USER MOD reduce.3.24.130724 H: found=0, std=0, add=1174, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1174 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 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 145 GLN : amide:sc= -0.522 K(o=-0.52,f=-1.8) USER MOD Set 2.1: A 49 CYS SG : rot 180:sc= -0.298 USER MOD Set 2.2: A 103 HIS : no HD1:sc= -2.14 K(o=-2.4,f=-4.9!) USER MOD Single : A 13 SER OG : rot 180:sc= -0.0834 USER MOD Single : A 14 TYR OH : rot 30:sc= -0.581 USER MOD Single : A 15 LYS NZ :NH3+ -114:sc= -0.14 (180deg=-1.18) USER MOD Single : A 16 HIS : no HD1:sc= -0.195 X(o=-0.19,f=-0.036) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0045) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 148:sc= 0.772 USER MOD Single : A 44 THR OG1 : rot -120:sc= -4.37! USER MOD Single : A 52 THR OG1 : rot 69:sc= 0.498 USER MOD Single : A 53 TYR OH : rot -37:sc= -2.86 USER MOD Single : A 55 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0729) USER MOD Single : A 56 THR OG1 : rot 180:sc= -2.96! USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 77:sc= 0.494 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 97:sc= 1.25 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 142:sc= -3.55! (180deg=-6.99!) USER MOD Single : A 93 CYS SG : rot -32:sc= 0.162 USER MOD Single : A 98 SER OG : rot -150:sc= -3.55! USER MOD Single : A 99 CYS SG : rot 136:sc= -0.415 USER MOD Single : A 104 CYS SG : rot 29:sc= 0.372 USER MOD Single : A 122 SER OG : rot -160:sc= -0.0663 USER MOD Single : A 124 MET CE :methyl -160:sc= -0.055 (180deg=-0.703) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= -0.737 K(o=-0.74,f=-1.7!) USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 ASN :FLIP amide:sc= -0.861 F(o=-3.3!,f=-0.86) USER MOD Single : A 143 SER OG : rot 103:sc= 0.207 USER MOD Single : A 147 THR OG1 : rot -27:sc= 1.12 USER MOD Single : A 148 TYR OH : rot -62:sc= -0.168 USER MOD Single : A 151 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.133) USER MOD Single : A 152 TYR OH : rot 180:sc= 0.996 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN :FLIP amide:sc= -0.479 F(o=-1.7,f=-0.48) USER MOD Single : A 161 LYS NZ :NH3+ 164:sc= -0.139 (180deg=-0.368) USER MOD ----------------------------------------------------------------- ATOM 107 N PRO A 7 -6.670 9.971 -4.869 1.00 73.24 N ATOM 108 CA PRO A 7 -7.661 10.150 -3.804 1.00 20.22 C ATOM 109 C PRO A 7 -7.830 11.613 -3.409 1.00 23.00 C ATOM 110 O PRO A 7 -6.863 12.283 -3.047 1.00 13.21 O ATOM 111 CB PRO A 7 -7.078 9.345 -2.639 1.00 54.41 C ATOM 112 CG PRO A 7 -5.610 9.322 -2.892 1.00 34.22 C ATOM 113 CD PRO A 7 -5.448 9.307 -4.387 1.00 22.14 C ATOM 0 HA PRO A 7 -8.654 9.823 -4.112 1.00 20.22 H new ATOM 0 HB2 PRO A 7 -7.307 9.812 -1.681 1.00 54.41 H new ATOM 0 HB3 PRO A 7 -7.490 8.337 -2.609 1.00 54.41 H new ATOM 0 HG2 PRO A 7 -5.125 10.195 -2.456 1.00 34.22 H new ATOM 0 HG3 PRO A 7 -5.150 8.443 -2.441 1.00 34.22 H new ATOM 0 HD2 PRO A 7 -4.551 9.841 -4.699 1.00 22.14 H new ATOM 0 HD3 PRO A 7 -5.364 8.291 -4.772 1.00 22.14 H new ATOM 121 N ALA A 8 -9.063 12.102 -3.481 1.00 13.00 N ATOM 122 CA ALA A 8 -9.358 13.485 -3.128 1.00 55.24 C ATOM 123 C ALA A 8 -10.087 13.567 -1.792 1.00 13.55 C ATOM 124 O ALA A 8 -11.310 13.449 -1.716 1.00 34.15 O ATOM 125 CB ALA A 8 -10.184 14.144 -4.223 1.00 53.23 C ATOM 0 H ALA A 8 -9.874 11.561 -3.781 1.00 13.00 H new ATOM 0 HA ALA A 8 -8.413 14.019 -3.030 1.00 55.24 H new ATOM 0 HB1 ALA A 8 -10.397 15.177 -3.946 1.00 53.23 H new ATOM 0 HB2 ALA A 8 -9.626 14.127 -5.159 1.00 53.23 H new ATOM 0 HB3 ALA A 8 -11.121 13.601 -4.349 1.00 53.23 H new ATOM 131 N PRO A 9 -9.321 13.775 -0.711 1.00 23.45 N ATOM 132 CA PRO A 9 -9.873 13.877 0.644 1.00 62.04 C ATOM 133 C PRO A 9 -10.676 15.157 0.847 1.00 51.12 C ATOM 134 O PRO A 9 -11.033 15.837 -0.115 1.00 42.41 O ATOM 135 CB PRO A 9 -8.628 13.879 1.535 1.00 53.42 C ATOM 136 CG PRO A 9 -7.539 14.403 0.663 1.00 33.33 C ATOM 137 CD PRO A 9 -7.856 13.925 -0.727 1.00 10.30 C ATOM 0 HA PRO A 9 -10.569 13.067 0.863 1.00 62.04 H new ATOM 0 HB2 PRO A 9 -8.770 14.509 2.413 1.00 53.42 H new ATOM 0 HB3 PRO A 9 -8.398 12.877 1.896 1.00 53.42 H new ATOM 0 HG2 PRO A 9 -7.498 15.492 0.702 1.00 33.33 H new ATOM 0 HG3 PRO A 9 -6.566 14.035 0.990 1.00 33.33 H new ATOM 0 HD2 PRO A 9 -7.534 14.642 -1.482 1.00 10.30 H new ATOM 0 HD3 PRO A 9 -7.358 12.982 -0.951 1.00 10.30 H new ATOM 145 N VAL A 10 -10.957 15.480 2.105 1.00 15.32 N ATOM 146 CA VAL A 10 -11.718 16.680 2.435 1.00 44.03 C ATOM 147 C VAL A 10 -10.985 17.528 3.468 1.00 12.04 C ATOM 148 O VAL A 10 -10.809 17.113 4.613 1.00 32.13 O ATOM 149 CB VAL A 10 -13.117 16.328 2.974 1.00 24.40 C ATOM 150 CG1 VAL A 10 -13.722 17.516 3.706 1.00 61.22 C ATOM 151 CG2 VAL A 10 -14.024 15.870 1.842 1.00 22.40 C ATOM 0 H VAL A 10 -10.669 14.928 2.913 1.00 15.32 H new ATOM 0 HA VAL A 10 -11.826 17.250 1.512 1.00 44.03 H new ATOM 0 HB VAL A 10 -13.018 15.507 3.684 1.00 24.40 H new ATOM 0 HG11 VAL A 10 -14.710 17.248 4.080 1.00 61.22 H new ATOM 0 HG12 VAL A 10 -13.081 17.793 4.543 1.00 61.22 H new ATOM 0 HG13 VAL A 10 -13.809 18.359 3.021 1.00 61.22 H new ATOM 0 HG21 VAL A 10 -15.008 15.625 2.241 1.00 22.40 H new ATOM 0 HG22 VAL A 10 -14.119 16.668 1.106 1.00 22.40 H new ATOM 0 HG23 VAL A 10 -13.596 14.988 1.367 1.00 22.40 H new ATOM 161 N GLU A 11 -10.561 18.718 3.056 1.00 42.50 N ATOM 162 CA GLU A 11 -9.847 19.625 3.947 1.00 23.03 C ATOM 163 C GLU A 11 -10.803 20.632 4.580 1.00 71.13 C ATOM 164 O GLU A 11 -11.486 21.380 3.880 1.00 12.24 O ATOM 165 CB GLU A 11 -8.744 20.362 3.185 1.00 41.14 C ATOM 166 CG GLU A 11 -8.355 21.691 3.810 1.00 53.31 C ATOM 167 CD GLU A 11 -9.160 22.853 3.259 1.00 20.41 C ATOM 168 OE1 GLU A 11 -9.898 22.649 2.273 1.00 72.21 O ATOM 169 OE2 GLU A 11 -9.051 23.966 3.815 1.00 32.53 O ATOM 0 H GLU A 11 -10.699 19.077 2.111 1.00 42.50 H new ATOM 0 HA GLU A 11 -9.395 19.031 4.741 1.00 23.03 H new ATOM 0 HB2 GLU A 11 -7.862 19.723 3.132 1.00 41.14 H new ATOM 0 HB3 GLU A 11 -9.075 20.535 2.161 1.00 41.14 H new ATOM 0 HG2 GLU A 11 -8.496 21.636 4.889 1.00 53.31 H new ATOM 0 HG3 GLU A 11 -7.295 21.874 3.636 1.00 53.31 H new ATOM 176 N VAL A 12 -10.847 20.644 5.908 1.00 22.13 N ATOM 177 CA VAL A 12 -11.718 21.558 6.636 1.00 14.42 C ATOM 178 C VAL A 12 -10.912 22.651 7.329 1.00 14.13 C ATOM 179 O VAL A 12 -10.243 22.402 8.332 1.00 60.22 O ATOM 180 CB VAL A 12 -12.562 20.813 7.688 1.00 63.45 C ATOM 181 CG1 VAL A 12 -11.691 19.858 8.491 1.00 15.31 C ATOM 182 CG2 VAL A 12 -13.268 21.802 8.602 1.00 31.44 C ATOM 0 H VAL A 12 -10.289 20.030 6.502 1.00 22.13 H new ATOM 0 HA VAL A 12 -12.384 22.011 5.902 1.00 14.42 H new ATOM 0 HB VAL A 12 -13.322 20.226 7.171 1.00 63.45 H new ATOM 0 HG11 VAL A 12 -12.304 19.340 9.229 1.00 15.31 H new ATOM 0 HG12 VAL A 12 -11.237 19.128 7.820 1.00 15.31 H new ATOM 0 HG13 VAL A 12 -10.908 20.420 8.999 1.00 15.31 H new ATOM 0 HG21 VAL A 12 -13.859 21.258 9.339 1.00 31.44 H new ATOM 0 HG22 VAL A 12 -12.528 22.417 9.113 1.00 31.44 H new ATOM 0 HG23 VAL A 12 -13.924 22.440 8.010 1.00 31.44 H new ATOM 192 N SER A 13 -10.982 23.863 6.788 1.00 3.35 N ATOM 193 CA SER A 13 -10.256 24.995 7.353 1.00 64.10 C ATOM 194 C SER A 13 -11.121 25.749 8.358 1.00 52.02 C ATOM 195 O SER A 13 -12.194 26.248 8.018 1.00 11.53 O ATOM 196 CB SER A 13 -9.802 25.943 6.241 1.00 22.31 C ATOM 197 OG SER A 13 -10.547 27.148 6.262 1.00 34.42 O ATOM 0 H SER A 13 -11.534 24.087 5.960 1.00 3.35 H new ATOM 0 HA SER A 13 -9.379 24.609 7.873 1.00 64.10 H new ATOM 0 HB2 SER A 13 -8.741 26.165 6.359 1.00 22.31 H new ATOM 0 HB3 SER A 13 -9.920 25.456 5.273 1.00 22.31 H new ATOM 0 HG SER A 13 -10.237 27.737 5.543 1.00 34.42 H new ATOM 203 N TYR A 14 -10.647 25.827 9.596 1.00 1.01 N ATOM 204 CA TYR A 14 -11.377 26.518 10.652 1.00 34.43 C ATOM 205 C TYR A 14 -10.857 27.940 10.834 1.00 54.54 C ATOM 206 O TYR A 14 -10.149 28.470 9.977 1.00 61.31 O ATOM 207 CB TYR A 14 -11.260 25.748 11.969 1.00 14.32 C ATOM 208 CG TYR A 14 -12.576 25.591 12.698 1.00 51.44 C ATOM 209 CD1 TYR A 14 -13.625 24.877 12.132 1.00 11.22 C ATOM 210 CD2 TYR A 14 -12.770 26.157 13.952 1.00 25.31 C ATOM 211 CE1 TYR A 14 -14.829 24.732 12.794 1.00 41.01 C ATOM 212 CE2 TYR A 14 -13.970 26.015 14.622 1.00 44.41 C ATOM 213 CZ TYR A 14 -14.996 25.303 14.038 1.00 33.45 C ATOM 214 OH TYR A 14 -16.193 25.159 14.702 1.00 55.15 O ATOM 0 H TYR A 14 -9.760 25.420 9.893 1.00 1.01 H new ATOM 0 HA TYR A 14 -12.426 26.569 10.360 1.00 34.43 H new ATOM 0 HB2 TYR A 14 -10.846 24.760 11.767 1.00 14.32 H new ATOM 0 HB3 TYR A 14 -10.553 26.263 12.620 1.00 14.32 H new ATOM 0 HD1 TYR A 14 -13.497 24.428 11.158 1.00 11.22 H new ATOM 0 HD2 TYR A 14 -11.969 26.718 14.411 1.00 25.31 H new ATOM 0 HE1 TYR A 14 -15.635 24.175 12.340 1.00 41.01 H new ATOM 0 HE2 TYR A 14 -14.103 26.459 15.597 1.00 44.41 H new ATOM 0 HH TYR A 14 -16.608 24.309 14.447 1.00 55.15 H new ATOM 224 N LYS A 15 -11.214 28.555 11.956 1.00 13.02 N ATOM 225 CA LYS A 15 -10.784 29.916 12.254 1.00 22.11 C ATOM 226 C LYS A 15 -9.273 30.056 12.094 1.00 54.21 C ATOM 227 O LYS A 15 -8.793 30.961 11.411 1.00 40.23 O ATOM 228 CB LYS A 15 -11.195 30.303 13.677 1.00 64.23 C ATOM 229 CG LYS A 15 -10.678 29.349 14.740 1.00 72.44 C ATOM 230 CD LYS A 15 -11.522 29.410 16.002 1.00 52.14 C ATOM 231 CE LYS A 15 -11.304 30.713 16.755 1.00 0.13 C ATOM 232 NZ LYS A 15 -12.173 31.806 16.237 1.00 65.13 N ATOM 0 H LYS A 15 -11.801 28.132 12.675 1.00 13.02 H new ATOM 0 HA LYS A 15 -11.271 30.587 11.547 1.00 22.11 H new ATOM 0 HB2 LYS A 15 -10.828 31.307 13.892 1.00 64.23 H new ATOM 0 HB3 LYS A 15 -12.283 30.342 13.734 1.00 64.23 H new ATOM 0 HG2 LYS A 15 -10.680 28.332 14.349 1.00 72.44 H new ATOM 0 HG3 LYS A 15 -9.644 29.596 14.980 1.00 72.44 H new ATOM 0 HD2 LYS A 15 -12.576 29.311 15.742 1.00 52.14 H new ATOM 0 HD3 LYS A 15 -11.273 28.569 16.649 1.00 52.14 H new ATOM 0 HE2 LYS A 15 -11.508 30.558 17.815 1.00 0.13 H new ATOM 0 HE3 LYS A 15 -10.259 31.010 16.672 1.00 0.13 H new ATOM 0 HZ1 LYS A 15 -11.582 32.542 15.801 1.00 65.13 H new ATOM 0 HZ2 LYS A 15 -12.828 31.422 15.527 1.00 65.13 H new ATOM 0 HZ3 LYS A 15 -12.717 32.219 17.022 1.00 65.13 H new ATOM 246 N HIS A 16 -8.529 29.155 12.727 1.00 74.54 N ATOM 247 CA HIS A 16 -7.073 29.177 12.652 1.00 1.10 C ATOM 248 C HIS A 16 -6.510 27.760 12.600 1.00 5.12 C ATOM 249 O HIS A 16 -5.462 27.477 13.181 1.00 33.22 O ATOM 250 CB HIS A 16 -6.491 29.926 13.851 1.00 13.14 C ATOM 251 CG HIS A 16 -5.363 30.844 13.494 1.00 12.35 C ATOM 252 ND1 HIS A 16 -4.227 30.975 14.264 1.00 23.04 N ATOM 253 CD2 HIS A 16 -5.200 31.679 12.441 1.00 14.04 C ATOM 254 CE1 HIS A 16 -3.414 31.852 13.701 1.00 35.53 C ATOM 255 NE2 HIS A 16 -3.982 32.293 12.593 1.00 3.33 N ATOM 0 H HIS A 16 -8.910 28.401 13.298 1.00 74.54 H new ATOM 0 HA HIS A 16 -6.789 29.696 11.736 1.00 1.10 H new ATOM 0 HB2 HIS A 16 -7.283 30.505 14.327 1.00 13.14 H new ATOM 0 HB3 HIS A 16 -6.140 29.202 14.586 1.00 13.14 H new ATOM 0 HD2 HIS A 16 -5.898 31.833 11.632 1.00 14.04 H new ATOM 0 HE1 HIS A 16 -2.450 32.156 14.082 1.00 35.53 H new ATOM 0 HE2 HIS A 16 -3.580 32.979 11.954 1.00 3.33 H new ATOM 263 N MET A 17 -7.212 26.874 11.901 1.00 10.45 N ATOM 264 CA MET A 17 -6.781 25.487 11.774 1.00 11.10 C ATOM 265 C MET A 17 -7.223 24.901 10.437 1.00 54.00 C ATOM 266 O MET A 17 -7.944 25.545 9.674 1.00 11.15 O ATOM 267 CB MET A 17 -7.344 24.648 12.923 1.00 41.20 C ATOM 268 CG MET A 17 -7.263 25.338 14.275 1.00 35.01 C ATOM 269 SD MET A 17 -8.084 24.404 15.581 1.00 13.21 S ATOM 270 CE MET A 17 -9.385 25.544 16.046 1.00 53.11 C ATOM 0 H MET A 17 -8.081 27.092 11.414 1.00 10.45 H new ATOM 0 HA MET A 17 -5.692 25.466 11.818 1.00 11.10 H new ATOM 0 HB2 MET A 17 -8.385 24.406 12.709 1.00 41.20 H new ATOM 0 HB3 MET A 17 -6.801 23.704 12.973 1.00 41.20 H new ATOM 0 HG2 MET A 17 -6.216 25.485 14.542 1.00 35.01 H new ATOM 0 HG3 MET A 17 -7.715 26.327 14.202 1.00 35.01 H new ATOM 0 HE1 MET A 17 -9.982 25.108 16.847 1.00 53.11 H new ATOM 0 HE2 MET A 17 -8.943 26.479 16.391 1.00 53.11 H new ATOM 0 HE3 MET A 17 -10.022 25.740 15.184 1.00 53.11 H new ATOM 280 N ARG A 18 -6.787 23.677 10.159 1.00 30.11 N ATOM 281 CA ARG A 18 -7.137 23.005 8.913 1.00 12.43 C ATOM 282 C ARG A 18 -6.889 21.503 9.017 1.00 44.43 C ATOM 283 O ARG A 18 -5.743 21.054 9.054 1.00 41.34 O ATOM 284 CB ARG A 18 -6.331 23.588 7.751 1.00 22.21 C ATOM 285 CG ARG A 18 -6.943 23.314 6.387 1.00 13.12 C ATOM 286 CD ARG A 18 -6.295 24.163 5.305 1.00 55.51 C ATOM 287 NE ARG A 18 -6.578 25.585 5.483 1.00 44.31 N ATOM 288 CZ ARG A 18 -6.498 26.479 4.503 1.00 24.31 C ATOM 289 NH1 ARG A 18 -6.146 26.099 3.282 1.00 33.13 N ATOM 290 NH2 ARG A 18 -6.770 27.755 4.743 1.00 21.14 N ATOM 0 H ARG A 18 -6.191 23.130 10.780 1.00 30.11 H new ATOM 0 HA ARG A 18 -8.199 23.168 8.727 1.00 12.43 H new ATOM 0 HB2 ARG A 18 -6.239 24.665 7.889 1.00 22.21 H new ATOM 0 HB3 ARG A 18 -5.322 23.176 7.777 1.00 22.21 H new ATOM 0 HG2 ARG A 18 -6.828 22.258 6.141 1.00 13.12 H new ATOM 0 HG3 ARG A 18 -8.013 23.519 6.419 1.00 13.12 H new ATOM 0 HD2 ARG A 18 -5.217 24.004 5.316 1.00 55.51 H new ATOM 0 HD3 ARG A 18 -6.655 23.841 4.328 1.00 55.51 H new ATOM 0 HE ARG A 18 -6.852 25.910 6.410 1.00 44.31 H new ATOM 0 HH11 ARG A 18 -5.936 25.119 3.094 1.00 33.13 H new ATOM 0 HH12 ARG A 18 -6.085 26.787 2.531 1.00 33.13 H new ATOM 0 HH21 ARG A 18 -7.041 28.051 5.681 1.00 21.14 H new ATOM 0 HH22 ARG A 18 -6.708 28.440 3.990 1.00 21.14 H new ATOM 304 N PHE A 19 -7.970 20.732 9.064 1.00 64.14 N ATOM 305 CA PHE A 19 -7.869 19.281 9.164 1.00 32.44 C ATOM 306 C PHE A 19 -8.184 18.619 7.826 1.00 43.44 C ATOM 307 O PHE A 19 -8.519 19.294 6.851 1.00 63.44 O ATOM 308 CB PHE A 19 -8.821 18.756 10.241 1.00 32.22 C ATOM 309 CG PHE A 19 -8.400 19.111 11.639 1.00 62.15 C ATOM 310 CD1 PHE A 19 -7.908 20.373 11.928 1.00 11.53 C ATOM 311 CD2 PHE A 19 -8.495 18.182 12.662 1.00 21.11 C ATOM 312 CE1 PHE A 19 -7.520 20.704 13.213 1.00 22.31 C ATOM 313 CE2 PHE A 19 -8.109 18.506 13.949 1.00 44.52 C ATOM 314 CZ PHE A 19 -7.619 19.768 14.224 1.00 13.44 C ATOM 0 H PHE A 19 -8.926 21.088 9.034 1.00 64.14 H new ATOM 0 HA PHE A 19 -6.844 19.032 9.440 1.00 32.44 H new ATOM 0 HB2 PHE A 19 -9.819 19.155 10.058 1.00 32.22 H new ATOM 0 HB3 PHE A 19 -8.891 17.672 10.156 1.00 32.22 H new ATOM 0 HD1 PHE A 19 -7.826 21.107 11.140 1.00 11.53 H new ATOM 0 HD2 PHE A 19 -8.875 17.193 12.452 1.00 21.11 H new ATOM 0 HE1 PHE A 19 -7.140 21.692 13.426 1.00 22.31 H new ATOM 0 HE2 PHE A 19 -8.190 17.774 14.739 1.00 44.52 H new ATOM 0 HZ PHE A 19 -7.314 20.022 15.228 1.00 13.44 H new ATOM 324 N LEU A 20 -8.073 17.296 7.786 1.00 41.32 N ATOM 325 CA LEU A 20 -8.345 16.542 6.567 1.00 43.11 C ATOM 326 C LEU A 20 -9.125 15.269 6.877 1.00 21.41 C ATOM 327 O LEU A 20 -8.572 14.304 7.407 1.00 52.03 O ATOM 328 CB LEU A 20 -7.035 16.192 5.858 1.00 74.31 C ATOM 329 CG LEU A 20 -6.798 16.874 4.510 1.00 14.02 C ATOM 330 CD1 LEU A 20 -7.998 16.679 3.595 1.00 5.42 C ATOM 331 CD2 LEU A 20 -6.509 18.355 4.706 1.00 54.22 C ATOM 0 H LEU A 20 -7.797 16.723 8.583 1.00 41.32 H new ATOM 0 HA LEU A 20 -8.951 17.166 5.910 1.00 43.11 H new ATOM 0 HB2 LEU A 20 -6.208 16.445 6.521 1.00 74.31 H new ATOM 0 HB3 LEU A 20 -7.004 15.113 5.707 1.00 74.31 H new ATOM 0 HG LEU A 20 -5.929 16.414 4.039 1.00 14.02 H new ATOM 0 HD11 LEU A 20 -7.811 17.171 2.640 1.00 5.42 H new ATOM 0 HD12 LEU A 20 -8.160 15.614 3.429 1.00 5.42 H new ATOM 0 HD13 LEU A 20 -8.884 17.112 4.059 1.00 5.42 H new ATOM 0 HD21 LEU A 20 -6.343 18.825 3.737 1.00 54.22 H new ATOM 0 HD22 LEU A 20 -7.358 18.829 5.198 1.00 54.22 H new ATOM 0 HD23 LEU A 20 -5.619 18.473 5.324 1.00 54.22 H new ATOM 343 N ILE A 21 -10.411 15.272 6.542 1.00 3.32 N ATOM 344 CA ILE A 21 -11.265 14.116 6.782 1.00 14.20 C ATOM 345 C ILE A 21 -11.255 13.168 5.588 1.00 72.11 C ATOM 346 O ILE A 21 -11.565 13.563 4.463 1.00 0.35 O ATOM 347 CB ILE A 21 -12.717 14.540 7.074 1.00 2.23 C ATOM 348 CG1 ILE A 21 -13.025 15.879 6.401 1.00 15.12 C ATOM 349 CG2 ILE A 21 -12.951 14.629 8.575 1.00 43.20 C ATOM 350 CD1 ILE A 21 -12.657 17.079 7.245 1.00 24.03 C ATOM 0 H ILE A 21 -10.884 16.062 6.104 1.00 3.32 H new ATOM 0 HA ILE A 21 -10.862 13.602 7.655 1.00 14.20 H new ATOM 0 HB ILE A 21 -13.390 13.786 6.665 1.00 2.23 H new ATOM 0 HG12 ILE A 21 -12.488 15.933 5.454 1.00 15.12 H new ATOM 0 HG13 ILE A 21 -14.089 15.922 6.167 1.00 15.12 H new ATOM 0 HG21 ILE A 21 -13.981 14.930 8.765 1.00 43.20 H new ATOM 0 HG22 ILE A 21 -12.767 13.656 9.030 1.00 43.20 H new ATOM 0 HG23 ILE A 21 -12.273 15.365 9.006 1.00 43.20 H new ATOM 0 HD11 ILE A 21 -12.903 17.993 6.705 1.00 24.03 H new ATOM 0 HD12 ILE A 21 -13.214 17.050 8.181 1.00 24.03 H new ATOM 0 HD13 ILE A 21 -11.588 17.060 7.458 1.00 24.03 H new ATOM 362 N THR A 22 -10.899 11.912 5.839 1.00 5.14 N ATOM 363 CA THR A 22 -10.849 10.906 4.786 