USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 754 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 67 MET CE :methyl -133:sc= -0.74 (180deg=-0.936) USER MOD Set 1.2: A 111 MET CE :methyl -102:sc= -7.54! (180deg=-9.89!) USER MOD Single : A 4 LYS NZ :NH3+ -151:sc= -0.0382 (180deg=-0.537) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.726 K(o=-0.73,f=-2.1!) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.365 K(o=-0.37,f=-4.7!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -124:sc= -0.0442 (180deg=-1.5) USER MOD Single : A 70 THR OG1 : rot -66:sc= -0.421 USER MOD Single : A 72 SER OG : rot 69:sc= 1.05 USER MOD Single : A 74 ASN : amide:sc= -1.11 X(o=-1.1,f=-1.5) USER MOD Single : A 76 THR OG1 : rot 62:sc= -0.255 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -67:sc= 1.03 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 100:sc= -0.612 USER MOD Single : A 93 ASN : amide:sc= -1.26 K(o=-1.3,f=-1.9!) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 96 TYR OH : rot 180:sc= -0.0572 USER MOD Single : A 99 GLN :FLIP amide:sc= 0 F(o=-0.63,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc=-0.00758 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -168:sc= -0.0888 (180deg=-0.221) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -1.2 X(o=-1.2,f=-1.7!) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 31:sc= -0.449 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 3.542 4.322 -7.031 1.00 4.14 N ATOM 70 CA LYS A 4 4.913 4.722 -7.327 1.00 12.20 C ATOM 71 C LYS A 4 5.799 4.583 -6.093 1.00 62.35 C ATOM 72 O LYS A 4 6.277 5.576 -5.545 1.00 52.11 O ATOM 73 CB LYS A 4 4.946 6.167 -7.831 1.00 64.45 C ATOM 74 CG LYS A 4 4.042 6.415 -9.026 1.00 71.21 C ATOM 75 CD LYS A 4 3.037 7.520 -8.745 1.00 23.41 C ATOM 76 CE LYS A 4 3.724 8.865 -8.568 1.00 53.42 C ATOM 77 NZ LYS A 4 3.701 9.318 -7.150 1.00 33.45 N ATOM 0 HA LYS A 4 5.298 4.063 -8.105 1.00 12.20 H new ATOM 0 HB2 LYS A 4 4.652 6.833 -7.019 1.00 64.45 H new ATOM 0 HB3 LYS A 4 5.970 6.426 -8.101 1.00 64.45 H new ATOM 0 HG2 LYS A 4 4.647 6.684 -9.892 1.00 71.21 H new ATOM 0 HG3 LYS A 4 3.513 5.497 -9.280 1.00 71.21 H new ATOM 0 HD2 LYS A 4 2.322 7.580 -9.565 1.00 23.41 H new ATOM 0 HD3 LYS A 4 2.471 7.278 -7.846 1.00 23.41 H new ATOM 0 HE2 LYS A 4 4.757 8.793 -8.909 1.00 53.42 H new ATOM 0 HE3 LYS A 4 3.232 9.609 -9.195 1.00 53.42 H new ATOM 0 HZ1 LYS A 4 3.705 10.357 -7.118 1.00 33.45 H new ATOM 0 HZ2 LYS A 4 2.842 8.960 -6.685 1.00 33.45 H new ATOM 0 HZ3 LYS A 4 4.540 8.953 -6.655 1.00 33.45 H new ATOM 91 N ASP A 5 6.016 3.345 -5.663 1.00 71.34 N ATOM 92 CA ASP A 5 6.847 3.075 -4.496 1.00 3.30 C ATOM 93 C ASP A 5 8.243 2.625 -4.915 1.00 44.33 C ATOM 94 O ASP A 5 8.663 1.508 -4.612 1.00 71.14 O ATOM 95 CB ASP A 5 6.197 2.007 -3.615 1.00 52.43 C ATOM 96 CG ASP A 5 5.949 0.712 -4.363 1.00 43.24 C ATOM 97 OD1 ASP A 5 6.402 0.601 -5.522 1.00 22.44 O ATOM 98 OD2 ASP A 5 5.302 -0.190 -3.791 1.00 11.31 O ATOM 0 H ASP A 5 5.628 2.512 -6.106 1.00 71.34 H new ATOM 0 HA ASP A 5 6.938 3.999 -3.925 1.00 3.30 H new ATOM 0 HB2 ASP A 5 6.838 1.810 -2.756 1.00 52.43 H new ATOM 0 HB3 ASP A 5 5.251 2.386 -3.227 1.00 52.43 H new ATOM 103 N ILE A 6 8.957 3.502 -5.614 1.00 71.30 N ATOM 104 CA ILE A 6 10.305 3.194 -6.075 1.00 2.24 C ATOM 105 C ILE A 6 11.231 2.891 -4.902 1.00 20.25 C ATOM 106 O ILE A 6 10.825 2.967 -3.742 1.00 24.13 O ATOM 107 CB ILE A 6 10.898 4.355 -6.895 1.00 62.32 C ATOM 108 CG1 ILE A 6 11.129 5.575 -6.001 1.00 74.22 C ATOM 109 CG2 ILE A 6 9.979 4.707 -8.055 1.00 51.21 C ATOM 110 CD1 ILE A 6 11.724 6.757 -6.733 1.00 63.35 C ATOM 0 H ILE A 6 8.624 4.431 -5.873 1.00 71.30 H new ATOM 0 HA ILE A 6 10.227 2.312 -6.711 1.00 2.24 H new ATOM 0 HB ILE A 6 11.859 4.040 -7.301 1.00 62.32 H new ATOM 0 HG12 ILE A 6 10.180 5.874 -5.556 1.00 74.22 H new ATOM 0 HG13 ILE A 6 11.791 5.295 -5.182 1.00 74.22 H new ATOM 0 HG21 ILE A 6 10.411 5.529 -8.625 1.00 51.21 H new ATOM 0 HG22 ILE A 6 9.862 3.838 -8.703 1.00 51.21 H new ATOM 0 HG23 ILE A 6 9.004 5.006 -7.669 1.00 51.21 H new ATOM 0 HD11 ILE A 6 11.860 7.585 -6.037 1.00 63.35 H new ATOM 0 HD12 ILE A 6 12.689 6.475 -7.155 1.00 63.35 H new ATOM 0 HD13 ILE A 6 11.053 7.064 -7.535 1.00 63.35 H new ATOM 122 N ARG A 7 12.477 2.548 -5.212 1.00 1.35 N ATOM 123 CA ARG A 7 13.461 2.234 -4.183 1.00 4.00 C ATOM 124 C ARG A 7 14.150 3.501 -3.684 1.00 13.12 C ATOM 125 O ARG A 7 15.378 3.585 -3.662 1.00 32.13 O ATOM 126 CB ARG A 7 14.504 1.255 -4.727 1.00 13.14 C ATOM 127 CG ARG A 7 15.419 0.683 -3.656 1.00 50.42 C ATOM 128 CD ARG A 7 15.564 -0.824 -3.794 1.00 72.11 C ATOM 129 NE ARG A 7 15.794 -1.472 -2.506 1.00 12.04 N ATOM 130 CZ ARG A 7 14.861 -1.594 -1.568 1.00 20.42 C ATOM 131 NH1 ARG A 7 13.642 -1.116 -1.774 1.00 51.01 N ATOM 132 NH2 ARG A 7 15.147 -2.197 -0.421 1.00 31.13 N ATOM 0 H ARG A 7 12.829 2.481 -6.167 1.00 1.35 H new ATOM 0 HA ARG A 7 12.939 1.771 -3.346 1.00 4.00 H new ATOM 0 HB2 ARG A 7 13.992 0.435 -5.232 1.00 13.14 H new ATOM 0 HB3 ARG A 7 15.110 1.763 -5.477 1.00 13.14 H new ATOM 0 HG2 ARG A 7 16.400 1.152 -3.726 1.00 50.42 H new ATOM 0 HG3 ARG A 7 15.021 0.923 -2.670 1.00 50.42 H new ATOM 0 HD2 ARG A 7 14.663 -1.234 -4.251 1.00 72.11 H new ATOM 0 HD3 ARG A 7 16.393 -1.048 -4.466 1.00 72.11 H new ATOM 0 HE ARG A 7 16.721 -1.852 -2.316 1.00 12.04 H new ATOM 0 HH11 ARG A 7 13.418 -0.653 -2.655 1.00 51.01 H new ATOM 0 HH12 ARG A 7 12.928 -1.211 -1.052 1.00 51.01 H new ATOM 0 HH21 ARG A 7 16.084 -2.567 -0.259 1.00 31.13 H new ATOM 0 HH22 ARG A 7 14.430 -2.290 0.299 1.00 31.13 H new ATOM 146 N ASP A 8 13.350 4.484 -3.285 1.00 3.21 N ATOM 147 CA ASP A 8 13.882 5.747 -2.786 1.00 11.05 C ATOM 148 C ASP A 8 14.852 6.363 -3.789 1.00 31.01 C ATOM 149 O ASP A 8 15.765 7.098 -3.414 1.00 4.35 O ATOM 150 CB ASP A 8 14.584 5.534 -1.443 1.00 52.34 C ATOM 151 CG ASP A 8 13.828 4.581 -0.539 1.00 74.33 C ATOM 152 OD1 ASP A 8 12.662 4.879 -0.205 1.00 4.43 O ATOM 153 OD2 ASP A 8 14.401 3.536 -0.166 1.00 4.03 O ATOM 0 H ASP A 8 12.331 4.431 -3.297 1.00 3.21 H new ATOM 0 HA ASP A 8 13.048 6.434 -2.646 1.00 11.05 H new ATOM 0 HB2 ASP A 8 15.587 5.145 -1.618 1.00 52.34 H new ATOM 0 HB3 ASP A 8 14.698 6.494 -0.940 1.00 52.34 H new ATOM 158 N TYR A 9 14.648 6.057 -5.065 1.00 50.13 N ATOM 159 CA TYR A 9 15.507 6.578 -6.123 1.00 35.44 C ATOM 160 C TYR A 9 16.959 6.170 -5.895 1.00 40.30 C ATOM 161 O TYR A 9 17.680 6.805 -5.127 1.00 2.31 O ATOM 162 CB TYR A 9 15.398 8.102 -6.193 1.00 34.32 C ATOM 163 CG TYR A 9 16.480 8.748 -7.028 1.00 12.33 C ATOM 164 CD1 TYR A 9 16.420 8.726 -8.416 1.00 12.33 C ATOM 165 CD2 TYR A 9 17.563 9.380 -6.429 1.00 14.22 C ATOM 166 CE1 TYR A 9 17.406 9.315 -9.183 1.00 5.12 C ATOM 167 CE2 TYR A 9 18.553 9.973 -7.188 1.00 30.22 C ATOM 168 CZ TYR A 9 18.471 9.937 -8.564 1.00 53.52 C ATOM 169 OH TYR A 9 19.456 10.525 -9.324 1.00 0.42 O ATOM 0 H TYR A 9 13.896 5.451 -5.393 1.00 50.13 H new ATOM 0 HA TYR A 9 15.174 6.153 -7.070 1.00 35.44 H new ATOM 0 HB2 TYR A 9 14.425 8.370 -6.604 1.00 34.32 H new ATOM 0 HB3 TYR A 9 15.440 8.508 -5.182 1.00 34.32 H new ATOM 0 HD1 TYR A 9 15.588 8.240 -8.904 1.00 12.33 H new ATOM 0 HD2 TYR A 9 17.632 9.408 -5.352 1.00 14.22 H new ATOM 0 HE1 TYR A 9 17.344 9.289 -10.261 1.00 5.12 H new ATOM 0 HE2 TYR A 9 19.387 10.462 -6.706 1.00 30.22 H new ATOM 0 HH TYR A 9 20.132 10.919 -8.735 1.00 0.42 H new