10.409 -1.380 3.538 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.744 -3.332 5.202 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.150 -2.251 6.448 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.310 -3.679 3.131 1.00 0.00 H new ATOM 0 HD2 PHE A 64 7.851 -1.623 6.543 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.050 -3.754 2.185 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.583 -1.768 5.627 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.138 -3.137 3.635 1.00 0.00 H new ATOM 950 N LEU A 65 10.334 0.323 6.357 1.00 0.00 N ATOM 951 CA LEU A 65 9.982 1.498 7.093 1.00 0.00 C ATOM 952 C LEU A 65 10.172 2.764 6.331 1.00 0.00 C ATOM 953 O LEU A 65 9.173 3.459 6.153 1.00 0.00 O ATOM 954 CB LEU A 65 10.779 1.595 8.405 1.00 0.00 C ATOM 955 CG LEU A 65 10.521 2.833 9.280 1.00 0.00 C ATOM 956 CD1 LEU A 65 9.145 2.967 9.953 1.00 0.00 C ATOM 957 CD2 LEU A 65 11.620 2.858 10.355 1.00 0.00 C ATOM 0 H LEU A 65 10.878 -0.321 6.932 1.00 0.00 H new ATOM 0 HA LEU A 65 8.917 1.389 7.300 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.564 0.707 9.000 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.841 1.566 8.161 1.00 0.00 H new ATOM 0 HG LEU A 65 10.536 3.680 8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.113 3.888 10.535 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.368 2.993 9.189 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.978 2.115 10.612 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.477 3.723 11.002 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.567 1.947 10.951 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.597 2.922 9.875 1.00 0.00 H new ATOM 969 N THR A 66 11.392 3.186 5.952 1.00 0.00 N ATOM 970 CA THR A 66 11.648 4.455 5.344 1.00 0.00 C ATOM 971 C THR A 66 11.302 4.449 3.895 1.00 0.00 C ATOM 972 O THR A 66 11.074 5.527 3.348 1.00 0.00 O ATOM 973 CB THR A 66 13.007 5.087 5.410 1.00 0.00 C ATOM 974 OG1 THR A 66 14.019 4.140 5.101 1.00 0.00 O ATOM 975 CG2 THR A 66 13.353 5.559 6.832 1.00 0.00 C ATOM 0 H THR A 66 12.233 2.621 6.074 1.00 0.00 H new ATOM 0 HA THR A 66 11.012 5.059 5.991 1.00 0.00 H new ATOM 0 HB THR A 66 12.973 5.918 4.705 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.897 4.573 5.148 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.345 6.010 6.834 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.619 6.295 7.160 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.340 4.707 7.511 1.00 0.00 H new ATOM 983 N MET A 67 11.021 3.299 3.257 1.00 0.00 N ATOM 984 CA MET A 67 10.451 3.259 1.946 1.00 0.00 C ATOM 985 C MET A 67 9.016 3.661 1.969 1.00 0.00 C ATOM 986 O MET A 67 8.687 4.556 1.191 1.00 0.00 O ATOM 987 CB MET A 67 10.510 1.834 1.370 1.00 0.00 C ATOM 988 CG MET A 67 9.715 1.663 0.074 1.00 0.00 C ATOM 989 SD MET A 67 9.848 0.224 -1.029 1.00 0.00 S ATOM 990 CE MET A 67 9.009 -0.850 0.171 1.00 0.00 C ATOM 0 H MET A 67 11.193 2.378 3.660 1.00 0.00 H new ATOM 0 HA MET A 67 11.029 3.950 1.333 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.551 1.569 1.185 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.130 1.134 2.114 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.664 1.735 0.352 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.943 2.536 -0.538 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.750 -1.438 0.713 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.445 -0.238 0.875 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.328 -1.520 -0.354 1.00 0.00 H new ATOM 1000 N MET A 68 8.239 3.078 2.899 1.00 0.00 N ATOM 1001 CA MET A 68 6.852 3.325 3.143 1.00 0.00 C ATOM 1002 C MET A 68 6.509 4.573 3.883 1.00 0.00 C ATOM 1003 O MET A 68 5.504 5.200 3.552 1.00 0.00 O ATOM 1004 CB MET A 68 6.169 2.162 3.882 1.00 0.00 C ATOM 1005 CG MET A 68 6.191 0.903 3.014 1.00 0.00 C ATOM 1006 SD MET A 68 5.777 0.923 1.244 1.00 0.00 S ATOM 1007 CE MET A 68 4.006 0.996 1.641 1.00 0.00 C ATOM 0 H MET A 68 8.615 2.374 3.534 1.00 0.00 H new ATOM 0 HA MET A 68 6.479 3.441 2.126 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.679 1.971 4.826 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.140 2.429 4.124 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.196 0.488 3.094 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.514 0.190 3.484 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.432 1.111 0.722 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.707 0.076 2.143 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.815 1.845 2.297 1.00 0.00 H new ATOM 1017 N ALA A 69 7.276 4.978 4.911 1.00 0.00 N ATOM 1018 CA ALA A 69 7.208 6.256 5.548 1.00 0.00 C ATOM 1019 C ALA A 69 7.672 7.469 4.818 1.00 0.00 C ATOM 1020 O ALA A 69 7.757 8.572 5.356 1.00 0.00 O ATOM 1021 CB ALA A 69 7.953 6.163 6.890 1.00 0.00 C ATOM 0 H ALA A 69 7.988 4.374 5.322 1.00 0.00 H new ATOM 0 HA ALA A 69 6.136 6.434 5.628 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.915 7.128 7.395 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.481 5.406 7.517 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.993 5.888 6.711 1.00 0.00 H new ATOM 1027 N ARG A 70 8.107 7.318 3.554 1.00 0.00 N ATOM 1028 CA ARG A 70 8.264 8.411 2.645 1.00 0.00 C ATOM 1029 C ARG A 70 6.965 8.768 2.007 1.00 0.00 C ATOM 1030 O ARG A 70 6.155 8.007 1.481 1.00 0.00 O ATOM 1031 CB ARG A 70 9.341 8.117 1.588 1.00 0.00 C ATOM 1032 CG ARG A 70 9.742 9.383 0.828 1.00 0.00 C ATOM 1033 CD ARG A 70 10.982 9.284 -0.064 1.00 0.00 C ATOM 1034 NE ARG A 70 10.496 8.517 -1.245 1.00 0.00 N ATOM 1035 CZ ARG A 70 10.742 7.204 -1.525 1.00 0.00 C ATOM 1036 NH1 ARG A 70 11.457 6.383 -0.701 1.00 0.00 N ATOM 1037 NH2 ARG A 70 10.460 6.753 -2.782 1.00 0.00 N ATOM 0 H ARG A 70 8.356 6.413 3.154 1.00 0.00 H new ATOM 0 HA ARG A 70 8.602 9.272 3.222 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.219 7.688 2.071 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.968 7.372 0.885 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.900 9.689 0.207 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.908 10.178 1.555 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.352 10.269 -0.349 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.800 8.770 0.440 1.00 0.00 H new ATOM 0 HE ARG A 70 9.919 9.026 -1.914 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.837 6.744 0.174 1.00 0.00 H new ATOM 0 HH12 ARG A 70 11.611 5.409 -0.960 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.077 7.392 -3.479 1.00 0.00 H new ATOM 0 HH22 ARG A 70 10.632 5.777 -3.024 1.00 0.00 H new ATOM 1051 N LYS A 71 6.536 10.036 2.136 1.00 0.00 N ATOM 1052 CA LYS A 71 5.313 10.555 1.605 1.00 0.00 C ATOM 1053 C LYS A 71 5.556 11.083 0.233 1.00 0.00 C ATOM 1054 O LYS A 71 6.591 11.713 0.023 1.00 0.00 O ATOM 1055 CB LYS A 71 4.757 11.656 2.524 1.00 0.00 C ATOM 1056 CG LYS A 71 3.252 11.912 2.422 1.00 0.00 C ATOM 1057 CD LYS A 71 2.702 12.987 3.361 1.00 0.00 C ATOM 1058 CE LYS A 71 1.220 13.197 3.045 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.677 14.119 4.068 1.00 0.00 N ATOM 0 H LYS A 71 7.075 10.740 2.641 1.00 0.00 H new ATOM 0 HA LYS A 71 4.573 9.757 1.551 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.993 11.395 3.556 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.280 12.586 2.303 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.018 12.196 1.396 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.728 10.977 2.621 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.828 12.683 4.400 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.252 13.919 3.233 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.096 13.615 2.046 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.685 12.247 3.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.333 14.286 3.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.792 13.697 5.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.190 15.023 4.028 1.00 0.00 H new ATOM 1073 N MET A 72 4.652 10.802 -0.723 1.00 0.00 N ATOM 1074 CA MET A 72 4.757 11.070 -2.124 1.00 0.00 C ATOM 1075 C MET A 72 3.849 12.182 -2.522 1.00 0.00 C ATOM 1076 O MET A 72 3.084 12.691 -1.704 1.00 0.00 O ATOM 1077 CB MET A 72 4.477 9.811 -2.961 1.00 0.00 C ATOM 1078 CG MET A 72 5.373 8.581 -2.802 1.00 0.00 C ATOM 1079 SD MET A 72 4.938 7.165 -3.856 1.00 0.00 S ATOM 1080 CE MET A 72 3.286 6.956 -3.132 1.00 0.00 C ATOM 0 H MET A 72 3.769 10.346 -0.492 1.00 0.00 H new ATOM 0 HA MET A 72 5.783 11.378 -2.323 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.455 9.499 -2.748 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.509 10.104 -4.010 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.402 8.871 -3.016 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.342 8.261 -1.760 1.00 0.00 H new ATOM 0 HE1 MET A 72 2.990 5.909 -3.196 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.305 7.264 -2.087 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.569 7.570 -3.678 1.00 0.00 H new ATOM 1090 N LYS A 73 3.991 12.622 -3.785 1.00 0.00 N ATOM 1091 CA LYS A 73 3.188 13.669 -4.337 1.00 0.00 C ATOM 1092 C LYS A 73 1.829 13.277 -4.806 1.00 0.00 C ATOM 1093 O LYS A 73 1.549 12.086 -4.932 1.00 0.00 O ATOM 1094 CB LYS A 73 3.941 14.356 -5.488 1.00 0.00 C ATOM 1095 CG LYS A 73 4.394 13.458 -6.641 1.00 0.00 C ATOM 1096 CD LYS A 73 5.231 14.217 -7.673 1.00 0.00 C ATOM 1097 CE LYS A 73 6.041 13.337 -8.627 1.00 0.00 C ATOM 1098 NZ LYS A 73 5.156 12.550 -9.516 1.00 0.00 N ATOM 0 H LYS A 73 4.678 12.243 -4.437 1.00 0.00 H new ATOM 0 HA LYS A 73 3.016 14.346 -3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.300 15.138 -5.896 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.821 14.849 -5.074 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.977 12.627 -6.244 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.519 13.029 -7.130 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.567 14.849 -8.262 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.916 14.880 -7.145 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.702 13.961 -9.228 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.676 12.662 -8.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.700 12.208 -10.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.771 11.738 -8.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 4.374 13.150 -9.848 1.00 0.00 H new ATOM 1112 N ASP A 74 0.930 14.244 -5.064 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.471 14.032 -5.256 1.00 0.00 C ATOM 1114 C ASP A 74 -0.871 13.021 -6.274 1.00 0.00 C ATOM 1115 O ASP A 74 -1.836 12.275 -6.115 1.00 0.00 O ATOM 1116 CB ASP A 74 -1.324 15.310 -5.330 1.00 0.00 C ATOM 1117 CG ASP A 74 -1.367 15.904 -3.929 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -2.216 15.394 -3.150 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.440 16.703 -3.628 1.00 0.00 O ATOM 0 H ASP A 74 1.195 15.226 -5.143 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.720 13.555 -4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.893 16.020 -6.036 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.330 15.081 -5.682 1.00 0.00 H new ATOM 1124 N THR A 75 -0.107 13.059 -7.380 1.00 0.00 N ATOM 1125 CA THR A 75 -0.283 12.293 -8.575 1.00 0.00 C ATOM 1126 C THR A 75 0.041 10.857 -8.345 1.00 0.00 C ATOM 1127 O THR A 75 -0.778 10.009 -8.695 1.00 0.00 O ATOM 1128 CB THR A 75 0.527 12.790 -9.735 1.00 0.00 C ATOM 1129 OG1 THR A 75 1.764 13.280 -9.240 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.198 13.933 -10.466 1.00 0.00 C ATOM 0 H THR A 75 0.701 13.678 -7.442 1.00 0.00 H new ATOM 0 HA THR A 75 -1.336 12.409 -8.834 1.00 0.00 H new ATOM 0 HB THR A 75 0.679 11.970 -10.436 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.677 14.233 -9.028 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.412 14.274 -11.303 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.158 13.576 -10.839 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.362 14.760 -9.775 1.00 0.00 H new ATOM 1138 N ASP A 76 1.095 10.563 -7.563 1.00 0.00 N ATOM 1139 CA ASP A 76 1.584 9.281 -7.160 1.00 0.00 C ATOM 1140 C ASP A 76 0.693 8.681 -6.128 1.00 0.00 C ATOM 1141 O ASP A 76 0.355 7.499 -6.179 1.00 0.00 O ATOM 1142 CB ASP A 76 3.051 9.337 -6.702 1.00 0.00 C ATOM 1143 CG ASP A 76 3.928 9.542 -7.929 1.00 0.00 C ATOM 1144 OD1 ASP A 76 3.905 8.633 -8.802 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.746 10.497 -8.009 1.00 0.00 O ATOM 0 H ASP A 76 