1.00 43.20 C ATOM 364 C THR A 22 -12.090 10.021 4.812 1.00 45.13 C ATOM 365 O THR A 22 -12.677 9.788 5.869 1.00 45.11 O ATOM 366 CB THR A 22 -9.596 10.019 4.915 1.00 33.35 C ATOM 367 OG1 THR A 22 -9.638 8.968 3.944 1.00 32.51 O ATOM 368 CG2 THR A 22 -9.498 9.422 6.311 1.00 4.55 C ATOM 0 H THR A 22 -10.641 11.567 6.764 1.00 5.14 H new ATOM 0 HA THR A 22 -10.809 11.442 3.838 1.00 43.20 H new ATOM 0 HB THR A 22 -8.718 10.640 4.740 1.00 33.35 H new ATOM 0 HG1 THR A 22 -8.837 8.410 4.031 1.00 32.51 H new ATOM 0 HG21 THR A 22 -8.606 8.800 6.379 1.00 4.55 H new ATOM 0 HG22 THR A 22 -9.437 10.224 7.046 1.00 4.55 H new ATOM 0 HG23 THR A 22 -10.381 8.814 6.509 1.00 4.55 H new ATOM 473 N LEU A 30 -2.666 2.251 2.380 1.00 33.10 N ATOM 474 CA LEU A 30 -1.696 3.072 3.096 1.00 71.00 C ATOM 475 C LEU A 30 -0.575 3.525 2.166 1.00 0.33 C ATOM 476 O LEU A 30 0.406 4.125 2.607 1.00 53.14 O ATOM 477 CB LEU A 30 -1.112 2.294 4.276 1.00 20.42 C ATOM 478 CG LEU A 30 -0.533 3.135 5.414 1.00 33.25 C ATOM 479 CD1 LEU A 30 -1.649 3.754 6.241 1.00 14.41 C ATOM 480 CD2 LEU A 30 0.377 2.289 6.293 1.00 41.20 C ATOM 0 HA LEU A 30 -2.212 3.956 3.471 1.00 71.00 H new ATOM 0 HB2 LEU A 30 -1.893 1.654 4.685 1.00 20.42 H new ATOM 0 HB3 LEU A 30 -0.327 1.638 3.900 1.00 20.42 H new ATOM 0 HG LEU A 30 0.060 3.940 4.980 1.00 33.25 H new ATOM 0 HD11 LEU A 30 -1.218 4.349 7.046 1.00 14.41 H new ATOM 0 HD12 LEU A 30 -2.261 4.393 5.605 1.00 14.41 H new ATOM 0 HD13 LEU A 30 -2.269 2.964 6.665 1.00 14.41 H new ATOM 0 HD21 LEU A 30 0.780 2.904 7.098 1.00 41.20 H new ATOM 0 HD22 LEU A 30 -0.193 1.463 6.718 1.00 41.20 H new ATOM 0 HD23 LEU A 30 1.197 1.893 5.693 1.00 41.20 H new ATOM 492 N SER A 31 -0.728 3.236 0.878 1.00 52.30 N ATOM 493 CA SER A 31 0.272 3.613 -0.114 1.00 70.21 C ATOM 494 C SER A 31 0.038 5.037 -0.608 1.00 11.20 C ATOM 495 O SER A 31 0.912 5.898 -0.496 1.00 72.24 O ATOM 496 CB SER A 31 0.241 2.640 -1.295 1.00 4.14 C ATOM 497 OG SER A 31 0.811 3.225 -2.452 1.00 44.45 O ATOM 0 H SER A 31 -1.535 2.742 0.497 1.00 52.30 H new ATOM 0 HA SER A 31 1.253 3.568 0.360 1.00 70.21 H new ATOM 0 HB2 SER A 31 0.786 1.732 -1.037 1.00 4.14 H new ATOM 0 HB3 SER A 31 -0.788 2.346 -1.501 1.00 4.14 H new ATOM 0 HG SER A 31 0.781 2.583 -3.192 1.00 44.45 H new ATOM 503 N THR A 32 -1.149 5.280 -1.155 1.00 72.43 N ATOM 504 CA THR A 32 -1.500 6.598 -1.668 1.00 4.12 C ATOM 505 C THR A 32 -2.060 7.486 -0.563 1.00 53.31 C ATOM 506 O THR A 32 -2.091 8.710 -0.692 1.00 52.34 O ATOM 507 CB THR A 32 -2.532 6.502 -2.807 1.00 61.11 C ATOM 508 OG1 THR A 32 -2.098 5.547 -3.782 1.00 43.52 O ATOM 509 CG2 THR A 32 -2.734 7.856 -3.470 1.00 43.12 C ATOM 0 H THR A 32 -1.884 4.580 -1.254 1.00 72.43 H new ATOM 0 HA THR A 32 -0.583 7.040 -2.056 1.00 4.12 H new ATOM 0 HB THR A 32 -3.482 6.179 -2.381 1.00 61.11 H new ATOM 0 HG1 THR A 32 -2.760 5.491 -4.502 1.00 43.52 H new ATOM 0 HG21 THR A 32 -3.467 7.763 -4.271 1.00 43.12 H new ATOM 0 HG22 THR A 32 -3.093 8.573 -2.731 1.00 43.12 H new ATOM 0 HG23 THR A 32 -1.787 8.204 -3.883 1.00 43.12 H new ATOM 517 N PHE A 33 -2.502 6.863 0.524 1.00 73.30 N ATOM 518 CA PHE A 33 -3.062 7.597 1.652 1.00 15.33 C ATOM 519 C PHE A 33 -2.044 8.582 2.219 1.00 13.24 C ATOM 520 O PHE A 33 -2.345 9.761 2.411 1.00 35.34 O ATOM 521 CB PHE A 33 -3.515 6.627 2.746 1.00 45.31 C ATOM 522 CG PHE A 33 -3.522 7.234 4.120 1.00 44.12 C ATOM 523 CD1 PHE A 33 -4.370 8.287 4.422 1.00 30.13 C ATOM 524 CD2 PHE A 33 -2.679 6.752 5.109 1.00 74.02 C ATOM 525 CE1 PHE A 33 -4.379 8.847 5.686 1.00 54.43 C ATOM 526 CE2 PHE A 33 -2.685 7.308 6.374 1.00 4.10 C ATOM 527 CZ PHE A 33 -3.535 8.358 6.663 1.00 63.25 C ATOM 0 H PHE A 33 -2.483 5.851 0.648 1.00 73.30 H new ATOM 0 HA PHE A 33 -3.925 8.159 1.295 1.00 15.33 H new ATOM 0 HB2 PHE A 33 -4.517 6.269 2.511 1.00 45.31 H new ATOM 0 HB3 PHE A 33 -2.857 5.758 2.745 1.00 45.31 H new ATOM 0 HD1 PHE A 33 -5.032 8.675 3.661 1.00 30.13 H new ATOM 0 HD2 PHE A 33 -2.010 5.933 4.889 1.00 74.02 H new ATOM 0 HE1 PHE A 33 -5.046 9.667 5.909 1.00 54.43 H new ATOM 0 HE2 PHE A 33 -2.025 6.922 7.137 1.00 4.10 H new ATOM 0 HZ PHE A 33 -3.539 8.795 7.651 1.00 63.25 H new ATOM 537 N ILE A 34 -0.839 8.090 2.486 1.00 51.34 N ATOM 538 CA ILE A 34 0.224 8.926 3.030 1.00 15.40 C ATOM 539 C ILE A 34 0.509 10.115 2.119 1.00 51.42 C ATOM 540 O ILE A 34 0.700 11.237 2.588 1.00 63.32 O ATOM 541 CB ILE A 34 1.523 8.125 3.232 1.00 61.15 C ATOM 542 CG1 ILE A 34 1.248 6.863 4.053 1.00 50.54 C ATOM 543 CG2 ILE A 34 2.577 8.987 3.911 1.00 32.52 C ATOM 544 CD1 ILE A 34 2.372 5.852 4.001 1.00 35.02 C ATOM 0 H ILE A 34 -0.574 7.117 2.334 1.00 51.34 H new ATOM 0 HA ILE A 34 -0.124 9.288 3.998 1.00 15.40 H new ATOM 0 HB ILE A 34 1.902 7.824 2.255 1.00 61.15 H new ATOM 0 HG12 ILE A 34 1.072 7.146 5.091 1.00 50.54 H new ATOM 0 HG13 ILE A 34 0.333 6.396 3.690 1.00 50.54 H new ATOM 0 HG21 ILE A 34 3.489 8.406 4.047 1.00 32.52 H new ATOM 0 HG22 ILE A 34 2.790 9.858 3.291 1.00 32.52 H new ATOM 0 HG23 ILE A 34 2.208 9.315 4.883 1.00 32.52 H new ATOM 0 HD11 ILE A 34 2.109 4.984 4.605 1.00 35.02 H new ATOM 0 HD12 ILE A 34 2.534 5.541 2.969 1.00 35.02 H new ATOM 0 HD13 ILE A 34 3.285 6.302 4.391 1.00 35.02 H new ATOM 556 N GLU A 35 0.534 9.862 0.814 1.00 31.41 N ATOM 557 CA GLU A 35 0.795 10.912 -0.163 1.00 13.11 C ATOM 558 C GLU A 35 -0.331 11.942 -0.168 1.00 53.10 C ATOM 559 O GLU A 35 -0.099 13.131 -0.389 1.00 23.33 O ATOM 560 CB GLU A 35 0.957 10.311 -1.560 1.00 60.35 C ATOM 561 CG GLU A 35 1.826 9.065 -1.590 1.00 21.33 C ATOM 562 CD GLU A 35 2.956 9.165 -2.596 1.00 72.12 C ATOM 563 OE1 GLU A 35 3.605 10.230 -2.656 1.00 61.32 O ATOM 564 OE2 GLU A 35 3.190 8.177 -3.324 1.00 4.30 O ATOM 0 H GLU A 35 0.377 8.939 0.409 1.00 31.41 H new ATOM 0 HA GLU A 35 1.721 11.413 0.119 1.00 13.11 H new ATOM 0 HB2 GLU A 35 -0.028 10.066 -1.957 1.00 60.35 H new ATOM 0 HB3 GLU A 35 1.390 11.062 -2.221 1.00 60.35 H new ATOM 0 HG2 GLU A 35 2.243 8.893 -0.597 1.00 21.33 H new ATOM 0 HG3 GLU A 35 1.207 8.201 -1.830 1.00 21.33 H new ATOM 571 N ASP A 36 -1.551 11.477 0.076 1.00 74.11 N ATOM 572 CA ASP A 36 -2.714 12.356 0.100 1.00 54.50 C ATOM 573 C ASP A 36 -2.577 13.409 1.196 1.00 33.52 C ATOM 574 O ASP A 36 -2.712 14.606 0.942 1.00 2.33 O ATOM 575 CB ASP A 36 -3.992 11.543 0.314 1.00 64.33 C ATOM 576 CG ASP A 36 -5.111 11.968 -0.616 1.00 14.13 C ATOM 577 OD1 ASP A 36 -4.968 13.019 -1.276 1.00 32.31 O ATOM 578 OD2 ASP A 36 -6.131 11.250 -0.683 1.00 64.04 O ATOM 0 H ASP A 36 -1.760 10.496 0.260 1.00 74.11 H new ATOM 0 HA ASP A 36 -2.773 12.864 -0.862 1.00 54.50 H new ATOM 0 HB2 ASP A 36 -3.777 10.486 0.159 1.00 64.33 H new ATOM 0 HB3 ASP A 36 -4.321 11.653 1.347 1.00 64.33 H new ATOM 583 N LEU A 37 -2.310 12.954 2.415 1.00 33.34 N ATOM 584 CA LEU A 37 -2.156 13.855 3.552 1.00 51.53 C ATOM 585 C LEU A 37 -0.835 14.614 3.469 1.00 15.24 C ATOM 586 O LEU A 37 -0.680 15.679 4.067 1.00 14.41 O ATOM 587 CB LEU A 37 -2.226 13.071 4.863 1.00 11.53 C ATOM 588 CG LEU A 37 -1.150 12.004 5.066 1.00 42.33 C ATOM 589 CD1 LEU A 37 0.132 12.632 5.592 1.00 34.31 C ATOM 590 CD2 LEU A 37 -1.644 10.921 6.014 1.00 52.35 C ATOM 0 H LEU A 37 -2.196 11.966 2.642 1.00 33.34 H new ATOM 0 HA LEU A 37 -2.972 14.578 3.525 1.00 51.53 H new ATOM 0 HB2 LEU A 37 -2.168 13.779 5.690 1.00 11.53 H new ATOM 0 HB3 LEU A 37 -3.202 12.590 4.924 1.00 11.53 H new ATOM 0 HG LEU A 37 -0.936 11.544 4.102 1.00 42.33 H new ATOM 0 HD11 LEU A 37 0.886 11.858 5.730 1.00 34.31 H new ATOM 0 HD12 LEU A 37 0.496 13.369 4.877 1.00 34.31 H new ATOM 0 HD13 LEU A 37 -0.067 13.120 6.546 1.00 34.31 H new ATOM 0 HD21 LEU A 37 -0.865 10.170 6.146 1.00 52.35 H new ATOM 0 HD22 LEU A 37 -1.887 11.366 6.979 1.00 52.35 H new ATOM 0 HD23 LEU A 37 -2.534 10.450 5.597 1.00 52.35 H new ATOM 602 N LYS A 38 0.114 14.060 2.723 1.00 32.11 N ATOM 603 CA LYS A 38 1.421 14.685 2.558 1.00 31.25 C ATOM 604 C LYS A 38 1.371 15.779 1.497 1.00 61.34 C ATOM 605 O LYS A 38 2.035 16.809 1.620 1.00 75.44 O ATOM 606 CB LYS A 38 2.466 13.635 2.176 1.00 64.14 C ATOM 607 CG LYS A 38 3.124 12.967 3.371 1.00 42.40 C ATOM 608 CD LYS A 38 4.518 12.466 3.033 1.00 41.04 C ATOM 609 CE LYS A 38 4.472 11.330 2.022 1.00 33.24 C ATOM 610 NZ LYS A 38 4.782 11.800 0.644 1.00 1.20 N ATOM 0 H LYS A 38 0.003 13.178 2.222 1.00 32.11 H new ATOM 0 HA LYS A 38 1.702 15.139 3.508 1.00 31.25 H new ATOM 0 HB2 LYS A 38 1.992 12.871 1.559 1.00 64.14 H new ATOM 0 HB3 LYS A 38 3.236 14.106 1.565 1.00 64.14 H new ATOM 0 HG2 LYS A 38 3.181 13.674 4.198 1.00 42.40 H new ATOM 0 HG3 LYS A 38 2.508 12.133 3.707 1.00 42.40 H new ATOM 0 HD2 LYS A 38 5.114 13.287 2.633 1.00 41.04 H new ATOM 0 HD3 LYS A 38 5.014 12.126 3.942 1.00 41.04 H new ATOM 0 HE2 LYS A 38 5.185 10.558 2.311 1.00 33.24 H new ATOM 0 HE3 LYS A 38 3.483 10.872 2.035 1.00 33.24 H new ATOM 0 HZ1 LYS A 38 4.807 10.986 -0.003 1.00 1.20 H new ATOM 0 HZ2 LYS A 38 4.049 12.468 0.332 1.00 1.20 H new ATOM 0 HZ3 LYS A 38 5.707 12.275 0.639 1.00 1.20 H new ATOM 624 N LYS A 39 0.580 15.550 0.454 1.00 35.44 N ATOM 625 CA LYS A 39 0.440 16.516 -0.628 1.00 42.33 C ATOM 626 C LYS A 39 -0.442 17.686 -0.203 1.00 74.55 C ATOM 627 O LYS A 39 -0.196 18.831 -0.581 1.00 41.23 O ATOM 628 CB LYS A 39 -0.150 15.842 -1.869 1.00 14.03 C ATOM 629 CG LYS A 39 -1.596 15.410 -1.696 1.00 31.32 C ATOM 630 CD LYS A 39 -2.171 14.857 -2.989 1.00 73.10 C ATOM 631 CE LYS A 39 -1.534 13.526 -3.359 1.00 2.43 C ATOM 632 NZ LYS A 39 -2.234 12.874 -4.500 1.00 22.13 N ATOM 0 H LYS A 39 0.025 14.702 0.336 1.00 35.44 H new ATOM 0 HA LYS A 39 1.431 16.900 -0.868 1.00 42.33 H new ATOM 0 HB2 LYS A 39 -0.083 16.530 -2.712 1.00 14.03 H new ATOM 0 HB3 LYS A 39 0.454 14.970 -2.120 1.00 14.03 H new ATOM 0 HG2 LYS A 39 -1.659 14.652 -0.915 1.00 31.32 H new ATOM 0 HG3 LYS A 39 -2.193 16.259 -1.365 1.00 31.32 H new ATOM 0 HD2 LYS A 39 -3.248 14.729 -2.884 1.00 73.10 H new ATOM 0 HD3 LYS A 39 -2.012 15.574 -3.795 1.00 73.10 H new ATOM 0 HE2 LYS A 39 -0.487 13.684 -3.618 1.00 2.43 H new ATOM 0 HE3 LYS A 39 -1.552 12.862 -2.495 1.00 2.43 H new ATOM 0 HZ1 LYS A 39 -1.770 11.970 -4.721 1.00 22.13 H new ATOM 0 HZ2 LYS A 39 -3.227 12.700 -4.244 1.00 22.13 H new ATOM 0 HZ3 LYS A 39 -2.195 13.496 -5.332 1.00 22.13 H new ATOM 646 N TYR A 40 -1.470 17.389 0.585 1.00 41.34 N ATOM 647 CA TYR A 40 -2.390 18.416 1.060 1.00 45.12 C ATOM 648 C TYR A 40 -1.703 19.342 2.060 1.00 71.33 C ATOM 649 O TYR A 40 -2.248 20.377 2.441 1.00 73.43 O ATOM 650 CB TYR A 40 -3.618 17.772 1.704 1.00 22.45 C ATOM 651 CG TYR A 40 -4.782 17.603 0.755 1.00 51.43 C ATOM 652 CD1 TYR A 40 -4.738 16.668 -0.272 1.00 3.04 C ATOM 653 CD2 TYR A 40 -5.927 18.380 0.884 1.00 34.54 C ATOM 654 CE1 TYR A 40 -5.799 16.512 -1.142 1.00 61.31 C ATOM 655 CE2 TYR A 40 -6.994 18.229 0.019 1.00 11.05 C ATOM 656 CZ TYR A 40 -6.925 17.294 -0.992 1.00 42.24 C ATOM 657 OH TYR A 40 -7.985 17.141 -1.857 1.00 24.55 O ATOM 0 H TYR A 40 -1.687 16.446 0.908 1.00 41.34 H new ATOM 0 HA TYR A 40 -2.707 19.009 0.202 1.00 45.12 H new ATOM 0 HB2 TYR A 40 -3.339 16.796 2.101 1.00 22.45 H new ATOM 0 HB3 TYR A 40 -3.936 18.381 2.550 1.00 22.45 H new ATOM 0 HD1 TYR A 40 -3.859 16.053 -0.392 1.00 3.04 H new ATOM 0 HD2 TYR A 40 -5.984 19.114 1.674 1.00 34.54 H new ATOM 0 HE1 TYR A 40 -5.747 15.781 -1.936 1.00 61.31 H new ATOM 0 HE2 TYR A 40 -7.877 18.840 0.134 1.00 11.05 H new ATOM 0 HH TYR A 40 -8.699 17.767 -1.613 1.00 24.55 H new ATOM 667 N GLY A 41 -0.501 18.960 2.481 1.00 41.22 N ATOM 668 CA GLY A 41 0.242 19.766 3.432 1.00 21.10 C ATOM 669 C GLY A 41 -0.177 19.505 4.865 1.00 13.01 C ATOM 670 O GLY A 41 -0.163 20.411 5.698 1.00 51.03 O ATOM 0 H GLY A 41 -0.029 18.107 2.181 1.00 41.22 H new ATOM 0 HA2 GLY A 41 1.307 19.560 3.325 1.00 21.10 H new ATOM 0 HA3 GLY A 41 0.097 20.821 3.201 1.00 21.10 H new ATOM 674 N ALA A 42 -0.553 18.263 5.153 1.00 14.32 N ATOM 675 CA ALA A 42 -0.978 17.886 6.495 1.00 34.14 C ATOM 676 C ALA A 42 0.112 17.100 7.216 1.00 50.11 C ATOM 677 O ALA A 42 0.535 16.039 6.756 1.00 50.04 O ATOM 678 CB ALA A 42 -2.263 17.074 6.433 1.00 35.33 C ATOM 0 H ALA A 42 -0.572 17.501 4.475 1.00 14.32 H new ATOM 0 HA ALA A 42 -1.165 18.799 7.060 1.00 34.14 H new ATOM 0 HB1 ALA A 42 -2.569 16.799 7.442 1.00 35.33 H new ATOM 0 HB2 ALA A 42 -3.047 17.669 5.966 1.00 35.33 H new ATOM 0 HB3 ALA A 42 -2.095 16.171 5.846 1.00 35.33 H new ATOM 684 N THR A 43 0.565 17.628 8.349 1.00 32.31 N ATOM 685 CA THR A 43 1.607 16.977 9.132 1.00 24.32 C ATOM 686 C THR A 43 1.008 16.053 10.186 1.00 74.42 C ATOM 687 O THR A 43 1.572 15.875 11.266 1.00 42.42 O ATOM 688 CB THR A 43 2.515 18.009 9.828 1.00 72.13 C ATOM 689 OG1 THR A 43 1.834 18.584 10.949 1.00 74.45 O ATOM 690 CG2 THR A 43 2.925 19.108 8.859 1.00 4.04 C ATOM 0 H THR A 43 0.226 18.505 8.744 1.00 32.31 H new ATOM 0 HA THR A 43 2.204 16.389 8.435 1.00 24.32 H new ATOM 0 HB THR A 43 3.413 17.496 10.173 1.00 72.13 H new ATOM 0 HG1 THR A 43 2.483 18.799 11.651 1.00 74.45 H new ATOM 0 HG21 THR A 43 3.566 19.825 9.372 1.00 4.04 H new ATOM 0 HG22 THR A 43 3.468 18.671 8.021 1.00 4.04 H new ATOM 0 HG23 THR A 43 2.035 19.617 8.488 1.00 4.04 H new ATOM 698 N THR A 44 -0.141 15.464 9.866 1.00 64.15 N ATOM 699 CA THR A 44 -0.817 14.558 10.785 1.00 75.02 C ATOM 700 C THR A 44 -1.485 13.411 10.035 1.00 50.03 C ATOM 701 O THR A 44 -1.982 13.589 8.923 1.00 53.23 O ATOM 702 CB THR A 44 -1.880 15.296 11.621 1.00 4.42 C ATOM 703 OG1 THR A 44 -1.979 16.659 11.193 1.00 15.33 O ATOM 704 CG2 THR A 44 -1.532 15.248 13.101 1.00 11.54 C ATOM 0 H THR A 44 -0.622 15.599 8.977 1.00 64.15 H new ATOM 0 HA THR A 44 -0.054 14.157 11.452 1.00 75.02 H new ATOM 0 HB THR A 44 -2.838 14.798 11.473 1.00 4.42 H new ATOM 0 HG1 THR A 44 -1.769 17.254 11.943 1.00 15.33 H new ATOM 0 HG21 THR A 44 -2.296 15.775 13.672 1.00 11.54 H new ATOM 0 HG22 THR A 44 -1.485 14.210 13.430 1.00 11.54 H new ATOM 0 HG23 THR A 44 -0.565 15.724 13.263 1.00 11.54 H new ATOM 712 N VAL A 45 -1.493 12.233 10.650 1.00 34.13 N ATOM 713 CA VAL A 45 -2.102 11.056 10.041 1.00 10.30 C ATOM 714 C VAL A 45 -3.541 10.877 10.510 1.00 34.13 C ATOM 715 O VAL A 45 -3.857 11.098 11.680 1.00 63.43 O ATOM 716 CB VAL A 45 -1.304 9.780 10.367 1.00 75.52 C ATOM 717 CG1 VAL A 45 -1.581 8.699 9.333 1.00 62.22 C ATOM 718 CG2 VAL A 45 0.183 10.087 10.445 1.00 64.44 C ATOM 0 H VAL A 45 -1.085 12.068 11.570 1.00 34.13 H new ATOM 0 HA VAL A 45 -2.092 11.216 8.963 1.00 10.30 H new ATOM 0 HB VAL A 45 -1.626 9.409 11.340 1.00 75.52 H new ATOM 0 HG11 VAL A 45 -1.009 7.805 9.579 1.00 62.22 H new ATOM 0 HG12 VAL A 45 -2.645 8.460 9.332 1.00 62.22 H new ATOM 0 HG13 VAL A 45 -1.288 9.056 8.346 1.00 62.22 H new ATOM 0 HG21 VAL A 45 0.731 9.174 10.676 1.00 64.44 H new ATOM 0 HG22 VAL A 45 0.524 10.482 9.488 1.00 64.44 H new ATOM 0 HG23 VAL A 45 0.362 10.825 11.227 1.00 64.44 H new ATOM 728 N VAL A 46 -4.412 10.474 9.590 1.00 12.42 N ATOM 729 CA VAL A 46 -5.819 10.263 9.910 1.00 51.34 C ATOM 730 C VAL A 46 -6.010 9.003 10.746 1.00 4.35 C ATOM 731 O VAL A 46 -7.025 8.317 10.631 1.00 62.43 O ATOM 732 CB VAL A 46 -6.674 10.153 8.633 1.00 21.41 C ATOM 733 CG1 VAL A 46 -6.247 11.197 7.612 1.00 33.54 C ATOM 734 CG2 VAL A 46 -6.578 8.752 8.048 1.00 65.14 C ATOM 0 H VAL A 46 -4.168 10.287 8.617 1.00 12.42 H new ATOM 0 HA VAL A 46 -6.146 11.129 10.485 1.00 51.34 H new ATOM 0 HB VAL A 46 -7.715 10.342 8.896 1.00 21.41 H new ATOM 0 HG11 VAL A 46 -6.862 11.104 6.717 1.00 33.54 H new ATOM 0 HG12 VAL A 46 -6.372 12.193 8.036 1.00 33.54 H new ATOM 0 HG13 VAL A 46 -5.200 11.043 7.350 1.00 33.54 H new ATOM 0 HG21 VAL A 46 -7.188 8.692 7.147 1.00 65.14 H new ATOM 0 HG22 VAL A 46 -5.540 8.532 7.799 1.00 65.14 H new ATOM 0 HG23 VAL A 46 -6.938 8.027 8.778 1.00 65.14 H new ATOM 744 N ARG A 47 -5.027 8.706 11.590 1.00 64.41 N ATOM 745 CA ARG A 47 -5.085 7.527 12.446 1.00 14.24 C ATOM 746 C ARG A 47 -6.273 7.608 13.401 1.00 73.42 C ATOM 747 O ARG A 47 -6.528 6.682 14.171 1.00 21.23 O ATOM 748 CB ARG A 47 -3.787 7.384 13.242 1.00 21.33 C ATOM 749 CG ARG A 47 -2.776 6.450 12.596 1.00 54.31 C ATOM 750 CD ARG A 47 -1.835 5.849 13.627 1.00 24.41 C ATOM 751 NE ARG A 47 -2.163 4.457 13.922 1.00 33.43 N ATOM 752 CZ ARG A 47 -1.838 3.849 15.058 1.00 1.51 C ATOM 753 NH1 ARG A 47 -1.179 4.509 16.001 1.00 62.22 N ATOM 754 NH2 ARG A 47 -2.172 2.580 15.253 1.00 53.31 N ATOM 0 H ARG A 47 -4.181 9.265 11.699 1.00 64.41 H new ATOM 0 HA ARG A 47 -5.211 6.652 11.809 1.00 14.24 H new ATOM 0 HB2 ARG A 47 -3.334 8.368 13.363 1.00 21.33 H new ATOM 0 HB3 ARG A 47 -4.022 7.017 14.241 1.00 21.33 H new ATOM 0 HG2 ARG A 47 -3.300 5.651 12.071 1.00 54.31 H new ATOM 0 HG3 ARG A 47 -2.199 6.996 11.850 1.00 54.31 H new ATOM 0 HD2 ARG A 47 -0.810 5.910 13.261 1.00 24.41 H new ATOM 0 HD3 ARG A 47 -1.881 6.435 14.545 1.00 24.41 H new ATOM 0 HE ARG A 47 -2.670 3.922 13.217 1.00 33.43 H new ATOM 0 HH11 ARG A 47 -0.921 5.485 15.855 1.00 62.22 