ATOM 179 N ASN A 10 17.381 5.106 -6.570 1.00 31.10 N ATOM 180 CA ASN A 10 18.747 4.612 -6.442 1.00 43.25 C ATOM 181 C ASN A 10 18.972 3.396 -7.336 1.00 41.44 C ATOM 182 O ASN A 10 19.620 3.491 -8.379 1.00 25.24 O ATOM 183 CB ASN A 10 19.047 4.251 -4.986 1.00 44.13 C ATOM 184 CG ASN A 10 19.972 5.252 -4.321 1.00 51.41 C ATOM 185 OD1 ASN A 10 20.801 5.881 -4.979 1.00 62.31 O ATOM 186 ND2 ASN A 10 19.833 5.405 -3.009 1.00 52.03 N ATOM 0 H ASN A 10 16.797 4.569 -7.211 1.00 31.10 H new ATOM 0 HA ASN A 10 19.424 5.405 -6.760 1.00 43.25 H new ATOM 0 HB2 ASN A 10 18.112 4.198 -4.428 1.00 44.13 H new ATOM 0 HB3 ASN A 10 19.499 3.260 -4.946 1.00 44.13 H new ATOM 0 HD21 ASN A 10 20.427 6.065 -2.507 1.00 52.03 H new ATOM 0 HD22 ASN A 10 19.132 4.863 -2.504 1.00 52.03 H new ATOM 193 N ASP A 11 18.431 2.256 -6.922 1.00 5.15 N ATOM 194 CA ASP A 11 18.571 1.021 -7.685 1.00 1.51 C ATOM 195 C ASP A 11 17.351 0.125 -7.496 1.00 64.11 C ATOM 196 O ASP A 11 17.473 -1.024 -7.071 1.00 52.52 O ATOM 197 CB ASP A 11 19.838 0.276 -7.262 1.00 71.13 C ATOM 198 CG ASP A 11 19.932 0.100 -5.759 1.00 41.34 C ATOM 199 OD1 ASP A 11 20.348 1.059 -5.076 1.00 21.45 O ATOM 200 OD2 ASP A 11 19.591 -0.996 -5.267 1.00 53.31 O ATOM 0 H ASP A 11 17.891 2.161 -6.062 1.00 5.15 H new ATOM 0 HA ASP A 11 18.648 1.281 -8.741 1.00 1.51 H new ATOM 0 HB2 ASP A 11 19.858 -0.703 -7.741 1.00 71.13 H new ATOM 0 HB3 ASP A 11 20.712 0.822 -7.616 1.00 71.13 H new ATOM 205 N ALA A 12 16.176 0.658 -7.814 1.00 3.41 N ATOM 206 CA ALA A 12 14.935 -0.093 -7.680 1.00 72.42 C ATOM 207 C ALA A 12 14.852 -1.205 -8.721 1.00 35.24 C ATOM 208 O ALA A 12 14.215 -2.234 -8.493 1.00 63.55 O ATOM 209 CB ALA A 12 13.738 0.838 -7.803 1.00 71.12 C ATOM 0 H ALA A 12 16.058 1.608 -8.166 1.00 3.41 H new ATOM 0 HA ALA A 12 14.923 -0.553 -6.692 1.00 72.42 H new ATOM 0 HB1 ALA A 12 12.818 0.263 -7.701 1.00 71.12 H new ATOM 0 HB2 ALA A 12 13.783 1.594 -7.019 1.00 71.12 H new ATOM 0 HB3 ALA A 12 13.755 1.325 -8.778 1.00 71.12 H new ATOM 215 N ASP A 13 15.497 -0.991 -9.862 1.00 1.24 N ATOM 216 CA ASP A 13 15.496 -1.975 -10.937 1.00 62.43 C ATOM 217 C ASP A 13 15.910 -3.349 -10.417 1.00 55.33 C ATOM 218 O ASP A 13 15.418 -4.375 -10.887 1.00 11.52 O ATOM 219 CB ASP A 13 16.438 -1.537 -12.060 1.00 11.32 C ATOM 220 CG ASP A 13 17.808 -1.141 -11.545 1.00 13.33 C ATOM 221 OD1 ASP A 13 17.929 -0.042 -10.964 1.00 14.41 O ATOM 222 OD2 ASP A 13 18.759 -1.930 -11.722 1.00 34.34 O ATOM 0 H ASP A 13 16.028 -0.144 -10.066 1.00 1.24 H new ATOM 0 HA ASP A 13 14.482 -2.045 -11.330 1.00 62.43 H new ATOM 0 HB2 ASP A 13 16.544 -2.349 -12.779 1.00 11.32 H new ATOM 0 HB3 ASP A 13 15.996 -0.695 -12.593 1.00 11.32 H new ATOM 227 N MET A 14 16.817 -3.360 -9.446 1.00 54.40 N ATOM 228 CA MET A 14 17.296 -4.607 -8.862 1.00 72.25 C ATOM 229 C MET A 14 16.134 -5.438 -8.326 1.00 3.45 C ATOM 230 O MET A 14 16.112 -6.659 -8.474 1.00 32.01 O ATOM 231 CB MET A 14 18.294 -4.320 -7.740 1.00 3.54 C ATOM 232 CG MET A 14 19.727 -4.167 -8.225 1.00 12.24 C ATOM 233 SD MET A 14 20.937 -4.679 -6.989 1.00 55.55 S ATOM 234 CE MET A 14 22.390 -4.902 -8.012 1.00 22.33 C ATOM 0 H MET A 14 17.235 -2.519 -9.047 1.00 54.40 H new ATOM 0 HA MET A 14 17.796 -5.177 -9.645 1.00 72.25 H new ATOM 0 HB2 MET A 14 17.995 -3.408 -7.223 1.00 3.54 H new ATOM 0 HB3 MET A 14 18.250 -5.129 -7.011 1.00 3.54 H new ATOM 0 HG2 MET A 14 19.865 -4.758 -9.130 1.00 12.24 H new ATOM 0 HG3 MET A 14 19.906 -3.126 -8.494 1.00 12.24 H new ATOM 0 HE1 MET A 14 23.227 -5.220 -7.391 1.00 22.33 H new ATOM 0 HE2 MET A 14 22.190 -5.662 -8.767 1.00 22.33 H new ATOM 0 HE3 MET A 14 22.638 -3.960 -8.501 1.00 22.33 H new ATOM 244 N ALA A 15 15.172 -4.767 -7.701 1.00 51.32 N ATOM 245 CA ALA A 15 14.007 -5.443 -7.144 1.00 1.00 C ATOM 246 C ALA A 15 13.328 -6.320 -8.191 1.00 4.31 C ATOM 247 O ALA A 15 12.735 -7.348 -7.863 1.00 43.33 O ATOM 248 CB ALA A 15 13.023 -4.426 -6.586 1.00 52.43 C ATOM 0 H ALA A 15 15.177 -3.756 -7.568 1.00 51.32 H new ATOM 0 HA ALA A 15 14.345 -6.087 -6.333 1.00 1.00 H new ATOM 0 HB1 ALA A 15 12.158 -4.945 -6.173 1.00 52.43 H new ATOM 0 HB2 ALA A 15 13.506 -3.845 -5.800 1.00 52.43 H new ATOM 0 HB3 ALA A 15 12.699 -3.758 -7.384 1.00 52.43 H new ATOM 254 N ARG A 16 13.419 -5.907 -9.451 1.00 11.52 N ATOM 255 CA ARG A 16 12.812 -6.654 -10.545 1.00 55.24 C ATOM 256 C ARG A 16 13.276 -8.107 -10.535 1.00 33.43 C ATOM 257 O ARG A 16 12.522 -9.014 -10.892 1.00 11.21 O ATOM 258 CB ARG A 16 13.158 -6.006 -11.887 1.00 64.43 C ATOM 259 CG ARG A 16 12.110 -6.237 -12.964 1.00 2.33 C ATOM 260 CD ARG A 16 12.227 -7.628 -13.567 1.00 3.32 C ATOM 261 NE ARG A 16 12.443 -7.582 -15.011 1.00 15.04 N ATOM 262 CZ ARG A 16 12.188 -8.601 -15.824 1.00 41.32 C ATOM 263 NH1 ARG A 16 11.712 -9.739 -15.338 1.00 54.52 N ATOM 264 NH2 ARG A 16 12.410 -8.482 -17.127 1.00 70.30 N ATOM 0 H ARG A 16 13.907 -5.059 -9.739 1.00 11.52 H new ATOM 0 HA ARG A 16 11.731 -6.635 -10.408 1.00 55.24 H new ATOM 0 HB2 ARG A 16 13.286 -4.933 -11.741 1.00 64.43 H new ATOM 0 HB3 ARG A 16 14.115 -6.397 -12.233 1.00 64.43 H new ATOM 0 HG2 ARG A 16 11.115 -6.106 -12.539 1.00 2.33 H new ATOM 0 HG3 ARG A 16 12.222 -5.489 -13.749 1.00 2.33 H new ATOM 0 HD2 ARG A 16 13.052 -8.160 -13.094 1.00 3.32 H new ATOM 0 HD3 ARG A 16 11.320 -8.193 -13.354 1.00 3.32 H new ATOM 0 HE ARG A 16 12.809 -6.721 -15.417 1.00 15.04 H new ATOM 0 HH11 ARG A 16 11.541 -9.834 -14.337 1.00 54.52 H new ATOM 0 HH12 ARG A 16 11.517 -10.520 -15.965 1.00 54.52 H new ATOM 0 HH21 ARG A 16 12.776 -7.608 -17.504 1.00 70.30 H new ATOM 0 HH22 ARG A 16 12.214 -9.265 -17.751 1.00 70.30 H new ATOM 278 N LEU A 17 14.520 -8.322 -10.124 1.00 25.45 N ATOM 279 CA LEU A 17 15.086 -9.666 -10.067 1.00 1.25 C ATOM 280 C LEU A 17 14.253 -10.569 -9.163 1.00 62.50 C ATOM 281 O LEU A 17 14.291 -11.794 -9.287 1.00 70.41 O ATOM 282 CB LEU A 17 16.529 -9.612 -9.562 1.00 43.13 C ATOM 283 CG LEU A 17 16.709 -9.566 -8.044 1.00 53.14 C ATOM 284 CD1 LEU A 17 16.809 -10.973 -7.476 1.00 12.11 C ATOM 285 CD2 LEU A 17 17.941 -8.752 -7.677 1.00 53.54 C ATOM 0 H LEU A 17 15.157 -7.583 -9.825 1.00 25.45 H new ATOM 0 HA LEU A 17 15.075 -10.081 -11.075 1.00 1.25 H new ATOM 0 HB2 LEU A 17 17.059 -10.484 -9.944 1.00 43.13 H new ATOM 0 HB3 LEU A 17 17.010 -8.733 -9.991 1.00 43.13 H new ATOM 0 HG LEU A 17 15.835 -9.081 -7.608 1.00 53.14 H new ATOM 0 HD11 LEU A 17 16.937 -10.921 -6.395 1.00 12.11 H new ATOM 0 HD12 LEU A 17 15.898 -11.524 -7.707 1.00 12.11 H new ATOM 0 HD13 LEU A 17 17.664 -11.484 -7.918 1.00 12.11 H new ATOM 0 HD21 LEU A 17 18.053 -8.730 -6.593 1.00 53.54 H new ATOM 0 HD22 LEU A 17 18.825 -9.208 -8.124 1.00 53.54 H new ATOM 0 HD23 LEU A 17 17.829 -7.734 -8.051 1.00 53.54 H new ATOM 297 N LEU A 18 13.500 -9.958 -8.256 1.00 2.24 N ATOM 298 CA LEU A 18 12.655 -10.707 -7.332 1.00 1.20 C ATOM 299 C LEU A 18 11.767 -11.693 -8.084 1.00 41.10 C ATOM 300 O LEU A 18 11.498 -12.792 -7.602 1.00 32.34 O ATOM 301 CB LEU A 18 11.791 -9.749 -6.510 1.00 31.23 C ATOM 302 CG LEU A 18 11.127 -10.343 -5.267 1.00 22.32 C ATOM 303 CD1 LEU A 18 11.992 -10.112 -4.038 1.00 23.34 C ATOM 304 CD2 LEU A 18 9.742 -9.747 -5.066 1.00 34.33 C ATOM 0 H LEU A 18 13.457 -8.946 -8.140 1.00 2.24 H new ATOM 0 HA LEU A 18 13.303 -11.270 -6.660 1.00 1.20 H new ATOM 0 HB2 LEU A 18 12.411 -8.908 -6.199 1.00 31.23 H new ATOM 0 HB3 LEU A 18 11.011 -9.348 -7.158 