1.667 11.311 -7.171 1.00 0.00 H new ATOM 0 HA ASP A 76 1.567 8.628 -8.033 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.196 10.151 -5.992 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.324 8.414 -6.190 1.00 0.00 H new ATOM 1150 N SER A 77 0.177 9.561 -5.252 1.00 0.00 N ATOM 1151 CA SER A 77 -0.601 9.225 -4.100 1.00 0.00 C ATOM 1152 C SER A 77 -1.919 8.618 -4.437 1.00 0.00 C ATOM 1153 O SER A 77 -2.484 7.750 -3.775 1.00 0.00 O ATOM 1154 CB SER A 77 -0.962 10.434 -3.221 1.00 0.00 C ATOM 1155 OG SER A 77 0.229 11.114 -2.853 1.00 0.00 O ATOM 0 H SER A 77 0.311 10.567 -5.354 1.00 0.00 H new ATOM 0 HA SER A 77 0.053 8.527 -3.577 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.627 11.107 -3.762 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.497 10.105 -2.330 1.00 0.00 H new ATOM 0 HG SER A 77 0.676 11.450 -3.658 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.389 9.089 -5.607 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.595 8.612 -6.209 1.00 0.00 C ATOM 1163 C GLU A 78 -3.380 7.409 -7.061 1.00 0.00 C ATOM 1164 O GLU A 78 -4.234 6.536 -7.208 1.00 0.00 O ATOM 1165 CB GLU A 78 -4.188 9.815 -6.961 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.443 9.503 -7.779 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.222 10.774 -8.088 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -5.769 11.540 -8.980 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -7.254 11.051 -7.421 1.00 0.00 O ATOM 0 H GLU A 78 -1.920 9.817 -6.146 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.300 8.251 -5.460 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.427 10.596 -6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.427 10.220 -7.628 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.162 9.009 -8.709 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.077 8.808 -7.228 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.212 7.254 -7.711 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.920 6.166 -8.592 1.00 0.00 C ATOM 1178 C GLU A 79 -1.748 4.942 -7.760 1.00 0.00 C ATOM 1179 O GLU A 79 -2.345 3.909 -8.059 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.713 6.462 -9.498 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.320 5.365 -10.490 1.00 0.00 C ATOM 1182 CD GLU A 79 0.579 5.946 -11.572 1.00 0.00 C ATOM 1183 OE1 GLU A 79 1.764 6.333 -11.391 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -0.006 5.948 -12.688 1.00 0.00 O ATOM 0 H GLU A 79 -1.440 7.914 -7.619 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.746 6.010 -9.286 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.923 7.372 -10.061 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.147 6.672 -8.863 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.197 4.559 -9.969 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -1.213 4.932 -10.940 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.863 5.027 -6.750 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.558 3.997 -5.806 1.00 0.00 C ATOM 1193 C GLU A 80 -1.731 3.143 -5.466 1.00 0.00 C ATOM 1194 O GLU A 80 -1.759 1.926 -5.641 1.00 0.00 O ATOM 1195 CB GLU A 80 0.120 4.694 -4.615 1.00 0.00 C ATOM 1196 CG GLU A 80 0.825 3.817 -3.578 1.00 0.00 C ATOM 1197 CD GLU A 80 0.708 4.336 -2.151 1.00 0.00 C ATOM 1198 OE1 GLU A 80 -0.445 4.316 -1.643 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.764 4.490 -1.481 1.00 0.00 O ATOM 0 H GLU A 80 -0.323 5.876 -6.583 1.00 0.00 H new ATOM 0 HA GLU A 80 0.128 3.261 -6.226 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.853 5.397 -5.012 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.637 5.282 -4.096 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.409 2.811 -3.624 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.880 3.738 -3.840 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.752 3.808 -4.896 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.970 3.223 -4.428 1.00 0.00 C ATOM 1208 C ILE A 81 -4.925 2.789 -5.485 1.00 0.00 C ATOM 1209 O ILE A 81 -5.790 1.949 -5.240 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.531 4.195 -3.432 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -5.793 3.721 -2.690 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -4.812 5.563 -4.077 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -5.550 2.465 -1.854 1.00 0.00 C ATOM 0 H ILE A 81 -2.724 4.818 -4.753 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.765 2.261 -3.959 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.745 4.278 -2.681 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.150 4.521 -2.041 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -6.583 3.523 -3.415 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.217 6.242 -3.327 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -3.885 5.974 -4.476 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.533 5.443 -4.885 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -6.474 2.177 -1.353 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.221 1.654 -2.503 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.781 2.667 -1.108 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.838 3.414 -6.673 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.746 3.085 -7.727 1.00 0.00 C ATOM 1227 C ARG A 82 -5.223 1.900 -8.463 1.00 0.00 C ATOM 1228 O ARG A 82 -6.059 1.134 -8.941 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.838 4.237 -8.741 1.00 0.00 C ATOM 1230 CG ARG A 82 -7.068 4.213 -9.651 1.00 0.00 C ATOM 1231 CD ARG A 82 -7.144 5.497 -10.480 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.996 5.389 -11.424 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.997 6.315 -11.501 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -5.207 7.634 -11.217 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -3.840 5.916 -12.105 1.00 0.00 N ATOM 0 H ARG A 82 -4.152 4.134 -6.901 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.724 2.891 -7.287 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.829 5.181 -8.195 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.945 4.221 -9.365 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.022 3.348 -10.312 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.971 4.107 -9.050 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.092 5.572 -11.012 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.061 6.383 -9.851 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.955 4.581 -12.045 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.134 7.954 -10.937 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -4.437 8.299 -11.285 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -3.756 4.967 -12.470 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.059 6.566 -12.191 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.912 1.721 -8.702 1.00 0.00 N ATOM 1250 CA GLU A 83 -3.294 0.567 -9.278 1.00 0.00 C ATOM 1251 C GLU A 83 -3.390 -0.604 -8.363 1.00 0.00 C ATOM 1252 O GLU A 83 -3.428 -1.758 -8.788 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.825 0.854 -9.630 1.00 0.00 C ATOM 1254 CG GLU A 83 -1.668 1.549 -10.984 1.00 0.00 C ATOM 1255 CD GLU A 83 -2.191 0.804 -12.204 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -1.586 -0.249 -12.539 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -3.290 1.095 -12.749 1.00 0.00 O ATOM 0 H GLU A 83 -3.229 2.444 -8.473 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.829 0.326 -10.197 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.384 1.478 -8.852 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.268 -0.083 -9.640 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.175 2.513 -10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.609 1.754 -11.140 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.245 -0.447 -7.035 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.538 -1.335 -5.953 1.00 0.00 C ATOM 1266 C ALA A 84 -4.889 -1.963 -5.943 1.00 0.00 C ATOM 1267 O ALA A 84 -5.066 -3.144 -5.646 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.400 -0.546 -4.640 1.00 0.00 C ATOM 0 H ALA A 84 -2.868 0.430 -6.675 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.832 -2.157 -6.073 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.619 -1.201 -3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.383 -0.165 -4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.101 0.289 -4.642 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.864 -1.127 -6.340 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.213 -1.558 -6.544 1.00 0.00 C ATOM 1276 C PHE A 85 -7.333 -2.542 -7.656 1.00 0.00 C ATOM 1277 O PHE A 85 -8.049 -3.536 -7.547 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.182 -0.367 -6.643 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.638 -0.645 -6.790 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.373 -0.934 -5.665 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.237 -0.465 -8.015 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.732 -1.084 -5.811 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.604 -0.543 -8.144 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.339 -0.817 -7.015 1.00 0.00 C ATOM 0 H PHE A 85 -5.714 -0.135 -6.523 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.522 -2.109 -5.656 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.050 0.243 -5.749 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.873 0.242 -7.493 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.900 -1.040 -4.700 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.628 -0.261 -8.883 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -12.327 -1.414 -4.973 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.084 -0.394 -9.100 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.417 -0.823 -7.075 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.609 -2.288 -8.761 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.366 -3.106 -9.909 1.00 0.00 C ATOM 1296 C ARG A 86 -5.758 -4.436 -9.625 1.00 0.00 C ATOM 1297 O ARG A 86 -5.762 -5.372 -10.424 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.631 -2.401 -11.061 1.00 0.00 C ATOM 1299 CG ARG A 86 -6.292 -1.200 -11.741 1.00 0.00 C ATOM 1300 CD ARG A 86 -6.108 -1.183 -13.260 1.00 0.00 C ATOM 1301 NE ARG A 86 -4.629 -1.137 -13.441 1.00 0.00 N ATOM 1302 CZ ARG A 86 -3.962 -1.965 -14.297 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -4.486 -2.960 -15.071 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -2.622 -1.708 -14.354 1.00 0.00 N ATOM 0 H ARG A 86 -6.134 -1.390 -8.857 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.381 -3.301 -10.255 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.664 -2.072 -10.681 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.434 -3.147 -11.831 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -7.358 -1.203 -11.512 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -5.879 -0.282 -11.322 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.540 -2.069 -13.725 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -6.593 -0.318 -13.712 1.00 0.00 H new ATOM 0 HE ARG A 86 -4.092 -0.457 -12.902 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.488 -3.151 -15.047 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.876 -3.512 -15.674 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.222 -0.959 -13.789 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -2.021 -2.265 -14.962 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.089 -4.582 -8.467 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.589 -5.852 -8.041 1.00 0.00 C ATOM 1320 C VAL A 87 -5.606 -6.667 -7.317 1.00 0.00 C ATOM 1321 O VAL A 87 -5.745 -7.882 -7.450 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.450 -5.597 -7.099 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.794 -6.872 -6.542 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.342 -4.793 -7.800 1.00 0.00 C ATOM 0 H VAL A 87 -4.894 -3.816 -7.823 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.292 -6.409 -8.930 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.896 -5.049 -6.269 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.980 -6.599 -5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.536 -7.454 -5.995 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.400 -7.468 -7.365 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.523 -4.617 -7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.973 -5.354 -8.658 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.744 -3.837 -8.137 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.482 -6.121 -6.455 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.547 -6.778 -5.765 1.00 0.00 C ATOM 1336 C PHE A 88 -8.581 -7.239 -6.735 1.00 0.00 C ATOM 1337 O PHE A 88 -8.967 -8.405 -6.682 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.166 -5.835 -4.720 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.429 -5.663 -3.437 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.319 -6.702 -2.542 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.673 -4.542 -3.187 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.614 -6.620 -1.364 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.855 -4.502 -2.082 1.00 0.00 C ATOM 1344 CZ PHE A 88 -5.819 -5.518 -1.157 1.00 0.00 C ATOM 0 H PHE A 88 -6.439 -5.129 -6.222 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.147 -7.650 -5.247 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.281 -4.853 -5.178 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.167 -6.198 -4.488 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.813 -7.633 -2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.721 -3.696 -3.856 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.683 -7.401 -0.621 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.218 -3.642 -1.936 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.181 -5.452 -0.288 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.160 -6.387 -7.600 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.057 -6.822 -8.624 1.00 0.00 C ATOM 1356 C ASP A 89 -9.295 -7.551 -9.676 1.00 0.00 C ATOM 1357 O ASP A 89 -8.265 -7.150 -10.217 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.758 -5.555 -9.144 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.735 -5.852 -10.272 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.763 -6.535 -10.016 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.552 -5.392 -11.431 1.00 0.00 O ATOM 0 H ASP A 89 -9.002 -5.379 -7.588 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.809 -7.524 -8.264 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.291 -5.075 -8.323 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -10.008 -4.846 -9.494 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.726 -8.803 -9.913 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.141 -9.857 -10.682 1.00 0.00 C ATOM 1368 C LYS A 90 -9.655 -9.818 -12.080 1.00 0.00 C ATOM 1369 O LYS A 90 -8.862 -9.762 -13.018 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.436 -11.265 -10.138 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.894 -12.406 -11.002 1.00 0.00 C ATOM 1372 CD LYS A 90 -9.005 -13.804 -10.390 1.00 0.00 C ATOM 1373 CE LYS A 90 -8.927 -14.914 -11.440 1.00 0.00 C ATOM 1374 NZ LYS A 90 -7.693 -14.674 -12.220 1.00 0.00 N ATOM 0 H LYS A 90 -10.608 -9.113 -9.506 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.066 -9.684 -10.629 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.011 -11.350 -9.138 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.515 -11.383 -10.038 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.425 -12.402 -11.954 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.845 -12.206 -11.221 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.206 -13.942 -9.661 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.948 -13.886 -9.849 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.900 -15.895 -10.965 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.804 -14.897 -12.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.411 -15.551 -12.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.868 -13.931 -12.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.931 -14.371 -11.580 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.987 -9.852 -12.264 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.606 -9.964 -13.548 1.00 0.00 C ATOM 1390 C ASP A 91 -11.378 -8.721 -14.337 1.00 0.00 C ATOM 1391 O ASP A 91 -10.789 -8.716 -15.417 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.076 -10.330 -13.279 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.734 -9.560 -12.142 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.778 -8.301 -12.099 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.268 -10.180 -11.185 1.00 0.00 O ATOM 0 H ASP A 91 -11.654 -9.800 -11.494 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.178 -10.745 -14.177 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.649 -10.162 -14.191 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.135 -11.396 -13.058 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.669 -7.553 -13.736 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.674 -6.359 -14.524 1.00 0.00 C ATOM 1402 C GLY A 92 -12.959 -5.616 -14.650 1.00 0.00 C ATOM 1403 O GLY A 92 -13.242 -4.702 -15.423 1.00 0.00 O ATOM 0 H GLY A 92 -11.892 -7.435 -12.748 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.933 -5.678 -14.105 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.337 -6.619 -15.528 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.942 -5.934 -13.789 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.146 -5.179 -13.632 1.00 0.00 C ATOM 1409 C ASN A 93 -15.094 -4.119 -12.586 1.00 0.00 C ATOM 1410 O ASN A 93 -15.945 -3.231 -12.585 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.438 -5.969 -13.366 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.489 -6.749 -12.060 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.669 -6.555 -11.163 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.507 -7.643 -11.947 1.00 0.00 N ATOM 0 H ASN A 93 -13.896 -6.749 -13.178 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.194 -4.747 -14.632 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.276 -5.272 -13.382 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.589 -6.668 -14.189 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.615 -8.187 -11.091 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.163 -7.769 -12.718 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.104 -4.069 -11.677 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.777 -2.910 -10.906 1.00 0.00 C ATOM 1423 C GLY A 94 -14.554 -2.935 -9.635 1.00 0.00 C ATOM 1424 O GLY A 94 -14.796 -1.892 -9.030 1.00 0.00 O ATOM 0 H GLY A 94 -13.507 -4.870 -11.471 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.708 -2.889 -10.693 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.007 -2.006 -11.470 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.844 -4.135 -9.101 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.513 -4.382 -7.861 1.00 0.00 C ATOM 1430 C TYR A 95 -14.896 -5.561 -7.190 1.00 0.00 C ATOM 1431 O TYR A 95 -14.786 -6.656 -7.739 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.023 -4.665 -7.935 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.688 -3.539 -8.649 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.065 -2.395 -7.985 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.302 -3.784 -9.854 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.072 -1.568 -8.426 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.224 -2.913 -10.387 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.653 -1.840 -9.642 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.721 -1.117 -10.214 1.00 0.00 O ATOM 0 H TYR A 95 -14.590 -5.001 -9.576 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.396 -3.444 -7.318 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.206 -5.604 -8.458 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.436 -4.773 -6.932 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.546 -2.134 -7.075 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.054 -4.684 -10.397 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.398 -0.727 -7.832 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.608 -3.071 -11.384 1.00 0.00 H new ATOM 0 HH TYR A 95 -20.952 -1.507 -11.083 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.437 -5.346 -5.944 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.694 -6.366 -5.272 1.00 0.00 C ATOM 1451 C ILE A 96 -14.635 -7.248 -4.525 1.00 0.00 C ATOM 1452 O ILE A 96 -15.132 -6.859 -3.469 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.605 -5.980 -4.316 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.617 -5.061 -5.057 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.777 -7.189 -3.849 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.051 -4.101 -4.011 1.00 0.00 C ATOM 0 H ILE A 96 -14.576 -4.487 -5.412 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.167 -6.836 -6.102 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.083 -5.509 -3.457 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.820 -5.642 -5.522 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.119 -4.514 -5.855 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.002 -6.855 -3.159 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.428 -7.903 -3.345 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.313 -7.667 -4.712 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.341 -3.423 -4.485 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.863 -3.524 -3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.544 -4.670 -3.231 1.00 0.00 H new ATOM 1468 N SER A 97 -14.798 -8.497 -4.997 1.00 0.00 N ATOM 1469 CA SER A 97 -15.598 -9.473 -4.324 1.00 0.00 C ATOM 1470 C SER A 97 -14.844 -10.243 -3.295 1.00 0.00 C ATOM 1471 O SER A 97 -13.626 -10.129 -3.164 1.00 0.00 O ATOM 1472 CB SER A 97 -16.232 -10.444 -5.334 1.00 0.00 C ATOM 1473 OG SER A 97 -15.309 -11.190 -6.113 1.00 0.00 O ATOM 0 H SER A 97 -14.368 -8.834 -5.858 1.00 0.00 H new ATOM 0 HA SER A 97 -16.377 -8.917 -3.803 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.873 -11.140 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.875 -9.876 -6.006 1.00 0.00 H new ATOM 0 HG SER A 97 -14.977 -10.634 -6.848 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.573 -11.116 -2.577 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.072 -11.762 -1.404 1.00 0.00 C ATOM 1481 C ALA A 98 -14.022 -12.750 -1.777 1.00 0.00 C ATOM 1482 O ALA A 98 -12.985 -12.885 -1.130 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.222 -12.360 -0.576 1.00 0.00 C ATOM 0 H ALA A 98 -16.529 -11.378 -2.816 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.593 -11.030 -0.754 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.817 -12.846 0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.905 -11.566 -0.275 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.761 -13.093 -1.177 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.325 -13.548 -2.817 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.460 -14.521 -3.409 1.00 0.00 C ATOM 1491 C ALA A 99 -12.279 -13.839 -4.009 1.00 0.00 C ATOM 1492 O ALA A 99 -11.138 -14.212 -3.740 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.184 -15.369 -4.468 1.00 0.00 C ATOM 0 H ALA A 99 -15.236 -13.510 -3.274 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.132 -15.201 -2.623 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.489 -16.094 -4.891 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.019 -15.894 -4.005 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.558 -14.720 -5.260 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.423 -12.702 -4.713 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.259 -11.947 -5.059 1.00 0.00 C ATOM 1501 C GLU A 100 -10.431 -11.395 -3.950 1.00 0.00 C ATOM 1502 O GLU A 100 -9.204 -11.485 -3.971 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.745 -10.777 -5.932 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.216 -11.144 -7.340 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.862 -9.923 -7.980 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.948 -9.450 -7.552 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.400 -9.391 -9.025 1.00 0.00 O ATOM 0 H GLU A 100 -13.311 -12.316 -5.033 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.587 -12.652 -5.549 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.565 -10.279 -5.414 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.935 -10.053 -6.018 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.373 -11.483 -7.942 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.929 -11.968 -7.296 