H new ATOM 0 HH12 ARG A 47 -0.930 4.041 16.872 1.00 62.22 H new ATOM 0 HH21 ARG A 47 -2.679 2.069 14.530 1.00 53.31 H new ATOM 0 HH22 ARG A 47 -1.922 2.115 16.126 1.00 53.31 H new ATOM 768 N VAL A 48 -6.997 8.721 13.344 1.00 12.11 N ATOM 769 CA VAL A 48 -8.158 8.923 14.202 1.00 34.54 C ATOM 770 C VAL A 48 -9.291 7.974 13.826 1.00 11.11 C ATOM 771 O VAL A 48 -10.244 8.366 13.152 1.00 73.12 O ATOM 772 CB VAL A 48 -8.670 10.373 14.123 1.00 53.12 C ATOM 773 CG1 VAL A 48 -9.996 10.513 14.855 1.00 31.42 C ATOM 774 CG2 VAL A 48 -7.636 11.334 14.688 1.00 2.51 C ATOM 0 H VAL A 48 -6.800 9.497 12.712 1.00 12.11 H new ATOM 0 HA VAL A 48 -7.837 8.715 15.223 1.00 34.54 H new ATOM 0 HB VAL A 48 -8.833 10.625 13.075 1.00 53.12 H new ATOM 0 HG11 VAL A 48 -10.341 11.545 14.788 1.00 31.42 H new ATOM 0 HG12 VAL A 48 -10.734 9.853 14.400 1.00 31.42 H new ATOM 0 HG13 VAL A 48 -9.864 10.242 15.902 1.00 31.42 H new ATOM 0 HG21 VAL A 48 -8.014 12.354 14.624 1.00 2.51 H new ATOM 0 HG22 VAL A 48 -7.439 11.085 15.731 1.00 2.51 H new ATOM 0 HG23 VAL A 48 -6.712 11.253 14.115 1.00 2.51 H new ATOM 784 N CYS A 49 -9.181 6.726 14.266 1.00 23.34 N ATOM 785 CA CYS A 49 -10.196 5.720 13.976 1.00 71.24 C ATOM 786 C CYS A 49 -9.810 4.370 14.571 1.00 31.31 C ATOM 787 O CYS A 49 -8.951 4.291 15.449 1.00 72.14 O ATOM 788 CB CYS A 49 -10.394 5.587 12.465 1.00 70.30 C ATOM 789 SG CYS A 49 -8.935 4.990 11.579 1.00 11.11 S ATOM 0 H CYS A 49 -8.399 6.386 14.825 1.00 23.34 H new ATOM 0 HA CYS A 49 -11.132 6.042 14.431 1.00 71.24 H new ATOM 0 HB2 CYS A 49 -11.224 4.906 12.277 1.00 70.30 H new ATOM 0 HB3 CYS A 49 -10.680 6.558 12.060 1.00 70.30 H new ATOM 0 HG CYS A 49 -9.201 4.909 10.309 1.00 11.11 H new ATOM 795 N GLU A 50 -10.452 3.310 14.088 1.00 13.44 N ATOM 796 CA GLU A 50 -10.177 1.964 14.576 1.00 73.14 C ATOM 797 C GLU A 50 -8.836 1.459 14.052 1.00 4.31 C ATOM 798 O GLU A 50 -8.765 0.428 13.384 1.00 33.53 O ATOM 799 CB GLU A 50 -11.294 1.007 14.154 1.00 72.11 C ATOM 800 CG GLU A 50 -11.457 0.888 12.648 1.00 55.01 C ATOM 801 CD GLU A 50 -12.865 0.497 12.243 1.00 74.02 C ATOM 802 OE1 GLU A 50 -13.765 1.360 12.314 1.00 32.32 O ATOM 803 OE2 GLU A 50 -13.067 -0.673 11.854 1.00 1.30 O ATOM 0 H GLU A 50 -11.165 3.358 13.360 1.00 13.44 H new ATOM 0 HA GLU A 50 -10.132 2.002 15.664 1.00 73.14 H new ATOM 0 HB2 GLU A 50 -11.091 0.019 14.568 1.00 72.11 H new ATOM 0 HB3 GLU A 50 -12.235 1.347 14.587 1.00 72.11 H new ATOM 0 HG2 GLU A 50 -11.200 1.839 12.182 1.00 55.01 H new ATOM 0 HG3 GLU A 50 -10.754 0.147 12.268 1.00 55.01 H new ATOM 810 N VAL A 51 -7.772 2.195 14.360 1.00 13.21 N ATOM 811 CA VAL A 51 -6.432 1.823 13.922 1.00 53.30 C ATOM 812 C VAL A 51 -5.911 0.624 14.705 1.00 31.24 C ATOM 813 O VAL A 51 -6.173 0.487 15.901 1.00 74.31 O ATOM 814 CB VAL A 51 -5.445 2.995 14.080 1.00 23.45 C ATOM 815 CG1 VAL A 51 -5.784 4.114 13.108 1.00 4.34 C ATOM 816 CG2 VAL A 51 -5.447 3.503 15.514 1.00 35.02 C ATOM 0 H VAL A 51 -7.813 3.052 14.911 1.00 13.21 H new ATOM 0 HA VAL A 51 -6.505 1.559 12.867 1.00 53.30 H new ATOM 0 HB VAL A 51 -4.442 2.637 13.847 1.00 23.45 H new ATOM 0 HG11 VAL A 51 -5.076 4.933 13.235 1.00 4.34 H new ATOM 0 HG12 VAL A 51 -5.726 3.739 12.086 1.00 4.34 H new ATOM 0 HG13 VAL A 51 -6.794 4.474 13.305 1.00 4.34 H new ATOM 0 HG21 VAL A 51 -4.744 4.331 15.608 1.00 35.02 H new ATOM 0 HG22 VAL A 51 -6.448 3.845 15.777 1.00 35.02 H new ATOM 0 HG23 VAL A 51 -5.150 2.697 16.186 1.00 35.02 H new ATOM 826 N THR A 52 -5.170 -0.244 14.024 1.00 22.41 N ATOM 827 CA THR A 52 -4.612 -1.433 14.655 1.00 25.54 C ATOM 828 C THR A 52 -3.305 -1.848 13.989 1.00 41.04 C ATOM 829 O THR A 52 -3.044 -3.036 13.796 1.00 14.13 O ATOM 830 CB THR A 52 -5.599 -2.614 14.602 1.00 72.22 C ATOM 831 OG1 THR A 52 -5.652 -3.149 13.274 1.00 12.43 O ATOM 832 CG2 THR A 52 -6.991 -2.176 15.033 1.00 5.04 C ATOM 0 H THR A 52 -4.942 -0.146 13.035 1.00 22.41 H new ATOM 0 HA THR A 52 -4.420 -1.176 15.697 1.00 25.54 H new ATOM 0 HB THR A 52 -5.248 -3.383 15.290 1.00 72.22 H new ATOM 0 HG1 THR A 52 -4.802 -3.589 13.064 1.00 12.43 H new ATOM 0 HG21 THR A 52 -7.671 -3.027 14.987 1.00 5.04 H new ATOM 0 HG22 THR A 52 -6.953 -1.796 16.054 1.00 5.04 H new ATOM 0 HG23 THR A 52 -7.348 -1.391 14.367 1.00 5.04 H new ATOM 840 N TYR A 53 -2.486 -0.862 13.638 1.00 33.24 N ATOM 841 CA TYR A 53 -1.206 -1.125 12.991 1.00 35.02 C ATOM 842 C TYR A 53 -0.145 -0.135 13.461 1.00 22.55 C ATOM 843 O TYR A 53 -0.447 1.018 13.769 1.00 75.34 O ATOM 844 CB TYR A 53 -1.355 -1.047 11.471 1.00 65.12 C ATOM 845 CG TYR A 53 -0.647 0.138 10.854 1.00 55.44 C ATOM 846 CD1 TYR A 53 -1.104 1.433 11.067 1.00 41.11 C ATOM 847 CD2 TYR A 53 0.478 -0.037 10.058 1.00 40.44 C ATOM 848 CE1 TYR A 53 -0.461 2.519 10.504 1.00 34.23 C ATOM 849 CE2 TYR A 53 1.128 1.043 9.492 1.00 12.40 C ATOM 850 CZ TYR A 53 0.654 2.319 9.718 1.00 61.01 C ATOM 851 OH TYR A 53 1.298 3.398 9.157 1.00 52.02 O ATOM 0 H TYR A 53 -2.686 0.126 13.791 1.00 33.24 H new ATOM 0 HA TYR A 53 -0.887 -2.130 13.267 1.00 35.02 H new ATOM 0 HB2 TYR A 53 -0.965 -1.964 11.028 1.00 65.12 H new ATOM 0 HB3 TYR A 53 -2.415 -0.998 11.220 1.00 65.12 H new ATOM 0 HD1 TYR A 53 -1.976 1.593 11.683 1.00 41.11 H new ATOM 0 HD2 TYR A 53 0.851 -1.035 9.878 1.00 40.44 H new ATOM 0 HE1 TYR A 53 -0.830 3.519 10.679 1.00 34.23 H new ATOM 0 HE2 TYR A 53 2.002 0.889 8.876 1.00 12.40 H new ATOM 0 HH TYR A 53 0.637 4.068 8.885 1.00 52.02 H new ATOM 861 N ASP A 54 1.100 -0.595 13.514 1.00 5.04 N ATOM 862 CA ASP A 54 2.209 0.249 13.945 1.00 22.21 C ATOM 863 C ASP A 54 2.610 1.224 12.842 1.00 23.35 C ATOM 864 O ASP A 54 2.844 0.825 11.701 1.00 3.42 O ATOM 865 CB ASP A 54 3.409 -0.612 14.343 1.00 71.41 C ATOM 866 CG ASP A 54 3.463 -0.877 15.835 1.00 54.23 C ATOM 867 OD1 ASP A 54 3.832 0.048 16.588 1.00 41.12 O ATOM 868 OD2 ASP A 54 3.136 -2.009 16.249 1.00 10.12 O ATOM 0 H ASP A 54 1.367 -1.547 13.264 1.00 5.04 H new ATOM 0 HA ASP A 54 1.881 0.823 14.811 1.00 22.21 H new ATOM 0 HB2 ASP A 54 3.364 -1.562 13.810 1.00 71.41 H new ATOM 0 HB3 ASP A 54 4.328 -0.115 14.032 1.00 71.41 H new ATOM 873 N LYS A 55 2.687 2.504 13.191 1.00 60.33 N ATOM 874 CA LYS A 55 3.060 3.537 12.232 1.00 72.12 C ATOM 875 C LYS A 55 4.507 3.365 11.781 1.00 31.24 C ATOM 876 O LYS A 55 5.440 3.713 12.506 1.00 33.02 O ATOM 877 CB LYS A 55 2.867 4.925 12.846 1.00 5.33 C ATOM 878 CG LYS A 55 3.263 5.002 14.311 1.00 54.22 C ATOM 879 CD LYS A 55 3.894 6.343 14.648 1.00 32.55 C ATOM 880 CE LYS A 55 3.868 6.609 16.146 1.00 45.13 C ATOM 881 NZ LYS A 55 4.517 5.512 16.916 1.00 64.15 N ATOM 0 H LYS A 55 2.496 2.851 14.131 1.00 60.33 H new ATOM 0 HA LYS A 55 2.413 3.439 11.360 1.00 72.12 H new ATOM 0 HB2 LYS A 55 3.455 5.648 12.281 1.00 5.33 H new ATOM 0 HB3 LYS A 55 1.821 5.216 12.745 1.00 5.33 H new ATOM 0 HG2 LYS A 55 2.383 4.846 14.935 1.00 54.22 H new ATOM 0 HG3 LYS A 55 3.965 4.200 14.542 1.00 54.22 H new ATOM 0 HD2 LYS A 55 4.924 6.362 14.292 1.00 32.55 H new ATOM 0 HD3 LYS A 55 3.362 7.138 14.127 1.00 32.55 H new ATOM 0 HE2 LYS A 55 4.376 7.550 16.356 1.00 45.13 H new ATOM 0 HE3 LYS A 55 2.836 6.723 16.477 1.00 45.13 H new ATOM 0 HZ1 LYS A 55 4.631 5.804 17.908 1.00 64.15 H new ATOM 0 HZ2 LYS A 55 3.923 4.659 16.873 1.00 64.15 H new ATOM 0 HZ3 LYS A 55 5.450 5.305 16.506 1.00 64.15 H new ATOM 895 N THR A 56 4.688 2.827 10.579 1.00 30.53 N ATOM 896 CA THR A 56 6.021 2.609 10.032 1.00 21.34 C ATOM 897 C THR A 56 6.413 3.729 9.076 1.00 73.15 C ATOM 898 O THR A 56 7.424 4.408 9.257 1.00 74.21 O ATOM 899 CB THR A 56 6.111 1.261 9.291 1.00 1.24 C ATOM 900 OG1 THR A 56 6.458 1.479 7.919 1.00 21.23 O ATOM 901 CG2 THR A 56 4.791 0.510 9.373 1.00 70.31 C ATOM 0 H THR A 56 3.928 2.534 9.966 1.00 30.53 H new ATOM 0 HA THR A 56 6.711 2.598 10.876 1.00 21.34 H new ATOM 0 HB THR A 56 6.883 0.659 9.769 1.00 1.24 H new ATOM 0 HG1 THR A 56 6.515 0.618 7.455 1.00 21.23 H new ATOM 0 HG21 THR A 56 4.878 -0.438 8.843 1.00 70.31 H new ATOM 0 HG22 THR A 56 4.545 0.320 10.418 1.00 70.31 H new ATOM 0 HG23 THR A 56 4.003 1.109 8.917 1.00 70.31 H new ATOM 909 N PRO A 57 5.595 3.929 8.032 1.00 52.44 N ATOM 910 CA PRO A 57 5.835 4.968 7.026 1.00 41.52 C ATOM 911 C PRO A 57 5.629 6.373 7.583 1.00 72.04 C ATOM 912 O PRO A 57 6.587 7.122 7.778 1.00 63.52 O ATOM 913 CB PRO A 57 4.795 4.664 5.945 1.00 33.52 C ATOM 914 CG PRO A 57 3.703 3.947 6.662 1.00 32.00 C ATOM 915 CD PRO A 57 4.372 3.158 7.753 1.00 61.41 C ATOM 0 HA PRO A 57 6.863 4.954 6.663 1.00 41.52 H new ATOM 0 HB2 PRO A 57 4.429 5.579 5.479 1.00 33.52 H new ATOM 0 HB3 PRO A 57 5.218 4.049 5.151 1.00 33.52 H new ATOM 0 HG2 PRO A 57 2.981 4.650 7.076 1.00 32.00 H new ATOM 0 HG3 PRO A 57 3.157 3.291 5.985 1.00 32.00 H new ATOM 0 HD2 PRO A 57 3.738 3.077 8.636 1.00 61.41 H new ATOM 0 HD3 PRO A 57 4.602 2.142 7.431 1.00 61.41 H new ATOM 923 N LEU A 58 4.373 6.725 7.837 1.00 24.11 N ATOM 924 CA LEU A 58 4.041 8.041 8.373 1.00 61.54 C ATOM 925 C LEU A 58 4.926 8.381 9.568 1.00 54.23 C ATOM 926 O LEU A 58 5.069 9.548 9.933 1.00 61.54 O ATOM 927 CB LEU A 58 2.568 8.089 8.783 1.00 24.44 C ATOM 928 CG LEU A 58 2.191 7.279 10.025 1.00 40.43 C ATOM 929 CD1 LEU A 58 2.638 5.833 9.876 1.00 41.55 C ATOM 930 CD2 LEU A 58 2.800 7.902 11.273 1.00 61.23 C ATOM 0 H LEU A 58 3.568 6.118 7.681 1.00 24.11 H new ATOM 0 HA LEU A 58 4.218 8.780 7.592 1.00 61.54 H new ATOM 0 HB2 LEU A 58 2.293 9.130 8.955 1.00 24.44 H new ATOM 0 HB3 LEU A 58 1.967 7.734 7.946 1.00 24.44 H new ATOM 0 HG LEU A 58 1.106 7.293 10.129 1.00 40.43 H new ATOM 0 HD11 LEU A 58 2.361 5.273 10.769 1.00 41.55 H new ATOM 0 HD12 LEU A 58 2.154 5.390 9.005 1.00 41.55 H new ATOM 0 HD13 LEU A 58 3.720 5.798 9.747 1.00 41.55 H new ATOM 0 HD21 LEU A 58 2.521 7.313 12.147 1.00 61.23 H new ATOM 0 HD22 LEU A 58 3.886 7.919 11.178 1.00 61.23 H new ATOM 0 HD23 LEU A 58 2.430 8.921 11.389 1.00 61.23 H new ATOM 942 N GLU A 59 5.518 7.355 10.171 1.00 15.11 N ATOM 943 CA GLU A 59 6.389 7.547 11.324 1.00 2.11 C ATOM 944 C GLU A 59 7.707 8.194 10.908 1.00 62.10 C ATOM 945 O GLU A 59 8.125 9.202 11.478 1.00 55.54 O ATOM 946 CB GLU A 59 6.661 6.209 12.015 1.00 72.04 C ATOM 947 CG GLU A 59 7.864 6.236 12.942 1.00 20.21 C ATOM 948 CD GLU A 59 7.722 7.259 14.052 1.00 23.02 C ATOM 949 OE1 GLU A 59 6.627 7.845 14.181 1.00 2.52 O ATOM 950 OE2 GLU A 59 8.706 7.474 14.791 1.00 34.52 O ATOM 0 H GLU A 59 5.410 6.383 9.880 1.00 15.11 H new ATOM 0 HA GLU A 59 5.882 8.212 12.023 1.00 2.11 H new ATOM 0 HB2 GLU A 59 5.779 5.919 12.586 1.00 72.04 H new ATOM 0 HB3 GLU A 59 6.815 5.442 11.256 1.00 72.04 H new ATOM 0 HG2 GLU A 59 8.003 5.247 13.380 1.00 20.21 H new ATOM 0 HG3 GLU A 59 8.760 6.457 12.362 1.00 20.21 H new ATOM 957 N LYS A 60 8.359 7.606 9.911 1.00 61.23 N ATOM 958 CA LYS A 60 9.629 8.123 9.416 1.00 64.00 C ATOM 959 C LYS A 60 9.414 9.366 8.559 1.00 10.31 C ATOM 960 O LYS A 60 10.350 10.123 8.300 1.00 11.12 O ATOM 961 CB LYS A 60 10.358 7.051 8.603 1.00 25.43 C ATOM 962 CG LYS A 60 10.432 5.704 9.301 1.00 23.35 C ATOM 963 CD LYS A 60 11.075 5.821 10.673 1.00 12.24 C ATOM 964 CE LYS A 60 11.041 4.496 11.420 1.00 44.41 C ATOM 965 NZ LYS A 60 12.383 3.851 11.464 1.00 35.40 N ATOM 0 H LYS A 60 8.028 6.770 9.429 1.00 61.23 H new ATOM 0 HA LYS A 60 10.240 8.397 10.276 1.00 64.00 H new ATOM 0 HB2 LYS A 60 9.853 6.927 7.645 1.00 25.43 H new ATOM 0 HB3 LYS A 60 11.370 7.395 8.388 1.00 25.43 H new ATOM 0 HG2 LYS A 60 9.429 5.290 9.403 1.00 23.35 H new ATOM 0 HG3 LYS A 60 11.004 5.007 8.689 1.00 23.35 H new ATOM 0 HD2 LYS A 60 12.108 6.152 10.565 1.00 12.24 H new ATOM 0 HD3 LYS A 60 10.556 6.582 11.256 1.00 12.24 H new ATOM 0 HE2 LYS A 60 10.684 4.661 12.436 1.00 44.41 H new ATOM 0 HE3 LYS A 60 10.331 3.825 10.937 1.00 44.41 H new ATOM 0 HZ1 LYS A 60 12.319 2.951 11.981 1.00 35.40 H new ATOM 0 HZ2 LYS A 60 12.713 3.671 10.495 1.00 35.40 H new ATOM 0 HZ3 LYS A 60 13.055 4.481 11.947 1.00 35.40 H new ATOM 979 N ASP A 61 8.176 9.572 8.123 1.00 30.53 N ATOM 980 CA ASP A 61 7.837 10.725 7.298 1.00 64.14 C ATOM 981 C ASP A 61 7.752 11.992 8.143 1.00 74.12 C ATOM 982 O ASP A 61 7.521 13.083 7.623 1.00 62.21 O ATOM 983 CB ASP A 61 6.511 10.489 6.574 1.00 72.02 C ATOM 984 CG ASP A 61 6.699 10.214 5.095 1.00 42.02 C ATOM 985 OD1 ASP A 61 7.518 10.912 4.461 1.00 41.23 O ATOM 986 OD2 ASP A 61 6.028 9.300 4.572 1.00 43.24 O ATOM 0 H ASP A 61 7.390 8.955 8.328 1.00 30.53 H new ATOM 0 HA ASP A 61 8.627 10.856 6.558 1.00 64.14 H new ATOM 0 HB2 ASP A 61 5.994 9.647 7.034 1.00 72.02 H new ATOM 0 HB3 ASP A 61 5.871 11.363 6.700 1.00 72.02 H new ATOM 991 N GLY A 62 7.938 11.839 9.451 1.00 73.25 N ATOM 992 CA GLY A 62 7.876 12.978 10.347 1.00 42.40 C ATOM 993 C GLY A 62 6.472 13.531 10.486 1.00 13.33 C ATOM 994 O GLY A 62 6.289 14.718 10.758 1.00 1.33 O ATOM 0 H GLY A 62 8.130 10.946 9.905 1.00 73.25 H new ATOM 0 HA2 GLY A 62 8.246 12.684 11.329 1.00 42.40 H new ATOM 0 HA3 GLY A 62 8.537 13.762 9.979 1.00 42.40 H new ATOM 998 N ILE A 63 5.477 12.670 10.298 1.00 43.40 N ATOM 999 CA ILE A 63 4.082 13.080 10.404 1.00 45.12 C ATOM 1000 C ILE A 63 3.499 12.700 11.761 1.00 43.24 C ATOM 1001 O ILE A 63 3.713 11.592 12.253 1.00 71.31 O ATOM 1002 CB ILE A 63 3.224 12.447 9.293 1.00 31.11 C ATOM 1003 CG1 ILE A 63 3.652 12.976 7.923 1.00 44.01 C ATOM 1004 CG2 ILE A 63 1.749 12.729 9.538 1.00 20.31 C ATOM 1005 CD1 ILE A 63 3.375 12.013 6.790 1.00 54.55 C ATOM 0 H ILE A 63 5.611 11.685 10.072 1.00 43.40 H new ATOM 0 HA ILE A 63 4.062 14.164 10.294 1.00 45.12 H new ATOM 0 HB ILE A 63 3.376 11.368 9.308 1.00 31.11 H new ATOM 0 HG12 ILE A 63 3.133 13.914 7.727 1.00 44.01 H new ATOM 0 HG13 ILE A 63 4.718 13.200 7.946 1.00 44.01 H new ATOM 0 HG21 ILE A 63 1.155 12.275 8.745 1.00 20.31 H new ATOM 0 HG22 ILE A 63 1.453 12.308 10.499 1.00 20.31 H new ATOM 0 HG23 ILE A 63 1.581 13.806 9.546 1.00 20.31 H new ATOM 0 HD11 ILE A 63 3.704 12.454 5.849 1.00 54.55 H new ATOM 0 HD12 ILE A 63 3.915 11.082 6.963 1.00 54.55 H new ATOM 0 HD13 ILE A 63 2.306 11.808 6.740 1.00 54.55 H new ATOM 1017 N THR A 64 2.759 13.627 12.361 1.00 3.13 N ATOM 1018 CA THR A 64 2.144 13.390 13.661 1.00 61.10 C ATOM 1019 C THR A 64 1.123 12.260 13.588 1.00 10.50 C ATOM 1020 O THR A 64 0.143 12.342 12.847 1.00 45.42 O ATOM 1021 CB THR A 64 1.452 14.658 14.195 1.00 43.41 C ATOM 1022 OG1 THR A 64 2.434 15.614 14.610 1.00 5.11 O ATOM 1023 CG2 THR A 64 0.537 14.325 15.363 1.00 73.51 C ATOM 0 H THR A 64 2.571 14.549 11.967 1.00 3.13 H new ATOM 0 HA THR A 64 2.946 13.108 14.343 1.00 61.10 H new ATOM 0 HB THR A 64 0.849 15.081 13.391 1.00 43.41 H new ATOM 0 HG1 THR A 64 2.814 16.055 13.822 1.00 5.11 H new ATOM 0 HG21 THR A 64 0.060 15.237 15.723 1.00 73.51 H new ATOM 0 HG22 THR A 64 -0.227 13.620 15.037 1.00 73.51 H new ATOM 0 HG23 THR A 64 1.122 13.880 16.168 1.00 73.51 H new ATOM 1031 N VAL A 65 1.357 11.206 14.363 1.00 64.14 N ATOM 1032 CA VAL A 65 0.457 10.060 14.387 1.00 35.20 C ATOM 1033 C VAL A 65 -0.766 10.340 15.253 1.00 12.33 C ATOM 1034 O VAL A 65 -0.668 10.420 16.478 1.00 70.41 O ATOM 1035 CB VAL A 65 1.167 8.799 14.914 1.00 72.33 C ATOM 1036 CG1 VAL A 65 1.873 9.093 16.228 1.00 3.22 C ATOM 1037 CG2 VAL A 65 0.174 7.657 15.076 1.00 2.55 C ATOM 0 H VAL A 65 2.163 11.122 14.983 1.00 64.14 H new ATOM 0 HA VAL A 65 0.139 9.886 13.359 1.00 35.20 H new ATOM 0 HB VAL A 65 1.919 8.496 14.186 1.00 72.33 H new ATOM 0 HG11 VAL A 65 2.369 8.190 16.585 1.00 3.22 H new ATOM 0 HG12 VAL A 65 2.614 9.878 16.075 1.00 3.22 H new ATOM 0 HG13 VAL A 65 1.143 9.422 16.967 1.00 3.22 H new ATOM 0 HG21 VAL A 65 0.693 6.774 15.449 1.00 2.55 H new ATOM 0 HG22 VAL A 65 -0.603 7.948 15.783 1.00 2.55 H new ATOM 0 HG23 VAL A 65 -0.280 7.430 14.111 1.00 2.55 H new ATOM 1047 N VAL A 66 -1.919 10.489 14.609 1.00 14.41 N ATOM 1048 CA VAL A 66 -3.163 10.760 15.321 1.00 71.55 C ATOM 1049 C VAL A 66 -4.055 9.524 15.356 1.00 34.10 C ATOM 1050 O VAL A 66 -4.873 9.310 14.460 1.00 25.34 O ATOM 1051 CB VAL A 66 -3.939 11.921 14.673 1.00 54.44 C ATOM 1052 CG1 VAL A 66 -4.981 12.471 15.636 1.00 62.24 C ATOM 1053 CG2 VAL A 66 -2.983 13.017 14.226 1.00 12.24 C ATOM 0 H VAL A 66 -2.018 10.427 13.596 1.00 14.41 H new ATOM 0 HA VAL A 66 -2.891 11.038 16.339 1.00 71.55 H new ATOM 0 HB VAL A 66 -4.458 11.541 13.793 1.00 54.44 H new ATOM 0 HG11 VAL A 66 -5.519 13.291 15.160 1.00 62.24 H new ATOM 0 HG12 VAL A 66 -5.684 11.681 15.902 1.00 62.24 H new ATOM 0 HG13 VAL A 66 -4.487 12.835 16.537 1.00 62.24 H new ATOM 0 HG21 VAL A 66 -3.549 13.830 13.770 1.00 12.24 H new ATOM 0 HG22 VAL A 66 -2.435 13.396 15.089 1.00 12.24 H new ATOM 0 HG23 VAL A 66 -2.280 12.612 13.498 1.00 12.24 H new ATOM 1063 N ASP A 67 -3.894 8.714 16.397 1.00 43.15 N ATOM 1064 CA ASP A 67 -4.686 7.499 16.550 1.00 2.44 C ATOM 1065 C ASP A 67 -5.625 7.611 17.747 1.00 0.14 C ATOM 1066 O ASP A 67 -5.181 7.654 18.895 1.00 72.12 O ATOM 1067 CB ASP A 67 -3.770 6.285 16.716 1.00 13.53 C ATOM 1068 