1.00 31.23 H new ATOM 0 HG LEU A 18 11.020 -11.418 -5.414 1.00 22.32 H new ATOM 0 HD11 LEU A 18 11.503 -10.541 -3.163 1.00 23.34 H new ATOM 0 HD12 LEU A 18 12.962 -10.587 -4.182 1.00 23.34 H new ATOM 0 HD13 LEU A 18 12.131 -9.042 -3.887 1.00 23.34 H new ATOM 0 HD21 LEU A 18 9.285 -10.181 -4.177 1.00 34.33 H new ATOM 0 HD22 LEU A 18 9.825 -8.667 -4.941 1.00 34.33 H new ATOM 0 HD23 LEU A 18 9.122 -9.965 -5.936 1.00 34.33 H new ATOM 316 N GLU A 19 11.317 -11.292 -9.269 1.00 4.20 N ATOM 317 CA GLU A 19 10.461 -12.142 -10.088 1.00 11.41 C ATOM 318 C GLU A 19 11.077 -13.527 -10.263 1.00 15.11 C ATOM 319 O GLU A 19 10.364 -14.520 -10.406 1.00 13.14 O ATOM 320 CB GLU A 19 10.226 -11.499 -11.457 1.00 21.24 C ATOM 321 CG GLU A 19 8.813 -11.688 -11.983 1.00 65.24 C ATOM 322 CD GLU A 19 8.397 -10.591 -12.944 1.00 24.20 C ATOM 323 OE1 GLU A 19 9.198 -9.659 -13.164 1.00 3.25 O ATOM 324 OE2 GLU A 19 7.270 -10.666 -13.476 1.00 41.14 O ATOM 0 H GLU A 19 11.531 -10.385 -9.683 1.00 4.20 H new ATOM 0 HA GLU A 19 9.504 -12.251 -9.577 1.00 11.41 H new ATOM 0 HB2 GLU A 19 10.440 -10.432 -11.390 1.00 21.24 H new ATOM 0 HB3 GLU A 19 10.931 -11.921 -12.173 1.00 21.24 H new ATOM 0 HG2 GLU A 19 8.742 -12.652 -12.486 1.00 65.24 H new ATOM 0 HG3 GLU A 19 8.117 -11.714 -11.144 1.00 65.24 H new ATOM 331 N GLN A 20 12.404 -13.584 -10.251 1.00 44.42 N ATOM 332 CA GLN A 20 13.116 -14.846 -10.410 1.00 30.41 C ATOM 333 C GLN A 20 12.633 -15.875 -9.393 1.00 0.03 C ATOM 334 O GLN A 20 12.694 -17.080 -9.637 1.00 44.12 O ATOM 335 CB GLN A 20 14.623 -14.630 -10.258 1.00 15.31 C ATOM 336 CG GLN A 20 15.456 -15.821 -10.701 1.00 43.03 C ATOM 337 CD GLN A 20 15.955 -16.651 -9.535 1.00 11.13 C ATOM 338 OE1 GLN A 20 15.258 -16.816 -8.533 1.00 23.30 O ATOM 339 NE2 GLN A 20 17.167 -17.178 -9.659 1.00 22.44 N ATOM 0 H GLN A 20 13.008 -12.771 -10.133 1.00 44.42 H new ATOM 0 HA GLN A 20 12.910 -15.226 -11.411 1.00 30.41 H new ATOM 0 HB2 GLN A 20 14.917 -13.756 -10.839 1.00 15.31 H new ATOM 0 HB3 GLN A 20 14.846 -14.409 -9.214 1.00 15.31 H new ATOM 0 HG2 GLN A 20 14.860 -16.451 -11.361 1.00 43.03 H new ATOM 0 HG3 GLN A 20 16.308 -15.468 -11.281 1.00 43.03 H new ATOM 0 HE21 GLN A 20 17.710 -17.015 -10.507 1.00 22.44 H new ATOM 0 HE22 GLN A 20 17.556 -17.746 -8.906 1.00 22.44 H new ATOM 348 N TRP A 21 12.154 -15.392 -8.252 1.00 52.43 N ATOM 349 CA TRP A 21 11.661 -16.270 -7.197 1.00 53.15 C ATOM 350 C TRP A 21 10.374 -16.966 -7.626 1.00 73.10 C ATOM 351 O TRP A 21 10.175 -18.148 -7.346 1.00 53.33 O ATOM 352 CB TRP A 21 11.421 -15.474 -5.913 1.00 64.23 C ATOM 353 CG TRP A 21 11.470 -16.317 -4.675 1.00 15.33 C ATOM 354 CD1 TRP A 21 12.500 -16.405 -3.783 1.00 1.21 C ATOM 355 CD2 TRP A 21 10.443 -17.191 -4.193 1.00 25.32 C ATOM 356 NE1 TRP A 21 12.176 -17.281 -2.776 1.00 25.54 N ATOM 357 CE2 TRP A 21 10.920 -17.777 -3.003 1.00 52.34 C ATOM 358 CE3 TRP A 21 9.168 -17.535 -4.649 1.00 22.22 C ATOM 359 CZ2 TRP A 21 10.165 -18.686 -2.268 1.00 21.53 C ATOM 360 CZ3 TRP A 21 8.420 -18.439 -3.918 1.00 5.53 C ATOM 361 CH2 TRP A 21 8.920 -19.005 -2.738 1.00 20.24 C ATOM 0 H TRP A 21 12.097 -14.397 -8.034 1.00 52.43 H new ATOM 0 HA TRP A 21 12.418 -17.031 -7.008 1.00 53.15 H new ATOM 0 HB2 TRP A 21 12.170 -14.686 -5.837 1.00 64.23 H new ATOM 0 HB3 TRP A 21 10.449 -14.985 -5.973 1.00 64.23 H new ATOM 0 HD1 TRP A 21 13.432 -15.865 -3.858 1.00 1.21 H new ATOM 0 HE1 TRP A 21 12.775 -17.523 -1.986 1.00 25.54 H new ATOM 0 HE3 TRP A 21 8.774 -17.102 -5.557 1.00 22.22 H new ATOM 0 HZ2 TRP A 21 10.548 -19.124 -1.358 1.00 21.53 H new ATOM 0 HZ3 TRP A 21 7.434 -18.713 -4.262 1.00 5.53 H new ATOM 0 HH2 TRP A 21 8.311 -19.707 -2.188 1.00 20.24 H new ATOM 372 N GLU A 22 9.504 -16.226 -8.306 1.00 54.11 N ATOM 373 CA GLU A 22 8.235 -16.774 -8.772 1.00 63.21 C ATOM 374 C GLU A 22 8.457 -18.058 -9.567 1.00 12.11 C ATOM 375 O GLU A 22 7.998 -19.131 -9.176 1.00 35.22 O ATOM 376 CB GLU A 22 7.497 -15.748 -9.635 1.00 30.44 C ATOM 377 CG GLU A 22 7.207 -14.443 -8.913 1.00 53.02 C ATOM 378 CD GLU A 22 6.728 -14.657 -7.490 1.00 41.43 C ATOM 379 OE1 GLU A 22 5.898 -15.564 -7.273 1.00 4.03 O ATOM 380 OE2 GLU A 22 7.184 -13.916 -6.594 1.00 42.22 O ATOM 0 H GLU A 22 9.654 -15.246 -8.546 1.00 54.11 H new ATOM 0 HA GLU A 22 7.626 -17.008 -7.898 1.00 63.21 H new ATOM 0 HB2 GLU A 22 8.092 -15.538 -10.524 1.00 30.44 H new ATOM 0 HB3 GLU A 22 6.557 -16.182 -9.976 1.00 30.44 H new ATOM 0 HG2 GLU A 22 8.109 -13.831 -8.901 1.00 53.02 H new ATOM 0 HG3 GLU A 22 6.451 -13.886 -9.467 1.00 53.02 H new ATOM 387 N LYS A 23 9.164 -17.939 -10.686 1.00 34.52 N ATOM 388 CA LYS A 23 9.448 -19.089 -11.537 1.00 11.30 C ATOM 389 C LYS A 23 8.158 -19.786 -11.958 1.00 44.15 C ATOM 390 O LYS A 23 8.158 -20.978 -12.266 1.00 41.11 O ATOM 391 CB LYS A 23 10.359 -20.077 -10.806 1.00 64.35 C ATOM 392 CG LYS A 23 11.231 -20.903 -11.737 1.00 40.21 C ATOM 393 CD LYS A 23 12.629 -21.090 -11.172 1.00 1.21 C ATOM 394 CE LYS A 23 13.567 -19.983 -11.628 1.00 2.34 C ATOM 395 NZ LYS A 23 14.971 -20.462 -11.754 1.00 23.51 N ATOM 0 H LYS A 23 9.551 -17.058 -11.025 1.00 34.52 H new ATOM 0 HA LYS A 23 9.955 -18.731 -12.433 1.00 11.30 H new ATOM 0 HB2 LYS A 23 10.998 -19.527 -10.116 1.00 64.35 H new ATOM 0 HB3 LYS A 23 9.745 -20.748 -10.205 1.00 64.35 H new ATOM 0 HG2 LYS A 23 10.770 -21.877 -11.900 1.00 40.21 H new ATOM 0 HG3 LYS A 23 11.293 -20.413 -12.709 1.00 40.21 H new ATOM 0 HD2 LYS A 23 12.584 -21.104 -10.083 1.00 1.21 H new ATOM 0 HD3 LYS A 23 13.024 -22.056 -11.487 1.00 1.21 H new ATOM 0 HE2 LYS A 23 13.229 -19.593 -12.588 1.00 2.34 H new ATOM 0 HE3 LYS A 23 13.527 -19.158 -10.917 1.00 2.34 H new ATOM 0 HZ1 LYS A 23 15.579 -19.678 -12.067 1.00 23.51 H new ATOM 0 HZ2 LYS A 23 15.303 -20.811 -10.832 1.00 23.51 H new ATOM 0 HZ3 LYS A 23 15.014 -21.232 -12.451 1.00 23.51 H new ATOM 409 N ASP A 24 7.062 -19.035 -11.972 1.00 25.24 N ATOM 410 CA ASP A 24 5.767 -19.581 -12.358 1.00 55.21 C ATOM 411 C ASP A 24 5.742 -19.922 -13.845 1.00 21.13 C ATOM 412 O ASP A 24 4.965 -20.769 -14.285 1.00 35.24 O ATOM 413 CB ASP A 24 4.652 -18.585 -12.032 1.00 43.15 C ATOM 414 CG ASP A 24 3.834 -19.005 -10.827 1.00 63.02 C ATOM 415 OD1 ASP A 24 3.610 -20.222 -10.658 1.00 10.42 O ATOM 416 OD2 ASP A 24 3.418 -18.117 -10.054 1.00 33.23 O ATOM 0 H ASP A 24 7.045 -18.047 -11.720 1.00 25.24 H new ATOM 0 HA ASP A 24 5.603 -20.497 -11.791 1.00 55.21 H new ATOM 0 HB2 ASP A 24 5.088 -17.603 -11.847 1.00 43.15 H new ATOM 0 HB3 ASP A 24 3.995 -18.484 -12.896 1.00 43.15 H new ATOM 421 N ASP A 25 6.597 -19.257 -14.613 1.00 43.32 N ATOM 422 CA ASP A 25 6.674 -19.489 -16.051 1.00 21.42 C ATOM 423 C ASP A 25 5.319 -19.259 -16.712 1.00 12.52 C ATOM 424 O ASP A 25 4.873 -20.060 -17.533 1.00 32.32 O ATOM 425 CB ASP A 25 7.158 -20.913 -16.334 1.00 15.34 C ATOM 426 CG ASP A 25 8.575 -21.149 -15.852 1.00 4.13 C ATOM 427 OD1 ASP A 25 9.468 -20.359 -16.225 1.00 34.14 O ATOM 428 OD2 ASP A 25 8.793 -22.124 -15.102 1.00 60.33 O ATOM 0 H ASP A 25 7.247 -18.553 -14.264 1.00 43.32 H new ATOM 0 HA ASP A 25 7.388 -18.780 -16.471 1.00 21.42 H new ATOM 0 HB2 ASP A 25 6.489 -21.624 -15.849 1.00 15.34 H new ATOM 0 HB3 ASP A 25 7.105 -21.105 -17.406 1.00 15.34 H new ATOM 433 N ASP A 26 4.669 -18.159 -16.348 1.00 15.13 N ATOM 434 CA ASP A 26 3.364 -17.822 -16.905 1.00 73.23 C ATOM 435 C ASP A 26 3.506 -17.235 -18.306 1.00 4.31 C ATOM 436 O