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.062 -10.903 -2.869 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.354 -10.475 -1.703 1.00 0.00 C ATOM 1516 C LEU A 101 -9.521 -11.577 -1.144 1.00 0.00 C ATOM 1517 O LEU A 101 -8.354 -11.414 -0.790 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.288 -9.966 -0.593 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.562 -9.448 0.661 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.698 -8.242 0.254 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.593 -9.028 1.722 1.00 0.00 C ATOM 0 H LEU A 101 -12.075 -10.801 -2.803 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.721 -9.651 -2.031 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.908 -9.165 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.960 -10.773 -0.302 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.932 -10.230 1.084 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.174 -7.858 1.129 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.972 -8.552 -0.497 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.336 -7.460 -0.159 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.075 -8.662 2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.227 -8.238 1.320 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.209 -9.886 1.991 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.092 -12.794 -1.123 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.503 -13.933 -0.490 1.00 0.00 C ATOM 1535 C ARG A 102 -8.329 -14.386 -1.289 1.00 0.00 C ATOM 1536 O ARG A 102 -7.260 -14.651 -0.740 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.527 -15.057 -0.263 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.086 -16.203 0.650 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.317 -17.094 0.818 1.00 0.00 C ATOM 1540 NE ARG A 102 -10.932 -18.192 1.749 1.00 0.00 N ATOM 1541 CZ ARG A 102 -11.768 -18.722 2.689 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.125 -18.582 2.650 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -11.198 -19.487 3.665 1.00 0.00 N ATOM 0 H ARG A 102 -10.992 -12.992 -1.560 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.156 -13.648 0.503 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.432 -14.616 0.155 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.795 -15.476 -1.233 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.258 -16.758 0.210 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.741 -15.826 1.613 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.155 -16.524 1.219 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.636 -17.497 -0.143 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.987 -18.570 1.680 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.562 -18.060 1.891 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.702 -19.000 3.380 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.190 -19.640 3.669 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.780 -19.905 4.390 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.523 -14.467 -2.617 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.615 -15.001 -3.584 1.00 0.00 C ATOM 1559 C HIS A 103 -6.294 -14.313 -3.566 1.00 0.00 C ATOM 1560 O HIS A 103 -5.251 -14.959 -3.646 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.177 -14.968 -5.016 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.148 -15.499 -5.970 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -6.755 -14.778 -7.079 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.475 -16.681 -5.999 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.917 -15.582 -7.786 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.703 -16.715 -7.143 1.00 0.00 N ATOM 0 H HIS A 103 -9.385 -14.132 -3.048 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.477 -16.041 -3.290 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.086 -15.566 -5.075 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.448 -13.948 -5.288 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.535 -17.460 -5.254 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.485 -15.328 -8.743 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.085 -17.472 -7.436 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.309 -12.976 -3.413 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.116 -12.189 -3.432 1.00 0.00 C ATOM 1576 C VAL A 104 -4.426 -12.177 -2.112 1.00 0.00 C ATOM 1577 O VAL A 104 -3.212 -12.367 -2.051 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.434 -10.839 -4.003 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.800 -9.746 -2.985 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.416 -10.335 -5.040 1.00 0.00 C ATOM 0 H VAL A 104 -7.162 -12.434 -3.274 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.375 -12.643 -4.091 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.361 -11.041 -4.540 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.010 -8.815 -3.511 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.683 -10.052 -2.424 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.967 -9.595 -2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.721 -9.353 -5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.432 -10.262 -4.578 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.373 -11.033 -5.876 1.00 0.00 H new ATOM 1590 N MET A 105 -5.173 -12.183 -0.994 1.00 0.00 N ATOM 1591 CA MET A 105 -4.582 -12.415 0.288 1.00 0.00 C ATOM 1592 C MET A 105 -4.087 -13.788 0.587 1.00 0.00 C ATOM 1593 O MET A 105 -3.079 -13.964 1.269 1.00 0.00 O ATOM 1594 CB MET A 105 -5.571 -11.988 1.385 1.00 0.00 C ATOM 1595 CG MET A 105 -5.994 -10.518 1.363 1.00 0.00 C ATOM 1596 SD MET A 105 -7.216 -10.145 2.656 1.00 0.00 S ATOM 1597 CE MET A 105 -6.225 -10.184 4.177 1.00 0.00 C ATOM 0 H MET A 105 -6.181 -12.028 -0.976 1.00 0.00 H new ATOM 0 HA MET A 105 -3.675 -11.811 0.265 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.465 -12.605 1.302 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.124 -12.204 2.355 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.117 -9.886 1.499 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.413 -10.275 0.386 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.795 -10.667 4.970 1.00 0.00 H new ATOM 0 HE2 MET A 105 -5.306 -10.743 3.998 1.00 0.00 H new ATOM 0 HE3 MET A 105 -5.978 -9.166 4.476 1.00 0.00 H new ATOM 1607 N THR A 106 -4.711 -14.875 0.100 1.00 0.00 N ATOM 1608 CA THR A 106 -4.209 -16.206 -0.053 1.00 0.00 C ATOM 1609 C THR A 106 -2.865 -16.230 -0.695 1.00 0.00 C ATOM 1610 O THR A 106 -1.876 -16.637 -0.086 1.00 0.00 O ATOM 1611 CB THR A 106 -5.167 -17.077 -0.809 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.303 -17.466 -0.050 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.529 -18.374 -1.333 1.00 0.00 C ATOM 0 H THR A 106 -5.677 -14.811 -0.222 1.00 0.00 H new ATOM 0 HA THR A 106 -4.103 -16.611 0.953 1.00 0.00 H new ATOM 0 HB THR A 106 -5.469 -16.439 -1.639 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.947 -16.728 -0.023 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.278 -18.957 -1.870 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.708 -18.129 -2.007 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.149 -18.957 -0.494 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.754 -15.743 -1.943 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.563 -15.629 -2.725 1.00 0.00 C ATOM 1623 C ASN A 107 -0.542 -14.793 -2.033 1.00 0.00 C ATOM 1624 O ASN A 107 0.636 -15.092 -2.220 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.805 -15.054 -4.131 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.752 -15.980 -4.880 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.712 -17.200 -4.730 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.506 -15.342 -5.815 1.00 0.00 N ATOM 0 H ASN A 107 -3.571 -15.399 -2.448 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.199 -16.650 -2.841 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.231 -14.053 -4.062 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.862 -14.962 -4.669 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.091 -15.881 -6.453 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.486 -14.324 -5.878 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.813 -13.689 -1.314 1.00 0.00 N ATOM 1636 CA LEU A 108 0.199 -12.922 -0.656 1.00 0.00 C ATOM 1637 C LEU A 108 0.674 -13.444 0.656 1.00 0.00 C ATOM 1638 O LEU A 108 1.737 -13.096 1.168 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.300 -11.474 -0.522 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.325 -10.557 -1.757 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.921 -9.207 -1.323 1.00 0.00 C ATOM 1642 CD2 LEU A 108 1.045 -10.305 -2.410 1.00 0.00 C ATOM 0 H LEU A 108 -1.756 -13.321 -1.187 1.00 0.00 H new ATOM 0 HA LEU A 108 1.085 -12.991 -1.287 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.315 -11.515 -0.127 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.317 -10.986 0.233 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.920 -11.068 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.953 -8.532 -2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.931 -9.360 -0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.302 -8.771 -0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.922 -9.648 -3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.712 -9.835 -1.687 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.473 -11.253 -2.735 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.057 -14.457 1.154 1.00 0.00 N ATOM 1655 CA GLY A 109 0.443 -15.300 2.196 1.00 0.00 C ATOM 1656 C GLY A 109 -0.482 -15.808 3.247 1.00 0.00 C ATOM 1657 O GLY A 109 -0.250 -16.837 3.879 1.00 0.00 O ATOM 0 H GLY A 109 -0.996 -14.693 0.834 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.902 -16.167 1.720 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.240 -14.754 2.701 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.588 -15.092 3.520 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.465 -15.364 4.616 1.00 0.00 C ATOM 1663 C GLU A 110 -3.258 -16.625 4.643 1.00 0.00 C ATOM 1664 O GLU A 110 -3.588 -17.147 3.579 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.440 -14.177 4.692 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.904 -12.830 5.181 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.641 -12.827 6.681 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -1.642 -13.473 7.095 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.375 -12.182 7.476 1.00 0.00 O ATOM 0 H GLU A 110 -1.882 -14.294 2.956 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.794 -15.504 5.464 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.860 -14.027 3.697 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.264 -14.464 5.345 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.981 -12.594 4.651 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.621 -12.046 4.938 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.595 -17.091 5.859 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.395 -18.266 6.016 1.00 0.00 C ATOM 1678 C LYS A 111 -5.665 -17.732 6.582 1.00 0.00 C ATOM 1679 O LYS A 111 -5.753 -17.633 7.805 1.00 0.00 O ATOM 1680 CB LYS A 111 -3.736 -19.299 6.947 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.707 -20.204 6.267 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.405 -19.543 5.812 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.572 -18.776 6.841 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.524 -18.143 6.074 1.00 0.00 N ATOM 0 H LYS A 111 -3.313 -16.653 6.736 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.539 -18.809 5.082 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.250 -18.771 7.768 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.515 -19.922 7.386 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.456 -21.011 6.955 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.178 -20.662 5.397 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -0.771 -20.321 5.387 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.649 -18.853 5.004 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.175 -18.027 7.354 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.179 -19.446 7.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.909 -17.343 6.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 1.276 -18.840 5.