CG ASP A 67 -2.620 6.554 17.666 1.00 22.44 C ATOM 1069 OD1 ASP A 67 -1.734 7.361 17.314 1.00 74.02 O ATOM 1070 OD2 ASP A 67 -2.605 5.957 18.763 1.00 31.20 O ATOM 0 H ASP A 67 -3.222 8.877 17.147 1.00 43.15 H new ATOM 0 HA ASP A 67 -5.287 7.370 15.650 1.00 2.44 H new ATOM 0 HB2 ASP A 67 -4.353 5.441 17.085 1.00 13.53 H new ATOM 0 HB3 ASP A 67 -3.374 5.997 15.742 1.00 13.53 H new ATOM 1075 N TRP A 68 -6.923 7.659 17.471 1.00 31.25 N ATOM 1076 CA TRP A 68 -7.925 7.767 18.526 1.00 21.00 C ATOM 1077 C TRP A 68 -9.153 6.924 18.199 1.00 25.12 C ATOM 1078 O TRP A 68 -9.651 6.921 17.074 1.00 71.25 O ATOM 1079 CB TRP A 68 -8.332 9.228 18.723 1.00 11.10 C ATOM 1080 CG TRP A 68 -7.164 10.155 18.873 1.00 51.33 C ATOM 1081 CD1 TRP A 68 -6.879 11.246 18.101 1.00 32.34 C ATOM 1082 CD2 TRP A 68 -6.124 10.072 19.853 1.00 63.33 C ATOM 1083 NE1 TRP A 68 -5.724 11.845 18.543 1.00 52.01 N ATOM 1084 CE2 TRP A 68 -5.242 11.145 19.617 1.00 61.43 C ATOM 1085 CE3 TRP A 68 -5.852 9.196 20.908 1.00 52.53 C ATOM 1086 CZ2 TRP A 68 -4.109 11.362 20.397 1.00 54.22 C ATOM 1087 CZ3 TRP A 68 -4.728 9.414 21.681 1.00 64.32 C ATOM 1088 CH2 TRP A 68 -3.868 10.490 21.423 1.00 61.31 C ATOM 0 H TRP A 68 -7.307 7.625 16.527 1.00 31.25 H new ATOM 0 HA TRP A 68 -7.485 7.392 19.450 1.00 21.00 H new ATOM 0 HB2 TRP A 68 -8.934 9.548 17.872 1.00 11.10 H new ATOM 0 HB3 TRP A 68 -8.964 9.305 19.608 1.00 11.10 H new ATOM 0 HD1 TRP A 68 -7.474 11.587 17.267 1.00 32.34 H new ATOM 0 HE1 TRP A 68 -5.295 12.677 18.137 1.00 52.01 H new ATOM 0 HE3 TRP A 68 -6.509 8.364 21.115 1.00 52.53 H new ATOM 0 HZ2 TRP A 68 -3.444 12.190 20.199 1.00 54.22 H new ATOM 0 HZ3 TRP A 68 -4.508 8.743 22.499 1.00 64.32 H new ATOM 0 HH2 TRP A 68 -2.998 10.634 22.046 1.00 61.31 H new ATOM 1099 N PRO A 69 -9.653 6.191 19.205 1.00 53.02 N ATOM 1100 CA PRO A 69 -10.830 5.331 19.048 1.00 62.32 C ATOM 1101 C PRO A 69 -12.114 6.132 18.863 1.00 44.45 C ATOM 1102 O PRO A 69 -13.060 5.995 19.638 1.00 53.43 O ATOM 1103 CB PRO A 69 -10.874 4.547 20.362 1.00 61.32 C ATOM 1104 CG PRO A 69 -10.174 5.418 21.347 1.00 52.44 C ATOM 1105 CD PRO A 69 -9.110 6.146 20.573 1.00 40.23 C ATOM 0 HA PRO A 69 -10.758 4.701 18.161 1.00 62.32 H new ATOM 0 HB2 PRO A 69 -11.900 4.347 20.670 1.00 61.32 H new ATOM 0 HB3 PRO A 69 -10.377 3.582 20.264 1.00 61.32 H new ATOM 0 HG2 PRO A 69 -10.868 6.119 21.810 1.00 52.44 H new ATOM 0 HG3 PRO A 69 -9.736 4.825 22.150 1.00 52.44 H new ATOM 0 HD2 PRO A 69 -8.938 7.146 20.970 1.00 40.23 H new ATOM 0 HD3 PRO A 69 -8.156 5.620 20.609 1.00 40.23 H new ATOM 1113 N PHE A 70 -12.139 6.969 17.830 1.00 15.14 N ATOM 1114 CA PHE A 70 -13.308 7.794 17.544 1.00 63.53 C ATOM 1115 C PHE A 70 -14.064 7.262 16.329 1.00 4.04 C ATOM 1116 O PHE A 70 -14.898 7.958 15.750 1.00 4.33 O ATOM 1117 CB PHE A 70 -12.887 9.245 17.302 1.00 73.32 C ATOM 1118 CG PHE A 70 -13.471 10.211 18.292 1.00 14.02 C ATOM 1119 CD1 PHE A 70 -14.801 10.116 18.672 1.00 63.14 C ATOM 1120 CD2 PHE A 70 -12.691 11.214 18.844 1.00 13.22 C ATOM 1121 CE1 PHE A 70 -15.341 11.004 19.582 1.00 3.31 C ATOM 1122 CE2 PHE A 70 -13.226 12.105 19.756 1.00 43.44 C ATOM 1123 CZ PHE A 70 -14.552 12.000 20.126 1.00 71.53 C ATOM 0 H PHE A 70 -11.364 7.094 17.178 1.00 15.14 H new ATOM 0 HA PHE A 70 -13.971 7.755 18.408 1.00 63.53 H new ATOM 0 HB2 PHE A 70 -11.800 9.311 17.340 1.00 73.32 H new ATOM 0 HB3 PHE A 70 -13.189 9.540 16.297 1.00 73.32 H new ATOM 0 HD1 PHE A 70 -15.422 9.339 18.252 1.00 63.14 H new ATOM 0 HD2 PHE A 70 -11.653 11.301 18.559 1.00 13.22 H new ATOM 0 HE1 PHE A 70 -16.379 10.920 19.868 1.00 3.31 H new ATOM 0 HE2 PHE A 70 -12.607 12.883 20.179 1.00 43.44 H new ATOM 0 HZ PHE A 70 -14.972 12.694 20.839 1.00 71.53 H new ATOM 1223 N LYS A 79 -13.106 11.410 27.680 1.00 3.12 N ATOM 1224 CA LYS A 79 -11.676 11.454 27.965 1.00 73.52 C ATOM 1225 C LYS A 79 -10.881 11.788 26.707 1.00 50.30 C ATOM 1226 O LYS A 79 -9.750 12.269 26.785 1.00 73.01 O ATOM 1227 CB LYS A 79 -11.208 10.113 28.535 1.00 30.13 C ATOM 1228 CG LYS A 79 -9.780 10.137 29.052 1.00 42.25 C ATOM 1229 CD LYS A 79 -9.653 10.992 30.302 1.00 71.34 C ATOM 1230 CE LYS A 79 -8.412 11.870 30.253 1.00 55.33 C ATOM 1231 NZ LYS A 79 -7.872 12.143 31.613 1.00 11.13 N ATOM 0 HA LYS A 79 -11.501 12.237 28.703 1.00 73.52 H new ATOM 0 HB2 LYS A 79 -11.874 9.820 29.346 1.00 30.13 H new ATOM 0 HB3 LYS A 79 -11.293 9.350 27.762 1.00 30.13 H new ATOM 0 HG2 LYS A 79 -9.454 9.120 29.271 1.00 42.25 H new ATOM 0 HG3 LYS A 79 -9.118 10.524 28.277 1.00 42.25 H new ATOM 0 HD2 LYS A 79 -10.539 11.618 30.407 1.00 71.34 H new ATOM 0 HD3 LYS A 79 -9.611 10.349 31.181 1.00 71.34 H new ATOM 0 HE2 LYS A 79 -7.646 11.383 29.649 1.00 55.33 H new ATOM 0 HE3 LYS A 79 -8.653 12.813 29.762 1.00 55.33 H new ATOM 0 HZ1 LYS A 79 -7.027 12.744 31.537 1.00 11.13 H new ATOM 0 HZ2 LYS A 79 -8.594 12.630 32.182 1.00 11.13 H new ATOM 0 HZ3 LYS A 79 -7.618 11.245 32.072 1.00 11.13 H new ATOM 1245 N VAL A 80 -11.480 11.532 25.548 1.00 2.50 N ATOM 1246 CA VAL A 80 -10.828 11.809 24.273 1.00 12.34 C ATOM 1247 C VAL A 80 -10.527 13.296 24.121 1.00 15.14 C ATOM 1248 O VAL A 80 -9.574 13.682 23.445 1.00 61.20 O ATOM 1249 CB VAL A 80 -11.696 11.348 23.088 1.00 53.55 C ATOM 1250 CG1 VAL A 80 -10.969 11.578 21.772 1.00 45.02 C ATOM 1251 CG2 VAL A 80 -12.080 9.885 23.246 1.00 52.03 C ATOM 0 H VAL A 80 -12.415 11.133 25.466 1.00 2.50 H new ATOM 0 HA VAL A 80 -9.892 11.250 24.268 1.00 12.34 H new ATOM 0 HB VAL A 80 -12.611 11.941 23.078 1.00 53.55 H new ATOM 0 HG11 VAL A 80 -11.598 11.246 20.946 1.00 45.02 H new ATOM 0 HG12 VAL A 80 -10.750 12.640 21.658 1.00 45.02 H new ATOM 0 HG13 VAL A 80 -10.037 11.013 21.768 1.00 45.02 H new ATOM 0 HG21 VAL A 80 -12.693 9.576 22.399 1.00 52.03 H new ATOM 0 HG22 VAL A 80 -11.178 9.274 23.283 1.00 52.03 H new ATOM 0 HG23 VAL A 80 -12.644 9.755 24.169 1.00 52.03 H new ATOM 1261 N VAL A 81 -11.347 14.128 24.756 1.00 54.00 N ATOM 1262 CA VAL A 81 -11.169 15.574 24.693 1.00 23.30 C ATOM 1263 C VAL A 81 -9.705 15.955 24.885 1.00 13.40 C ATOM 1264 O VAL A 81 -9.183 16.820 24.183 1.00 4.41 O ATOM 1265 CB VAL A 81 -12.019 16.291 25.758 1.00 11.21 C ATOM 1266 CG1 VAL A 81 -13.462 15.812 25.702 1.00 65.21 C ATOM 1267 CG2 VAL A 81 -11.430 16.075 27.144 1.00 73.31 C ATOM 0 H VAL A 81 -12.141 13.825 25.320 1.00 54.00 H new ATOM 0 HA VAL A 81 -11.498 15.891 23.703 1.00 23.30 H new ATOM 0 HB VAL A 81 -12.008 17.360 25.546 1.00 11.21 H new ATOM 0 HG11 VAL A 81 -14.047 16.330 26.462 1.00 65.21 H new ATOM 0 HG12 VAL A 81 -13.878 16.024 24.717 1.00 65.21 H new ATOM 0 HG13 VAL A 81 -13.496 14.738 25.887 1.00 65.21 H new ATOM 0 HG21 VAL A 81 -12.043 16.589 27.884 1.00 73.31 H new ATOM 0 HG22 VAL A 81 -11.408 15.008 27.368 1.00 73.31 H new ATOM 0 HG23 VAL A 81 -10.416 16.473 27.174 1.00 73.31 H new ATOM 1277 N GLU A 82 -9.050 15.304 25.840 1.00 22.35 N ATOM 1278 CA GLU A 82 -7.646 15.576 26.125 1.00 63.03 C ATOM 1279 C GLU A 82 -6.796 15.419 24.867 1.00 3.31 C ATOM 1280 O GLU A 82 -5.913 16.233 24.596 1.00 2.53 O ATOM 1281 CB GLU A 82 -7.133 14.639 27.220 1.00 31.41 C ATOM 1282 CG GLU A 82 -7.025 13.189 26.779 1.00 73.40 C ATOM 1283 CD GLU A 82 -5.637 12.831 26.284 1.00 53.12 C ATOM 1284 OE1 GLU A 82 -4.885 13.755 25.910 1.00 52.51 O ATOM 1285 OE2 GLU A 82 -5.303 11.628 26.270 1.00 53.11 O ATOM 0 H GLU A 82 -9.469 14.585 26.430 1.00 22.35 H new ATOM 0 HA GLU A 82 -7.565 16.606 26.472 1.00 63.03 H new ATOM 0 HB2 GLU A 82 -6.153 14.983 27.551 1.00 31.41 H new ATOM 0 HB3 GLU A 82 -7.800 14.700 28.080 1.00 31.41 H new ATOM 0 HG2 GLU A 82 -7.288 12.539 27.614 1.00 73.40 H new ATOM 0 HG3 GLU A 82 -7.749 12.999 25.987 1.00 73.40 H new ATOM 1292 N ASP A 83 -7.068 14.367 24.103 1.00 14.24 N ATOM 1293 CA ASP A 83 -6.330 14.103 22.874 1.00 61.20 C ATOM 1294 C ASP A 83 -6.745 15.072 21.772 1.00 44.43 C ATOM 1295 O ASP A 83 -5.953 15.396 20.887 1.00 41.54 O ATOM 1296 CB ASP A 83 -6.559 12.662 22.416 1.00 75.23 C ATOM 1297 CG ASP A 83 -5.916 11.650 23.343 1.00 31.23 C ATOM 1298 OD1 ASP A 83 -4.766 11.884 23.771 1.00 31.41 O ATOM 1299 OD2 ASP A 83 -6.563 10.624 23.642 1.00 1.52 O ATOM 0 H ASP A 83 -7.795 13.683 24.313 1.00 14.24 H new ATOM 0 HA ASP A 83 -5.269 14.247 23.079 1.00 61.20 H new ATOM 0 HB2 ASP A 83 -7.630 12.468 22.358 1.00 75.23 H new ATOM 0 HB3 ASP A 83 -6.158 12.535 21.411 1.00 75.23 H new ATOM 1304 N TRP A 84 -7.990 15.530 21.832 1.00 43.52 N ATOM 1305 CA TRP A 84 -8.510 16.462 20.838 1.00 41.34 C ATOM 1306 C TRP A 84 -7.668 17.732 20.789 1.00 43.33 C ATOM 1307 O TRP A 84 -6.995 18.005 19.794 1.00 63.04 O ATOM 1308 CB TRP A 84 -9.966 16.813 21.150 1.00 63.35 C ATOM 1309 CG TRP A 84 -10.835 16.881 19.930 1.00 4.02 C ATOM 1310 CD1 TRP A 84 -11.978 16.171 19.698 1.00 50.42 C ATOM 1311 CD2 TRP A 84 -10.629 17.703 18.776 1.00 24.02 C ATOM 1312 NE1 TRP A 84 -12.495 16.503 18.469 1.00 73.33 N ATOM 1313 CE2 TRP A 84 -11.687 17.441 17.884 1.00 65.22 C ATOM 1314 CE3 TRP A 84 -9.655 18.636 18.411 1.00 40.34 C ATOM 1315 CZ2 TRP A 84 -11.795 18.078 16.651 1.00 61.15 C ATOM 1316 CZ3 TRP A 84 -9.764 19.268 17.186 1.00 23.52 C ATOM 1317 CH2 TRP A 84 -10.827 18.987 16.318 1.00 35.13 C ATOM 0 H TRP A 84 -8.658 15.271 22.558 1.00 43.52 H new ATOM 0 HA TRP A 84 -8.461 15.978 19.863 1.00 41.34 H new ATOM 0 HB2 TRP A 84 -10.372 16.070 21.836 1.00 63.35 H new ATOM 0 HB3 TRP A 84 -9.999 17.773 21.665 1.00 63.35 H new ATOM 0 HD1 TRP A 84 -12.412 15.454 20.380 1.00 50.42 H new ATOM 0 HE1 TRP A 84 -13.344 16.114 18.059 1.00 73.33 H new ATOM 0 HE3 TRP A 84 -8.832 18.859 19.074 1.00 40.34 H new ATOM 0 HZ2 TRP A 84 -12.614 17.863 15.981 1.00 61.15 H new ATOM 0 HZ3 TRP A 84 -9.017 19.991 16.893 1.00 23.52 H new ATOM 0 HH2 TRP A 84 -10.884 19.497 15.368 1.00 35.13 H new ATOM 1328 N LEU A 85 -7.709 18.506 21.868 1.00 44.03 N ATOM 1329 CA LEU A 85 -6.948 19.748 21.948 1.00 51.43 C ATOM 1330 C LEU A 85 -5.453 19.482 21.802 1.00 13.11 C ATOM 1331 O LEU A 85 -4.741 20.233 21.136 1.00 2.21 O ATOM 1332 CB LEU A 85 -7.225 20.454 23.276 1.00 0.32 C ATOM 1333 CG LEU A 85 -8.693 20.753 23.584 1.00 24.15 C ATOM 1334 CD1 LEU A 85 -9.487 20.909 22.297 1.00 14.23 C ATOM 1335 CD2 LEU A 85 -9.290 19.654 24.452 1.00 45.30 C ATOM 0 H LEU A 85 -8.261 18.295 22.699 1.00 44.03 H new ATOM 0 HA LEU A 85 -7.265 20.392 21.128 1.00 51.43 H new ATOM 0 HB2 LEU A 85 -6.823 19.840 24.082 1.00 0.32 H new ATOM 0 HB3 LEU A 85 -6.674 21.394 23.287 1.00 0.32 H new ATOM 0 HG LEU A 85 -8.745 21.692 24.135 1.00 24.15 H new ATOM 0 HD11 LEU A 85 -10.529 21.121 22.536 1.00 14.23 H new ATOM 0 HD12 LEU A 85 -9.074 21.731 21.712 1.00 14.23 H new ATOM 0 HD13 LEU A 85 -9.428 19.987 21.719 1.00 14.23 H new ATOM 0 HD21 LEU A 85 -10.335 19.883 24.661 1.00 45.30 H new ATOM 0 HD22 LEU A 85 -9.226 18.701 23.927 1.00 45.30 H new ATOM 0 HD23 LEU A 85 -8.738 19.590 25.389 1.00 45.30 H new ATOM 1347 N SER A 86 -4.985 18.407 22.428 1.00 72.12 N ATOM 1348 CA SER A 86 -3.575 18.042 22.369 1.00 24.13 C ATOM 1349 C SER A 86 -3.133 17.808 20.928 1.00 53.33 C ATOM 1350 O SER A 86 -2.110 18.333 20.486 1.00 12.42 O ATOM 1351 CB SER A 86 -3.316 16.786 23.204 1.00 60.03 C ATOM 1352 OG SER A 86 -3.382 17.072 24.590 1.00 4.30 O ATOM 0 H SER A 86 -5.562 17.774 22.982 1.00 72.12 H new ATOM 0 HA SER A 86 -2.994 18.869 22.779 1.00 24.13 H new ATOM 0 HB2 SER A 86 -4.050 16.021 22.952 1.00 60.03 H new ATOM 0 HB3 SER A 86 -2.335 16.379 22.960 1.00 60.03 H new ATOM 0 HG SER A 86 -4.270 16.837 24.931 1.00 4.30 H new ATOM 1358 N LEU A 87 -3.912 17.017 20.198 1.00 20.24 N ATOM 1359 CA LEU A 87 -3.603 16.712 18.806 1.00 51.25 C ATOM 1360 C LEU A 87 -3.445 17.992 17.991 1.00 62.25 C ATOM 1361 O LEU A 87 -2.387 18.247 17.414 1.00 31.44 O ATOM 1362 CB LEU A 87 -4.703 15.840 18.198 1.00 62.33 C ATOM 1363 CG LEU A 87 -4.958 16.027 16.702 1.00 73.12 C ATOM 1364 CD1 LEU A 87 -3.753 15.572 15.893 1.00 31.04 C ATOM 1365 CD2 LEU A 87 -6.206 15.268 16.275 1.00 54.31 C ATOM 0 H LEU A 87 -4.762 16.575 20.547 1.00 20.24 H new ATOM 0 HA LEU A 87 -2.660 16.167 18.780 1.00 51.25 H new ATOM 0 HB2 LEU A 87 -4.450 14.795 18.375 1.00 62.33 H new ATOM 0 HB3 LEU A 87 -5.632 16.038 18.732 1.00 62.33 H new ATOM 0 HG LEU A 87 -5.118 17.088 16.511 1.00 73.12 H new ATOM 0 HD11 LEU A 87 -3.954 15.713 14.831 1.00 31.04 H new ATOM 0 HD12 LEU A 87 -2.880 16.159 16.178 1.00 31.04 H new ATOM 0 HD13 LEU A 87 -3.560 14.517 16.089 1.00 31.04 H new ATOM 0 HD21 LEU A 87 -6.372 15.412 15.207 1.00 54.31 H new ATOM 0 HD22 LEU A 87 -6.074 14.206 16.481 1.00 54.31 H new ATOM 0 HD23 LEU A 87 -7.067 15.641 16.830 1.00 54.31 H new ATOM 1377 N VAL A 88 -4.503 18.795 17.948 1.00 11.22 N ATOM 1378 CA VAL A 88 -4.481 20.051 17.207 1.00 62.50 C ATOM 1379 C VAL A 88 -3.386 20.976 17.726 1.00 63.32 C ATOM 1380 O VAL A 88 -2.552 21.460 16.960 1.00 21.21 O ATOM 1381 CB VAL A 88 -5.836 20.778 17.294 1.00 63.32 C ATOM 1382 CG1 VAL A 88 -6.235 20.992 18.746 1.00 41.02 C ATOM 1383 CG2 VAL A 88 -5.778 22.102 16.547 1.00 31.21 C ATOM 0 H VAL A 88 -5.387 18.598 18.418 1.00 11.22 H new ATOM 0 HA VAL A 88 -4.278 19.801 16.166 1.00 62.50 H new ATOM 0 HB VAL A 88 -6.595 20.154 16.823 1.00 63.32 H new ATOM 0 HG11 VAL A 88 -7.195 21.507 18.787 1.00 41.02 H new ATOM 0 HG12 VAL A 88 -6.319 20.027 19.246 1.00 41.02 H new ATOM 0 HG13 VAL A 88 -5.478 21.595 19.246 1.00 41.02 H new ATOM 0 HG21 VAL A 88 -6.744 22.603 16.618 1.00 31.21 H new ATOM 0 HG22 VAL A 88 -5.008 22.735 16.988 1.00 31.21 H new ATOM 0 HG23 VAL A 88 -5.541 21.918 15.499 1.00 31.21 H new ATOM 1393 N LYS A 89 -3.393 21.218 19.032 1.00 30.52 N ATOM 1394 CA LYS A 89 -2.400 22.083 19.656 1.00 4.41 C ATOM 1395 C LYS A 89 -0.986 21.634 19.301 1.00 40.04 C ATOM 1396 O LYS A 89 -0.038 22.415 19.379 1.00 53.13 O ATOM 1397 CB LYS A 89 -2.578 22.086 21.176 1.00 11.40 C ATOM 1398 CG LYS A 89 -3.782 22.885 21.645 1.00 20.25 C ATOM 1399 CD LYS A 89 -4.029 22.699 23.133 1.00 21.52 C ATOM 1400 CE LYS A 89 -3.613 23.929 23.925 1.00 35.34 C ATOM 1401 NZ LYS A 89 -2.561 23.612 24.930 1.00 43.01 N ATOM 0 H LYS A 89 -4.077 20.826 19.680 1.00 30.52 H new ATOM 0 HA LYS A 89 -2.547 23.094 19.277 1.00 4.41 H new ATOM 0 HB2 LYS A 89 -2.677 21.058 21.524 1.00 11.40 H new ATOM 0 HB3 LYS A 89 -1.679 22.494 21.638 1.00 11.40 H new ATOM 0 HG2 LYS A 89 -3.624 23.942 21.431 1.00 20.25 H new ATOM 0 HG3 LYS A 89 -4.665 22.575 21.087 1.00 20.25 H new ATOM 0 HD2 LYS A 89 -5.086 22.495 23.305 1.00 21.52 H new ATOM 0 HD3 LYS A 89 -3.474 21.831 23.489 1.00 21.52 H new ATOM 0 HE2 LYS A 89 -3.244 24.693 23.241 1.00 35.34 H new ATOM 0 HE3 LYS A 89 -4.484 24.347 24.430 1.00 35.34 H new ATOM 0 HZ1 LYS A 89 -2.305 24.476 25.449 1.00 43.01 H new ATOM 0 HZ2 LYS A 89 -2.922 22.901 25.598 1.00 43.01 H new ATOM 0 HZ3 LYS A 89 -1.720 23.237 24.446 1.00 43.01 H new ATOM 1415 N ALA A 90 -0.852 20.371 18.909 1.00 54.12 N ATOM 1416 CA ALA A 90 0.445 19.820 18.538 1.00 72.52 C ATOM 1417 C ALA A 90 0.723 20.023 17.052 1.00 5.25 C ATOM 1418 O ALA A 90 1.641 20.753 16.676 1.00 23.45 O ATOM 1419 CB ALA A 90 0.510 18.341 18.891 1.00 2.12 C ATOM 0 H ALA A 90 -1.626 19.710 18.840 1.00 54.12 H new ATOM 0 HA ALA A 90 1.212 20.351 19.101 1.00 72.52 H new ATOM 0 HB1 ALA A 90 1.484 17.942 18.609 1.00 2.12 H new ATOM 0 HB2 ALA A 90 0.364 18.216 19.964 1.00 2.12 H new ATOM 0 HB3 ALA A 90 -0.272 17.804 18.354 1.00 2.12 H new ATOM 1425 N LYS A 91 -0.074 19.374 16.211 1.00 23.52 N ATOM 1426 CA LYS A 91 0.086 19.483 14.766 1.00 1.00 C ATOM 1427 C LYS A 91 0.208 20.943 14.341 1.00 32.12 C ATOM 1428 O LYS A 91 0.898 21.263 13.373 1.00 23.43 O ATOM 1429 CB LYS A 91 -1.098 18.830 14.050 1.00 34.43 C ATOM 1430 CG LYS A 91 -2.439 19.118 14.705 1.00 65.25 C ATOM 1431 CD LYS A 91 -3.321 19.975 13.813 1.00 35.20 C ATOM 1432 CE LYS A 91 -3.098 21.458 14.067 1.00 62.40 C ATOM 1433 NZ LYS A 91 -4.338 22.251 13.846 1.00 12.54 N ATOM 0 H LYS A 91 -0.838 18.766 16.505 1.00 23.52 H new ATOM 0 HA LYS A 91 1.003 18.963 14.487 1.00 1.00 H new ATOM 0 HB2 LYS A 91 -1.125 19.179 13.018 1.00 34.43 H new ATOM 0 HB3 LYS A 91 -0.943 17.752 14.018 1.00 34.43 H new ATOM 0 HG2 LYS A 91 -2.946 18.179 14.926 1.00 65.25 H new ATOM 0 HG3 LYS A 91 -2.279 19.626 15.656 1.00 65.25 H new ATOM 0 HD2 LYS A 91 -3.112 19.749 12.767 1.00 35.20 H new ATOM 0 HD3 LYS A 91 -4.368 19.728 13.990 1.00 35.20 H new ATOM 0 HE2 LYS A 91 -2.752 21.603 15.090 1.00 62.40 H new ATOM 0 HE3 LYS A 91 -2.310 21.825 13.409 1.00 62.40 H new ATOM 0 HZ1 LYS A 91 -4.399 23.006 14.559 1.00 12.54 H new ATOM 0 HZ2 LYS A 91 -4.316 22.673 12.896 1.00 12.54 H new ATOM 0 HZ3 LYS A 91 -5.167 21.629 13.929 1.00 12.54 H new ATOM 1447 N PHE A 92 -0.466 21.825 15.072 1.00 42.23 N ATOM 1448 CA PHE A 92 -0.432 23.252 14.771 1.00 73.34 C ATOM 1449 C PHE A 92 0.804 23.907 15.378 1.00 24.05 C ATOM 1450 O PHE A 92 1.454 24.739 14.744 1.00 24.21 O ATOM 1451 CB PHE A 92 -1.696 23.935 15.296 1.00 12.34 C ATOM 1452 CG PHE A 