ASP A 26 2.589 -17.323 -19.123 1.00 2.43 O ATOM 437 CB ASP A 26 2.637 -16.831 -15.995 1.00 35.52 C ATOM 438 CG ASP A 26 1.724 -17.522 -15.000 1.00 3.42 C ATOM 439 OD1 ASP A 26 0.653 -18.008 -15.417 1.00 33.24 O ATOM 440 OD2 ASP A 26 2.082 -17.574 -13.804 1.00 73.31 O ATOM 0 H ASP A 26 5.025 -17.485 -15.670 1.00 15.13 H new ATOM 0 HA ASP A 26 2.778 -18.739 -16.972 1.00 73.23 H new ATOM 0 HB2 ASP A 26 3.371 -16.232 -15.456 1.00 35.52 H new ATOM 0 HB3 ASP A 26 2.051 -16.144 -16.605 1.00 35.52 H new ATOM 445 N ILE A 27 4.661 -16.635 -18.576 1.00 21.15 N ATOM 446 CA ILE A 27 4.923 -16.033 -19.877 1.00 22.40 C ATOM 447 C ILE A 27 6.332 -16.360 -20.360 1.00 61.32 C ATOM 448 O ILE A 27 7.258 -16.490 -19.560 1.00 60.34 O ATOM 449 CB ILE A 27 4.749 -14.504 -19.835 1.00 50.32 C ATOM 450 CG1 ILE A 27 3.380 -14.140 -19.258 1.00 33.05 C ATOM 451 CG2 ILE A 27 4.916 -13.913 -21.227 1.00 63.44 C ATOM 452 CD1 ILE A 27 2.221 -14.612 -20.108 1.00 13.45 C ATOM 0 H ILE A 27 5.430 -16.553 -17.911 1.00 21.15 H new ATOM 0 HA ILE A 27 4.196 -16.454 -20.572 1.00 22.40 H new ATOM 0 HB ILE A 27 5.519 -14.084 -19.188 1.00 50.32 H new ATOM 0 HG12 ILE A 27 3.288 -14.572 -18.261 1.00 33.05 H new ATOM 0 HG13 ILE A 27 3.319 -13.058 -19.144 1.00 33.05 H new ATOM 0 HG21 ILE A 27 4.790 -12.831 -21.181 1.00 63.44 H new ATOM 0 HG22 ILE A 27 5.912 -14.147 -21.604 1.00 63.44 H new ATOM 0 HG23 ILE A 27 4.166 -14.337 -21.895 1.00 63.44 H new ATOM 0 HD11 ILE A 27 1.282 -14.319 -19.638 1.00 13.45 H new ATOM 0 HD12 ILE A 27 2.288 -14.160 -21.098 1.00 13.45 H new ATOM 0 HD13 ILE A 27 2.257 -15.697 -20.202 1.00 13.45 H new ATOM 1035 N THR A 64 18.070 4.416 -24.407 1.00 1.20 N ATOM 1036 CA THR A 64 16.640 4.521 -24.147 1.00 72.43 C ATOM 1037 C THR A 64 16.174 3.431 -23.188 1.00 3.21 C ATOM 1038 O THR A 64 16.648 2.295 -23.245 1.00 54.51 O ATOM 1039 CB THR A 64 15.824 4.424 -25.450 1.00 52.51 C ATOM 1040 OG1 THR A 64 14.423 4.474 -25.156 1.00 23.42 O ATOM 1041 CG2 THR A 64 16.145 3.139 -26.197 1.00 24.55 C ATOM 0 HA THR A 64 16.472 5.498 -23.693 1.00 72.43 H new ATOM 0 HB THR A 64 16.092 5.269 -26.083 1.00 52.51 H new ATOM 0 HG1 THR A 64 13.911 4.414 -25.990 1.00 23.42 H new ATOM 0 HG21 THR A 64 15.556 3.094 -27.113 1.00 24.55 H new ATOM 0 HG22 THR A 64 17.206 3.118 -26.446 1.00 24.55 H new ATOM 0 HG23 THR A 64 15.903 2.282 -25.568 1.00 24.55 H new ATOM 1049 N LEU A 65 15.244 3.783 -22.307 1.00 42.22 N ATOM 1050 CA LEU A 65 14.713 2.834 -21.335 1.00 3.23 C ATOM 1051 C LEU A 65 13.218 2.620 -21.544 1.00 33.53 C ATOM 1052 O LEU A 65 12.430 3.563 -21.478 1.00 22.10 O ATOM 1053 CB LEU A 65 14.975 3.332 -19.912 1.00 33.30 C ATOM 1054 CG LEU A 65 14.505 4.754 -19.601 1.00 65.53 C ATOM 1055 CD1 LEU A 65 13.883 4.819 -18.215 1.00 53.35 C ATOM 1056 CD2 LEU A 65 15.664 5.734 -19.715 1.00 14.14 C ATOM 0 H LEU A 65 14.842 4.719 -22.246 1.00 42.22 H new ATOM 0 HA LEU A 65 15.221 1.880 -21.479 1.00 3.23 H new ATOM 0 HB2 LEU A 65 14.489 2.650 -19.215 1.00 33.30 H new ATOM 0 HB3 LEU A 65 16.046 3.275 -19.720 1.00 33.30 H new ATOM 0 HG LEU A 65 13.745 5.034 -20.331 1.00 65.53 H new ATOM 0 HD11 LEU A 65 13.554 5.838 -18.011 1.00 53.35 H new ATOM 0 HD12 LEU A 65 13.027 4.146 -18.168 1.00 53.35 H new ATOM 0 HD13 LEU A 65 14.621 4.520 -17.471 1.00 53.35 H new ATOM 0 HD21 LEU A 65 15.312 6.741 -19.491 1.00 14.14 H new ATOM 0 HD22 LEU A 65 16.446 5.457 -19.008 1.00 14.14 H new ATOM 0 HD23 LEU A 65 16.065 5.707 -20.728 1.00 14.14 H new ATOM 1068 N MET A 66 12.833 1.372 -21.794 1.00 5.12 N ATOM 1069 CA MET A 66 11.431 1.033 -22.009 1.00 4.31 C ATOM 1070 C MET A 66 11.190 -0.455 -21.778 1.00 21.03 C ATOM 1071 O MET A 66 11.703 -1.298 -22.513 1.00 41.22 O ATOM 1072 CB MET A 66 11.004 1.417 -23.427 1.00 14.03 C ATOM 1073 CG MET A 66 9.499 1.561 -23.590 1.00 21.15 C ATOM 1074 SD MET A 66 9.023 3.169 -24.251 1.00 13.22 S ATOM 1075 CE MET A 66 7.432 2.779 -24.976 1.00 11.42 C ATOM 0 H MET A 66 13.472 0.579 -21.853 1.00 5.12 H new ATOM 0 HA MET A 66 10.832 1.595 -21.292 1.00 4.31 H new ATOM 0 HB2 MET A 66 11.483 2.358 -23.700 1.00 14.03 H new ATOM 0 HB3 MET A 66 11.366 0.661 -24.124 1.00 14.03 H new ATOM 0 HG2 MET A 66 9.133 0.777 -24.253 1.00 21.15 H new ATOM 0 HG3 MET A 66 9.017 1.413 -22.624 1.00 21.15 H new ATOM 0 HE1 MET A 66 7.435 3.056 -26.030 1.00 11.42 H new ATOM 0 HE2 MET A 66 7.242 1.710 -24.882 1.00 11.42 H new ATOM 0 HE3 MET A 66 6.650 3.334 -24.457 1.00 11.42 H new ATOM 1085 N MET A 67 10.407 -0.771 -20.751 1.00 52.45 N ATOM 1086 CA MET A 67 10.098 -2.158 -20.425 1.00 15.21 C ATOM 1087 C MET A 67 8.778 -2.257 -19.666 1.00 52.53 C ATOM 1088 O MET A 67 8.555 -1.537 -18.692 1.00 61.31 O ATOM 1089 CB MET A 67 11.225 -2.772 -19.593 1.00 12.35 C ATOM 1090 CG MET A 67 12.321 -3.409 -20.431 1.00 4.14 C ATOM 1091 SD MET A 67 13.275 -4.633 -19.512 1.00 2.51 S ATOM 1092 CE MET A 67 14.912 -4.363 -20.188 1.00 72.31 C ATOM 0 H MET A 67 9.975 -0.086 -20.131 1.00 52.45 H new ATOM 0 HA MET A 67 10.002 -2.712 -21.359 1.00 15.21 H new ATOM 0 HB2 MET A 67 11.664 -1.998 -18.963 1.00 12.35 H new ATOM 0 HB3 MET A 67 10.805 -3.525 -18.926 1.00 12.35 H new ATOM 0 HG2 MET A 67 11.875 -3.883 -21.305 1.00 4.14 H new ATOM 0 HG3 MET A 67 12.991 -2.631 -20.797 1.00 4.14 H new ATOM 0 HE1 MET A 67 15.362 -5.322 -20.446 1.00 72.31 H new ATOM 0 HE2 MET A 67 14.839 -3.744 -21.082 1.00 72.31 H new ATOM 0 HE3 MET A 67 15.533 -3.859 -19.447 1.00 72.31 H new ATOM 1102 N PHE A 68 7.906 -3.151 -20.119 1.00 74.02 N ATOM 1103 CA PHE A 68 6.607 -3.342 -19.484 1.00 22.54 C ATOM 1104 C PHE A 68 6.353 -4.820 -19.200 1.00 61.10 C ATOM 1105 O PHE A 68 6.326 -5.644 -20.115 1.00 11.34 O ATOM 1106 CB PHE A 68 5.494 -2.783 -20.371 1.00 74.14 C ATOM 1107 CG PHE A 68 5.807 -1.431 -20.946 1.00 31.04 C ATOM 1108 CD1 PHE A 68 6.187 -0.385 -20.121 1.00 12.44 C ATOM 1109 CD2 PHE A 68 5.722 -1.207 -22.310 1.00 40.42 C ATOM 1110 CE1 PHE A 68 6.475 0.861 -20.646 1.00 72.34 C ATOM 1111 CE2 PHE A 68 6.009 0.037 -22.842 1.00 23.42 C ATOM 1112 CZ PHE A 68 6.387 1.071 -22.009 1.00 2.23 C ATOM 0 H PHE A 68 8.075 -3.755 -20.923 1.00 74.02 H new ATOM 0 HA PHE A 68 6.611 -2.803 -18.537 1.00 22.54 H new ATOM 0 HB2 PHE A 68 5.305 -3.481 -21.187 1.00 74.14 H new ATOM 0 HB3 PHE A 68 4.575 -2.717 -19.789 1.00 74.14 H new ATOM 0 HD1 PHE A 68 6.259 -0.545 -19.055 1.00 12.44 H new ATOM 0 HD2 PHE A 68 5.428 -2.013 -22.966 1.00 40.42 H new ATOM 0 HE1 PHE A 68 6.768 1.669 -19.992 1.00 72.34 H new ATOM 0 HE2 PHE A 68 5.938 0.199 -23.907 1.00 23.42 H new ATOM 0 HZ PHE A 68 6.614 2.043 -22.422 1.00 2.23 H new ATOM 1122 N VAL A 69 6.168 -5.149 -17.925 1.00 50.43 N ATOM 1123 CA VAL A 69 5.916 -6.526 -17.520 1.00 34.13 C ATOM 1124 C VAL A 69 4.903 -6.587 -16.382 1.00 33.21 C ATOM 1125 O VAL A 69 4.804 -5.664 -15.573 1.00 11.02 O ATOM 1126 CB VAL A 69 7.213 -7.227 -17.075 1.00 61.15 C ATOM 1127 CG1 VAL A 69 6.968 -8.711 -16.848 1.00 52.04 C ATOM 1128 CG2 VAL A 69 8.314 -7.011 -18.103 1.00 75.55 C ATOM 0 H VAL A 69 6.188 -4.480 -17.155 1.00 50.43 H new ATOM 0 HA VAL A 69 5.513 -7.043 -18.391 1.00 34.13 H new ATOM 0 HB VAL A 69 7.537 -6.789 -16.131 1.00 61.15 H new ATOM 0 HG11 VAL A 69 7.896 -9.189 -16.534 1.00 52.04 H new ATOM 0 HG12 VAL A 69 6.213 -8.841 -16.073 1.00 52.04 H new ATOM 0 HG13 VAL A 69 6.620 -9.168 -17.774 1.00 52.04 H new ATOM 0 HG21 VAL A 69 9.224 -7.513 -17.773 1.00 75.55 H new ATOM 