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.157 -17.800 5.163 1.00 0.00 H new ATOM 1698 N LEU A 112 -6.648 -17.407 5.724 1.00 0.00 N ATOM 1699 CA LEU A 112 -7.926 -16.851 6.046 1.00 0.00 C ATOM 1700 C LEU A 112 -8.854 -17.977 6.345 1.00 0.00 C ATOM 1701 O LEU A 112 -8.671 -19.088 5.849 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.581 -15.962 4.975 1.00 0.00 C ATOM 1703 CG LEU A 112 -7.885 -14.600 4.814 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.065 -13.926 3.444 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.468 -13.714 5.928 1.00 0.00 C ATOM 0 H LEU A 112 -6.538 -17.546 4.719 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.744 -16.187 6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.568 -16.485 4.019 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.627 -15.800 5.235 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.807 -14.746 4.885 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.536 -12.973 3.435 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.661 -14.572 2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.125 -13.754 3.260 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.018 -12.723 5.877 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.547 -13.630 5.799 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.253 -14.161 6.899 1.00 0.00 H new ATOM 1717 N THR A 113 -9.918 -17.778 7.143 1.00 0.00 N ATOM 1718 CA THR A 113 -11.011 -18.670 7.375 1.00 0.00 C ATOM 1719 C THR A 113 -12.204 -17.930 6.875 1.00 0.00 C ATOM 1720 O THR A 113 -12.137 -16.715 6.696 1.00 0.00 O ATOM 1721 CB THR A 113 -11.245 -19.109 8.790 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.474 -18.062 9.721 1.00 0.00 O ATOM 1723 CG2 THR A 113 -9.976 -19.831 9.274 1.00 0.00 C ATOM 0 H THR A 113 -10.020 -16.913 7.673 1.00 0.00 H new ATOM 0 HA THR A 113 -10.793 -19.610 6.869 1.00 0.00 H new ATOM 0 HB THR A 113 -12.144 -19.724 8.760 1.00 0.00 H new ATOM 0 HG1 THR A 113 -10.616 -17.739 10.068 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.116 -20.163 10.303 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.783 -20.694 8.637 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.128 -19.148 9.225 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.369 -18.573 6.678 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.498 -17.915 6.098 1.00 0.00 C ATOM 1733 C ASP A 114 -15.106 -16.898 7.001 1.00 0.00 C ATOM 1734 O ASP A 114 -15.544 -15.859 6.512 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.752 -18.762 5.824 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.450 -20.046 5.064 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.050 -19.890 3.880 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.433 -21.171 5.633 1.00 0.00 O ATOM 0 H ASP A 114 -13.529 -19.551 6.921 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.023 -17.555 5.185 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.229 -19.011 6.772 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.467 -18.169 5.254 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.105 -17.094 8.332 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.319 -16.153 9.387 1.00 0.00 C ATOM 1745 C GLU A 115 -14.729 -14.799 9.190 1.00 0.00 C ATOM 1746 O GLU A 115 -15.257 -13.692 9.279 1.00 0.00 O ATOM 1747 CB GLU A 115 -14.739 -16.754 10.678 1.00 0.00 C ATOM 1748 CG GLU A 115 -14.769 -16.013 12.017 1.00 0.00 C ATOM 1749 CD GLU A 115 -14.160 -16.901 13.093 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.375 -18.142 13.079 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -13.528 -16.319 14.014 1.00 0.00 O ATOM 0 H GLU A 115 -14.933 -18.026 8.709 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.396 -15.989 9.423 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.249 -17.704 10.836 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -13.694 -16.984 10.472 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.213 -15.079 11.942 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -15.794 -15.753 12.280 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.448 -14.846 8.780 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.610 -13.692 8.682 1.00 0.00 C ATOM 1760 C GLU A 116 -12.843 -12.857 7.470 1.00 0.00 C ATOM 1761 O GLU A 116 -13.054 -11.647 7.520 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.158 -14.168 8.500 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.536 -14.842 9.724 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.241 -15.618 9.531 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.223 -14.886 9.408 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.202 -16.876 9.602 1.00 0.00 O ATOM 0 H GLU A 116 -12.982 -15.712 8.509 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.819 -13.113 9.581 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.123 -14.866 7.664 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.543 -13.311 8.225 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.355 -14.072 10.474 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.276 -15.525 10.141 1.00 0.00 H new ATOM 1773 N VAL A 117 -12.990 -13.505 6.300 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.278 -12.873 5.050 1.00 0.00 C ATOM 1775 C VAL A 117 -14.611 -12.211 4.997 1.00 0.00 C ATOM 1776 O VAL A 117 -14.769 -11.098 4.499 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.160 -13.813 3.886 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -13.362 -13.036 2.575 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -11.771 -14.475 3.877 1.00 0.00 C ATOM 0 H VAL A 117 -12.904 -14.518 6.223 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.515 -12.099 4.972 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.923 -14.586 3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.276 -13.719 1.730 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.351 -12.578 2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -12.602 -12.259 2.492 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.697 -15.155 3.028 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.002 -13.707 3.794 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.628 -15.033 4.802 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.669 -12.838 5.543 1.00 0.00 N ATOM 1790 CA ASP A 118 -16.938 -12.272 5.878 1.00 0.00 C ATOM 1791 C ASP A 118 -16.796 -11.022 6.677 1.00 0.00 C ATOM 1792 O ASP A 118 -17.415 -10.006 6.367 1.00 0.00 O ATOM 1793 CB ASP A 118 -17.768 -13.310 6.652 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.186 -13.387 6.104 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.559 -12.787 5.061 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -19.877 -14.250 6.707 1.00 0.00 O ATOM 0 H ASP A 118 -15.629 -13.832 5.769 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.448 -12.005 4.952 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.293 -14.288 6.581 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.796 -13.045 7.709 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.072 -11.087 7.809 1.00 0.00 N ATOM 1802 CA GLU A 119 -15.854 -9.924 8.613 1.00 0.00 C ATOM 1803 C GLU A 119 -15.118 -8.808 7.955 1.00 0.00 C ATOM 1804 O GLU A 119 -15.479 -7.638 8.080 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.059 -10.408 9.838 1.00 0.00 C ATOM 1806 CG GLU A 119 -14.935 -9.397 10.979 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.030 -9.999 12.044 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -14.431 -10.959 12.755 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -12.852 -9.552 12.015 1.00 0.00 O ATOM 0 H GLU A 119 -15.640 -11.939 8.166 1.00 0.00 H new ATOM 0 HA GLU A 119 -16.828 -9.494 8.848 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.533 -11.310 10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.057 -10.688 9.513 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.520 -8.458 10.613 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.916 -9.171 11.396 1.00 0.00 H new ATOM 1816 N MET A 120 -14.170 -9.150 7.065 1.00 0.00 N ATOM 1817 CA MET A 120 -13.532 -8.198 6.209 1.00 0.00 C ATOM 1818 C MET A 120 -14.409 -7.521 5.213 1.00 0.00 C ATOM 1819 O MET A 120 -14.224 -6.318 5.033 1.00 0.00 O ATOM 1820 CB MET A 120 -12.265 -8.835 5.614 1.00 0.00 C ATOM 1821 CG MET A 120 -11.083 -9.019 6.567 1.00 0.00 C ATOM 1822 SD MET A 120 -9.576 -9.738 5.849 1.00 0.00 S ATOM 1823 CE MET A 120 -9.128 -8.206 4.984 1.00 0.00 C ATOM 0 H MET A 120 -13.840 -10.107 6.937 1.00 0.00 H new ATOM 0 HA MET A 120 -13.246 -7.349 6.830 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.532 -9.811 5.209 1.00 0.00 H new ATOM 0 HB3 MET A 120 -11.935 -8.221 4.776 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.830 -8.047 6.991 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.405 -9.653 7.393 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.051 -8.185 4.815 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.646 -8.164 4.026 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.417 -7.348 5.591 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.278 -8.232 4.473 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.192 -7.554 3.608 1.00 0.00 C ATOM 1835 C ILE A 121 -17.213 -6.758 4.346 1.00 0.00 C ATOM 1836 O ILE A 121 -17.584 -5.680 3.884 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.859 -8.569 2.728 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.874 -9.288 1.791 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.978 -7.837 1.967 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.419 -8.437 0.606 1.00 0.00 C ATOM 0 H ILE A 121 -15.348 -9.250 4.471 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.624 -6.839 3.013 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.278 -9.372 3.334 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.999 -9.594 2.364 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.342 -10.197 1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.492 -8.540 1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.689 -7.418 2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.547 -7.034 1.370 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.726 -9.011 -0.009 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.285 -8.153 0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.921 -7.540 0.973 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.638 -7.095 5.577 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.583 -6.403 6.397 1.00 0.00 C ATOM 1854 C ARG A 122 -18.026 -5.067 6.749 1.00 0.00 C ATOM 1855 O ARG A 122 -18.641 -4.036 6.480 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.004 -7.238 7.618 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.168 -6.595 8.374 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.051 -7.600 9.118 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.823 -8.527 8.244 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.689 -9.883 8.160 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.843 -10.593 8.963 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -22.466 -10.522 7.238 1.00 0.00 N ATOM 0 H ARG A 122 -17.285 -7.932 6.040 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.508 -6.245 5.842 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.291 -8.238 7.293 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.154 -7.353 8.290 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -19.771 -5.875 9.089 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.784 -6.037 7.668 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.422 -8.191 9.783 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.751 -7.050 9.747 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.529 -8.102 7.643 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.278 -10.110 9.662 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -20.776 -11.606 8.864 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -23.108 -9.987 6.653 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -22.405 -11.535 7.134 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.771 -5.004 7.228 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.950 -3.888 7.582 1.00 0.00 C ATOM 1878 C GLU A 123 -15.744 -2.987 6.414 1.00 0.00 C ATOM 1879 O GLU A 123 -15.923 -1.771 6.459 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.577 -4.432 8.010 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.503 -3.378 8.285 