92 -1.415 25.128 16.165 1.00 33.12 C ATOM 1453 CD1 PHE A 92 -1.243 24.981 17.532 1.00 22.51 C ATOM 1454 CD2 PHE A 92 -1.323 26.396 15.615 1.00 14.20 C ATOM 1455 CE1 PHE A 92 -0.985 26.076 18.334 1.00 50.42 C ATOM 1456 CE2 PHE A 92 -1.065 27.496 16.412 1.00 74.12 C ATOM 1457 CZ PHE A 92 -0.895 27.335 17.773 1.00 50.42 C ATOM 0 H PHE A 92 -1.042 21.577 15.876 1.00 42.23 H new ATOM 0 HA PHE A 92 -0.387 23.369 13.688 1.00 73.34 H new ATOM 0 HB2 PHE A 92 -2.309 24.248 14.450 1.00 12.34 H new ATOM 0 HB3 PHE A 92 -2.281 23.212 15.864 1.00 12.34 H new ATOM 0 HD1 PHE A 92 -1.311 23.999 17.976 1.00 22.51 H new ATOM 0 HD2 PHE A 92 -1.454 26.527 14.551 1.00 14.20 H new ATOM 0 HE1 PHE A 92 -0.854 25.948 19.398 1.00 50.42 H new ATOM 0 HE2 PHE A 92 -0.997 28.479 15.971 1.00 74.12 H new ATOM 0 HZ PHE A 92 -0.692 28.192 18.398 1.00 50.42 H new ATOM 1467 N CYS A 93 1.122 23.527 16.611 1.00 65.32 N ATOM 1468 CA CYS A 93 2.280 24.078 17.306 1.00 22.21 C ATOM 1469 C CYS A 93 3.573 23.455 16.789 1.00 74.43 C ATOM 1470 O CYS A 93 4.665 23.943 17.073 1.00 4.24 O ATOM 1471 CB CYS A 93 2.155 23.845 18.812 1.00 11.05 C ATOM 1472 SG CYS A 93 3.457 24.630 19.792 1.00 54.15 S ATOM 0 H CYS A 93 0.594 22.840 17.150 1.00 65.32 H new ATOM 0 HA CYS A 93 2.312 25.150 17.112 1.00 22.21 H new ATOM 0 HB2 CYS A 93 1.188 24.219 19.147 1.00 11.05 H new ATOM 0 HB3 CYS A 93 2.167 22.772 19.005 1.00 11.05 H new ATOM 0 HG CYS A 93 4.561 24.654 19.106 1.00 54.15 H new ATOM 1478 N GLU A 94 3.439 22.372 16.029 1.00 53.02 N ATOM 1479 CA GLU A 94 4.597 21.681 15.474 1.00 32.12 C ATOM 1480 C GLU A 94 4.778 22.022 13.998 1.00 44.01 C ATOM 1481 O GLU A 94 5.887 21.962 13.468 1.00 5.31 O ATOM 1482 CB GLU A 94 4.445 20.168 15.644 1.00 24.14 C ATOM 1483 CG GLU A 94 3.365 19.561 14.765 1.00 40.52 C ATOM 1484 CD GLU A 94 3.928 18.632 13.707 1.00 55.01 C ATOM 1485 OE1 GLU A 94 4.185 17.453 14.028 1.00 4.33 O ATOM 1486 OE2 GLU A 94 4.110 19.084 12.557 1.00 14.20 O ATOM 0 H GLU A 94 2.541 21.955 15.784 1.00 53.02 H new ATOM 0 HA GLU A 94 5.482 22.014 16.017 1.00 32.12 H new ATOM 0 HB2 GLU A 94 5.397 19.688 15.418 1.00 24.14 H new ATOM 0 HB3 GLU A 94 4.218 19.949 16.687 1.00 24.14 H new ATOM 0 HG2 GLU A 94 2.661 19.011 15.389 1.00 40.52 H new ATOM 0 HG3 GLU A 94 2.804 20.360 14.280 1.00 40.52 H new ATOM 1493 N ALA A 95 3.680 22.379 13.340 1.00 44.02 N ATOM 1494 CA ALA A 95 3.718 22.731 11.926 1.00 73.13 C ATOM 1495 C ALA A 95 3.194 24.145 11.698 1.00 65.12 C ATOM 1496 O ALA A 95 2.289 24.616 12.387 1.00 43.35 O ATOM 1497 CB ALA A 95 2.911 21.730 11.111 1.00 4.04 C ATOM 0 H ALA A 95 2.754 22.432 13.763 1.00 44.02 H new ATOM 0 HA ALA A 95 4.757 22.699 11.597 1.00 73.13 H new ATOM 0 HB1 ALA A 95 2.948 22.005 10.057 1.00 4.04 H new ATOM 0 HB2 ALA A 95 3.331 20.733 11.241 1.00 4.04 H new ATOM 0 HB3 ALA A 95 1.875 21.735 11.451 1.00 4.04 H new ATOM 1503 N PRO A 96 3.776 24.840 10.709 1.00 23.11 N ATOM 1504 CA PRO A 96 3.384 26.211 10.368 1.00 24.40 C ATOM 1505 C PRO A 96 2.000 26.277 9.732 1.00 21.51 C ATOM 1506 O PRO A 96 1.865 26.237 8.510 1.00 42.21 O ATOM 1507 CB PRO A 96 4.455 26.646 9.365 1.00 41.44 C ATOM 1508 CG PRO A 96 4.948 25.377 8.761 1.00 31.41 C ATOM 1509 CD PRO A 96 4.861 24.341 9.848 1.00 63.34 C ATOM 0 HA PRO A 96 3.322 26.849 11.250 1.00 24.40 H new ATOM 0 HB2 PRO A 96 4.040 27.310 8.607 1.00 41.44 H new ATOM 0 HB3 PRO A 96 5.261 27.189 9.858 1.00 41.44 H new ATOM 0 HG2 PRO A 96 4.342 25.093 7.901 1.00 31.41 H new ATOM 0 HG3 PRO A 96 5.973 25.486 8.406 1.00 31.41 H new ATOM 0 HD2 PRO A 96 4.633 23.354 9.445 1.00 63.34 H new ATOM 0 HD3 PRO A 96 5.800 24.253 10.395 1.00 63.34 H new ATOM 1517 N GLY A 97 0.973 26.377 10.570 1.00 12.52 N ATOM 1518 CA GLY A 97 -0.388 26.448 10.071 1.00 60.32 C ATOM 1519 C GLY A 97 -0.691 25.360 9.060 1.00 74.31 C ATOM 1520 O GLY A 97 -1.594 25.503 8.235 1.00 2.51 O ATOM 0 H GLY A 97 1.059 26.410 11.586 1.00 12.52 H new ATOM 0 HA2 GLY A 97 -1.083 26.367 10.907 1.00 60.32 H new ATOM 0 HA3 GLY A 97 -0.553 27.423 9.612 1.00 60.32 H new ATOM 1524 N SER A 98 0.065 24.269 9.122 1.00 21.40 N ATOM 1525 CA SER A 98 -0.124 23.154 8.201 1.00 22.11 C ATOM 1526 C SER A 98 -1.525 22.567 8.339 1.00 32.32 C ATOM 1527 O SER A 98 -2.407 23.173 8.950 1.00 25.52 O ATOM 1528 CB SER A 98 0.924 22.069 8.459 1.00 74.15 C ATOM 1529 OG SER A 98 2.234 22.608 8.431 1.00 52.12 O ATOM 0 H SER A 98 0.814 24.133 9.800 1.00 21.40 H new ATOM 0 HA SER A 98 -0.005 23.530 7.185 1.00 22.11 H new ATOM 0 HB2 SER A 98 0.739 21.604 9.427 1.00 74.15 H new ATOM 0 HB3 SER A 98 0.834 21.286 7.707 1.00 74.15 H new ATOM 0 HG SER A 98 2.863 21.923 8.123 1.00 52.12 H new ATOM 1535 N CYS A 99 -1.723 21.384 7.767 1.00 11.25 N ATOM 1536 CA CYS A 99 -3.017 20.714 7.825 1.00 14.12 C ATOM 1537 C CYS A 99 -2.941 19.458 8.687 1.00 14.23 C ATOM 1538 O CYS A 99 -1.855 18.989 9.025 1.00 25.00 O ATOM 1539 CB CYS A 99 -3.491 20.353 6.417 1.00 71.44 C ATOM 1540 SG CYS A 99 -3.638 21.768 5.301 1.00 13.13 S ATOM 0 H CYS A 99 -1.004 20.870 7.258 1.00 11.25 H new ATOM 0 HA CYS A 99 -3.734 21.400 8.277 1.00 14.12 H new ATOM 0 HB2 CYS A 99 -2.795 19.634 5.985 1.00 71.44 H new ATOM 0 HB3 CYS A 99 -4.459 19.857 6.487 1.00 71.44 H new ATOM 0 HG CYS A 99 -3.138 21.460 4.141 1.00 13.13 H new ATOM 1546 N VAL A 100 -4.104 18.919 9.042 1.00 65.11 N ATOM 1547 CA VAL A 100 -4.169 17.718 9.865 1.00 32.45 C ATOM 1548 C VAL A 100 -5.045 16.653 9.215 1.00 34.24 C ATOM 1549 O VAL A 100 -6.145 16.942 8.745 1.00 33.33 O ATOM 1550 CB VAL A 100 -4.717 18.030 11.271 1.00 70.32 C ATOM 1551 CG1 VAL A 100 -5.110 19.495 11.377 1.00 0.34 C ATOM 1552 CG2 VAL A 100 -5.898 17.128 11.594 1.00 34.41 C ATOM 0 H VAL A 100 -5.013 19.295 8.772 1.00 65.11 H new ATOM 0 HA VAL A 100 -3.150 17.341 9.955 1.00 32.45 H new ATOM 0 HB VAL A 100 -3.931 17.836 12.000 1.00 70.32 H new ATOM 0 HG11 VAL A 100 -5.495 19.697 12.377 1.00 0.34 H new ATOM 0 HG12 VAL A 100 -4.237 20.120 11.191 1.00 0.34 H new ATOM 0 HG13 VAL A 100 -5.881 19.719 10.639 1.00 0.34 H new ATOM 0 HG21 VAL A 100 -6.273 17.362 12.591 1.00 34.41 H new ATOM 0 HG22 VAL A 100 -6.689 17.289 10.862 1.00 34.41 H new ATOM 0 HG23 VAL A 100 -5.580 16.086 11.561 1.00 34.41 H new ATOM 1562 N ALA A 101 -4.550 15.420 9.193 1.00 71.33 N ATOM 1563 CA ALA A 101 -5.289 14.310 8.603 1.00 41.55 C ATOM 1564 C ALA A 101 -5.961 13.464 9.678 1.00 23.05 C ATOM 1565 O ALA A 101 -5.292 12.885 10.535 1.00 41.41 O ATOM 1566 CB ALA A 101 -4.363 13.452 7.754 1.00 21.52 C ATOM 0 H ALA A 101 -3.640 15.164 9.577 1.00 71.33 H new ATOM 0 HA ALA A 101 -6.069 14.724 7.965 1.00 41.55 H new ATOM 0 HB1 ALA A 101 -4.928 12.627 7.320 1.00 21.52 H new ATOM 0 HB2 ALA A 101 -3.935 14.059 6.956 1.00 21.52 H new ATOM 0 HB3 ALA A 101 -3.562 13.055 8.377 1.00 21.52 H new ATOM 1572 N VAL A 102 -7.287 13.396 9.629 1.00 13.32 N ATOM 1573 CA VAL A 102 -8.050 12.620 10.600 1.00 42.12 C ATOM 1574 C VAL A 102 -9.095 11.752 9.909 1.00 33.44 C ATOM 1575 O VAL A 102 -9.699 12.159 8.917 1.00 53.14 O ATOM 1576 CB VAL A 102 -8.751 13.534 11.622 1.00 32.45 C ATOM 1577 CG1 VAL A 102 -10.045 12.898 12.107 1.00 34.00 C ATOM 1578 CG2 VAL A 102 -7.825 13.834 12.791 1.00 1.11 C ATOM 0 H VAL A 102 -7.856 13.869 8.927 1.00 13.32 H new ATOM 0 HA VAL A 102 -7.340 11.980 11.124 1.00 42.12 H new ATOM 0 HB VAL A 102 -8.998 14.476 11.132 1.00 32.45 H new ATOM 0 HG11 VAL A 102 -10.527 13.558 12.829 1.00 34.00 H new ATOM 0 HG12 VAL A 102 -10.712 12.738 11.260 1.00 34.00 H new ATOM 0 HG13 VAL A 102 -9.825 11.941 12.581 1.00 34.00 H new ATOM 0 HG21 VAL A 102 -8.336 14.481 13.504 1.00 1.11 H new ATOM 0 HG22 VAL A 102 -7.546 12.902 13.283 1.00 1.11 H new ATOM 0 HG23 VAL A 102 -6.928 14.334 12.426 1.00 1.11 H new ATOM 1588 N HIS A 103 -9.305 10.552 10.442 1.00 72.22 N ATOM 1589 CA HIS A 103 -10.280 9.625 9.877 1.00 24.33 C ATOM 1590 C HIS A 103 -11.643 9.799 10.540 1.00 3.11 C ATOM 1591 O HIS A 103 -11.742 9.880 11.765 1.00 12.10 O ATOM 1592 CB HIS A 103 -9.799 8.183 10.044 1.00 72.20 C ATOM 1593 CG HIS A 103 -10.759 7.166 9.508 1.00 34.12 C ATOM 1594 ND1 HIS A 103 -12.006 6.946 10.055 1.00 2.13 N ATOM 1595 CD2 HIS A 103 -10.651 6.308 8.467 1.00 64.11 C ATOM 1596 CE1 HIS A 103 -12.622 5.996 9.375 1.00 65.30 C ATOM 1597 NE2 HIS A 103 -11.821 5.592 8.405 1.00 23.13 N ATOM 0 H HIS A 103 -8.814 10.199 11.263 1.00 72.22 H new ATOM 0 HA HIS A 103 -10.382 9.846 8.815 1.00 24.33 H new ATOM 0 HB2 HIS A 103 -8.840 8.068 9.538 1.00 72.20 H new ATOM 0 HB3 HIS A 103 -9.627 7.986 11.102 1.00 72.20 H new ATOM 0 HD2 HIS A 103 -9.802 6.205 7.807 1.00 64.11 H new ATOM 0 HE1 HIS A 103 -13.612 5.614 9.577 1.00 65.30 H new ATOM 0 HE2 HIS A 103 -12.037 4.866 7.721 1.00 23.13 H new ATOM 1605 N CYS A 104 -12.689 9.857 9.724 1.00 61.23 N ATOM 1606 CA CYS A 104 -14.046 10.023 10.231 1.00 54.31 C ATOM 1607 C CYS A 104 -15.064 9.415 9.271 1.00 42.40 C ATOM 1608 O CYS A 104 -14.784 9.233 8.086 1.00 25.02 O ATOM 1609 CB CYS A 104 -14.354 11.506 10.448 1.00 62.43 C ATOM 1610 SG CYS A 104 -13.850 12.135 12.066 1.00 33.03 S ATOM 0 H CYS A 104 -12.623 9.792 8.708 1.00 61.23 H new ATOM 0 HA CYS A 104 -14.117 9.501 11.185 1.00 54.31 H new ATOM 0 HB2 CYS A 104 -13.855 12.087 9.673 1.00 62.43 H new ATOM 0 HB3 CYS A 104 -15.425 11.665 10.326 1.00 62.43 H new ATOM 0 HG CYS A 104 -12.823 11.462 12.492 1.00 33.03 H new ATOM 1616 N VAL A 105 -16.246 9.102 9.791 1.00 74.01 N ATOM 1617 CA VAL A 105 -17.306 8.514 8.980 1.00 31.24 C ATOM 1618 C VAL A 105 -18.053 9.584 8.192 1.00 34.34 C ATOM 1619 O VAL A 105 -17.578 10.710 8.049 1.00 25.52 O ATOM 1620 CB VAL A 105 -18.312 7.736 9.850 1.00 63.00 C ATOM 1621 CG1 VAL A 105 -19.330 8.683 10.466 1.00 41.30 C ATOM 1622 CG2 VAL A 105 -19.003 6.658 9.029 1.00 22.42 C ATOM 0 H VAL A 105 -16.494 9.246 10.770 1.00 74.01 H new ATOM 0 HA VAL A 105 -16.827 7.824 8.285 1.00 31.24 H new ATOM 0 HB VAL A 105 -17.767 7.251 10.660 1.00 63.00 H new ATOM 0 HG11 VAL A 105 -20.032 8.115 11.077 1.00 41.30 H new ATOM 0 HG12 VAL A 105 -18.816 9.415 11.089 1.00 41.30 H new ATOM 0 HG13 VAL A 105 -19.873 9.199 9.674 1.00 41.30 H new ATOM 0 HG21 VAL A 105 -19.710 6.118 9.659 1.00 22.42 H new ATOM 0 HG22 VAL A 105 -19.536 7.119 8.198 1.00 22.42 H new ATOM 0 HG23 VAL A 105 -18.258 5.963 8.641 1.00 22.42 H new ATOM 1632 N ALA A 106 -19.227 9.224 7.683 1.00 13.34 N ATOM 1633 CA ALA A 106 -20.042 10.154 6.912 1.00 55.30 C ATOM 1634 C ALA A 106 -20.211 11.478 7.649 1.00 13.43 C ATOM 1635 O ALA A 106 -20.428 12.520 7.032 1.00 14.44 O ATOM 1636 CB ALA A 106 -21.401 9.540 6.609 1.00 20.32 C ATOM 0 H ALA A 106 -19.634 8.295 7.791 1.00 13.34 H new ATOM 0 HA ALA A 106 -19.528 10.354 5.972 1.00 55.30 H new ATOM 0 HB1 ALA A 106 -21.999 10.246 6.033 1.00 20.32 H new ATOM 0 HB2 ALA A 106 -21.266 8.624 6.034 1.00 20.32 H new ATOM 0 HB3 ALA A 106 -21.913 9.309 7.543 1.00 20.32 H new ATOM 1642 N GLY A 107 -20.111 11.430 8.974 1.00 23.13 N ATOM 1643 CA GLY A 107 -20.256 12.632 9.774 1.00 41.32 C ATOM 1644 C GLY A 107 -21.380 12.524 10.785 1.00 22.11 C ATOM 1645 O GLY A 107 -21.189 12.000 11.883 1.00 24.13 O ATOM 0 H GLY A 107 -19.932 10.579 9.508 1.00 23.13 H new ATOM 0 HA2 GLY A 107 -19.320 12.832 10.296 1.00 41.32 H new ATOM 0 HA3 GLY A 107 -20.443 13.481 9.117 1.00 41.32 H new ATOM 1649 N LEU A 108 -22.555 13.021 10.416 1.00 11.45 N ATOM 1650 CA LEU A 108 -23.715 12.980 11.301 1.00 62.25 C ATOM 1651 C LEU A 108 -23.311 13.269 12.743 1.00 42.14 C ATOM 1652 O LEU A 108 -23.492 14.381 13.238 1.00 73.51 O ATOM 1653 CB LEU A 108 -24.398 11.614 11.214 1.00 24.35 C ATOM 1654 CG LEU A 108 -25.388 11.429 10.064 1.00 43.51 C ATOM 1655 CD1 LEU A 108 -25.965 10.023 10.076 1.00 22.53 C ATOM 1656 CD2 LEU A 108 -26.500 12.465 10.146 1.00 22.13 C ATOM 0 H LEU A 108 -22.730 13.457 9.511 1.00 11.45 H new ATOM 0 HA LEU A 108 -24.415 13.751 10.979 1.00 62.25 H new ATOM 0 HB2 LEU A 108 -23.626 10.849 11.128 1.00 24.35 H new ATOM 0 HB3 LEU A 108 -24.924 11.433 12.152 1.00 24.35 H new ATOM 0 HG LEU A 108 -24.854 11.571 9.124 1.00 43.51 H new ATOM 0 HD11 LEU A 108 -26.667 9.911 9.250 1.00 22.53 H new ATOM 0 HD12 LEU A 108 -25.159 9.298 9.967 1.00 22.53 H new ATOM 0 HD13 LEU A 108 -26.484 9.851 11.019 1.00 22.53 H new ATOM 0 HD21 LEU A 108 -27.196 12.318 9.320 1.00 22.13 H new ATOM 0 HD22 LEU A 108 -27.031 12.355 11.091 1.00 22.13 H new ATOM 0 HD23 LEU A 108 -26.071 13.465 10.086 1.00 22.13 H new ATOM 1668 N GLY A 109 -22.759 12.261 13.411 1.00 35.43 N ATOM 1669 CA GLY A 109 -22.336 12.428 14.789 1.00 31.43 C ATOM 1670 C GLY A 109 -20.900 12.901 14.901 1.00 34.35 C ATOM 1671 O GLY A 109 -20.642 14.099 15.020 1.00 70.45 O ATOM 0 H GLY A 109 -22.597 11.332 13.023 1.00 35.43 H new ATOM 0 HA2 GLY A 109 -22.991 13.146 15.283 1.00 31.43 H new ATOM 0 HA3 GLY A 109 -22.446 11.481 15.317 1.00 31.43 H new ATOM 1675 N ARG A 110 -19.964 11.958 14.866 1.00 0.32 N ATOM 1676 CA ARG A 110 -18.547 12.285 14.968 1.00 42.34 C ATOM 1677 C ARG A 110 -18.247 13.621 14.293 1.00 74.31 C ATOM 1678 O ARG A 110 -17.492 14.438 14.819 1.00 71.41 O ATOM 1679 CB ARG A 110 -17.700 11.180 14.334 1.00 51.25 C ATOM 1680 CG ARG A 110 -18.000 9.794 14.880 1.00 23.10 C ATOM 1681 CD ARG A 110 -17.858 9.749 16.393 1.00 10.14 C ATOM 1682 NE ARG A 110 -17.987 8.391 16.915 1.00 3.22 N ATOM 1683 CZ ARG A 110 -19.154 7.796 17.135 1.00 63.33 C ATOM 1684 NH1 ARG A 110 -20.287 8.435 16.879 1.00 45.25 N ATOM 1685 NH2 ARG A 110 -19.189 6.558 17.611 1.00 30.21 N ATOM 0 H ARG A 110 -20.161 10.962 14.768 1.00 0.32 H new ATOM 0 HA ARG A 110 -18.294 12.367 16.025 1.00 42.34 H new ATOM 0 HB2 ARG A 110 -17.865 11.180 13.257 1.00 51.25 H new ATOM 0 HB3 ARG A 110 -16.646 11.404 14.495 1.00 51.25 H new ATOM 0 HG2 ARG A 110 -19.012 9.502 14.600 1.00 23.10 H new ATOM 0 HG3 ARG A 110 -17.323 9.069 14.428 1.00 23.10 H new ATOM 0 HD2 ARG A 110 -16.888 10.156 16.678 1.00 10.14 H new ATOM 0 HD3 ARG A 110 -18.617 10.386 16.847 1.00 10.14 H new ATOM 0 HE ARG A 110 -17.134 7.871 17.122 1.00 3.22 H new ATOM 0 HH11 ARG A 110 -20.264 9.386 16.512 1.00 45.25 H new ATOM 0 HH12 ARG A 110 -21.181 7.975 17.049 1.00 45.25 H new ATOM 0 HH21 ARG A 110 -18.319 6.063 17.808 1.00 30.21 H new ATOM 0 HH22 ARG A 110 -20.085 6.102 17.780 1.00 30.21 H new ATOM 1699 N ALA A 111 -18.845 13.835 13.125 1.00 25.20 N ATOM 1700 CA ALA A 111 -18.643 15.071 12.379 1.00 30.13 C ATOM 1701 C ALA A 111 -18.743 16.287 13.294 1.00 32.43 C ATOM 1702 O ALA A 111 -17.741 16.898 13.667 1.00 73.25 O ATOM 1703 CB ALA A 111 -19.654 15.175 11.247 1.00 14.23 C ATOM 0 H ALA A 111 -19.473 13.169 12.675 1.00 25.20 H new ATOM 0 HA ALA A 111 -17.639 15.050 11.954 1.00 30.13 H new ATOM 0 HB1 ALA A 111 -19.492 16.103 10.698 1.00 14.23 H new ATOM 0 HB2 ALA A 111 -19.533 14.328 10.572 1.00 14.23 H new ATOM 0 HB3 ALA A 111 -20.663 15.169 11.659 1.00 14.23 H new ATOM 1709 N PRO A 112 -19.980 16.648 13.666 1.00 12.12 N ATOM 1710 CA PRO A 112 -20.240 17.794 14.542 1.00 12.33 C ATOM 1711 C PRO A 112 -19.776 17.547 15.974 1.00 74.24 C ATOM 1712 O PRO A 112 -19.396 18.478 16.683 1.00 21.04 O ATOM 1713 CB PRO A 112 -21.763 17.941 14.491 1.00 10.34 C ATOM 1714 CG PRO A 112 -22.264 16.580 14.152 1.00 42.05 C ATOM 1715 CD PRO A 112 -21.220 15.965 13.260 1.00 12.44 C ATOM 0 HA PRO A 112 -19.701 18.684 14.219 1.00 12.33 H new ATOM 0 HB2 PRO A 112 -22.160 18.282 15.447 1.00 10.34 H new ATOM 0 HB3 PRO A 112 -22.065 18.672 13.741 1.00 10.34 H new ATOM 0 HG2 PRO A 112 -22.410 15.982 15.052 1.00 42.05 H new ATOM 0 HG3 PRO A 112 -23.228 16.634 13.645 1.00 42.05 H new ATOM 0 HD2 PRO A 112 -21.151 14.887 13.406 1.00 12.44 H new ATOM 0 HD3 PRO A 112 -21.444 16.131 12.206 1.00 12.44 H new ATOM 1723 N VAL A 113 -19.810 16.286 16.392 1.00 31.42 N ATOM 1724 CA VAL A 113 -19.392 15.915 17.739 1.00 45.51 C ATOM 1725 C VAL A 113 -17.927 16.268 17.976 1.00 73.14 C ATOM 1726 O VAL A 113 -17.587 16.926 18.960 1.00 62.32 O ATOM 1727 CB VAL A 113 -19.594 14.410 17.996 1.00 41.42 C ATOM 1728 CG1 VAL A 113 -18.780 13.960 19.199 1.00 22.30 C ATOM 1729 CG2 VAL A 113 -21.070 14.098 18.193 1.00 64.43 C ATOM 0 H VAL A 113 -20.123 15.504 15.817 1.00 31.42 H new ATOM 0 HA VAL A 113 -20.016 16.480 18.431 1.00 45.51 H new ATOM 0 HB VAL A 113 -19.243 13.859 17.124 1.00 41.42 H new ATOM 0 HG11 VAL A 113 -18.935 12.894 19.365 1.00 22.30 H new ATOM 0 HG12 VAL A 113 -17.722 14.148 19.014 1.00 22.30 H new ATOM 0 HG13 VAL A 113 -19.098 14.515 20.082 1.00 22.30 H new ATOM 0 HG21 VAL A 113 -21.195 13.030 18.373 1.00 64.43 H new ATOM 0 HG22 VAL A 113 -21.449 14.658 19.048 1.00 64.43 H new ATOM 0 HG23 VAL A 113 -21.624 14.382 17.299 1.00 64.43 H new ATOM 1739 N LEU A 114 -17.064 15.827 17.067 1.00 32.22 N ATOM 1740 CA LEU A 114 -15.635 16.096 17.176 1.00 24.01 C ATOM 1741 C LEU A 114 -15.352 17.591 17.068 1.00 51.01 C ATOM 1742 O LEU A 114 -14.742 18.184 17.957 1.00 3.23 O ATOM 1743 CB LEU A 114 -14.869 15.341 16.088 1.00 31.31 C ATOM 