0 HG22 VAL A 69 8.001 -7.421 -19.063 1.00 75.55 H new ATOM 0 HG23 VAL A 69 8.507 -5.944 -18.210 1.00 75.55 H new ATOM 1138 N THR A 70 4.151 -7.682 -16.324 1.00 54.15 N ATOM 1139 CA THR A 70 3.144 -7.864 -15.286 1.00 62.22 C ATOM 1140 C THR A 70 2.638 -9.302 -15.257 1.00 51.35 C ATOM 1141 O THR A 70 1.600 -9.617 -15.839 1.00 54.31 O ATOM 1142 CB THR A 70 1.948 -6.915 -15.490 1.00 44.21 C ATOM 1143 OG1 THR A 70 0.845 -7.335 -14.680 1.00 22.51 O ATOM 1144 CG2 THR A 70 1.527 -6.881 -16.951 1.00 62.25 C ATOM 0 H THR A 70 4.221 -8.456 -16.984 1.00 54.15 H new ATOM 0 HA THR A 70 3.625 -7.631 -14.336 1.00 62.22 H new ATOM 0 HB THR A 70 2.254 -5.912 -15.193 1.00 44.21 H new ATOM 0 HG1 THR A 70 0.520 -8.205 -14.995 1.00 22.51 H new ATOM 0 HG21 THR A 70 0.681 -6.204 -17.070 1.00 62.25 H new ATOM 0 HG22 THR A 70 2.360 -6.532 -17.562 1.00 62.25 H new ATOM 0 HG23 THR A 70 1.238 -7.883 -17.270 1.00 62.25 H new ATOM 1152 N VAL A 71 3.378 -10.171 -14.576 1.00 75.33 N ATOM 1153 CA VAL A 71 3.002 -11.576 -14.470 1.00 61.12 C ATOM 1154 C VAL A 71 3.895 -12.310 -13.476 1.00 11.12 C ATOM 1155 O VAL A 71 4.975 -11.833 -13.126 1.00 74.31 O ATOM 1156 CB VAL A 71 3.084 -12.284 -15.836 1.00 11.41 C ATOM 1157 CG1 VAL A 71 4.532 -12.563 -16.207 1.00 43.30 C ATOM 1158 CG2 VAL A 71 2.272 -13.570 -15.818 1.00 50.04 C ATOM 0 H VAL A 71 4.241 -9.927 -14.090 1.00 75.33 H new ATOM 0 HA VAL A 71 1.971 -11.602 -14.117 1.00 61.12 H new ATOM 0 HB VAL A 71 2.661 -11.625 -16.594 1.00 11.41 H new ATOM 0 HG11 VAL A 71 4.570 -13.063 -17.175 1.00 43.30 H new ATOM 0 HG12 VAL A 71 5.081 -11.623 -16.263 1.00 43.30 H new ATOM 0 HG13 VAL A 71 4.985 -13.203 -15.450 1.00 43.30 H new ATOM 0 HG21 VAL A 71 2.341 -14.057 -16.791 1.00 50.04 H new ATOM 0 HG22 VAL A 71 2.663 -14.237 -15.050 1.00 50.04 H new ATOM 0 HG23 VAL A 71 1.229 -13.339 -15.601 1.00 50.04 H new ATOM 1168 N SER A 72 3.437 -13.473 -13.024 1.00 11.01 N ATOM 1169 CA SER A 72 4.193 -14.272 -12.067 1.00 34.15 C ATOM 1170 C SER A 72 5.155 -15.214 -12.784 1.00 52.45 C ATOM 1171 O SER A 72 4.739 -16.062 -13.572 1.00 31.52 O ATOM 1172 CB SER A 72 3.241 -15.077 -11.179 1.00 4.35 C ATOM 1173 OG SER A 72 2.174 -15.621 -11.936 1.00 2.42 O ATOM 0 H SER A 72 2.546 -13.883 -13.305 1.00 11.01 H new ATOM 0 HA SER A 72 4.775 -13.593 -11.444 1.00 34.15 H new ATOM 0 HB2 SER A 72 3.789 -15.881 -10.688 1.00 4.35 H new ATOM 0 HB3 SER A 72 2.843 -14.436 -10.392 1.00 4.35 H new ATOM 0 HG SER A 72 2.517 -16.325 -12.526 1.00 2.42 H new ATOM 1179 N GLY A 73 6.445 -15.056 -12.506 1.00 45.21 N ATOM 1180 CA GLY A 73 7.448 -15.898 -13.133 1.00 12.42 C ATOM 1181 C GLY A 73 8.175 -15.192 -14.260 1.00 2.31 C ATOM 1182 O GLY A 73 7.606 -14.960 -15.325 1.00 51.44 O ATOM 0 H GLY A 73 6.814 -14.360 -11.858 1.00 45.21 H new ATOM 0 HA2 GLY A 73 8.171 -16.217 -12.382 1.00 12.42 H new ATOM 0 HA3 GLY A 73 6.972 -16.799 -13.520 1.00 12.42 H new ATOM 1186 N ASN A 74 9.437 -14.848 -14.024 1.00 2.01 N ATOM 1187 CA ASN A 74 10.243 -14.162 -15.027 1.00 51.14 C ATOM 1188 C ASN A 74 11.694 -14.044 -14.572 1.00 43.00 C ATOM 1189 O ASN A 74 12.164 -12.974 -14.185 1.00 24.15 O ATOM 1190 CB ASN A 74 9.670 -12.771 -15.308 1.00 21.21 C ATOM 1191 CG ASN A 74 8.796 -12.745 -16.547 1.00 32.03 C ATOM 1192 OD1 ASN A 74 7.606 -12.436 -16.474 1.00 44.42 O ATOM 1193 ND2 ASN A 74 9.383 -13.071 -17.692 1.00 62.12 N ATOM 0 H ASN A 74 9.923 -15.033 -13.147 1.00 2.01 H new ATOM 0 HA ASN A 74 10.215 -14.751 -15.944 1.00 51.14 H new ATOM 0 HB2 ASN A 74 9.087 -12.441 -14.448 1.00 21.21 H new ATOM 0 HB3 ASN A 74 10.489 -12.062 -15.429 1.00 21.21 H new ATOM 0 HD21 ASN A 74 8.845 -13.072 -18.559 1.00 62.12 H new ATOM 0 HD22 ASN A 74 10.372 -13.320 -17.705 1.00 62.12 H new ATOM 1200 N PRO A 75 12.423 -15.169 -14.620 1.00 34.33 N ATOM 1201 CA PRO A 75 13.831 -15.218 -14.217 1.00 63.11 C ATOM 1202 C PRO A 75 14.739 -14.473 -15.190 1.00 74.44 C ATOM 1203 O PRO A 75 15.074 -14.985 -16.259 1.00 73.13 O ATOM 1204 CB PRO A 75 14.151 -16.715 -14.227 1.00 23.05 C ATOM 1205 CG PRO A 75 13.180 -17.304 -15.190 1.00 52.12 C ATOM 1206 CD PRO A 75 11.927 -16.481 -15.071 1.00 2.42 C ATOM 0 HA PRO A 75 13.995 -14.739 -13.252 1.00 63.11 H new ATOM 0 HB2 PRO A 75 15.179 -16.898 -14.540 1.00 23.05 H new ATOM 0 HB3 PRO A 75 14.038 -17.151 -13.234 1.00 23.05 H new ATOM 0 HG2 PRO A 75 13.572 -17.274 -16.207 1.00 52.12 H new ATOM 0 HG3 PRO A 75 12.983 -18.350 -14.955 1.00 52.12 H new ATOM 0 HD2 PRO A 75 11.403 -16.407 -16.024 1.00 2.42 H new ATOM 0 HD3 PRO A 75 11.228 -16.914 -14.356 1.00 2.42 H new ATOM 1214 N THR A 76 15.134 -13.261 -14.814 1.00 64.22 N ATOM 1215 CA THR A 76 16.002 -12.446 -15.654 1.00 44.30 C ATOM 1216 C THR A 76 16.799 -11.450 -14.818 1.00 62.53 C ATOM 1217 O THR A 76 16.913 -10.278 -15.175 1.00 32.32 O ATOM 1218 CB THR A 76 15.195 -11.676 -16.716 1.00 71.13 C ATOM 1219 OG1 THR A 76 14.013 -11.122 -16.127 1.00 4.21 O ATOM 1220 CG2 THR A 76 14.811 -12.589 -17.871 1.00 23.31 C ATOM 0 H THR A 76 14.866 -12.822 -13.933 1.00 64.22 H new ATOM 0 HA THR A 76 16.689 -13.129 -16.154 1.00 44.30 H new ATOM 0 HB THR A 76 15.820 -10.871 -17.102 1.00 71.13 H new ATOM 0 HG1 THR A 76 14.265 -10.484 -15.427 1.00 4.21 H new ATOM 0 HG21 THR A 76 14.242 -12.023 -18.608 1.00 23.31 H new ATOM 0 HG22 THR A 76 15.713 -12.986 -18.336 1.00 23.31 H new ATOM 0 HG23 THR A 76 14.203 -13.412 -17.497 1.00 23.31 H new ATOM 1228 N GLU A 77 17.349 -11.926 -13.705 1.00 44.04 N ATOM 1229 CA GLU A 77 18.136 -11.076 -12.819 1.00 51.13 C ATOM 1230 C GLU A 77 19.216 -10.330 -13.598 1.00 55.20 C ATOM 1231 O GLU A 77 19.601 -9.218 -13.237 1.00 41.54 O ATOM 1232 CB GLU A 77 18.777 -11.913 -11.710 1.00 44.54 C ATOM 1233 CG GLU A 77 19.611 -13.073 -12.228 1.00 54.11 C ATOM 1234 CD GLU A 77 21.069 -12.970 -11.825 1.00 52.54 C ATOM 1235 OE1 GLU A 77 21.340 -12.561 -10.677 1.00 43.43 O ATOM 1236 OE2 GLU A 77 21.939 -13.298 -12.659 1.00 74.22 O ATOM 0 H GLU A 77 17.264 -12.894 -13.396 1.00 44.04 H new ATOM 0 HA GLU A 77 17.465 -10.343 -12.370 1.00 51.13 H new ATOM 0 HB2 GLU A 77 19.407 -11.268 -11.098 1.00 44.54 H new ATOM 0 HB3 GLU A 77 17.993 -12.302 -11.060 1.00 44.54 H new ATOM 0 HG2 GLU A 77 19.199 -14.009 -11.850 1.00 54.11 H new ATOM 0 HG3 GLU A 77 19.540 -13.109 -13.315 1.00 54.11 H new ATOM 1243 N LYS A 78 19.700 -10.950 -14.668 1.00 64.51 N ATOM 1244 CA LYS A 78 20.735 -10.347 -15.500 1.00 21.32 C ATOM 1245 C LYS A 78 20.181 -9.162 -16.283 1.00 52.33 C ATOM 1246 O LYS A 78 20.850 -8.140 -16.436 1.00 32.32 O ATOM 1247 CB LYS A 78 21.312 -11.385 -16.465 1.00 20.30 C ATOM 1248 CG LYS A 78 22.611 -10.950 -17.121 1.00 52.12 C ATOM 1249 CD LYS A 78 23.711 -10.739 -16.095 1.00 11.14 C ATOM 1250 CE LYS A 78 25.026 -11.349 -16.554 1.00 23.13 C ATOM 1251 NZ LYS A 78 25.909 -10.340 -17.202 1.00 63.42 N ATOM 0 H LYS A 78 19.392 -11.871 -14.980 1.00 64.51 H new ATOM 0 HA LYS A 78 21.529 -9.988 -14.845 1.00 21.32 H new ATOM 0 HB2 LYS A 78 21.482 -12.316 -15.925 1.00 20.30 H new ATOM 0 HB3 LYS A 78 20.576 -11.596 -17.241 1.00 20.30 H new ATOM 0 HG2 LYS A 78 22.925 -11.704 -17.843 1.00 52.12 H new ATOM 0 HG3 LYS A 78 22.448 -10.026 -17.676 1.00 52.12 H new ATOM 0 HD2 LYS A 78 23.846 -9.672 -15.919 1.00 11.14 H new ATOM 0 HD3 LYS A 78 23.414 -11.184 -15.145 1.00 11.14 H new ATOM 0 HE2 LYS A 78 25.541 -11.787 -15.699 1.00 23.13 H new ATOM 0 HE3 LYS A 78 24.825 -12.160 -17.255 1.00 23.13 H new ATOM 0 HZ1 LYS A 78 26.795 -10.795 -17.501 1.00 63.42 H new ATOM 0 HZ2 LYS A 78 25.428 -9.940 -18.033 1.00 63.42 H new ATOM 0 HZ3 LYS A 78 26.122 -9.579 -16.526 1.00 63.42 H new ATOM 1265 N GLU A 79 18.955 -9.305 -16.776 1.00 74.14 N ATOM 1266 CA GLU A 79 18.312 -8.245 -17.543 1.00 54.35 C ATOM 1267 C GLU A 79 17.962 -7.060 -16.647 1.00 75.50 C ATOM 1268 O GLU A 79 18.003 -5.907 -17.077 1.00 21.10 O ATOM 1269 CB GLU A 79 17.048 -8.773 -18.226 1.00 1.10 C ATOM 1270 CG GLU A 79 16.822 -8.201 -19.615 1.00 43.43 C ATOM 1271 CD GLU A 79 17.211 -9.169 -20.715 1.00 65.04 C ATOM 1272 OE1 GLU A 79 18.345 -9.690 -20.674 1.00 64.12 O ATOM 1273 OE2 GLU A 79 16.381 -9.406 -21.618 1.00 11.23 O ATOM 0 H GLU A 79 18.387 -10.144 -16.658 1.00 74.14 H new ATOM 0 HA GLU A 79 19.014 -7.907 -18.305 1.00 54.35 H new ATOM 0 HB2 GLU A 79 17.109 -9.859 -18.295 1.00 1.10 H new ATOM 0 HB3 GLU A 79 16.185 -8.542 -17.602 1.00 1.10 H new ATOM 0 HG2 GLU A 79 15.771 -7.933 -19.727 1.00 43.43 H new ATOM 0 HG3 GLU A 79 17.399 -7.282 -19.724 1.00 43.43 H new ATOM 1280 N THR A 80 17.615 -7.354 -15.397 1.00 44.43 N ATOM 1281 CA THR A 80 17.256 -6.315 -14.440 1.00 62.11 C ATOM 1282 C THR A 80 18.419 -5.358 -14.205 1.00 23.35 C ATOM 1283 O THR A 80 18.242 -4.141 -14.203 1.00 10.40 O ATOM 1284 CB THR A 80 16.823 -6.920 -13.091 1.00 54.24 C ATOM 1285 OG1 THR A 80 17.968 -7.397 -12.377 1.00 45.33 O ATOM 1286 CG2 THR A 80 15.838 -8.061 -13.301 1.00 44.43 C ATOM 0 H THR A 80 17.575 -8.303 -15.025 1.00 44.43 H new ATOM 0 HA THR A 80 16.418 -5.765 -14.869 1.00 62.11 H new ATOM 0 HB THR A 80 16.333 -6.140 -12.509 1.00 54.24 H new ATOM 0 HG1 THR A 80 18.358 -8.158 -12.855 1.00 45.33 H new ATOM 0 HG21 THR A 80 15.546 -8.473 -12.335 1.00 44.43 H new ATOM 0 HG22 THR A 80 14.954 -7.688 -13.818 1.00 44.43 H new ATOM 0 HG23 THR A 80 16.307 -8.841 -13.901 1.00 44.43 H new ATOM 1294 N GLU A 81 19.609 -5.918 -14.007 1.00 10.54 N ATOM 1295 CA GLU A 81 20.801 -5.112 -13.770 1.00 42.10 C ATOM 1296 C GLU A 81 21.038 -4.139 -14.921 1.00 54.25 C ATOM 1297 O GLU A 81 21.321 -2.961 -14.704 1.00 22.54 O ATOM 1298 CB GLU A 81 22.025 -6.013 -13.590 1.00 12.44 C ATOM 1299 CG GLU A 81 23.167 -5.345 -12.843 1.00 44.21 C ATOM 1300 CD GLU A 81 24.098 -4.580 -13.764 1.00 63.54 C ATOM 1301 OE1 GLU A 81 24.506 -5.147 -14.800 1.00 1.22 O ATOM 1302 OE2 GLU A 81 24.419 -3.415 -13.449 1.00 73.22 O ATOM 0 H GLU A 81 19.773 -6.925 -14.006 1.00 10.54 H new ATOM 0 HA GLU A 81 20.644 -4.537 -12.857 1.00 42.10 H new ATOM 0 HB2 GLU A 81 21.727 -6.913 -13.052 1.00 12.44 H new ATOM 0 HB3 GLU A 81 22.380 -6.330 -14.571 1.00 12.44 H new ATOM 0 HG2 GLU A 81 22.759 -4.663 -12.097 1.00 44.21 H new ATOM 0 HG3 GLU A 81 23.736 -6.103 -12.304 1.00 44.21 H new ATOM 1309 N GLU A 82 20.919 -4.641 -16.147 1.00 10.13 N ATOM 1310 CA GLU A 82 21.121 -3.816 -17.332 1.00 63.42 C ATOM 1311 C GLU A 82 20.250 -2.565 -17.280 1.00 14.12 C ATOM 1312 O GLU A 82 20.591 -1.533 -17.859 1.00 24.15 O ATOM 1313 CB GLU A 82 20.807 -4.617 -18.597 1.00 70.45 C ATOM 1314 CG GLU A 82 21.692 -4.260 -19.780 1.00 13.51 C ATOM 1315 CD GLU A 82 23.118 -4.746 -19.610 1.00 33.31 C ATOM 1316 OE1 GLU A 82 23.405 -5.392 -18.580 1.00 74.22 O ATOM 1317 OE2 GLU A 82 23.946 -4.482 -20.506 1.00 3.53 O ATOM 0 H GLU A 82 20.684 -5.614 -16.345 1.00 10.13 H new ATOM 0 HA GLU A 82 22.166 -3.508 -17.355 1.00 63.42 H new ATOM 0 HB2 GLU A 82 20.916 -5.680 -18.380 1.00 70.45 H new ATOM 0 HB3 GLU A 82 19.765 -4.453 -18.871 1.00 70.45 H new ATOM 0 HG2 GLU A 82 21.271 -4.692 -20.688 1.00 13.51 H new ATOM 0 HG3 GLU A 82 21.694 -3.178 -19.914 1.00 13.51 H new ATOM 1324 N ILE A 83 19.123 -2.665 -16.583 1.00 13.21 N ATOM 1325 CA ILE A 83 18.203 -1.542 -16.454 1.00 55.23 C ATOM 1326 C ILE A 83 18.892 -0.336 -15.825 1.00 53.43 C ATOM 1327 O ILE A 83 18.688 0.802 -16.250 1.00 51.24 O ATOM 1328 CB ILE A 83 16.973 -1.916 -15.606 1.00 75.03 C ATOM 1329 CG1 ILE A 83 16.308 -3.177 -16.162 1.00 34.12 C ATOM 1330 CG2 ILE A 83 15.983 -0.761 -15.570 1.00 30.00 C ATOM 1331 CD1 ILE A 83 15.084 -3.608 -15.383 1.00 63.12 C ATOM 0 H ILE A 83 18.825 -3.512 -16.099 1.00 13.21 H new ATOM 0 HA ILE A 83 17.875 -1.286 -17.462 1.00 55.23 H new ATOM 0 HB ILE A 83 17.301 -2.120 -14.587 1.00 75.03 H new ATOM 0 HG12 ILE A 83 16.025 -3.001 -17.200 1.00 34.12 H new ATOM 0 HG13 ILE A 83 17.033 -3.991 -16.163 1.00 34.12 H new ATOM 0 HG21 ILE A 83 15.119 -1.041 -14.967 1.00 30.00 H new ATOM 0 HG22 ILE A 83 16.462 0.115 -15.133 1.00 30.00 H new ATOM 0 HG23 ILE A 83 15.658 -0.529 -16.584 1.00 30.00 H new ATOM 0 HD11 ILE A 83 14.664 -4.508 -15.833 1.00 63.12 H new ATOM 0 HD12 ILE A 83 15.364 -3.816 -14.350 1.00 63.12 H new ATOM 0 HD13 ILE A 83 14.340 -2.811 -15.404 1.00 63.12 H new ATOM 1343 N THR A 84 19.711 -0.592 -14.810 1.00 50.31 N ATOM 1344 CA THR A 84 20.432 0.472 -14.122 1.00 55.24 C ATOM 1345 C THR A 84 21.154 1.377 -15.114 1.00 14.31 C ATOM 1346 O THR A 84 21.300 2.577 -14.881 1.00 1.11 O ATOM 1347 CB THR A 84 21.457 -0.098 -13.124 1.00 51.13 C ATOM 1348 OG1 THR A 84 21.820 0.905 -12.168 1.00 73.53 O ATOM 1349 CG2 THR A 84 22.701 -0.589 -13.848 1.00 63.43 C ATOM 0 H THR A 84 19.892 -1.527 -14.446 1.00 50.31 H new ATOM 0 HA THR A 84 19.690 1.055 -13.576 1.00 55.24 H new ATOM 0 HB THR A 84 20.999 -0.942 -12.608 1.00 51.13 H new ATOM 0 HG1 THR A 84 22.471 0.534 -11.536 1.00 73.53 H new ATOM 0 HG21 THR A 84 23.411 -0.987 -13.123 1.00 63.43 H new ATOM 0 HG22 THR A 84 22.426 -1.372 -14.554 1.00 63.43 H new ATOM 0 HG23 THR A 84 23.160 0.240 -14.387 1.00 63.43 H new ATOM 1357 N SER A 85 21.603 0.795 -16.221 1.00 55.02 N ATOM 1358 CA SER A 85 22.313 1.549 -17.248 1.00 15.35 C ATOM 1359 C SER A 85 21.363 2.488 -17.987 1.00 22.54 C ATOM 1360 O SER A 85 21.565 3.702 -18.009 1.00 51.54 O ATOM 1361 CB SER A 85 22.981 0.596 -18.240 1.00 40.21 C ATOM 1362 OG SER A 85 24.030 -0.130 -17.623 1.00 14.04 O ATOM 0 H SER A 85 21.488 -0.197 -16.430 1.00 55.02 H new ATOM 0 HA SER A 85 23.081 2.148 -16.759 1.00 15.35 H new ATOM 0 HB2 SER A 85 22.240 -0.097 -18.638 1.00 40.21 H new ATOM 0 HB3 SER A 85 23.374 1.162 -19.084 1.00 40.21 H new ATOM 0 HG SER A 85 24.440 -0.733 -18.278 1.00 14.04 H new ATOM 1368 N LEU A 86 20.327 1.915 -18.590 1.00 43.42 N ATOM 1369 CA LEU A 86 19.345 2.699 -19.331 1.00 50.21 C ATOM 1370 C LEU A 86 18.814 3.850 -18.482 1.00 72.40 C ATOM 1371 O LEU A 86 18.481 4.915 -19.001 1.00 44.12 O ATOM 1372 CB LEU A 86 18.188 1.807 -19.783 1.00 74.01 C ATOM 1373 CG LEU A 86 18.577 0.466 -20.405 1.00 23.50 C ATOM 1374 CD1 LEU A 86 17.345 -0.263 -20.919 1.00 1.30 C ATOM 1375 CD2 LEU A 86 19.585 0.670 -21.527 1.00 12.41 C ATOM 0 H LEU A 86 20.145 0.911 -18.580 1.00 43.42 H new ATOM 0 HA LEU A 86 19.838 3.117 -20.209 1.00 50.21 H new ATOM 0 HB2 LEU A 86 17.548 1.613 -18.923 1.00 74.01 H new ATOM 0 HB3 LEU A 86 17.590 2.361 -20.507 1.00 74.01 H new ATOM 0 HG LEU A 86 19.041 -0.148 -19.634 1.00 23.50 H new ATOM 0 HD11 LEU A 86 17.642 -1.215 -21.358 1.00 1.30 H new ATOM 0 HD12 LEU A 86 16.658 -0.443 -20.092 1.00 1.30 H new ATOM 0 HD13 LEU A 86 16.851 0.347 -21.675 1.00 1.30 H new ATOM 0 HD21 LEU A 86 19.850 -0.295 -21.958 1.00 12.41 H new ATOM 0 HD22 LEU A 86 19.147 1.304 -22.298 1.00 12.41 H new ATOM 0 HD23 LEU A 86 20.480 1.148 -21.129 1.00 12.41 H new ATOM 1387 N TRP A 87 18.739 3.627 -17.175 1.00 13.31 N ATOM 1388 