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.360 -3.906 9.141 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.575 -4.639 10.143 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.184 -3.645 8.770 1.00 0.00 O ATOM 0 H GLU A 123 -16.261 -5.872 7.389 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.435 -3.327 8.381 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.709 -5.033 8.910 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.212 -5.101 7.230 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.104 -3.018 7.337 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.959 -2.523 8.784 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.568 -3.489 5.178 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.250 -2.741 4.001 1.00 0.00 C ATOM 1893 C ALA A 124 -16.412 -2.111 3.314 1.00 0.00 C ATOM 1894 O ALA A 124 -16.352 -0.945 2.926 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.687 -3.786 3.024 1.00 0.00 C ATOM 0 H ALA A 124 -15.654 -4.488 4.989 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.585 -1.926 4.287 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.415 -3.299 2.088 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.804 -4.253 3.460 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.443 -4.547 2.831 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.536 -2.846 3.246 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.694 -2.465 2.498 1.00 0.00 C ATOM 1903 C ASP A 125 -19.428 -1.423 3.269 1.00 0.00 C ATOM 1904 O ASP A 125 -19.673 -1.549 4.468 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.613 -3.694 2.391 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.738 -3.640 1.367 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.599 -3.408 0.136 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.864 -3.917 1.861 1.00 0.00 O ATOM 0 H ASP A 125 -17.643 -3.738 3.729 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.410 -2.094 1.513 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.992 -4.560 2.164 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.057 -3.869 3.371 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.799 -0.310 2.611 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.578 0.733 3.201 1.00 0.00 C ATOM 1915 C ILE A 126 -22.017 0.555 2.858 1.00 0.00 C ATOM 1916 O ILE A 126 -22.939 0.666 3.664 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.086 2.104 2.841 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.631 2.221 3.324 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.856 3.206 3.588 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -18.006 3.571 2.975 1.00 0.00 C ATOM 0 H ILE A 126 -19.549 -0.131 1.638 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.464 0.654 4.282 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.208 2.229 1.765 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.597 2.077 4.404 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.038 1.423 2.877 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.467 4.182 3.298 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.914 3.147 3.334 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.733 3.071 4.663 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.979 3.601 3.338 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -18.012 3.706 1.893 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.580 4.370 3.444 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.261 0.254 1.570 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.605 0.245 1.082 1.00 0.00 C ATOM 1934 C ASP A 127 -24.437 -0.963 1.342 1.00 0.00 C ATOM 1935 O ASP A 127 -25.030 -1.082 2.413 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.554 0.674 -0.394 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.671 -0.177 -1.295 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.946 -1.405 -1.354 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.650 0.235 -1.908 1.00 0.00 O ATOM 0 H ASP A 127 -21.546 0.022 0.880 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.168 0.958 1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.568 0.662 -0.793 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.205 1.705 -0.442 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.573 -1.991 0.485 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.187 -3.219 0.883 1.00 0.00 C ATOM 1946 C GLY A 128 -25.108 -4.336 -0.100 1.00 0.00 C ATOM 1947 O GLY A 128 -25.862 -5.299 0.023 1.00 0.00 O ATOM 0 H GLY A 128 -24.257 -1.971 -0.485 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.726 -3.548 1.815 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.238 -3.024 1.098 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.222 -4.275 -1.111 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.012 -5.312 -2.072 1.00 0.00 C ATOM 1953 C ASP A 129 -23.038 -6.338 -1.603 1.00 0.00 C ATOM 1954 O ASP A 129 -23.140 -7.511 -1.958 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.726 -4.719 -3.462 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.434 -3.931 -3.620 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.660 -3.907 -2.626 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.206 -3.314 -4.695 1.00 0.00 O ATOM 0 H ASP A 129 -23.624 -3.463 -1.265 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.938 -5.877 -2.183 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.716 -5.536 -4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.557 -4.066 -3.730 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.037 -6.004 -0.770 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.013 -6.894 -0.317 1.00 0.00 C ATOM 1965 C GLY A 130 -19.887 -7.046 -1.281 1.00 0.00 C ATOM 1966 O GLY A 130 -19.173 -8.015 -1.027 1.00 0.00 O ATOM 0 H GLY A 130 -21.937 -5.062 -0.392 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.621 -6.530 0.633 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.452 -7.873 -0.126 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.678 -6.102 -2.217 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.528 -5.949 -3.053 1.00 0.00 C ATOM 1972 C GLN A 131 -17.921 -4.636 -2.697 1.00 0.00 C ATOM 1973 O GLN A 131 -18.654 -3.694 -2.401 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.813 -5.855 -4.561 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.457 -7.095 -5.184 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.126 -7.193 -6.666 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.217 -7.853 -7.167 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -19.946 -6.453 -7.460 1.00 0.00 N ATOM 0 H GLN A 131 -20.377 -5.383 -2.403 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.912 -6.833 -2.887 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -19.465 -5.000 -4.738 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.875 -5.654 -5.079 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.106 -7.989 -4.669 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -20.538 -7.054 -5.051 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -20.700 -5.906 -7.045 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.807 -6.446 -8.470 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.580 -4.557 -2.763 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.973 -3.286 -2.519 1.00 0.00 C ATOM 1989 C VAL A 132 -15.780 -2.450 -3.737 1.00 0.00 C ATOM 1990 O VAL A 132 -15.097 -2.815 -4.693 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.668 -3.277 -1.779 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -14.532 -1.971 -0.979 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.663 -4.463 -0.799 1.00 0.00 C ATOM 0 H VAL A 132 -15.945 -5.327 -2.973 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.733 -2.860 -1.864 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.841 -3.354 -2.485 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.583 -1.970 -0.443 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -14.565 -1.121 -1.661 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -15.352 -1.895 -0.265 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.722 -4.477 -0.249 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.491 -4.359 -0.098 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.772 -5.394 -1.355 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.518 -1.330 -3.846 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.200 -0.355 -4.842 1.00 0.00 C ATOM 2005 C ASN A 133 -14.983 0.449 -4.541 1.00 0.00 C ATOM 2006 O ASN A 133 -14.320 0.289 -3.518 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.444 0.440 -5.273 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.013 1.448 -4.284 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -17.390 2.297 -3.649 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.348 1.344 -4.043 1.00 0.00 N ATOM 0 H ASN A 133 -17.319 -1.102 -3.257 1.00 0.00 H new ATOM 0 HA ASN A 133 -15.891 -0.897 -5.736 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.201 0.972 -6.193 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.231 -0.274 -5.516 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.792 1.956 -3.359 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.905 0.654 -4.547 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.556 1.344 -5.451 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.379 2.147 -5.330 1.00 0.00 C ATOM 2019 C TYR A 134 -13.554 3.244 -4.337 1.00 0.00 C ATOM 2020 O TYR A 134 -12.585 3.720 -3.747 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.016 2.873 -6.636 1.00 0.00 C ATOM 2022 CG TYR A 134 -11.727 3.621 -6.655 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -10.544 3.030 -6.278 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.795 4.964 -6.942 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.426 3.830 -6.260 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.654 5.729 -7.003 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.474 5.167 -6.577 1.00 0.00 C ATOM 2028 OH TYR A 134 -8.409 6.071 -6.379 1.00 0.00 O ATOM 0 H TYR A 134 -15.062 1.516 -6.320 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.606 1.437 -5.036 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.993 2.136 -7.439 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.818 3.573 -6.869 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -10.495 1.985 -6.008 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.756 5.423 -7.122 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.477 3.393 -5.987 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.684 6.742 -7.375 1.00 0.00 H new ATOM 0 HH TYR A 134 -8.677 6.964 -6.681 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.780 3.782 -4.206 1.00 0.00 N ATOM 2039 CA GLU A 135 -15.104 4.772 -3.227 1.00 0.00 C ATOM 2040 C GLU A 135 -15.090 4.287 -1.819 1.00 0.00 C ATOM 2041 O GLU A 135 -14.472 4.841 -0.911 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.296 5.693 -3.539 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.089 6.498 -4.823 1.00 0.00 C ATOM 2044 CD GLU A 135 -17.440 6.914 -5.389 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -18.197 7.716 -4.780 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -17.883 6.341 -6.420 1.00 0.00 O ATOM 0 H GLU A 135 -15.568 3.521 -4.798 1.00 0.00 H new ATOM 0 HA GLU A 135 -14.247 5.439 -3.319 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -17.201 5.093 -3.631 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.451 6.377 -2.705 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.482 7.380 -4.617 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -15.545 5.901 -5.555 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.663 3.095 -1.573 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.482 2.400 -0.336 1.00 0.00 C ATOM 2055 C GLU A 136 -14.064 2.131 0.035 1.00 0.00 C ATOM 2056 O GLU A 136 -13.681 2.417 1.168 1.00 0.00 O ATOM 2057 CB GLU A 136 -16.310 1.111 -0.467 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.833 1.254 -0.484 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.595 0.008 -0.912 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.458 -0.602 -2.006 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.507 -0.343 -0.117 1.00 0.00 O ATOM 0 H GLU A 136 -16.260 2.607 -2.241 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.819 3.027 0.489 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -16.008 0.608 -1.386 