1744 CG LEU A 114 -14.474 13.902 16.422 1.00 63.24 C ATOM 1745 CD1 LEU A 114 -13.108 13.865 17.090 1.00 33.33 C ATOM 1746 CD2 LEU A 114 -15.523 13.253 17.312 1.00 75.12 C ATOM 0 H LEU A 114 -17.329 15.282 16.247 1.00 32.22 H new ATOM 0 HA LEU A 114 -15.300 15.751 18.154 1.00 24.01 H new ATOM 0 HB2 LEU A 114 -15.478 15.329 15.184 1.00 31.31 H new ATOM 0 HB3 LEU A 114 -13.963 15.900 15.854 1.00 31.31 H new ATOM 0 HG LEU A 114 -14.416 13.336 15.492 1.00 63.24 H new ATOM 0 HD11 LEU A 114 -12.843 12.833 17.320 1.00 33.33 H new ATOM 0 HD12 LEU A 114 -12.362 14.289 16.417 1.00 33.33 H new ATOM 0 HD13 LEU A 114 -13.138 14.446 18.012 1.00 33.33 H new ATOM 0 HD21 LEU A 114 -15.225 12.229 17.539 1.00 75.12 H new ATOM 0 HD22 LEU A 114 -15.614 13.819 18.239 1.00 75.12 H new ATOM 0 HD23 LEU A 114 -16.483 13.245 16.796 1.00 75.12 H new ATOM 1758 N VAL A 115 -15.802 18.195 15.973 1.00 54.41 N ATOM 1759 CA VAL A 115 -15.601 19.622 15.750 1.00 53.14 C ATOM 1760 C VAL A 115 -16.180 20.445 16.895 1.00 32.42 C ATOM 1761 O VAL A 115 -15.643 21.492 17.255 1.00 65.53 O ATOM 1762 CB VAL A 115 -16.245 20.079 14.427 1.00 12.52 C ATOM 1763 CG1 VAL A 115 -15.801 19.185 13.280 1.00 54.23 C ATOM 1764 CG2 VAL A 115 -17.761 20.091 14.549 1.00 34.04 C ATOM 0 H VAL A 115 -16.308 17.719 15.226 1.00 54.41 H new ATOM 0 HA VAL A 115 -14.525 19.785 15.698 1.00 53.14 H new ATOM 0 HB VAL A 115 -15.913 21.095 14.213 1.00 12.52 H new ATOM 0 HG11 VAL A 115 -16.266 19.523 12.354 1.00 54.23 H new ATOM 0 HG12 VAL A 115 -14.717 19.233 13.180 1.00 54.23 H new ATOM 0 HG13 VAL A 115 -16.102 18.157 13.483 1.00 54.23 H new ATOM 0 HG21 VAL A 115 -18.199 20.416 13.606 1.00 34.04 H new ATOM 0 HG22 VAL A 115 -18.115 19.088 14.787 1.00 34.04 H new ATOM 0 HG23 VAL A 115 -18.057 20.778 15.342 1.00 34.04 H new ATOM 1774 N ALA A 116 -17.280 19.963 17.465 1.00 1.13 N ATOM 1775 CA ALA A 116 -17.931 20.652 18.572 1.00 1.35 C ATOM 1776 C ALA A 116 -17.009 20.738 19.784 1.00 1.10 C ATOM 1777 O ALA A 116 -16.889 21.791 20.412 1.00 23.34 O ATOM 1778 CB ALA A 116 -19.228 19.948 18.943 1.00 51.53 C ATOM 0 H ALA A 116 -17.739 19.098 17.178 1.00 1.13 H new ATOM 0 HA ALA A 116 -18.161 21.668 18.250 1.00 1.35 H new ATOM 0 HB1 ALA A 116 -19.703 20.474 19.771 1.00 51.53 H new ATOM 0 HB2 ALA A 116 -19.898 19.944 18.084 1.00 51.53 H new ATOM 0 HB3 ALA A 116 -19.013 18.922 19.240 1.00 51.53 H new ATOM 1784 N LEU A 117 -16.360 19.625 20.108 1.00 71.03 N ATOM 1785 CA LEU A 117 -15.448 19.574 21.245 1.00 15.15 C ATOM 1786 C LEU A 117 -14.382 20.660 21.138 1.00 72.51 C ATOM 1787 O LEU A 117 -14.214 21.471 22.048 1.00 75.03 O ATOM 1788 CB LEU A 117 -14.785 18.198 21.332 1.00 52.45 C ATOM 1789 CG LEU A 117 -14.044 17.891 22.633 1.00 35.44 C ATOM 1790 CD1 LEU A 117 -12.721 18.637 22.684 1.00 44.43 C ATOM 1791 CD2 LEU A 117 -14.907 18.249 23.835 1.00 22.50 C ATOM 0 H LEU A 117 -16.449 18.745 19.599 1.00 71.03 H new ATOM 0 HA LEU A 117 -16.028 19.748 22.152 1.00 15.15 H new ATOM 0 HB2 LEU A 117 -15.552 17.437 21.186 1.00 52.45 H new ATOM 0 HB3 LEU A 117 -14.081 18.103 20.505 1.00 52.45 H new ATOM 0 HG LEU A 117 -13.835 16.822 22.665 1.00 35.44 H new ATOM 0 HD11 LEU A 117 -12.208 18.405 23.618 1.00 44.43 H new ATOM 0 HD12 LEU A 117 -12.098 18.332 21.843 1.00 44.43 H new ATOM 0 HD13 LEU A 117 -12.906 19.710 22.628 1.00 44.43 H new ATOM 0 HD21 LEU A 117 -14.364 18.024 24.753 1.00 22.50 H new ATOM 0 HD22 LEU A 117 -15.147 19.312 23.807 1.00 22.50 H new ATOM 0 HD23 LEU A 117 -15.829 17.668 23.807 1.00 22.50 H new ATOM 1803 N ALA A 118 -13.665 20.669 20.019 1.00 75.23 N ATOM 1804 CA ALA A 118 -12.619 21.657 19.790 1.00 24.02 C ATOM 1805 C ALA A 118 -13.209 23.053 19.623 1.00 43.12 C ATOM 1806 O ALA A 118 -12.614 24.045 20.048 1.00 72.32 O ATOM 1807 CB ALA A 118 -11.795 21.280 18.568 1.00 63.01 C ATOM 0 H ALA A 118 -13.790 20.003 19.257 1.00 75.23 H new ATOM 0 HA ALA A 118 -11.968 21.669 20.664 1.00 24.02 H new ATOM 0 HB1 ALA A 118 -11.017 22.027 18.409 1.00 63.01 H new ATOM 0 HB2 ALA A 118 -11.334 20.305 18.726 1.00 63.01 H new ATOM 0 HB3 ALA A 118 -12.442 21.238 17.692 1.00 63.01 H new ATOM 1813 N LEU A 119 -14.380 23.124 19.001 1.00 52.33 N ATOM 1814 CA LEU A 119 -15.051 24.400 18.776 1.00 11.23 C ATOM 1815 C LEU A 119 -15.325 25.111 20.098 1.00 52.14 C ATOM 1816 O LEU A 119 -15.110 26.317 20.221 1.00 52.31 O ATOM 1817 CB LEU A 119 -16.362 24.183 18.019 1.00 14.11 C ATOM 1818 CG LEU A 119 -17.374 25.328 18.087 1.00 61.21 C ATOM 1819 CD1 LEU A 119 -16.745 26.625 17.603 1.00 52.15 C ATOM 1820 CD2 LEU A 119 -18.612 24.995 17.267 1.00 31.54 C ATOM 0 H LEU A 119 -14.885 22.313 18.643 1.00 52.33 H new ATOM 0 HA LEU A 119 -14.393 25.028 18.176 1.00 11.23 H new ATOM 0 HB2 LEU A 119 -16.127 23.995 16.972 1.00 14.11 H new ATOM 0 HB3 LEU A 119 -16.837 23.282 18.406 1.00 14.11 H new ATOM 0 HG LEU A 119 -17.676 25.460 19.126 1.00 61.21 H new ATOM 0 HD11 LEU A 119 -17.480 27.428 17.658 1.00 52.15 H new ATOM 0 HD12 LEU A 119 -15.890 26.871 18.232 1.00 52.15 H new ATOM 0 HD13 LEU A 119 -16.414 26.506 16.571 1.00 52.15 H new ATOM 0 HD21 LEU A 119 -19.321 25.821 17.327 1.00 31.54 H new ATOM 0 HD22 LEU A 119 -18.328 24.836 16.227 1.00 31.54 H new ATOM 0 HD23 LEU A 119 -19.075 24.090 17.659 1.00 31.54 H new ATOM 1832 N ILE A 120 -15.799 24.356 21.083 1.00 63.42 N ATOM 1833 CA ILE A 120 -16.098 24.913 22.396 1.00 55.12 C ATOM 1834 C ILE A 120 -14.828 25.384 23.096 1.00 33.43 C ATOM 1835 O ILE A 120 -14.761 26.509 23.589 1.00 22.13 O ATOM 1836 CB ILE A 120 -16.816 23.887 23.293 1.00 61.13 C ATOM 1837 CG1 ILE A 120 -18.333 24.057 23.187 1.00 62.00 C ATOM 1838 CG2 ILE A 120 -16.360 24.035 24.737 1.00 51.35 C ATOM 1839 CD1 ILE A 120 -18.862 23.900 21.778 1.00 3.45 C ATOM 0 H ILE A 120 -15.984 23.357 20.997 1.00 63.42 H new ATOM 0 HA ILE A 120 -16.758 25.766 22.234 1.00 55.12 H new ATOM 0 HB ILE A 120 -16.557 22.885 22.952 1.00 61.13 H new ATOM 0 HG12 ILE A 120 -18.818 23.325 23.832 1.00 62.00 H new ATOM 0 HG13 ILE A 120 -18.607 25.043 23.561 1.00 62.00 H new ATOM 0 HG21 ILE A 120 -16.876 23.303 25.358 1.00 51.35 H new ATOM 0 HG22 ILE A 120 -15.285 23.868 24.798 1.00 51.35 H new ATOM 0 HG23 ILE A 120 -16.592 25.040 25.091 1.00 51.35 H new ATOM 0 HD11 ILE A 120 -19.944 24.033 21.779 1.00 3.45 H new ATOM 0 HD12 ILE A 120 -18.404 24.649 21.132 1.00 3.45 H new ATOM 0 HD13 ILE A 120 -18.619 22.904 21.407 1.00 3.45 H new ATOM 1851 N GLU A 121 -13.823 24.514 23.134 1.00 13.33 N ATOM 1852 CA GLU A 121 -12.554 24.842 23.774 1.00 54.13 C ATOM 1853 C GLU A 121 -11.858 25.988 23.045 1.00 62.42 C ATOM 1854 O GLU A 121 -10.992 26.659 23.606 1.00 54.51 O ATOM 1855 CB GLU A 121 -11.642 23.614 23.806 1.00 11.25 C ATOM 1856 CG GLU A 121 -12.315 22.371 24.363 1.00 70.42 C ATOM 1857 CD GLU A 121 -12.392 22.377 25.877 1.00 12.12 C ATOM 1858 OE1 GLU A 121 -12.207 23.458 26.475 1.00 32.24 O ATOM 1859 OE2 GLU A 121 -12.637 21.302 26.464 1.00 51.50 O ATOM 0 H GLU A 121 -13.863 23.578 22.730 1.00 13.33 H new ATOM 0 HA GLU A 121 -12.762 25.158 24.796 1.00 54.13 H new ATOM 0 HB2 GLU A 121 -11.292 23.405 22.795 1.00 11.25 H new ATOM 0 HB3 GLU A 121 -10.762 23.841 24.408 1.00 11.25 H new ATOM 0 HG2 GLU A 121 -13.322 22.293 23.952 1.00 70.42 H new ATOM 0 HG3 GLU A 121 -11.767 21.488 24.034 1.00 70.42 H new ATOM 1866 N SER A 122 -12.242 26.203 21.791 1.00 44.44 N ATOM 1867 CA SER A 122 -11.651 27.264 20.982 1.00 15.04 C ATOM 1868 C SER A 122 -12.082 28.637 21.489 1.00 34.04 C ATOM 1869 O SER A 122 -11.473 29.653 21.158 1.00 71.02 O ATOM 1870 CB SER A 122 -12.054 27.100 19.515 1.00 3.25 C ATOM 1871 OG SER A 122 -12.287 28.359 18.907 1.00 61.51 O ATOM 0 H SER A 122 -12.959 25.657 21.313 1.00 44.44 H new ATOM 0 HA SER A 122 -10.567 27.189 21.064 1.00 15.04 H new ATOM 0 HB2 SER A 122 -11.268 26.572 18.975 1.00 3.25 H new ATOM 0 HB3 SER A 122 -12.953 26.488 19.448 1.00 3.25 H new ATOM 0 HG SER A 122 -12.833 28.238 18.103 1.00 61.51 H new ATOM 1877 N GLY A 123 -13.139 28.658 22.296 1.00 1.25 N ATOM 1878 CA GLY A 123 -13.635 29.911 22.837 1.00 63.52 C ATOM 1879 C GLY A 123 -15.085 30.163 22.477 1.00 52.41 C ATOM 1880 O GLY A 123 -15.569 31.290 22.578 1.00 13.35 O ATOM 0 H GLY A 123 -13.660 27.830 22.585 1.00 1.25 H new ATOM 0 HA2 GLY A 123 -13.529 29.902 23.922 1.00 63.52 H new ATOM 0 HA3 GLY A 123 -13.023 30.732 22.464 1.00 63.52 H new ATOM 1884 N MET A 124 -15.780 29.113 22.053 1.00 31.34 N ATOM 1885 CA MET A 124 -17.184 29.227 21.676 1.00 12.05 C ATOM 1886 C MET A 124 -18.088 28.663 22.768 1.00 1.35 C ATOM 1887 O MET A 124 -17.684 27.785 23.531 1.00 71.11 O ATOM 1888 CB MET A 124 -17.442 28.496 20.357 1.00 25.15 C ATOM 1889 CG MET A 124 -18.179 29.339 19.329 1.00 24.43 C ATOM 1890 SD MET A 124 -17.069 30.376 18.357 1.00 33.41 S ATOM 1891 CE MET A 124 -17.194 31.928 19.242 1.00 32.33 C ATOM 0 H MET A 124 -15.394 28.173 21.962 1.00 31.34 H new ATOM 0 HA MET A 124 -17.414 30.285 21.548 1.00 12.05 H new ATOM 0 HB2 MET A 124 -16.489 28.176 19.936 1.00 25.15 H new ATOM 0 HB3 MET A 124 -18.021 27.594 20.558 1.00 25.15 H new ATOM 0 HG2 MET A 124 -18.737 28.684 18.660 1.00 24.43 H new ATOM 0 HG3 MET A 124 -18.908 29.970 19.837 1.00 24.43 H new ATOM 0 HE1 MET A 124 -16.870 32.743 18.595 1.00 32.33 H new ATOM 0 HE2 MET A 124 -18.229 32.093 19.543 1.00 32.33 H new ATOM 0 HE3 MET A 124 -16.559 31.894 20.128 1.00 32.33 H new ATOM 1901 N LYS A 125 -19.313 29.174 22.839 1.00 45.01 N ATOM 1902 CA LYS A 125 -20.275 28.721 23.837 1.00 45.43 C ATOM 1903 C LYS A 125 -20.858 27.365 23.454 1.00 25.33 C ATOM 1904 O LYS A 125 -21.226 27.139 22.301 1.00 13.54 O ATOM 1905 CB LYS A 125 -21.400 29.747 23.992 1.00 70.32 C ATOM 1906 CG LYS A 125 -21.229 30.975 23.116 1.00 45.44 C ATOM 1907 CD LYS A 125 -22.235 32.057 23.469 1.00 12.31 C ATOM 1908 CE LYS A 125 -21.648 33.069 24.441 1.00 22.24 C ATOM 1909 NZ LYS A 125 -22.409 34.348 24.438 1.00 55.51 N ATOM 0 H LYS A 125 -19.663 29.903 22.217 1.00 45.01 H new ATOM 0 HA LYS A 125 -19.753 28.616 24.788 1.00 45.43 H new ATOM 0 HB2 LYS A 125 -22.351 29.270 23.753 1.00 70.32 H new ATOM 0 HB3 LYS A 125 -21.454 30.060 25.035 1.00 70.32 H new ATOM 0 HG2 LYS A 125 -20.218 31.366 23.230 1.00 45.44 H new ATOM 0 HG3 LYS A 125 -21.347 30.695 22.069 1.00 45.44 H new ATOM 0 HD2 LYS A 125 -22.556 32.567 22.561 1.00 12.31 H new ATOM 0 HD3 LYS A 125 -23.122 31.601 23.909 1.00 12.31 H new ATOM 0 HE2 LYS A 125 -21.648 32.649 25.447 1.00 22.24 H new ATOM 0 HE3 LYS A 125 -20.609 33.265 24.178 1.00 22.24 H new ATOM 0 HZ1 LYS A 125 -21.977 35.011 25.113 1.00 55.51 H new ATOM 0 HZ2 LYS A 125 -22.387 34.763 23.484 1.00 55.51 H new ATOM 0 HZ3 LYS A 125 -23.395 34.166 24.714 1.00 55.51 H new ATOM 1923 N TYR A 126 -20.939 26.465 24.428 1.00 11.45 N ATOM 1924 CA TYR A 126 -21.477 25.131 24.193 1.00 23.43 C ATOM 1925 C TYR A 126 -22.831 25.204 23.495 1.00 12.00 C ATOM 1926 O TYR A 126 -23.032 24.599 22.443 1.00 72.23 O ATOM 1927 CB TYR A 126 -21.612 24.372 25.515 1.00 51.32 C ATOM 1928 CG TYR A 126 -22.878 23.551 25.615 1.00 65.24 C ATOM 1929 CD1 TYR A 126 -23.056 22.415 24.834 1.00 2.41 C ATOM 1930 CD2 TYR A 126 -23.895 23.910 26.491 1.00 63.14 C ATOM 1931 CE1 TYR A 126 -24.211 21.662 24.922 1.00 44.53 C ATOM 1932 CE2 TYR A 126 -25.052 23.162 26.586 1.00 54.12 C ATOM 1933 CZ TYR A 126 -25.206 22.040 25.799 1.00 21.30 C ATOM 1934 OH TYR A 126 -26.357 21.292 25.890 1.00 32.52 O ATOM 0 H TYR A 126 -20.639 26.636 25.388 1.00 11.45 H new ATOM 0 HA TYR A 126 -20.783 24.597 23.544 1.00 23.43 H new ATOM 0 HB2 TYR A 126 -20.752 23.714 25.636 1.00 51.32 H new ATOM 0 HB3 TYR A 126 -21.586 25.086 26.338 1.00 51.32 H new ATOM 0 HD1 TYR A 126 -22.278 22.116 24.147 1.00 2.41 H new ATOM 0 HD2 TYR A 126 -23.779 24.789 27.108 1.00 63.14 H new ATOM 0 HE1 TYR A 126 -24.334 20.782 24.308 1.00 44.53 H new ATOM 0 HE2 TYR A 126 -25.832 23.454 27.273 1.00 54.12 H new ATOM 0 HH TYR A 126 -26.956 21.693 26.554 1.00 32.52 H new ATOM 1944 N GLU A 127 -23.756 25.951 24.090 1.00 74.24 N ATOM 1945 CA GLU A 127 -25.092 26.104 23.525 1.00 33.42 C ATOM 1946 C GLU A 127 -25.022 26.646 22.100 1.00 33.54 C ATOM 1947 O GLU A 127 -25.528 26.027 21.164 1.00 63.51 O ATOM 1948 CB GLU A 127 -25.935 27.037 24.397 1.00 44.41 C ATOM 1949 CG GLU A 127 -26.053 26.580 25.841 1.00 73.31 C ATOM 1950 CD GLU A 127 -27.431 26.833 26.422 1.00 42.31 C ATOM 1951 OE1 GLU A 127 -28.429 26.589 25.713 1.00 62.15 O ATOM 1952 OE2 GLU A 127 -27.510 27.276 27.587 1.00 11.30 O ATOM 0 H GLU A 127 -23.605 26.459 24.962 1.00 74.24 H new ATOM 0 HA GLU A 127 -25.562 25.121 23.498 1.00 33.42 H new ATOM 0 HB2 GLU A 127 -25.497 28.035 24.375 1.00 44.41 H new ATOM 0 HB3 GLU A 127 -26.934 27.118 23.968 1.00 44.41 H new ATOM 0 HG2 GLU A 127 -25.827 25.515 25.901 1.00 73.31 H new ATOM 0 HG3 GLU A 127 -25.308 27.098 26.444 1.00 73.31 H new ATOM 1959 N ASP A 128 -24.393 27.805 21.945 1.00 0.13 N ATOM 1960 CA ASP A 128 -24.256 28.431 20.635 1.00 2.34 C ATOM 1961 C ASP A 128 -23.705 27.441 19.615 1.00 63.24 C ATOM 1962 O ASP A 128 -24.324 27.191 18.581 1.00 63.22 O ATOM 1963 CB ASP A 128 -23.341 29.654 20.724 1.00 23.41 C ATOM 1964 CG ASP A 128 -23.608 30.658 19.621 1.00 41.24 C ATOM 1965 OD1 ASP A 128 -23.592 30.258 18.438 1.00 43.10 O ATOM 1966 OD2 ASP A 128 -23.832 31.845 19.940 1.00 73.24 O ATOM 0 H ASP A 128 -23.970 28.330 22.710 1.00 0.13 H new ATOM 0 HA ASP A 128 -25.245 28.750 20.307 1.00 2.34 H new ATOM 0 HB2 ASP A 128 -23.478 30.137 21.692 1.00 23.41 H new ATOM 0 HB3 ASP A 128 -22.301 29.331 20.673 1.00 23.41 H new ATOM 1971 N ALA A 129 -22.537 26.881 19.912 1.00 64.21 N ATOM 1972 CA ALA A 129 -21.903 25.917 19.021 1.00 44.12 C ATOM 1973 C ALA A 129 -22.865 24.792 18.655 1.00 24.34 C ATOM 1974 O ALA A 129 -23.008 24.442 17.484 1.00 73.43 O ATOM 1975 CB ALA A 129 -20.645 25.351 19.664 1.00 12.31 C ATOM 0 H ALA A 129 -22.010 27.078 20.763 1.00 64.21 H new ATOM 0 HA ALA A 129 -21.626 26.436 18.103 1.00 44.12 H new ATOM 0 HB1 ALA A 129 -20.182 24.633 18.987 1.00 12.31 H new ATOM 0 HB2 ALA A 129 -19.945 26.161 19.868 1.00 12.31 H new ATOM 0 HB3 ALA A 129 -20.906 24.854 20.598 1.00 12.31 H new ATOM 1981 N ILE A 130 -23.520 24.229 19.665 1.00 60.21 N ATOM 1982 CA ILE A 130 -24.468 23.143 19.449 1.00 53.24 C ATOM 1983 C ILE A 130 -25.567 23.558 18.476 1.00 43.41 C ATOM 1984 O ILE A 130 -25.777 22.912 17.450 1.00 34.43 O ATOM 1985 CB ILE A 130 -25.114 22.688 20.771 1.00 40.03 C ATOM 1986 CG1 ILE A 130 -24.068 22.032 21.675 1.00 75.22 C ATOM 1987 CG2 ILE A 130 -26.262 21.728 20.496 1.00 12.45 C ATOM 1988 CD1 ILE A 130 -22.778 21.696 20.961 1.00 22.11 C ATOM 0 H ILE A 130 -23.412 24.507 20.640 1.00 60.21 H new ATOM 0 HA ILE A 130 -23.904 22.312 19.025 1.00 53.24 H new ATOM 0 HB ILE A 130 -25.513 23.563 21.284 1.00 40.03 H new ATOM 0 HG12 ILE A 130 -23.849 22.700 22.508 1.00 75.22 H new ATOM 0 HG13 ILE A 130 -24.487 21.120 22.099 1.00 75.22 H new ATOM 0 HG21 ILE A 130 -26.709 21.415 21.440 1.00 12.45 H new ATOM 0 HG22 ILE A 130 -27.015 22.227 19.886 1.00 12.45 H new ATOM 0 HG23 ILE A 130 -25.886 20.854 19.965 1.00 12.45 H new ATOM 0 HD11 ILE A 130 -22.083 21.234 21.663 1.00 22.11 H new ATOM 0 HD12 ILE A 130 -22.984 21.003 20.145 1.00 22.11 H new ATOM 0 HD13 ILE A 130 -22.336 22.608 20.560 1.00 22.11 H new ATOM 2000 N GLN A 131 -26.262 24.642 18.805 1.00 52.33 N ATOM 2001 CA GLN A 131 -27.339 25.144 17.959 1.00 4.30 C ATOM 2002 C GLN A 131 -26.880 25.267 16.510 1.00 71.34 C ATOM 2003 O GLN A 131 -27.665 25.073 15.581 1.00 61.31 O ATOM 2004 CB GLN A 131 -27.825 26.502 18.469 1.00 51.02 C ATOM 2005 CG GLN A 131 -28.782 26.403 19.646 1.00 70.42 C ATOM 2006 CD GLN A 131 -28.775 25.030 20.289 1.00 74.10 C ATOM 2007 OE1 GLN A 131 -29.469 24.117 19.839 1.00 50.40 O ATOM 2008 NE2 GLN A 131 -27.989 24.876 21.348 1.00 33.11 N ATOM 0 H GLN A 131 -26.099 25.189 19.650 1.00 52.33 H new ATOM 0 HA GLN A 131 -28.163 24.431 18.001 1.00 4.30 H new ATOM 0 HB2 GLN A 131 -26.962 27.101 18.762 1.00 51.02 H new ATOM 0 HB3 GLN A 131 -28.318 27.032 17.654 1.00 51.02 H new ATOM 0 HG2 GLN A 131 -28.513 27.151 20.392 1.00 70.42 H new ATOM 0 HG3 GLN A 131 -29.792 26.637 19.309 1.00 70.42 H new ATOM 0 HE21 GLN A 131 -27.431 25.660 21.687 1.00 33.11 H new ATOM 0 HE22 GLN A 131 -27.943 23.974 21.822 1.00 33.11 H new ATOM 2017 N PHE A 132 -25.605 25.590 16.323 1.00 62.01 N ATOM 2018 CA PHE A 132 -25.042 25.740 14.986 1.00 22.30 C ATOM 2019 C PHE A 132 -24.963 24.392 14.275 1.00 24.22 C ATOM 2020 O PHE A 132 -25.664 24.155 13.291 1.00 0.12 O ATOM 2021 CB PHE A 132 -23.650 26.371 15.063 1.00 30.34 C ATOM 2022 CG PHE A 132 -23.190 26.968 13.764 1.00 24.14 C ATOM 2023 CD1 PHE A 132 -24.031 27.783 13.025 1.00 42.51 C ATOM 2024 CD2 PHE A 132 -21.916 26.713 13.283 1.00 44.23 C ATOM 2025 CE1 PHE A 132 -23.610 28.335 11.829 1.00 31.03 C ATOM 2026 CE2 PHE A 132 -21.489 27.262 12.088 1.00 13.21 C ATOM 2027 CZ PHE A 132 -22.338 