CA TRP A 87 18.250 4.647 -16.253 1.00 71.33 C ATOM 1389 C TRP A 87 18.970 5.972 -16.476 1.00 55.23 C ATOM 1390 O TRP A 87 18.344 7.031 -16.498 1.00 54.54 O ATOM 1391 CB TRP A 87 18.437 4.187 -14.806 1.00 43.54 C ATOM 1392 CG TRP A 87 17.178 3.672 -14.179 1.00 15.53 C ATOM 1393 CD1 TRP A 87 16.063 3.222 -14.828 1.00 25.25 C ATOM 1394 CD2 TRP A 87 16.903 3.557 -12.778 1.00 51.33 C ATOM 1395 NE1 TRP A 87 15.113 2.833 -13.915 1.00 13.54 N ATOM 1396 CE2 TRP A 87 15.603 3.028 -12.651 1.00 5.52 C ATOM 1397 CE3 TRP A 87 17.629 3.847 -11.620 1.00 14.41 C ATOM 1398 CZ2 TRP A 87 15.017 2.786 -11.411 1.00 42.24 C ATOM 1399 CZ3 TRP A 87 17.045 3.607 -10.391 1.00 21.44 C ATOM 1400 CH2 TRP A 87 15.750 3.080 -10.294 1.00 24.41 C ATOM 0 H TRP A 87 19.010 2.750 -16.730 1.00 13.31 H new ATOM 0 HA TRP A 87 17.187 4.796 -16.445 1.00 71.33 H new ATOM 0 HB2 TRP A 87 19.195 3.405 -14.776 1.00 43.54 H new ATOM 0 HB3 TRP A 87 18.815 5.020 -14.213 1.00 43.54 H new ATOM 0 HD1 TRP A 87 15.946 3.179 -15.901 1.00 25.25 H new ATOM 0 HE1 TRP A 87 14.191 2.459 -14.142 1.00 13.54 H new ATOM 0 HE3 TRP A 87 18.628 4.251 -11.684 1.00 14.41 H new ATOM 0 HZ2 TRP A 87 14.019 2.380 -11.334 1.00 42.24 H new ATOM 0 HZ3 TRP A 87 17.596 3.829 -9.489 1.00 21.44 H new ATOM 0 HH2 TRP A 87 15.322 2.903 -9.318 1.00 24.41 H new ATOM 1411 N GLN A 88 20.287 5.905 -16.641 1.00 53.22 N ATOM 1412 CA GLN A 88 21.090 7.102 -16.862 1.00 62.31 C ATOM 1413 C GLN A 88 20.510 7.946 -17.992 1.00 11.35 C ATOM 1414 O GLN A 88 20.542 9.175 -17.941 1.00 15.15 O ATOM 1415 CB GLN A 88 22.535 6.718 -17.186 1.00 42.54 C ATOM 1416 CG GLN A 88 23.529 7.129 -16.112 1.00 43.11 C ATOM 1417 CD GLN A 88 24.310 8.374 -16.484 1.00 55.43 C ATOM 1418 OE1 GLN A 88 25.505 8.309 -16.772 1.00 50.14 O ATOM 1419 NE2 GLN A 88 23.636 9.519 -16.480 1.00 72.35 N ATOM 0 H GLN A 88 20.820 5.036 -16.626 1.00 53.22 H new ATOM 0 HA GLN A 88 21.075 7.694 -15.947 1.00 62.31 H new ATOM 0 HB2 GLN A 88 22.592 5.639 -17.328 1.00 42.54 H new ATOM 0 HB3 GLN A 88 22.822 7.180 -18.131 1.00 42.54 H new ATOM 0 HG2 GLN A 88 22.996 7.305 -15.178 1.00 43.11 H new ATOM 0 HG3 GLN A 88 24.224 6.309 -15.933 1.00 43.11 H new ATOM 0 HE21 GLN A 88 22.646 9.527 -16.235 1.00 72.35 H new ATOM 0 HE22 GLN A 88 24.109 10.390 -16.722 1.00 72.35 H new ATOM 1428 N GLY A 89 19.980 7.278 -19.012 1.00 1.12 N ATOM 1429 CA GLY A 89 19.401 7.984 -20.140 1.00 34.32 C ATOM 1430 C GLY A 89 18.187 8.804 -19.749 1.00 45.41 C ATOM 1431 O GLY A 89 17.974 9.897 -20.274 1.00 13.22 O ATOM 0 H GLY A 89 19.941 6.261 -19.077 1.00 1.12 H new ATOM 0 HA2 GLY A 89 20.153 8.640 -20.579 1.00 34.32 H new ATOM 0 HA3 GLY A 89 19.118 7.265 -20.908 1.00 34.32 H new ATOM 1435 N SER A 90 17.390 8.276 -18.826 1.00 52.33 N ATOM 1436 CA SER A 90 16.188 8.965 -18.370 1.00 23.13 C ATOM 1437 C SER A 90 16.541 10.296 -17.713 1.00 24.10 C ATOM 1438 O SER A 90 15.782 11.262 -17.793 1.00 54.11 O ATOM 1439 CB SER A 90 15.415 8.086 -17.385 1.00 13.54 C ATOM 1440 OG SER A 90 14.603 8.872 -16.530 1.00 14.44 O ATOM 0 H SER A 90 17.554 7.374 -18.379 1.00 52.33 H new ATOM 0 HA SER A 90 15.561 9.164 -19.239 1.00 23.13 H new ATOM 0 HB2 SER A 90 14.793 7.379 -17.934 1.00 13.54 H new ATOM 0 HB3 SER A 90 16.115 7.499 -16.790 1.00 13.54 H new ATOM 0 HG SER A 90 13.678 8.859 -16.854 1.00 14.44 H new ATOM 1446 N LEU A 91 17.699 10.339 -17.063 1.00 63.14 N ATOM 1447 CA LEU A 91 18.155 11.551 -16.392 1.00 3.03 C ATOM 1448 C LEU A 91 18.093 12.751 -17.332 1.00 30.33 C ATOM 1449 O LEU A 91 17.495 13.777 -17.007 1.00 25.13 O ATOM 1450 CB LEU A 91 19.584 11.366 -15.877 1.00 33.32 C ATOM 1451 CG LEU A 91 19.798 11.623 -14.385 1.00 31.12 C ATOM 1452 CD1 LEU A 91 21.061 10.929 -13.900 1.00 22.15 C ATOM 1453 CD2 LEU A 91 19.867 13.117 -14.106 1.00 3.24 C ATOM 0 H LEU A 91 18.339 9.549 -16.987 1.00 63.14 H new ATOM 0 HA LEU A 91 17.492 11.740 -15.548 1.00 3.03 H new ATOM 0 HB2 LEU A 91 19.900 10.346 -16.099 1.00 33.32 H new ATOM 0 HB3 LEU A 91 20.240 12.032 -16.438 1.00 33.32 H new ATOM 0 HG LEU A 91 18.949 11.211 -13.839 1.00 31.12 H new ATOM 0 HD11 LEU A 91 21.197 11.123 -12.836 1.00 22.15 H new ATOM 0 HD12 LEU A 91 20.972 9.855 -14.065 1.00 22.15 H new ATOM 0 HD13 LEU A 91 21.920 11.311 -14.451 1.00 22.15 H new ATOM 0 HD21 LEU A 91 20.020 13.281 -13.039 1.00 3.24 H new ATOM 0 HD22 LEU A 91 20.696 13.553 -14.663 1.00 3.24 H new ATOM 0 HD23 LEU A 91 18.934 13.588 -14.416 1.00 3.24 H new ATOM 1465 N PHE A 92 18.712 12.614 -18.499 1.00 62.45 N ATOM 1466 CA PHE A 92 18.726 13.686 -19.488 1.00 23.31 C ATOM 1467 C PHE A 92 17.309 14.032 -19.935 1.00 10.14 C ATOM 1468 O PHE A 92 17.019 15.176 -20.283 1.00 71.44 O ATOM 1469 CB PHE A 92 19.570 13.281 -20.698 1.00 42.14 C ATOM 1470 CG PHE A 92 19.892 14.427 -21.615 1.00 30.13 C ATOM 1471 CD1 PHE A 92 20.840 15.372 -21.257 1.00 63.21 C ATOM 1472 CD2 PHE A 92 19.247 14.559 -22.834 1.00 32.34 C ATOM 1473 CE1 PHE A 92 21.138 16.427 -22.098 1.00 54.42 C ATOM 1474 CE2 PHE A 92 19.540 15.612 -23.679 1.00 43.11 C ATOM 1475 CZ PHE A 92 20.488 16.547 -23.311 1.00 52.11 C ATOM 0 H PHE A 92 19.211 11.771 -18.784 1.00 62.45 H new ATOM 0 HA PHE A 92 19.167 14.568 -19.025 1.00 23.31 H new ATOM 0 HB2 PHE A 92 20.500 12.833 -20.349 1.00 42.14 H new ATOM 0 HB3 PHE A 92 19.039 12.514 -21.261 1.00 42.14 H new ATOM 0 HD1 PHE A 92 21.352 15.283 -20.310 1.00 63.21 H new ATOM 0 HD2 PHE A 92 18.506 13.830 -23.127 1.00 32.34 H new ATOM 0 HE1 PHE A 92 21.879 17.157 -21.807 1.00 54.42 H new ATOM 0 HE2 PHE A 92 19.029 15.704 -24.626 1.00 43.11 H new ATOM 0 HZ PHE A 92 20.721 17.370 -23.970 1.00 52.11 H new ATOM 1485 N ASN A 93 16.430 13.035 -19.922 1.00 25.15 N ATOM 1486 CA ASN A 93 15.043 13.233 -20.326 1.00 64.13 C ATOM 1487 C ASN A 93 14.292 14.076 -19.300 1.00 63.12 C ATOM 1488 O ASN A 93 13.787 15.152 -19.617 1.00 14.23 O ATOM 1489 CB ASN A 93 14.345 11.883 -20.504 1.00 54.40 C ATOM 1490 CG ASN A 93 13.314 11.908 -21.616 1.00 51.12 C ATOM 1491 OD1 ASN A 93 13.648 11.753 -22.791 1.00 22.22 O ATOM 1492 ND2 ASN A 93 12.053 12.104 -21.250 1.00 12.24 N ATOM 0 H ASN A 93 16.654 12.082 -19.636 1.00 25.15 H new ATOM 0 HA ASN A 93 15.040 13.765 -21.278 1.00 64.13 H new ATOM 0 HB2 ASN A 93 15.090 11.117 -20.720 1.00 54.40 H new ATOM 0 HB3 ASN A 93 13.860 11.601 -19.569 1.00 54.40 H new ATOM 0 HD21 ASN A 93 11.316 12.131 -21.954 1.00 12.24 H new ATOM 0 HD22 ASN A 93 11.821 12.228 -20.264 1.00 12.24 H new ATOM 1499 N ALA A 94 14.225 13.579 -18.070 1.00 34.44 N ATOM 1500 CA ALA A 94 13.538 14.287 -16.996 1.00 61.33 C ATOM 1501 C ALA A 94 14.349 14.246 -15.705 1.00 75.52 C ATOM 1502 O ALA A 94 15.019 15.214 -15.351 1.00 40.22 O ATOM 1503 CB ALA A 94 12.155 13.693 -16.773 1.00 0.34 C ATOM 0 H ALA A 94 14.638 12.689 -17.792 1.00 34.44 H new ATOM 0 HA ALA A 94 13.429 15.330 -17.293 1.00 61.33 H new ATOM 0 HB1 ALA A 94 11.653 14.231 -15.969 1.00 0.34 H new ATOM 0 HB2 ALA A 94 11.570 13.780 -17.688 1.00 0.34 H new ATOM 0 HB3 ALA A 94 12.250 12.641 -16.502 1.00 0.34 H new ATOM 1509 N ASN A 95 14.281 13.118 -15.005 1.00 62.44 N ATOM 1510 CA ASN A 95 15.008 12.951 -13.752 1.00 43.12 C ATOM 1511 C ASN A 95 14.798 11.551 -13.183 1.00 15.42 C ATOM 1512 O ASN A 95 14.350 11.393 -12.047 1.00 20.03 O ATOM 1513 CB ASN A 95 14.559 14.001 -12.734 1.00 54.02 C ATOM 1514 CG ASN A 95 15.683 14.430 -11.811 1.00 34.10 C ATOM 1515 OD1 ASN A 95 16.478 