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -16.042 0.453 0.359 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -18.166 1.540 0.514 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.098 2.071 -1.155 1.00 0.00 H new ATOM 2068 N PHE A 137 -13.192 1.701 -0.894 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.790 1.443 -0.781 1.00 0.00 C ATOM 2070 C PHE A 137 -11.019 2.663 -0.412 1.00 0.00 C ATOM 2071 O PHE A 137 -10.075 2.648 0.376 1.00 0.00 O ATOM 2072 CB PHE A 137 -11.224 0.945 -2.121 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.899 0.263 -2.091 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.747 -0.996 -1.558 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.860 0.840 -2.782 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.569 -1.691 -1.703 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.692 0.142 -2.983 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.557 -1.109 -2.429 1.00 0.00 C ATOM 0 H PHE A 137 -13.515 1.512 -1.843 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.685 0.691 0.001 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.948 0.257 -2.558 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -11.149 1.799 -2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.566 -1.446 -1.017 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.961 1.844 -3.168 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.442 -2.667 -1.259 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.892 0.571 -3.568 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.632 -1.649 -2.568 1.00 0.00 H new ATOM 2088 N VAL A 138 -11.299 3.782 -1.104 1.00 0.00 N ATOM 2089 CA VAL A 138 -10.572 4.980 -0.820 1.00 0.00 C ATOM 2090 C VAL A 138 -10.888 5.532 0.528 1.00 0.00 C ATOM 2091 O VAL A 138 -10.067 6.035 1.293 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.618 6.016 -1.905 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -10.023 7.347 -1.416 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.890 5.597 -3.193 1.00 0.00 C ATOM 0 H VAL A 138 -12.005 3.859 -1.837 1.00 0.00 H new ATOM 0 HA VAL A 138 -9.527 4.670 -0.796 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.675 6.131 -2.146 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -10.067 8.082 -2.219 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.594 7.709 -0.561 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.985 7.195 -1.120 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.966 6.396 -3.930 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.840 5.406 -2.972 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.347 4.691 -3.591 1.00 0.00 H new ATOM 2104 N GLN A 139 -12.159 5.349 0.928 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.728 5.739 2.181 1.00 0.00 C ATOM 2106 C GLN A 139 -12.270 4.978 3.377 1.00 0.00 C ATOM 2107 O GLN A 139 -12.023 5.572 4.426 1.00 0.00 O ATOM 2108 CB GLN A 139 -14.263 5.830 2.207 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.839 6.935 1.320 1.00 0.00 C ATOM 2110 CD GLN A 139 -16.351 6.916 1.491 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -17.014 6.362 0.616 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -16.886 7.457 2.619 1.00 0.00 N ATOM 0 H GLN A 139 -12.843 4.891 0.325 1.00 0.00 H new ATOM 0 HA GLN A 139 -12.320 6.747 2.259 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.678 4.873 1.892 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.589 5.996 3.234 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -14.433 7.906 1.604 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.569 6.770 0.277 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -16.280 7.903 3.307 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -17.893 7.416 2.776 1.00 0.00 H new ATOM 2121 N MET A 140 -12.067 3.655 3.253 1.00 0.00 N ATOM 2122 CA MET A 140 -11.366 2.725 4.083 1.00 0.00 C ATOM 2123 C MET A 140 -9.903 2.985 4.187 1.00 0.00 C ATOM 2124 O MET A 140 -9.309 3.293 5.220 1.00 0.00 O ATOM 2125 CB MET A 140 -11.633 1.276 3.639 1.00 0.00 C ATOM 2126 CG MET A 140 -10.959 0.210 4.505 1.00 0.00 C ATOM 2127 SD MET A 140 -11.393 -1.490 4.029 1.00 0.00 S ATOM 2128 CE MET A 140 -11.447 -1.603 2.217 1.00 0.00 C ATOM 0 H MET A 140 -12.457 3.170 2.445 1.00 0.00 H new ATOM 0 HA MET A 140 -11.766 2.872 5.086 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.709 1.101 3.643 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.294 1.157 2.610 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.878 0.332 4.442 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.237 0.370 5.547 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.707 -2.620 1.923 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.196 -0.911 1.831 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.470 -1.345 1.807 1.00 0.00 H new ATOM 2138 N MET A 141 -9.194 2.987 3.044 1.00 0.00 N ATOM 2139 CA MET A 141 -7.765 3.002 3.091 1.00 0.00 C ATOM 2140 C MET A 141 -7.065 4.261 3.473 1.00 0.00 C ATOM 2141 O MET A 141 -6.181 4.181 4.324 1.00 0.00 O ATOM 2142 CB MET A 141 -7.230 2.412 1.775 1.00 0.00 C ATOM 2143 CG MET A 141 -7.552 0.959 1.424 1.00 0.00 C ATOM 2144 SD MET A 141 -6.460 -0.069 2.451 1.00 0.00 S ATOM 2145 CE MET A 141 -7.055 -1.631 1.741 1.00 0.00 C ATOM 0 H MET A 141 -9.598 2.978 2.108 1.00 0.00 H new ATOM 0 HA MET A 141 -7.516 2.386 3.955 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.600 3.036 0.961 1.00 0.00 H new ATOM 0 HB3 MET A 141 -6.145 2.514 1.787 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.599 0.734 1.624 1.00 0.00 H new ATOM 0 HG3 MET A 141 -7.382 0.768 0.364 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.532 -2.466 2.208 1.00 0.00 H new ATOM 0 HE2 MET A 141 -8.126 -1.727 1.920 1.00 0.00 H new ATOM 0 HE3 MET A 141 -6.864 -1.639 0.668 1.00 0.00 H new ATOM 2155 N THR A 142 -7.492 5.396 2.892 1.00 0.00 N ATOM 2156 CA THR A 142 -6.645 6.547 2.834 1.00 0.00 C ATOM 2157 C THR A 142 -6.778 7.367 4.109 1.00 0.00 C ATOM 2158 O THR A 142 -5.889 7.304 4.999 1.00 0.00 O ATOM 2159 CB THR A 142 -6.841 7.539 1.725 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.588 6.906 0.479 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.822 8.690 1.754 1.00 0.00 C ATOM 0 H THR A 142 -8.411 5.517 2.467 1.00 0.00 H new ATOM 0 HA THR A 142 -5.677 6.075 2.667 1.00 0.00 H new ATOM 0 HB THR A 142 -7.857 7.913 1.850 1.00 0.00 H new ATOM 0 HG1 THR A 142 -6.717 7.551 -0.248 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.019 9.371 0.926 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.909 9.230 2.697 1.00 0.00 H new ATOM 0 HG23 THR A 142 -4.814 8.286 1.659 1.00 0.00 H new ATOM 2170 N ARG B 1 -9.999 -2.146 10.436 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.647 -1.698 10.036 1.00 0.00 C ATOM 2172 C ARG B 1 -7.688 -2.774 9.657 1.00 0.00 C ATOM 2173 O ARG B 1 -7.345 -2.951 8.490 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.102 -0.654 11.026 1.00 0.00 C ATOM 2175 CG ARG B 1 -7.046 0.111 10.225 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.149 1.039 11.046 1.00 0.00 C ATOM 2177 NE ARG B 1 -5.142 1.573 10.087 1.00 0.00 N ATOM 2178 CZ ARG B 1 -5.288 2.665 9.282 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.508 3.265 9.165 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -4.286 3.118 8.473 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.673 -1.363 10.318 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.290 -2.947 9.839 1.00 0.00 H new ATOM 0 H3 ARG B 1 -9.985 -2.444 11.432 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.769 -1.195 9.077 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.891 0.010 11.379 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -7.667 -1.129 11.906 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -6.416 -0.610 9.705 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -7.551 0.703 9.461 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -6.727 1.845 11.497 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -5.667 0.499 11.861 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.255 1.073 10.026 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.309 2.897 9.679 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.619 4.081 8.564 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -3.387 2.636 8.455 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -4.436 3.939 7.886 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.151 -3.478 10.670 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.903 -4.153 10.494 1.00 0.00 C ATOM 2195 C ARG B 2 -5.706 -5.001 9.285 1.00 0.00 C ATOM 2196 O ARG B 2 -4.815 -4.721 8.484 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.751 -5.089 11.704 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.432 -4.420 13.043 1.00 0.00 C ATOM 2199 CD ARG B 2 -5.503 -5.413 14.205 1.00 0.00 C ATOM 2200 NE ARG B 2 -6.896 -5.590 14.704 1.00 0.00 N ATOM 2201 CZ ARG B 2 -7.101 -6.497 15.704 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -6.046 -7.082 16.342 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -8.383 -6.845 16.015 1.00 0.00 N ATOM 0 H ARG B 2 -7.571 -3.579 11.594 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.174 -3.351 10.382 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.675 -5.656 11.816 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -4.961 -5.807 11.484 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.436 -3.980 13.001 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -6.134 -3.604 13.218 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.108 -6.377 13.883 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -4.868 -5.064 15.019 1.00 0.00 H new ATOM 0 HE ARG B 2 -7.669 -5.052 14.312 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.091 -6.843 16.073 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -6.212 -7.758 17.087 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -9.162 -6.430 15.504 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -8.562 -7.520 16.758 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.454 -6.095 9.055 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.073 -7.029 8.041 1.00 0.00 C ATOM 2219 C LYS B 3 -6.251 -6.562 6.638 1.00 0.00 C ATOM 2220 O LYS B 3 -5.478 -6.945 5.762 1.00 0.00 O ATOM 2221 CB LYS B 3 -6.926 -8.302 8.173 1.00 0.00 C ATOM 2222 CG LYS B 3 -6.430 -9.248 9.269 1.00 0.00 C ATOM 2223 CD LYS B 3 -7.221 -10.555 9.345 1.00 0.00 C ATOM 2224 CE LYS B 3 -6.793 -11.713 8.440 1.00 0.00 C ATOM 2225 NZ LYS B 3 -5.560 -12.476 8.737 1.00 0.00 N ATOM 0 H LYS B 3 -7.308 -6.331 9.561 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.007 -7.186 8.208 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.958 -8.020 8.384 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -6.929 -8.830 7.220 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -5.379 -9.477 9.093 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -6.488 -8.740 10.232 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -7.184 -10.907 10.376 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.263 -10.327 9.123 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -7.617 -12.427 8.418 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -6.690 -11.313 7.431 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.741 -13.492 8.