28.073 11.360 1.00 41.01 C ATOM 0 H PHE A 132 -24.942 25.753 17.080 1.00 62.01 H new ATOM 0 HA PHE A 132 -25.699 26.395 14.414 1.00 22.30 H new ATOM 0 HB2 PHE A 132 -23.653 27.146 15.829 1.00 30.34 H new ATOM 0 HB3 PHE A 132 -22.933 25.613 15.379 1.00 30.34 H new ATOM 0 HD1 PHE A 132 -25.027 27.990 13.387 1.00 42.51 H new ATOM 0 HD2 PHE A 132 -21.249 26.078 13.848 1.00 44.23 H new ATOM 0 HE1 PHE A 132 -24.275 28.970 11.263 1.00 31.03 H new ATOM 0 HE2 PHE A 132 -20.493 27.057 11.724 1.00 13.21 H new ATOM 0 HZ PHE A 132 -22.007 28.501 10.425 1.00 41.01 H new ATOM 2037 N ILE A 133 -24.104 23.513 14.780 1.00 23.14 N ATOM 2038 CA ILE A 133 -23.933 22.189 14.195 1.00 42.12 C ATOM 2039 C ILE A 133 -25.219 21.376 14.289 1.00 15.10 C ATOM 2040 O ILE A 133 -25.370 20.354 13.619 1.00 14.13 O ATOM 2041 CB ILE A 133 -22.796 21.411 14.883 1.00 2.34 C ATOM 2042 CG1 ILE A 133 -22.997 21.407 16.400 1.00 12.02 C ATOM 2043 CG2 ILE A 133 -21.447 22.017 14.524 1.00 20.54 C ATOM 2044 CD1 ILE A 133 -22.401 20.198 17.085 1.00 22.55 C ATOM 0 H ILE A 133 -23.516 23.694 15.593 1.00 23.14 H new ATOM 0 HA ILE A 133 -23.676 22.339 13.146 1.00 42.12 H new ATOM 0 HB ILE A 133 -22.815 20.380 14.530 1.00 2.34 H new ATOM 0 HG12 ILE A 133 -22.551 22.309 16.820 1.00 12.02 H new ATOM 0 HG13 ILE A 133 -24.064 21.448 16.617 1.00 12.02 H new ATOM 0 HG21 ILE A 133 -20.653 21.456 15.018 1.00 20.54 H new ATOM 0 HG22 ILE A 133 -21.304 21.973 13.444 1.00 20.54 H new ATOM 0 HG23 ILE A 133 -21.416 23.056 14.852 1.00 20.54 H new ATOM 0 HD11 ILE A 133 -22.581 20.262 18.158 1.00 22.55 H new ATOM 0 HD12 ILE A 133 -22.864 19.293 16.693 1.00 22.55 H new ATOM 0 HD13 ILE A 133 -21.328 20.167 16.899 1.00 22.55 H new ATOM 2056 N ARG A 134 -26.145 21.838 15.123 1.00 31.04 N ATOM 2057 CA ARG A 134 -27.420 21.154 15.305 1.00 42.12 C ATOM 2058 C ARG A 134 -28.443 21.631 14.279 1.00 55.14 C ATOM 2059 O ARG A 134 -29.162 20.827 13.685 1.00 2.04 O ATOM 2060 CB ARG A 134 -27.952 21.389 16.719 1.00 13.45 C ATOM 2061 CG ARG A 134 -29.318 20.770 16.967 1.00 21.32 C ATOM 2062 CD ARG A 134 -29.503 20.395 18.429 1.00 1.54 C ATOM 2063 NE ARG A 134 -30.677 19.551 18.634 1.00 63.10 N ATOM 2064 CZ ARG A 134 -31.165 19.249 19.832 1.00 52.12 C ATOM 2065 NH1 ARG A 134 -30.584 19.721 20.926 1.00 34.13 N ATOM 2066 NH2 ARG A 134 -32.237 18.474 19.936 1.00 12.25 N ATOM 0 H ARG A 134 -26.036 22.683 15.683 1.00 31.04 H new ATOM 0 HA ARG A 134 -27.255 20.086 15.160 1.00 42.12 H new ATOM 0 HB2 ARG A 134 -27.242 20.981 17.438 1.00 13.45 H new ATOM 0 HB3 ARG A 134 -28.010 22.462 16.903 1.00 13.45 H new ATOM 0 HG2 ARG A 134 -30.096 21.473 16.669 1.00 21.32 H new ATOM 0 HG3 ARG A 134 -29.435 19.882 16.345 1.00 21.32 H new ATOM 0 HD2 ARG A 134 -28.615 19.873 18.784 1.00 1.54 H new ATOM 0 HD3 ARG A 134 -29.600 21.302 19.026 1.00 1.54 H new ATOM 0 HE ARG A 134 -31.148 19.173 17.812 1.00 63.10 H new ATOM 0 HH11 ARG A 134 -29.760 20.318 20.849 1.00 34.13 H new ATOM 0 HH12 ARG A 134 -30.961 19.488 21.845 1.00 34.13 H new ATOM 0 HH21 ARG A 134 -32.687 18.110 19.096 1.00 12.25 H new ATOM 0 HH22 ARG A 134 -32.611 18.242 20.856 1.00 12.25 H new ATOM 2080 N GLN A 135 -28.504 22.943 14.076 1.00 5.32 N ATOM 2081 CA GLN A 135 -29.440 23.527 13.123 1.00 70.41 C ATOM 2082 C GLN A 135 -29.058 23.162 11.692 1.00 33.21 C ATOM 2083 O GLN A 135 -29.888 23.214 10.784 1.00 50.40 O ATOM 2084 CB GLN A 135 -29.480 25.048 13.281 1.00 71.44 C ATOM 2085 CG GLN A 135 -28.250 25.749 12.727 1.00 15.30 C ATOM 2086 CD GLN A 135 -28.430 27.252 12.631 1.00 64.51 C ATOM 2087 OE1 GLN A 135 -29.374 27.813 13.187 1.00 22.35 O ATOM 2088 NE2 GLN A 135 -27.521 27.912 11.922 1.00 14.13 N ATOM 0 H GLN A 135 -27.916 23.622 14.559 1.00 5.32 H new ATOM 0 HA GLN A 135 -30.430 23.122 13.330 1.00 70.41 H new ATOM 0 HB2 GLN A 135 -30.366 25.434 12.777 1.00 71.44 H new ATOM 0 HB3 GLN A 135 -29.582 25.293 14.338 1.00 71.44 H new ATOM 0 HG2 GLN A 135 -27.393 25.529 13.364 1.00 15.30 H new ATOM 0 HG3 GLN A 135 -28.023 25.350 11.738 1.00 15.30 H new ATOM 0 HE21 GLN A 135 -26.755 27.406 11.478 1.00 14.13 H new ATOM 0 HE22 GLN A 135 -27.589 28.925 11.822 1.00 14.13 H new ATOM 2097 N LYS A 136 -27.797 22.792 11.497 1.00 0.25 N ATOM 2098 CA LYS A 136 -27.304 22.417 10.177 1.00 1.45 C ATOM 2099 C LYS A 136 -27.879 21.073 9.743 1.00 12.03 C ATOM 2100 O LYS A 136 -27.857 20.731 8.561 1.00 73.30 O ATOM 2101 CB LYS A 136 -25.775 22.353 10.181 1.00 60.31 C ATOM 2102 CG LYS A 136 -25.220 21.131 10.892 1.00 25.10 C ATOM 2103 CD LYS A 136 -24.294 20.333 9.989 1.00 20.20 C ATOM 2104 CE LYS A 136 -23.129 21.178 9.498 1.00 4.34 C ATOM 2105 NZ LYS A 136 -21.816 20.540 9.797 1.00 54.54 N ATOM 0 H LYS A 136 -27.097 22.744 12.237 1.00 0.25 H new ATOM 0 HA LYS A 136 -27.628 23.177 9.466 1.00 1.45 H new ATOM 0 HB2 LYS A 136 -25.417 22.358 9.152 1.00 60.31 H new ATOM 0 HB3 LYS A 136 -25.383 23.251 10.659 1.00 60.31 H new ATOM 0 HG2 LYS A 136 -24.679 21.443 11.785 1.00 25.10 H new ATOM 0 HG3 LYS A 136 -26.042 20.497 11.223 1.00 25.10 H new ATOM 0 HD2 LYS A 136 -23.914 19.467 10.531 1.00 20.20 H new ATOM 0 HD3 LYS A 136 -24.855 19.954 9.135 1.00 20.20 H new ATOM 0 HE2 LYS A 136 -23.221 21.334 8.423 1.00 4.34 H new ATOM 0 HE3 LYS A 136 -23.170 22.161 9.967 1.00 4.34 H new ATOM 0 HZ1 LYS A 136 -21.047 21.147 9.447 1.00 54.54 H new ATOM 0 HZ2 LYS A 136 -21.717 20.415 10.825 1.00 54.54 H new ATOM 0 HZ3 LYS A 136 -21.766 19.613 9.329 1.00 54.54 H new ATOM 2119 N ARG A 137 -28.394 20.316 10.707 1.00 54.14 N ATOM 2120 CA ARG A 137 -28.976 19.010 10.423 1.00 23.50 C ATOM 2121 C ARG A 137 -29.566 18.391 11.687 1.00 4.01 C ATOM 2122 O ARG A 137 -29.116 17.340 12.144 1.00 42.10 O ATOM 2123 CB ARG A 137 -27.919 18.075 9.831 1.00 51.35 C ATOM 2124 CG ARG A 137 -28.487 17.050 8.863 1.00 63.21 C ATOM 2125 CD ARG A 137 -29.530 16.169 9.533 1.00 41.31 C ATOM 2126 NE ARG A 137 -30.051 15.150 8.625 1.00 4.44 N ATOM 2127 CZ ARG A 137 -31.094 14.379 8.908 1.00 32.30 C ATOM 2128 NH1 ARG A 137 -31.725 14.510 10.067 1.00 74.34 N ATOM 2129 NH2 ARG A 137 -31.509 13.474 8.030 1.00 22.25 N ATOM 0 H ARG A 137 -28.420 20.585 11.691 1.00 54.14 H new ATOM 0 HA ARG A 137 -29.778 19.148 9.698 1.00 23.50 H new ATOM 0 HB2 ARG A 137 -27.166 18.671 9.315 1.00 51.35 H new ATOM 0 HB3 ARG A 137 -27.412 17.554 10.643 1.00 51.35 H new ATOM 0 HG2 ARG A 137 -28.934 17.562 8.011 1.00 63.21 H new ATOM 0 HG3 ARG A 137 -27.680 16.429 8.474 1.00 63.21 H new ATOM 0 HD2 ARG A 137 -29.090 15.686 10.406 1.00 41.31 H new ATOM 0 HD3 ARG A 137 -30.352 16.789 9.892 1.00 41.31 H new ATOM 0 HE ARG A 137 -29.588 15.024 7.725 1.00 4.44 H new ATOM 0 HH11 ARG A 137 -31.409 15.205 10.744 1.00 74.34 H new ATOM 0 HH12 ARG A 137 -32.526 13.916 10.282 1.00 74.34 H new ATOM 0 HH21 ARG A 137 -31.026 13.371 7.137 1.00 22.25 H new ATOM 0 HH22 ARG A 137 -32.310 12.882 8.248 1.00 22.25 H new ATOM 2143 N ARG A 138 -30.574 19.051 12.247 1.00 34.41 N ATOM 2144 CA ARG A 138 -31.224 18.567 13.459 1.00 35.30 C ATOM 2145 C ARG A 138 -30.192 18.205 14.523 1.00 61.15 C ATOM 2146 O ARG A 138 -29.009 18.512 14.383 1.00 23.33 O ATOM 2147 CB ARG A 138 -32.096 17.350 13.144 1.00 33.34 C ATOM 2148 CG ARG A 138 -33.495 17.434 13.733 1.00 52.12 C ATOM 2149 CD ARG A 138 -34.269 18.613 13.164 1.00 43.23 C ATOM 2150 NE ARG A 138 -34.202 18.659 11.706 1.00 43.35 N ATOM 2151 CZ ARG A 138 -34.481 19.744 10.991 1.00 65.31 C ATOM 2152 NH1 ARG A 138 -34.843 20.866 11.597 1.00 61.11 N ATOM 2153 NH2 ARG A 138 -34.397 19.707 9.667 1.00 4.22 N ATOM 0 H ARG A 138 -30.958 19.922 11.881 1.00 34.41 H new ATOM 0 HA ARG A 138 -31.854 19.367 13.847 1.00 35.30 H new ATOM 0 HB2 ARG A 138 -32.172 17.239 12.062 1.00 33.34 H new ATOM 0 HB3 ARG A 138 -31.605 16.454 13.523 1.00 33.34 H new ATOM 0 HG2 ARG A 138 -34.034 16.510 13.526 1.00 52.12 H new ATOM 0 HG3 ARG A 138 -33.430 17.529 14.817 1.00 52.12 H new ATOM 0 HD2 ARG A 138 -35.311 18.548 13.477 1.00 43.23 H new ATOM 0 HD3 ARG A 138 -33.870 19.541 13.575 1.00 43.23 H new ATOM 0 HE ARG A 138 -33.926 17.812 11.209 1.00 43.35 H new ATOM 0 HH11 ARG A 138 -34.908 20.898 12.614 1.00 61.11 H new ATOM 0 HH12 ARG A 138 -35.057 21.697 11.046 1.00 61.11 H new ATOM 0 HH21 ARG A 138 -34.118 18.845 9.198 1.00 4.22 H new ATOM 0 HH22 ARG A 138 -34.611 20.540 9.119 1.00 4.22 H new ATOM 2167 N GLY A 139 -30.649 17.551 15.586 1.00 71.40 N ATOM 2168 CA GLY A 139 -29.753 17.158 16.658 1.00 43.43 C ATOM 2169 C GLY A 139 -28.556 16.375 16.155 1.00 34.43 C ATOM 2170 O GLY A 139 -28.627 15.157 15.995 1.00 22.53 O ATOM 0 H GLY A 139 -31.624 17.286 15.724 1.00 71.40 H new ATOM 0 HA2 GLY A 139 -29.407 18.048 17.183 1.00 43.43 H new ATOM 0 HA3 GLY A 139 -30.300 16.554 17.382 1.00 43.43 H new ATOM 2174 N ALA A 140 -27.455 17.075 15.904 1.00 12.03 N ATOM 2175 CA ALA A 140 -26.238 16.437 15.417 1.00 35.13 C ATOM 2176 C ALA A 140 -25.374 15.948 16.575 1.00 41.45 C ATOM 2177 O ALA A 140 -24.974 14.784 16.615 1.00 54.43 O ATOM 2178 CB ALA A 140 -25.453 17.399 14.539 1.00 51.43 C ATOM 0 H ALA A 140 -27.381 18.084 16.030 1.00 12.03 H new ATOM 0 HA ALA A 140 -26.524 15.571 14.821 1.00 35.13 H new ATOM 0 HB1 ALA A 140 -24.547 16.909 14.182 1.00 51.43 H new ATOM 0 HB2 ALA A 140 -26.065 17.695 13.687 1.00 51.43 H new ATOM 0 HB3 ALA A 140 -25.184 18.283 15.118 1.00 51.43 H new ATOM 2184 N ILE A 141 -25.088 16.845 17.513 1.00 71.31 N ATOM 2185 CA ILE A 141 -24.271 16.504 18.671 1.00 70.22 C ATOM 2186 C ILE A 141 -25.138 16.063 19.845 1.00 73.41 C ATOM 2187 O ILE A 141 -24.632 15.579 20.856 1.00 21.13 O ATOM 2188 CB ILE A 141 -23.396 17.692 19.112 1.00 63.24 C ATOM 2189 CG1 ILE A 141 -22.519 17.294 20.301 1.00 61.23 C ATOM 2190 CG2 ILE A 141 -24.266 18.888 19.465 1.00 10.52 C ATOM 2191 CD1 ILE A 141 -21.389 18.263 20.569 1.00 22.22 C ATOM 0 H ILE A 141 -25.410 17.813 17.494 1.00 71.31 H new ATOM 0 HA ILE A 141 -23.625 15.679 18.369 1.00 70.22 H new ATOM 0 HB ILE A 141 -22.746 17.973 18.283 1.00 63.24 H new ATOM 0 HG12 ILE A 141 -23.142 17.219 21.192 1.00 61.23 H new ATOM 0 HG13 ILE A 141 -22.102 16.303 20.119 1.00 61.23 H new ATOM 0 HG21 ILE A 141 -23.633 19.720 19.775 1.00 10.52 H new ATOM 0 HG22 ILE A 141 -24.851 19.182 18.594 1.00 10.52 H new ATOM 0 HG23 ILE A 141 -24.939 18.621 20.280 1.00 10.52 H new ATOM 0 HD11 ILE A 141 -20.809 17.918 21.425 1.00 22.22 H new ATOM 0 HD12 ILE A 141 -20.743 18.320 19.693 1.00 22.22 H new ATOM 0 HD13 ILE A 141 -21.799 19.250 20.783 1.00 22.22 H new ATOM 2203 N ASN A 142 -26.449 16.231 19.702 1.00 42.42 N ATOM 2204 CA ASN A 142 -27.388 15.849 20.750 1.00 3.13 C ATOM 2205 C ASN A 142 -26.994 14.513 21.373 1.00 45.13 C ATOM 2206 O ASN A 142 -26.196 13.764 20.808 1.00 55.44 O ATOM 2207 CB ASN A 142 -28.807 15.763 20.186 1.00 72.52 C ATOM 2208 CG ASN A 142 -29.849 15.563 21.270 1.00 51.05 C ATOM 2209 OD1 ASN A 142 -29.819 16.420 22.284 1.00 32.31 O flip ATOM 2210 ND2 ASN A 142 -30.671 14.650 21.195 1.00 70.42 N flip ATOM 0 H ASN A 142 -26.885 16.629 18.870 1.00 42.42 H new ATOM 0 HA ASN A 142 -27.359 16.614 21.526 1.00 3.13 H new ATOM 0 HB2 ASN A 142 -29.032 16.676 19.634 1.00 72.52 H new ATOM 0 HB3 ASN A 142 -28.863 14.939 19.475 1.00 72.52 H new ATOM 0 HD21 ASN A 142 -30.657 14.015 20.397 1.00 70.42 H new ATOM 0 HD22 ASN A 142 -31.367 14.528 21.931 1.00 70.42 H new ATOM 2217 N SER A 143 -27.558 14.221 22.540 1.00 71.20 N ATOM 2218 CA SER A 143 -27.264 12.977 23.241 1.00 24.33 C ATOM 2219 C SER A 143 -26.183 13.191 24.297 1.00 70.11 C ATOM 2220 O SER A 143 -25.935 14.317 24.730 1.00 73.43 O ATOM 2221 CB SER A 143 -26.817 11.901 22.250 1.00 75.35 C ATOM 2222 OG SER A 143 -27.667 11.869 21.116 1.00 60.53 O ATOM 0 H SER A 143 -28.221 14.829 23.020 1.00 71.20 H new ATOM 0 HA SER A 143 -28.175 12.646 23.739 1.00 24.33 H new ATOM 0 HB2 SER A 143 -25.792 12.095 21.935 1.00 75.35 H new ATOM 0 HB3 SER A 143 -26.821 10.927 22.739 1.00 75.35 H new ATOM 0 HG SER A 143 -27.224 12.312 20.362 1.00 60.53 H new ATOM 2228 N LYS A 144 -25.542 12.102 24.708 1.00 71.14 N ATOM 2229 CA LYS A 144 -24.487 12.168 25.711 1.00 24.44 C ATOM 2230 C LYS A 144 -23.577 13.368 25.467 1.00 35.32 C ATOM 2231 O LYS A 144 -23.191 14.065 26.405 1.00 65.32 O ATOM 2232 CB LYS A 144 -23.662 10.879 25.699 1.00 22.40 C ATOM 2233 CG LYS A 144 -24.496 9.621 25.873 1.00 3.12 C ATOM 2234 CD LYS A 144 -24.157 8.577 24.822 1.00 2.24 C ATOM 2235 CE LYS A 144 -25.067 8.691 23.609 1.00 12.44 C ATOM 2236 NZ LYS A 144 -24.455 9.518 22.532 1.00 13.25 N ATOM 0 H LYS A 144 -25.735 11.162 24.361 1.00 71.14 H new ATOM 0 HA LYS A 144 -24.957 12.283 26.688 1.00 24.44 H new ATOM 0 HB2 LYS A 144 -23.116 10.816 24.758 1.00 22.40 H new ATOM 0 HB3 LYS A 144 -22.919 10.925 26.495 1.00 22.40 H new ATOM 0 HG2 LYS A 144 -24.327 9.206 26.867 1.00 3.12 H new ATOM 0 HG3 LYS A 144 -25.554 9.873 25.808 1.00 3.12 H new ATOM 0 HD2 LYS A 144 -23.119 8.695 24.512 1.00 2.24 H new ATOM 0 HD3 LYS A 144 -24.249 7.581 25.255 1.00 2.24 H new ATOM 0 HE2 LYS A 144 -25.284 7.695 23.223 1.00 12.44 H new ATOM 0 HE3 LYS A 144 -26.018 9.131 23.909 1.00 12.44 H new ATOM 0 HZ1 LYS A 144 -25.106 9.571 21.723 1.00 13.25 H new ATOM 0 HZ2 LYS A 144 -24.271 10.476 22.892 1.00 13.25 H new ATOM 0 HZ3 LYS A 144 -23.560 9.085 22.228 1.00 13.25 H new ATOM 2250 N GLN A 145 -23.242 13.603 24.203 1.00 72.12 N ATOM 2251 CA GLN A 145 -22.379 14.720 23.837 1.00 73.21 C ATOM 2252 C GLN A 145 -22.886 16.022 24.447 1.00 15.21 C ATOM 2253 O GLN A 145 -22.168 16.694 25.189 1.00 60.13 O ATOM 2254 CB GLN A 145 -22.300 14.853 22.315 1.00 25.11 C ATOM 2255 CG GLN A 145 -22.303 13.519 21.587 1.00 64.43 C ATOM 2256 CD GLN A 145 -21.383 12.500 22.230 1.00 4.15 C ATOM 2257 OE1 GLN A 145 -21.783 11.367 22.500 1.00 51.24 O ATOM 2258 NE2 GLN A 145 -20.141 12.899 22.481 1.00 21.41 N ATOM 0 H GLN A 145 -23.555 13.035 23.415 1.00 72.12 H new ATOM 0 HA GLN A 145 -21.382 14.520 24.230 1.00 73.21 H new ATOM 0 HB2 GLN A 145 -23.143 15.450 21.967 1.00 25.11 H new ATOM 0 HB3 GLN A 145 -21.393 15.399 22.053 1.00 25.11 H new ATOM 0 HG2 GLN A 145 -23.318 13.123 21.566 1.00 64.43 H new ATOM 0 HG3 GLN A 145 -22.000 13.674 20.552 1.00 64.43 H new ATOM 0 HE21 GLN A 145 -19.852 13.847 22.241 1.00 21.41 H new ATOM 0 HE22 GLN A 145 -19.477 12.257 22.914 1.00 21.41 H new ATOM 2267 N LEU A 146 -24.128 16.374 24.131 1.00 43.05 N ATOM 2268 CA LEU A 146 -24.732 17.597 24.648 1.00 42.14 C ATOM 2269 C LEU A 146 -24.649 17.644 26.170 1.00 42.01 C ATOM 2270 O LEU A 146 -24.150 18.611 26.746 1.00 15.55 O ATOM 2271 CB LEU A 146 -26.192 17.696 24.202 1.00 43.33 C ATOM 2272 CG LEU A 146 -26.571 18.956 23.422 1.00 72.41 C ATOM 2273 CD1 LEU A 146 -26.232 18.793 21.948 1.00 14.43 C ATOM 2274 CD2 LEU A 146 -28.050 19.268 23.600 1.00 60.42 C ATOM 0 H LEU A 146 -24.736 15.830 23.519 1.00 43.05 H new ATOM 0 HA LEU A 146 -24.177 18.445 24.246 1.00 42.14 H new ATOM 0 HB2 LEU A 146 -26.422 16.828 23.585 1.00 43.33 H new ATOM 0 HB3 LEU A 146 -26.826 17.636 25.086 1.00 43.33 H new ATOM 0 HG LEU A 146 -25.994 19.792 23.816 1.00 72.41 H new ATOM 0 HD11 LEU A 146 -26.509 19.699 21.409 1.00 14.43 H new ATOM 0 HD12 LEU A 146 -25.162 18.618 21.838 1.00 14.43 H new ATOM 0 HD13 LEU A 146 -26.782 17.945 21.540 1.00 14.43 H new ATOM 0 HD21 LEU A 146 -28.302 20.167 23.038 1.00 60.42 H new ATOM 0 HD22 LEU A 146 -28.645 18.432 23.233 1.00 60.42 H new ATOM 0 HD23 LEU A 146 -28.263 19.428 24.657 1.00 60.42 H new ATOM 2286 N THR A 147 -25.139 16.591 26.817 1.00 23.00 N ATOM 2287 CA THR A 147 -25.119 16.511 28.272 1.00 13.11 C ATOM 2288 C THR A 147 -23.700 16.650 28.811 1.00 14.55 C ATOM 2289 O THR A 147 -23.481 17.263 29.857 1.00 64.31 O ATOM 2290 CB THR A 147 -25.717 15.182 28.770 1.00 73.32 C ATOM 2291 OG1 THR A 147 -24.872 14.091 28.388 1.00 21.10 O ATOM 2292 CG2 THR A 147 -27.113 14.970 28.203 1.00 12.52 C ATOM 0 H THR A 147 -25.555 15.782 26.356 1.00 23.00 H new ATOM 0 HA THR A 147 -25.728 17.336 28.642 1.00 13.11 H new ATOM 0 HB THR A 147 -25.786 15.225 29.857 1.00 73.32 H new ATOM 0 HG1 THR A 147 -24.375 14.330 27.578 1.00 21.10 H new ATOM 0 HG21 THR A 147 -27.515 14.025 28.569 1.00 12.52 H new ATOM 0 HG22 THR A 147 -27.762 15.787 28.519 1.00 12.52 H new ATOM 0 HG23 THR A 147 -27.064 14.946 27.114 1.00 12.52 H new ATOM 2300 N TYR A 148 -22.741 16.080 28.092 1.00 25.22 N ATOM 2301 CA TYR A 148 -21.342 16.139 28.500 1.00 1.11 C ATOM 2302 C TYR A 148 -20.895 17.583 28.704 1.00 2.45 C ATOM 2303 O TYR A 148 -20.499 17.974 29.804 1.00 71.13 O ATOM 2304 CB TYR A 148 -20.455 15.462 27.454 1.00 3.02 C ATOM 2305 CG TYR A 148 -18.976 15.568 27.754 1.00 35.42 C ATOM 2306 CD1 TYR A 148 -18.489 15.332 29.034 1.00 45.24 C ATOM 2307 CD2 TYR A 148 -18.068 15.902 26.758 1.00 64.33 C ATOM 2308 CE1 TYR A 148 -17.139 15.428 29.312 1.00 1.42 C ATOM 2309 CE2 TYR A 148 -16.716 15.999 27.027 1.00 71.32 C ATOM 2310 CZ TYR A 148 -16.257 15.762 28.306 1.00 63.44 C ATOM 2311 OH TYR A 148 -14.911 15.857 28.579 1.00 74.02 O ATOM 0 H TYR A 148 -22.906 15.571 27.223 1.00 25.22 H new ATOM 0 HA TYR A 148 -21.244 15.610 29.448 1.00 1.11 H new ATOM 0 HB2 TYR A 148 -20.729 14.409 27.384 1.00 3.02 H new ATOM 0 HB3 TYR A 148 -20.652 15.908 26.479 1.00 3.02 H new ATOM 0 HD1 TYR A 148 -19.177 15.069 29.824 1.00 45.24 H new ATOM 0 HD2 TYR A 148 -18.425 16.089 25.756 1.00 64.33 H new ATOM 0 HE1 TYR A 148 -16.776 15.242 30.312 1.00 1.42 H new ATOM 0 HE2 TYR A 148 -16.023 16.259 26.241 1.00 71.32 H new ATOM 0 HH TYR A 148 -14.760 16.569 29.236 1.00 74.02 H new ATOM 2321 N LEU A 149 -20.961 18.373 27.638 1.00 33.31 N ATOM 2322 CA LEU A 149 -20.564 19.775 27.698 1.00 14.23 C ATOM 2323 C LEU A 149 -21.499 20.567 28.607 1.00 11.11 C ATOM 2324 O LEU A 149 -21.130 21.620 29.126 1.00 52.23 O ATOM 2325 CB LEU A 149 -20.561 20.385 26.296 1.00 44.34 C ATOM 2326 CG LEU A 149 -19.344 21.240 25.939 1.00 61.14 C ATOM 2327 CD1 LEU A 149 -19.119 22.314 26.991 1.00 1.22 C ATOM 2328 CD2 LEU A 149 -18.105 20.369 25.790 1.00 73.51 C ATOM 0 H LEU A 149 -21.286 18.066 26.721 1.00 33.31 H new ATOM 0 HA LEU A 149 -19.557 19.824 28.111 1.00 14.23 H new ATOM 0 HB2 LEU A 149 -20.638 19.576 25.569 1.00 44.34 H new ATOM 0 HB3 LEU A 149 -21.456 20.998 26.186 1.00 44.34 H new ATOM 0 HG LEU A 149 -19.536 21.730 24.984 1.00 61.14 H new ATOM 0 HD11 LEU A 149 -18.249 22.912 26.720 1.00 1.22 H new ATOM 0 HD12 LEU A 149 -19.998 22.957 27.049 1.00 1.22 H new ATOM 0 HD13 LEU A 149 -18.949 21.844 27.960 1.00 1.22 H new ATOM 0 HD21 LEU A 149 -17.249 20.994 25.536 1.00 73.51 H new ATOM 0 HD22 LEU A 149 -17.910 19.850 26.729 1.00 73.51 H new ATOM 0 HD23 LEU A 149 -18.268 19.637 24.998 1.00 73.51 H new ATOM 2340 N GLU A 150 -22.710 20.051 28.796 1.00 4.15 N ATOM 2341 CA GLU A 150 -23.696 20.710 29.644 1.00 11.22 C ATOM 2342 C GLU A 150 -23.208 20.788 31.088 1.00 61.31 C ATOM 2343 O GLU A 150 -23.280 21.839 31.725 1.00 54.03 O ATOM 2344 CB GLU A 150 -25.031 19.965 29.585 1.00 12.21 C ATOM 2345 CG GLU A 150 -26.238 20.859 29.818 1.00 62.03 C ATOM 2346 CD GLU A 150 -26.016 21.860 30.935 1.00 44.13 C ATOM 2347 OE1 GLU A 150 -26.114 21.465 32.115 1.00 71.50 O ATOM 2348 OE2 GLU A 150 -25.743 23.040 30.628 1.00 62.42 O ATOM 0 H GLU A 150 -23.031 19.180 28.374 1.00 4.15 H new ATOM 0 HA GLU A 150 -23.837 21.725 29.272 1.00 11.22 H new ATOM 0 HB2 GLU A 150 -25.127 19.486 28.611 1.00 12.21 H new ATOM 0 HB3 GLU A 150 -25.028 19.171 30.332 1.00 12.21 H new ATOM 0 HG2 GLU A 150 -26.472 21.394 28.897 1.00 62.03 H new ATOM 0 HG3 GLU A 150 -27.103 20.240 30.056 1.00 62.03 H new ATOM 2355 N LYS A 151 -22.711 19.667 31.599 1.00 23.40 N ATOM 2356 CA LYS A 151 -22.209 19.605 32.967 1.00 54.11 C ATOM 2357 C LYS A 151 -20.719 19.927 33.015 1.00 31.22 C ATOM 2358 O LYS A 151 -20.165 20.187 34.083 1.00 2.13 O ATOM 2359 CB LYS A 151 -22.462 18.218 33.563 1.00 51.33 C ATOM 2360 CG LYS A 151 -23.804 18.092 34.262 1.00 13.45 C ATOM 2361 CD LYS A 151 -23.985 16.715 34.878 1.00 11.01 C ATOM 2362 CE LYS A 151 -24.848 15.821 34.001 1.00 53.43 C ATOM 2363 NZ LYS A 151 -24.058 15.182 32.913 1.00 63.31 N ATOM 0 H LYS A 151 -22.645 18.788 31.086 1.00 23.40 H new ATOM 0 HA LYS A 151 -22.743 20.350 33.557 1.00 54.11 H new ATOM 0 HB2 LYS A 151 -22.405 17.474 32.768 1.00 51.33 H new ATOM 0 HB3 LYS A 151 -21.669 17.987 34.274 1.00 51.33 H new ATOM 0 HG2 LYS A 151 -23.883 18.852 35.039 1.00 13.45 H new ATOM 0 HG3 LYS A 151 -24.606 18.281 33.548 1.00 13.45 H new ATOM 0 HD2 LYS A 151 -23.010 16.250 35.025 1.00 11.01 H new ATOM 0 HD3 LYS A 151 -24.443 16.813 35.862 1.00 11.01 H new ATOM 0 HE2 LYS A 151 -25.312 15.049 34.615 1.00 53.43 H new ATOM 0 HE3 LYS A 151 -25.656 16.410 33.566 1.00 53.43 H new ATOM 0 HZ1 LYS A 151 -24.631 14.444 32.456 1.00 63.31 H new ATOM 0 HZ2 LYS A 151 -23.792 15.900 32.209 1.00 63.31 H new ATOM 0 HZ3 LYS A 151 -23.198 14.755 33.313 1.00 63.31 H new ATOM 2377 N TYR A 152 -20.077 19.909 31.853 1.00 62.43 N ATOM 2378 CA TYR A 152 -18.650 20.198 31.763 1.00 74.40 C ATOM 2379 C TYR A 152 -18.402 21.702 31.699 1.00 32.51 C ATOM 2380 O TYR A 152 -19.231 22.458 31.192 1.00 30.32 O ATOM 2381 CB TYR A 152 -18.047 19.517 30.533 1.00 12.10 C ATOM 2382 CG TYR A 152 -16.535 19.518 30.521 1.00 33.11 C ATOM 2383 CD1 TYR A 152 -15.824 20.654 30.154 1.00 32.33 C ATOM 2384 CD2 TYR A 152 -15.818 18.383 30.878 1.00 62.44 C ATOM 2385 CE1 TYR A 152 -14.443 20.658 30.141 1.00 1.53 C ATOM 2386 CE2 TYR A 152 -14.436 18.379 30.869 1.00 73.31 C ATOM 2387 CZ TYR A 152 -13.754 19.519 30.500 1.00 65.25 C ATOM 2388 OH TYR A 152 -12.377 19.520 30.489 1.00 35.02 O ATOM 0 H TYR A 152 -20.522 19.697 30.960 1.00 62.43 H new ATOM 0 HA TYR A 152 -18.168 19.807 32.659 1.00 74.40 H new ATOM 0 HB2 TYR A 152 -18.402 18.487 30.488 1.00 12.10 H new ATOM 0 HB3 TYR A 152 -18.410 20.019 29.636 1.00 12.10 H new ATOM 0 HD1 TYR A 152 -16.360 21.549 29.874 1.00 32.33 H new ATOM 0 HD2 TYR A 152 -16.350 17.489 31.167 1.00 62.44 H new ATOM 0 HE1 TYR A 152 -13.906 21.549 29.851 1.00 1.53 H new ATOM 0 HE2 TYR A 152 -13.894 17.488 31.149 1.00 73.31 H new ATOM 0 HH TYR A 152 -12.047 18.641 30.769 1.00 35.02 H new ATOM 2398 N ARG A 153 -17.255 22.128 32.217 1.00 63.35 N ATOM 2399 CA ARG A 153 -16.896 23.541 32.220 1.00 70.24 C ATOM 2400 C ARG A 153 -15.576 23.768 31.489 1.00 51.24 C ATOM 2401 O ARG A 153 -14.596 23.050 31.688 1.00 1.31 O ATOM 2402 CB ARG A 153 -16.792 24.059 33.655 1.00 14.50 C ATOM 2403 CG ARG A 153 -15.416 23.872 34.272 1.00 11.23 C ATOM 2404 CD ARG A 153 -14.505 25.052 33.971 1.00 13.23 C ATOM 2405 NE ARG A 153 -13.561 25.305 35.056 1.00 1.41 N ATOM 2406 CZ ARG A 153 -12.566 24.484 35.371 1.00 62.40 C ATOM 2407 NH1 ARG A 153 -12.386 23.362 34.687 1.00 51.21 N ATOM 2408 NH2 ARG A 153 -11.748 24.783 36.372 1.00 43.32 N ATOM 0 H ARG A 153 -16.558 21.515 32.640 1.00 63.35 H new ATOM 0 HA ARG A 153 -17.680 24.091 31.698 1.00 70.24 H new ATOM 0 HB2 ARG A 153 -17.046 25.119 33.669 1.00 14.50 H new ATOM 0 HB3 ARG A 153 -17.530 23.546 34.272 1.00 14.50 H new ATOM 0 HG2 ARG A 153 -15.513 23.752 35.351 1.00 11.23 H new ATOM 0 HG3 ARG A 153 -14.966 22.956 33.889 1.00 11.23 H new ATOM 0 HD2 ARG A 153 -13.955 24.860 33.050 1.00 13.23 H new ATOM 0 HD3 ARG A 153 -15.110 25.943 33.801 1.00 13.23 H new ATOM 0 HE ARG A 153 -13.672 26.159 35.602 1.00 1.41 H new ATOM 0 HH11 ARG A 153 -13.013 23.128 33.917 1.00 51.21 H new ATOM 0 HH12 ARG A 153 -11.621 22.733 34.931 1.00 51.21 H new ATOM 0 HH21 ARG A 153 -11.883 25.645 36.901 1.00 43.32 H new ATOM 0 HH22 ARG A 153 -10.984 24.151 36.613 1.00 43.32 H new ATOM 2422 N PRO A 154 -15.548 24.791 30.621 1.00 74.42 N ATOM 2423 CA PRO A 154 -14.355 25.136 29.843 1.00 52.34 C ATOM 2424 C PRO A 154 -13.244 25.716 30.712 1.00 73.14 C ATOM 2425 O PRO A 154 -13.417 26.757 31.346 1.00 41.02 O ATOM 2426 CB PRO A 154 -14.867 26.189 28.857 1.00 55.42 C ATOM 2427 CG PRO A 154 -16.052 26.793 29.529 1.00 10.00 C ATOM 2428 CD PRO A 154 -16.680 25.688 30.333 1.00 42.12 C ATOM 0 HA PRO A 154 -13.914 24.262 29.364 1.00 52.34 H new ATOM 0 HB2 PRO A 154 -14.105 26.940 28.648 1.00 55.42 H new ATOM 0 HB3 PRO A 154 -15.140 25.738 27.903 1.00 55.42 H new ATOM 0 HG2 PRO A 154 -15.756 27.623 30.171 1.00 10.00 H new ATOM 0 HG3 PRO A 154 -16.755 27.191 28.797 1.00 10.00 H new ATOM 0 HD2 PRO A 154 -17.136 26.066 31.248 1.00 42.12 H new ATOM 0 HD3 PRO A 154 -17.464 25.179 29.773 1.00 42.12 H new ATOM 2436 N LYS A 155 -12.103 25.036 30.736 1.00 31.13 N ATOM 2437 CA LYS A 155 -10.962 25.483 31.526 1.00 11.51 C ATOM 2438 C LYS A 155 -10.102 26.463 30.733 1.00 33.14 C ATOM 2439 O LYS A 155 -9.052 26.901 31.203 1.00 73.42 O ATOM 2440 CB LYS A 155 -10.117 24.285 31.964 1.00 40.03 C ATOM 2441 CG LYS A 155 -9.095 23.850 30.927 1.00 14.22 C ATOM 2442 CD LYS A 155 -8.494 22.498 31.270 1.00 24.24 C ATOM 2443 CE LYS A 155 -7.520 22.600 32.435 1.00 54.32 C ATOM 2444 NZ LYS A 155 -6.802 21.318 32.672 1.00 60.53 N ATOM 0 H LYS A 155 -11.944 24.173 30.217 1.00 31.13 H new ATOM 0 HA LYS A 155 -11.342 25.994 32.411 1.00 11.51 H new ATOM 0 HB2 LYS A 155 -9.599 24.535 32.890 1.00 40.03 H new ATOM 0 HB3 LYS A 155 -10.777 23.447 32.185 1.00 40.03 H new ATOM 0 HG2 LYS A 155 -9.569 23.800 29.947 1.00 14.22 H new ATOM 0 HG3 LYS A 155 -8.302 24.595 30.861 1.00 14.22 H new ATOM 0 HD2 LYS A 155 -9.291 21.798 31.521 1.00 24.24 H new ATOM 0 HD3 LYS A 155 -7.979 22.096 30.398 1.00 24.24 H new ATOM 0 HE2 LYS A 155 -6.796 23.390 32.235 1.00 54.32 H new ATOM 0 HE3 LYS A 155 -8.061 22.885 33.337 1.00 54.32 H new ATOM 0 HZ1 LYS A 155 -6.148 21.429 33.473 1.00 60.53 H new ATOM 0 HZ2 LYS A 155 -7.491 20.569 32.888 1.00 60.53 H new ATOM 0 HZ3 LYS A 155 -6.264 21.059 31.820 1.00 60.53 H new ATOM 2458 N GLN A 156 -10.556 26.803 29.531 1.00 30.23 N ATOM 2459 CA GLN A 156 -9.828 27.731 28.675 1.00 43.41 C ATOM 2460 C GLN A 156 -8.471 27.158 28.280 1.00 60.43 C ATOM 2461 O GLN A 156 -7.431 27.617 28.751 1.00 23.15 O ATOM 2462 CB GLN A 156 -9.640 29.073 29.385 1.00 1.03 C ATOM 2463 CG GLN A 156 -10.906 29.595 30.044 1.00 34.15 C ATOM 2464 CD GLN A 156 -10.937 29.336 31.538 1.00 63.52 C ATOM 2465 OE1 GLN A 156 -9.906 29.792 32.239 1.00 52.14 O flip ATOM 2466 NE2 GLN A 156 -11.876 28.731 32.056 1.00 2.12 N flip ATOM 0 H GLN A 156 -11.424 26.450 29.128 1.00 30.23 H new ATOM 0 HA GLN A 156 -10.414 27.886 27.769 1.00 43.41 H new ATOM 0 HB2 GLN A 156 -8.863 28.968 30.142 1.00 1.03 H new ATOM 0 HB3 GLN A 156 -9.285 29.810 28.664 1.00 1.03 H new ATOM 0 HG2 GLN A 156 -10.990 30.667 29.863 1.00 34.15 H new ATOM 0 HG3 GLN A 156 -11.773 29.125 29.580 1.00 34.15 H new ATOM 0 HE21 GLN A 156 -12.648 28.398 31.479 1.00 2.12 H new ATOM 0 HE22 GLN A 156 -11.881 28.563 33.062 1.00 2.12 H new ATOM 2475 N ARG A 157 -8.490 26.151 27.412 1.00 42.32 N ATOM 2476 CA ARG A 157 -7.261 25.514 26.955 1.00 60.24 C ATOM 2477 C ARG A 157 -6.840 26.058 25.592 1.00 34.05 C ATOM 2478 O ARG A 157 -5.682 26.425 25.389 1.00 14.23 O ATOM 2479 CB ARG A 157 -7.447 23.997 26.875 1.00 53.55 C ATOM 2480 CG ARG A 157 -8.600 23.572 25.980 1.00 31.11 C ATOM 2481 CD ARG A 157 -9.239 22.282 26.471 1.00 52.22 C ATOM 2482 NE ARG A 157 -9.920 22.461 27.750 1.00 13.12 N ATOM 2483 CZ ARG A 157 -10.375 21.454 28.488 1.00 5.20 C ATOM 2484 NH1 ARG A 157 -10.220 20.204 28.076 1.00 74.53 N ATOM 2485 NH2 ARG A 157 -10.984 21.697 29.641 1.00 1.44 N ATOM 0 H ARG A 157 -9.342 25.759 27.012 1.00 42.32 H new ATOM 0 HA ARG A 157 -6.475 25.740 27.676 1.00 60.24 H new ATOM 0 HB2 ARG A 157 -6.526 23.545 26.506 1.00 53.55 H new ATOM 0 HB3 ARG A 157 -7.614 23.606 27.879 1.00 53.55 H new ATOM 0 HG2 ARG A 157 -9.350 24.363 25.950 1.00 31.11 H new ATOM 0 HG3 ARG A 157 -8.240 23.436 24.960 1.00 31.11 H new ATOM 0 HD2 ARG A 157 -9.952 21.925 25.728 1.00 52.22 H new ATOM 0 HD3 ARG A 157 -8.473 21.514 26.573 1.00 52.22 H new ATOM 0 HE ARG A 157 -10.054 23.411 28.096 1.00 13.12 H new ATOM 0 HH11 ARG A 157 -9.751 20.013 27.191 1.00 74.53 H new ATOM 0 HH12 ARG A 157 -10.570 19.433 28.644 1.00 74.53 H new ATOM 0 HH21 ARG A 157 -11.104 22.658 29.962 1.00 1.44 H new ATOM 0 HH22 ARG A 157 -11.333 20.923 30.207 1.00 1.44 H new ATOM 2499 N LEU A 158 -7.788 26.106 24.663 1.00 42.45 N ATOM 2500 CA LEU A 158 -7.516 26.605 23.319 1.00 51.22 C ATOM 2501 C LEU A 158 -7.708 28.117 23.250 1.00 60.10 C ATOM 2502 O LEU A 158 -7.148 28.785 22.381 1.00 63.34 O ATOM 2503 CB LEU A 158 -8.430 25.917 22.303 1.00 21.15 C ATOM 2504 CG LEU A 158 -7.773 24.855 21.421 1.00 31.21 C ATOM 2505 CD1 LEU A 158 -6.671 25.472 20.574 1.00 71.31 C ATOM 2506 CD2 LEU A 158 -7.222 23.720 22.273 1.00 40.44 C ATOM 0 H LEU A 158 -8.751 25.806 24.815 1.00 42.45 H new ATOM 0 HA LEU A 158 -6.478 26.377 23.077 1.00 51.22 H new ATOM 0 HB2 LEU A 158 -9.255 25.453 22.843 1.00 21.15 H new ATOM 0 HB3 LEU A 158 -8.862 26.681 21.657 1.00 21.15 H new ATOM 0 HG LEU A 158 -8.531 24.446 20.753 1.00 31.21 H new ATOM 0 HD11 LEU A 158 -6.215 24.701 19.953 1.00 71.31 H new ATOM 0 HD12 LEU A 158 -7.094 26.249 19.937 1.00 71.31 H new ATOM 0 HD13 LEU A 158 -5.914 25.909 21.225 1.00 71.31 H new ATOM 0 HD21 LEU A 158 -6.758 22.973 21.628 1.00 40.44 H new ATOM 0 HD22 LEU A 158 -6.478 24.113 22.966 1.00 40.44 H new ATOM 0 HD23 LEU A 158 -8.034 23.260 22.835 1.00 40.44 H new ATOM 2518 N ARG A 159 -8.501 28.650 24.173 1.00 15.12 N ATOM 2519 CA ARG A 159 -8.766 30.083 24.218 1.00 53.02 C ATOM 2520 C ARG A 159 -9.714 30.425 25.363 1.00 13.34 C ATOM 2521 O ARG A 159 -10.003 29.586 26.216 1.00 21.53 O ATOM 2522 CB ARG A 159 -9.362 30.555 22.890 1.00 33.32 C ATOM 2523 CG ARG A 159 -8.585 31.689 22.242 1.00 22.33 C ATOM 2524 CD ARG A 159 -9.405 32.968 22.191 1.00 42.31 C ATOM 2525 NE ARG A 159 -8.961 33.860 21.123 1.00 51.20 N ATOM 2526 CZ ARG A 159 -7.802 34.509 21.141 1.00 30.22 C ATOM 2527 NH1 ARG A 159 -6.974 34.365 22.167 1.00 52.02 N ATOM 2528 NH2 ARG A 159 -7.469 35.303 20.132 1.00 62.24 N ATOM 0 H ARG A 159 -8.971 28.111 24.900 1.00 15.12 H new ATOM 0 HA ARG A 159 -7.820 30.597 24.387 1.00 53.02 H new ATOM 0 HB2 ARG A 159 -9.402 29.712 22.200 1.00 33.32 H new ATOM 0 HB3 ARG A 159 -10.389 30.879 23.057 1.00 33.32 H new ATOM 0 HG2 ARG A 159 -7.666 31.867 22.800 1.00 22.33 H new ATOM 0 HG3 ARG A 159 -8.294 31.401 21.232 1.00 22.33 H new ATOM 0 HD2 ARG A 159 -10.456 32.719 22.042 1.00 42.31 H new ATOM 0 HD3 ARG A 159 -9.332 33.484 23.148 1.00 42.31 H new ATOM 0 HE ARG A 159 -9.575 33.992 20.319 1.00 51.20 H new ATOM 0 HH11 ARG A 159 -7.227 33.755 22.944 1.00 52.02 H new ATOM 0 HH12 ARG A 159 -6.085 34.864 22.179 1.00 52.02 H new ATOM 0 HH21 ARG A 159 -8.103 35.416 19.341 1.00 62.24 H new ATOM 0 HH22 ARG A 159 -6.579 35.801 20.147 1.00 62.24 H new ATOM 2542 N PHE A 160 -10.195 31.664 25.377 1.00 52.14 N ATOM 2543 CA PHE A 160 -11.109 32.118 26.418 1.00 14.20 C ATOM 2544 C PHE A 160 -12.544 31.706 26.100 1.00 42.40 C ATOM 2545 O PHE A 160 -13.125 32.152 25.110 1.00 13.15 O ATOM 2546 CB PHE A 160 -11.026 33.638 26.573 1.00 45.25 C ATOM 2547 CG PHE A 160 -11.333 34.117 27.962 1.00 1.35 C ATOM 2548 CD1 PHE A 160 -10.377 34.044 28.962 1.00 24.43 C ATOM 2549 CD2 PHE A 160 -12.579 34.641 28.269 1.00 25.13 C ATOM 2550 CE1 PHE A 160 -10.656 34.484 30.242 1.00 30.03 C ATOM 2551 CE2 PHE A 160 -12.864 35.083 29.547 1.00 4.23 C ATOM 2552 CZ PHE A 160 -11.902 35.004 30.535 1.00 23.53 C ATOM 0 H PHE A 160 -9.967 32.372 24.679 1.00 52.14 H new ATOM 0 HA PHE A 160 -10.813 31.647 27.356 1.00 14.20 H new ATOM 0 HB2 PHE A 160 -10.025 33.969 26.296 1.00 45.25 H new ATOM 0 HB3 PHE A 160 -11.721 34.105 25.875 1.00 45.25 H new ATOM 0 HD1 PHE A 160 -9.401 33.638 28.738 1.00 24.43 H new ATOM 0 HD2 PHE A 160 -13.336 34.705 27.501 1.00 25.13 H new ATOM 0 HE1 PHE A 160 -9.901 34.421 31.012 1.00 30.03 H new ATOM 0 HE2 PHE A 160 -13.838 35.490 29.773 1.00 4.23 H new ATOM 0 HZ PHE A 160 -12.123 35.348 31.535 1.00 23.53 H new ATOM 2562 N LYS A 161 -13.109 30.852 26.946 1.00 60.20 N ATOM 2563 CA LYS A 161 -14.475 30.379 26.758 1.00 72.43 C ATOM 2564 C LYS A 161 -15.414 31.006 27.783 1.00 33.52 C ATOM 2565 O LYS A 161 -14.990 31.392 28.873 1.00 73.15 O ATOM 2566 CB LYS A 161 -14.528 28.853 26.867 1.00 11.15 C ATOM 2567 CG LYS A 161 -15.488 28.205 25.884 1.00 2.53 C ATOM 2568 CD LYS A 161 -16.921 28.262 26.385 1.00 53.22 C ATOM 2569 CE LYS A 161 -17.559 26.881 26.408 1.00 5.24 C ATOM 2570 NZ LYS A 161 -18.899 26.900 27.057 1.00 24.35 N ATOM 0 H LYS A 161 -12.641 30.473 27.769 1.00 60.20 H new ATOM 0 HA LYS A 161 -14.802 30.677 25.762 1.00 72.43 H new ATOM 0 HB2 LYS A 161 -13.528 28.451 26.704 1.00 11.15 H new ATOM 0 HB3 LYS A 161 -14.820 28.580 27.881 1.00 11.15 H new ATOM 0 HG2 LYS A 161 -15.418 28.709 24.920 1.00 2.53 H new ATOM 0 HG3 LYS A 161 -15.199 27.166 25.723 1.00 2.53 H new ATOM 0 HD2 LYS A 161 -16.940 28.690 27.387 1.00 53.22 H new ATOM 0 HD3 LYS A 161 -17.505 28.923 25.745 1.00 53.22 H new ATOM 0 HE2 LYS A 161 -17.655 26.508 25.388 1.00 5.24 H new ATOM 0 HE3 LYS A 161 -16.907 26.189 26.941 1.00 5.24 H new ATOM 0 HZ1 LYS A 161 -19.412 26.027 26.819 1.00 24.35 H new ATOM 0 HZ2 LYS A 161 -18.784 26.964 28.089 1.00 24.35 H new ATOM 0 HZ3 LYS A 161 -19.438 27.722 26.717 1.00 24.35 H new ATOM 2584 N ASP A 162 -16.691 31.102 27.428 1.00 22.13 N ATOM 2585 CA ASP A 162 -17.691 31.679 28.319 1.00 5.52 C ATOM 2586 C ASP A 162 -17.595 31.067 29.713 1.00 3.32 C ATOM 2587 O ASP A 162 -17.675 31.799 30.699 1.00 63.22 O ATOM 2588 CB ASP A 162 -19.095 31.467 27.751 1.00 44.32 C ATOM 2589 CG ASP A 162 -19.552 32.628 26.889 1.00 63.41 C ATOM 2590 OD1 ASP A 162 -19.040 32.764 25.757 1.00 14.35 O ATOM 2591 OD2 ASP A 162 -20.421 33.399 27.345 1.00 33.42 O ATOM 0 H ASP A 162 -17.058 30.788 26.530 1.00 22.13 H new ATOM 0 HA ASP A 162 -17.497 32.749 28.397 1.00 5.52 H new ATOM 0 HB2 ASP A 162 -19.110 30.551 27.160 1.00 44.32 H new ATOM 0 HB3 ASP A 162 -19.799 31.328 28.572 1.00 44.32 H new