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -4.802 -12.175 8.092 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -5.270 -12.298 9.720 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.140 -5.603 6.321 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.129 -4.912 5.070 1.00 0.00 C ATOM 2241 C TRP B 4 -5.873 -4.124 4.921 1.00 0.00 C ATOM 2242 O TRP B 4 -5.194 -4.189 3.897 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.343 -3.978 4.927 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.624 -4.606 4.432 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.685 -4.977 5.206 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.995 -4.714 3.044 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.672 -5.460 4.389 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.231 -5.368 3.090 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.376 -4.488 1.845 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.846 -5.754 1.931 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.995 -4.836 0.668 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.277 -5.324 0.755 1.00 0.00 C ATOM 0 H TRP B 4 -7.884 -5.301 6.950 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.182 -5.664 4.283 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.539 -3.523 5.898 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.074 -3.171 4.246 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.737 -4.902 6.282 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.576 -5.824 4.691 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.396 -4.034 1.823 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.735 -6.367 1.939 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.496 -4.731 -0.284 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.868 -5.372 -0.147 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.487 -3.280 5.894 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.320 -2.457 5.824 1.00 0.00 C ATOM 2265 C GLN B 5 -3.043 -3.223 5.766 1.00 0.00 C ATOM 2266 O GLN B 5 -2.054 -2.838 5.144 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.198 -1.516 7.035 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.278 -0.433 7.074 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.172 0.542 5.911 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.254 0.428 5.099 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -6.017 1.607 5.937 1.00 0.00 N ATOM 0 H GLN B 5 -6.008 -3.166 6.763 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.460 -1.901 4.897 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -4.252 -2.105 7.950 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.217 -1.040 7.019 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -6.261 -0.905 7.059 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.202 0.117 8.012 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -6.762 1.650 6.633 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -5.906 2.363 5.261 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.039 -4.414 6.391 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.997 -5.383 6.250 1.00 0.00 C ATOM 2282 C LYS B 6 -1.619 -5.764 4.860 1.00 0.00 C ATOM 2283 O LYS B 6 -0.429 -5.824 4.555 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.253 -6.662 7.064 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.304 -7.862 7.082 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.700 -8.995 8.030 1.00 0.00 C ATOM 2287 CE LYS B 6 -0.608 -10.062 8.135 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.082 -11.292 8.807 1.00 0.00 N ATOM 0 H LYS B 6 -3.787 -4.713 7.016 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.144 -4.838 6.655 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.367 -6.347 8.101 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.221 -7.043 6.739 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.234 -8.264 6.071 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.308 -7.513 7.356 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.903 -8.586 9.020 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.624 -9.455 7.679 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.251 -10.312 7.136 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.241 -9.656 8.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.563 -12.113 8.435 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -0.918 -11.213 9.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.099 -11.416 8.628 1.00 0.00 H new ATOM 2302 N THR B 7 -2.629 -5.932 3.987 1.00 0.00 N ATOM 2303 CA THR B 7 -2.407 -6.557 2.721 1.00 0.00 C ATOM 2304 C THR B 7 -2.204 -5.459 1.735 1.00 0.00 C ATOM 2305 O THR B 7 -1.435 -5.624 0.789 1.00 0.00 O ATOM 2306 CB THR B 7 -3.334 -7.658 2.297 1.00 0.00 C ATOM 2307 OG1 THR B 7 -3.001 -8.100 0.990 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.777 -7.124 2.285 1.00 0.00 C ATOM 0 H THR B 7 -3.591 -5.638 4.156 1.00 0.00 H new ATOM 0 HA THR B 7 -1.513 -7.175 2.803 1.00 0.00 H new ATOM 0 HB THR B 7 -3.242 -8.490 2.995 1.00 0.00 H new ATOM 0 HG1 THR B 7 -3.808 -8.425 0.539 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.457 -7.919 1.978 1.00 0.00 H new ATOM 0 HG22 THR B 7 -5.047 -6.782 3.284 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.851 -6.292 1.585 1.00 0.00 H new ATOM 2316 N GLY B 8 -2.844 -4.305 1.994 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.699 -3.221 1.073 1.00 0.00 C ATOM 2318 C GLY B 8 -1.387 -2.529 1.219 1.00 0.00 C ATOM 2319 O GLY B 8 -0.837 -2.139 0.191 1.00 0.00 O ATOM 0 H GLY B 8 -3.437 -4.125 2.804 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -2.798 -3.596 0.054 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.505 -2.504 1.229 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.782 -2.592 2.418 1.00 0.00 N ATOM 2324 CA HIS B 9 0.572 -2.152 2.553 1.00 0.00 C ATOM 2325 C HIS B 9 1.613 -2.904 1.797 1.00 0.00 C ATOM 2326 O HIS B 9 2.546 -2.338 1.231 1.00 0.00 O ATOM 2327 CB HIS B 9 1.157 -1.971 3.964 1.00 0.00 C ATOM 2328 CG HIS B 9 0.687 -0.672 4.547 1.00 0.00 C ATOM 2329 ND1 HIS B 9 -0.561 -0.532 5.121 1.00 0.00 N ATOM 2330 CD2 HIS B 9 1.201 0.587 4.509 1.00 0.00 C ATOM 2331 CE1 HIS B 9 -0.745 0.798 5.334 1.00 0.00 C ATOM 2332 NE2 HIS B 9 0.327 1.512 5.042 1.00 0.00 N ATOM 0 H HIS B 9 -1.216 -2.938 3.274 1.00 0.00 H new ATOM 0 HA HIS B 9 0.386 -1.174 2.109 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.851 -2.799 4.603 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.246 -1.988 3.921 1.00 0.00 H new ATOM 0 HD1 HIS B 9 -1.217 -1.281 5.342 1.00 0.00 H new ATOM 0 HD2 HIS B 9 2.174 0.832 4.110 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -1.667 1.224 5.702 1.00 0.00 H new ATOM 2340 N ALA B 10 1.394 -4.225 1.667 1.00 0.00 N ATOM 2341 CA ALA B 10 2.159 -5.121 0.857 1.00 0.00 C ATOM 2342 C ALA B 10 1.969 -4.857 -0.597 1.00 0.00 C ATOM 2343 O ALA B 10 2.903 -4.609 -1.358 1.00 0.00 O ATOM 2344 CB ALA B 10 1.703 -6.535 1.257 1.00 0.00 C ATOM 0 H ALA B 10 0.635 -4.696 2.159 1.00 0.00 H new ATOM 0 HA ALA B 10 3.229 -4.993 1.024 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.252 -7.273 0.672 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.899 -6.694 2.317 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.635 -6.641 1.065 1.00 0.00 H new ATOM 2350 N VAL B 11 0.718 -4.806 -1.088 1.00 0.00 N ATOM 2351 CA VAL B 11 0.419 -4.557 -2.464 1.00 0.00 C ATOM 2352 C VAL B 11 1.026 -3.289 -2.959 1.00 0.00 C ATOM 2353 O VAL B 11 1.645 -3.233 -4.021 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.062 -4.419 -2.660 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.411 -3.930 -4.076 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.800 -5.754 -2.470 1.00 0.00 C ATOM 0 H VAL B 11 -0.111 -4.942 -0.510 1.00 0.00 H new ATOM 0 HA VAL B 11 0.828 -5.404 -3.015 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.378 -3.695 -1.909 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.493 -3.844 -4.175 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -0.952 -2.956 -4.248 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.035 -4.643 -4.810 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.869 -5.604 -2.622 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.429 -6.481 -3.193 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.626 -6.126 -1.460 1.00 0.00 H new ATOM 2366 N ARG B 12 0.856 -2.232 -2.146 1.00 0.00 N ATOM 2367 CA ARG B 12 1.455 -0.948 -2.345 1.00 0.00 C ATOM 2368 C ARG B 12 2.944 -0.975 -2.328 1.00 0.00 C ATOM 2369 O ARG B 12 3.504 -0.370 -3.241 1.00 0.00 O ATOM 2370 CB ARG B 12 0.857 -0.006 -1.287 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.597 0.398 -1.542 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.499 0.963 -0.443 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.814 2.238 -0.089 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.174 2.590 1.064 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.357 1.852 2.198 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.779 3.567 1.053 1.00 0.00 N ATOM 0 H ARG B 12 0.273 -2.274 -1.310 1.00 0.00 H new ATOM 0 HA ARG B 12 1.225 -0.586 -3.347 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.920 -0.489 -0.312 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.467 0.896 -1.236 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.579 1.138 -2.342 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.101 -0.484 -1.936 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.515 1.133 -0.799 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.569 0.289 0.411 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.825 2.954 -0.816 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.972 1.038 2.183 1.00 0.00 H new ATOM 0 HH12 ARG B 12 0.121 2.114 3.060 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.016 4.038 0.180 1.00 0.00 H new ATOM 0 HH22 ARG B 12 1.254 3.826 1.918 1.00 0.00 H new ATOM 2390 N ALA B 13 3.562 -1.606 -1.313 1.00 0.00 N ATOM 2391 CA ALA B 13 4.974 -1.774 -1.164 1.00 0.00 C ATOM 2392 C ALA B 13 5.672 -2.293 -2.374 1.00 0.00 C ATOM 2393 O ALA B 13 6.682 -1.779 -2.852 1.00 0.00 O ATOM 2394 CB ALA B 13 5.419 -2.651 0.018 1.00 0.00 C ATOM 0 H ALA B 13 3.038 -2.027 -0.545 1.00 0.00 H new ATOM 0 HA ALA B 13 5.270 -0.742 -0.974 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.507 -2.711 0.037 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.063 -2.213 0.950 1.00 0.00 H new ATOM 0 HB3 ALA B 13 5.002 -3.652 -0.094 1.00 0.00 H new ATOM 2400 N ILE B 14 5.104 -3.440 -2.789 1.00 0.00 N ATOM 2401 CA ILE B 14 5.596 -4.227 -3.877 1.00 0.00 C ATOM 2402 C ILE B 14 5.627 -3.563 -5.211 1.00 0.00 C ATOM 2403 O ILE B 14 6.499 -3.633 -6.075 1.00 0.00 O ATOM 2404 CB ILE B 14 5.165 -5.662 -3.955 1.00 0.00 C ATOM 2405 CG1 ILE B 14 6.159 -6.548 -4.723 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.794 -5.685 -4.652 1.00 0.00 C ATOM 2407 CD1 ILE B 14 5.696 -7.998 -4.591 1.00 0.00 C ATOM 0 H ILE B 14 4.271 -3.834 -2.350 1.00 0.00 H new ATOM 0 HA ILE B 14 6.637 -4.294 -3.560 1.00 0.00 H new ATOM 0 HB ILE B 14 5.117 -6.071 -2.946 1.00 0.00 H new ATOM 0 HG12 ILE B 14 6.200 -6.255 -5.772 1.00 0.00 H new ATOM 0 HG13 ILE B 14 7.165 -6.431 -4.320 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.443 -6.714 -4.730 1.00 0.00 H new ATOM 0 HG22 ILE B 14 3.081 -5.101 -4.071 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.886 -5.257 -5.650 1.00 0.00 H new ATOM 0 HD11 ILE B 14 6.385 -8.650 -5.128 1.00 0.00 H new ATOM 0 HD12 ILE B 14 5.676 -8.279 -3.538 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.696 -8.101 -5.013 1.00 0.00 H new ATOM 2419 N GLY B 15 4.614 -2.703 -5.421 1.00 0.00 N ATOM 2420 CA GLY B 15 4.398 -1.908 -6.590 1.00 0.00 C ATOM 2421 C GLY B 15 5.220 -0.669 -6.496 1.00 0.00 C ATOM 2422 O GLY B 15 5.619 -0.102 -7.512 1.00 0.00 O ATOM 0 H GLY B 15 3.891 -2.553 -4.718 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.668 -2.472 -7.483 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.342 -1.653 -6.681 1.00 0.00 H new ATOM 2426 N ARG B 16 5.455 -0.108 -5.296 1.00 0.00 N ATOM 2427 CA ARG B 16 6.319 1.017 -5.110 1.00 0.00 C ATOM 2428 C ARG B 16 7.784 0.828 -5.307 1.00 0.00 C ATOM 2429 O ARG B 16 8.410 1.761 -5.807 1.00 0.00 O ATOM 2430 CB ARG B 16 6.111 1.498 -3.664 1.00 0.00 C ATOM 2431 CG ARG B 16 4.997 2.543 -3.571 1.00 0.00 C ATOM 2432 CD ARG B 16 4.573 2.888 -2.142 1.00 0.00 C ATOM 2433 NE ARG B 16 5.659 3.670 -1.488 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.474 4.840 -0.810 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.212 5.280 -0.533 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.547 5.623 -0.498 1.00 0.00 N ATOM 0 H ARG B 16 5.033 -0.446 -4.431 1.00 0.00 H new ATOM 0 HA ARG B 16 6.036 1.715 -5.898 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.866 0.647 -3.029 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.041 1.922 -3.284 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.328 3.454 -4.069 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.127 2.179 -4.117 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.648 3.465 -2.153 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.374 1.977 -1.578 1.00 0.00 H new ATOM 0 HE ARG B 16 6.609 3.305 -1.551 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.404 4.734 -0.833 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.077 6.155 -0.026 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.486 5.334 -0.771 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.410 6.498 0.009 1.00 0.00 H new