13.606 -11.359 1.00 42.22 O ATOM 1516 ND2 ASN A 95 15.753 15.725 -11.526 1.00 54.12 N ATOM 0 H ASN A 95 13.730 12.306 -15.284 1.00 62.44 H new ATOM 0 HA ASN A 95 16.070 13.084 -13.957 1.00 43.12 H new ATOM 0 HB2 ASN A 95 14.173 14.873 -13.262 1.00 54.02 H new ATOM 0 HB3 ASN A 95 13.738 13.599 -12.140 1.00 54.02 H new ATOM 0 HD21 ASN A 95 16.488 16.073 -10.910 1.00 54.12 H new ATOM 0 HD22 ASN A 95 15.072 16.372 -11.924 1.00 54.12 H new ATOM 1523 N TYR A 96 15.123 10.540 -13.979 1.00 64.43 N ATOM 1524 CA TYR A 96 14.968 9.153 -13.556 1.00 3.01 C ATOM 1525 C TYR A 96 13.509 8.839 -13.242 1.00 54.14 C ATOM 1526 O TYR A 96 13.006 9.177 -12.171 1.00 34.23 O ATOM 1527 CB TYR A 96 15.837 8.872 -12.329 1.00 11.45 C ATOM 1528 CG TYR A 96 17.209 8.336 -12.668 1.00 22.03 C ATOM 1529 CD1 TYR A 96 17.924 8.836 -13.749 1.00 71.35 C ATOM 1530 CD2 TYR A 96 17.791 7.329 -11.907 1.00 72.04 C ATOM 1531 CE1 TYR A 96 19.178 8.348 -14.064 1.00 12.32 C ATOM 1532 CE2 TYR A 96 19.045 6.837 -12.213 1.00 74.44 C ATOM 1533 CZ TYR A 96 19.734 7.349 -13.292 1.00 40.25 C ATOM 1534 OH TYR A 96 20.983 6.860 -13.601 1.00 53.43 O ATOM 0 H TYR A 96 15.496 10.654 -14.922 1.00 64.43 H new ATOM 0 HA TYR A 96 15.290 8.512 -14.376 1.00 3.01 H new ATOM 0 HB2 TYR A 96 15.947 9.792 -11.754 1.00 11.45 H new ATOM 0 HB3 TYR A 96 15.324 8.155 -11.688 1.00 11.45 H new ATOM 0 HD1 TYR A 96 17.492 9.620 -14.354 1.00 71.35 H new ATOM 0 HD2 TYR A 96 17.254 6.924 -11.062 1.00 72.04 H new ATOM 0 HE1 TYR A 96 19.719 8.746 -14.909 1.00 12.32 H new ATOM 0 HE2 TYR A 96 19.483 6.055 -11.610 1.00 74.44 H new ATOM 0 HH TYR A 96 21.229 6.162 -12.959 1.00 53.43 H new ATOM 1544 N ASP A 97 12.834 8.190 -14.185 1.00 44.23 N ATOM 1545 CA ASP A 97 11.433 7.828 -14.011 1.00 15.11 C ATOM 1546 C ASP A 97 11.259 6.312 -14.009 1.00 1.44 C ATOM 1547 O ASP A 97 11.568 5.640 -14.993 1.00 11.23 O ATOM 1548 CB ASP A 97 10.581 8.450 -15.119 1.00 64.43 C ATOM 1549 CG ASP A 97 9.258 7.733 -15.304 1.00 65.44 C ATOM 1550 OD1 ASP A 97 8.313 8.024 -14.541 1.00 44.15 O ATOM 1551 OD2 ASP A 97 9.168 6.881 -16.213 1.00 31.44 O ATOM 0 H ASP A 97 13.235 7.904 -15.078 1.00 44.23 H new ATOM 0 HA ASP A 97 11.101 8.215 -13.048 1.00 15.11 H new ATOM 0 HB2 ASP A 97 10.393 9.498 -14.884 1.00 64.43 H new ATOM 0 HB3 ASP A 97 11.137 8.428 -16.056 1.00 64.43 H new ATOM 1556 N VAL A 98 10.764 5.780 -12.896 1.00 11.22 N ATOM 1557 CA VAL A 98 10.549 4.344 -12.765 1.00 24.00 C ATOM 1558 C VAL A 98 9.384 4.045 -11.828 1.00 41.54 C ATOM 1559 O VAL A 98 9.162 4.761 -10.852 1.00 74.30 O ATOM 1560 CB VAL A 98 11.811 3.634 -12.240 1.00 31.45 C ATOM 1561 CG1 VAL A 98 12.183 4.156 -10.860 1.00 73.12 C ATOM 1562 CG2 VAL A 98 11.600 2.127 -12.209 1.00 41.34 C ATOM 0 H VAL A 98 10.504 6.322 -12.072 1.00 11.22 H new ATOM 0 HA VAL A 98 10.316 3.967 -13.761 1.00 24.00 H new ATOM 0 HB VAL A 98 12.636 3.849 -12.918 1.00 31.45 H new ATOM 0 HG11 VAL A 98 13.077 3.643 -10.506 1.00 73.12 H new ATOM 0 HG12 VAL A 98 12.378 5.227 -10.916 1.00 73.12 H new ATOM 0 HG13 VAL A 98 11.361 3.973 -10.168 1.00 73.12 H new ATOM 0 HG21 VAL A 98 12.501 1.641 -11.836 1.00 41.34 H new ATOM 0 HG22 VAL A 98 10.762 1.890 -11.553 1.00 41.34 H new ATOM 0 HG23 VAL A 98 11.385 1.769 -13.216 1.00 41.34 H new ATOM 1572 N GLN A 99 8.644 2.984 -12.133 1.00 41.30 N ATOM 1573 CA GLN A 99 7.501 2.591 -11.318 1.00 12.42 C ATOM 1574 C GLN A 99 7.355 1.074 -11.281 1.00 33.35 C ATOM 1575 O GLN A 99 7.179 0.432 -12.316 1.00 60.32 O ATOM 1576 CB GLN A 99 6.219 3.226 -11.860 1.00 31.21 C ATOM 1577 CG GLN A 99 4.953 2.693 -11.208 1.00 63.41 C ATOM 1578 CD GLN A 99 4.112 1.865 -12.159 1.00 35.52 C ATOM 1579 OE1 GLN A 99 4.366 0.562 -12.193 1.00 22.11 O flip ATOM 1580 NE2 GLN A 99 3.242 2.390 -12.855 1.00 73.35 N flip ATOM 0 H GLN A 99 8.815 2.382 -12.938 1.00 41.30 H new ATOM 0 HA GLN A 99 7.672 2.946 -10.302 1.00 12.42 H new ATOM 0 HB2 GLN A 99 6.267 4.305 -11.712 1.00 31.21 H new ATOM 0 HB3 GLN A 99 6.164 3.054 -12.935 1.00 31.21 H new ATOM 0 HG2 GLN A 99 5.222 2.086 -10.344 1.00 63.41 H new ATOM 0 HG3 GLN A 99 4.360 3.529 -10.838 1.00 63.41 H new ATOM 0 HE21 GLN A 99 3.080 3.395 -12.797 1.00 73.35 H new ATOM 0 HE22 GLN A 99 2.683 1.819 -13.489 1.00 73.35 H new ATOM 1589 N ARG A 100 7.429 0.506 -10.081 1.00 11.40 N ATOM 1590 CA ARG A 100 7.306 -0.936 -9.909 1.00 65.23 C ATOM 1591 C ARG A 100 6.284 -1.270 -8.827 1.00 23.14 C ATOM 1592 O ARG A 100 6.150 -0.545 -7.840 1.00 71.54 O ATOM 1593 CB ARG A 100 8.663 -1.545 -9.550 1.00 60.42 C ATOM 1594 CG ARG A 100 9.047 -1.361 -8.091 1.00 54.41 C ATOM 1595 CD ARG A 100 10.414 -1.957 -7.795 1.00 12.12 C ATOM 1596 NE ARG A 100 10.956 -1.479 -6.526 1.00 1.41 N ATOM 1597 CZ ARG A 100 10.594 -1.963 -5.343 1.00 5.30 C ATOM 1598 NH1 ARG A 100 9.695 -2.934 -5.267 1.00 62.03 N ATOM 1599 NH2 ARG A 100 11.133 -1.476 -4.232 1.00 42.55 N ATOM 0 H ARG A 100 7.574 1.023 -9.214 1.00 11.40 H new ATOM 0 HA ARG A 100 6.962 -1.361 -10.852 1.00 65.23 H new ATOM 0 HB2 ARG A 100 8.646 -2.610 -9.781 1.00 60.42 H new ATOM 0 HB3 ARG A 100 9.431 -1.095 -10.179 1.00 60.42 H new ATOM 0 HG2 ARG A 100 9.051 -0.299 -7.846 1.00 54.41 H new ATOM 0 HG3 ARG A 100 8.298 -1.832 -7.454 1.00 54.41 H new ATOM 0 HD2 ARG A 100 10.338 -3.044 -7.770 1.00 12.12 H new ATOM 0 HD3 ARG A 100 11.102 -1.704 -8.601 1.00 12.12 H new ATOM 0 HE ARG A 100 11.651 -0.732 -6.549 1.00 1.41 H new ATOM 0 HH11 ARG A 100 9.279 -3.312 -6.118 1.00 62.03 H new ATOM 0 HH12 ARG A 100 9.419 -3.304 -4.357 1.00 62.03 H new ATOM 0 HH21 ARG A 100 11.826 -0.729 -4.286 1.00 42.55 H new ATOM 0 HH22 ARG A 100 10.854 -1.848 -3.324 1.00 42.55 H new ATOM 1613 N PHE A 101 5.566 -2.371 -9.018 1.00 74.41 N ATOM 1614 CA PHE A 101 4.554 -2.801 -8.059 1.00 44.31 C ATOM 1615 C PHE A 101 4.475 -4.323 -7.997 1.00 62.32 C ATOM 1616 O PHE A 101 4.610 -5.004 -9.014 1.00 71.14 O ATOM 1617 CB PHE A 101 3.188 -2.222 -8.433 1.00 61.54 C ATOM 1618 CG PHE A 101 2.217 -2.189 -7.288 1.00 4.43 C ATOM 1619 CD1 PHE A 101 2.585 -1.648 -6.066 1.00 44.13 C ATOM 1620 CD2 PHE A 101 0.937 -2.698 -7.432 1.00 51.02 C ATOM 1621 CE1 PHE A 101 1.694 -1.615 -5.010 1.00 44.31 C ATOM 1622 CE2 PHE A 101 0.042 -2.667 -6.380 1.00 34.22 C ATOM 1623 CZ PHE A 101 0.421 -2.126 -5.167 1.00 21.11 C ATOM 0 H PHE A 101 5.666 -2.983 -9.828 1.00 74.41 H new ATOM 0 HA PHE A 101 4.841 -2.430 -7.075 1.00 44.31 H new ATOM 0 HB2 PHE A 101 3.323 -1.210 -8.813 1.00 61.54 H new ATOM 0 HB3 PHE A 101 2.762 -2.813 -9.244 1.00 61.54 H new ATOM 0 HD1 PHE A 101 3.580 -1.248 -5.938 1.00 44.13 H new ATOM 0 HD2 PHE A 101 0.635 -3.124 -8.377 1.00 51.02 H new ATOM 0 HE1 PHE A 101 1.993 -1.190 -4.063 1.00 44.31 H new ATOM 0 HE2 PHE A 101 -0.954 -3.066 -6.506 1.00 34.22 H new ATOM 0 HZ PHE A 101 -0.277 -2.103 -4.343 1.00 21.11 H new ATOM 1633 N ILE A 102 4.257 -4.850 -6.797 1.00 54.01 N ATOM 1634 CA ILE A 102 4.159 -6.291 -6.602 1.00 61.22 C ATOM 1635 C ILE A 102 2.907 -6.655 -5.811 1.00 62.43 C ATOM 1636 O ILE A 102 2.610 -6.046 -4.784 1.00 33.12 O ATOM 1637 CB ILE A 102 5.395 -6.845 -5.869 1.00 61.12 C ATOM 1638 CG1 ILE A 102 6.676 -6.415 -6.587 1.00 61.10 C ATOM 1639 CG2 ILE A 102 5.319 -8.362 -5.773 1.00 53.54 C ATOM 1640 CD1 ILE A 102 7.406 -5.285 -5.895 1.00 62.32 C ATOM 0 H ILE A 102 4.145 -4.300 -5.945 1.00 54.01 H new ATOM 0 HA ILE A 102 4.103 -6.741 -7.593 1.00 61.22 H new ATOM 0 HB ILE A 102 5.413 -6.437 -4.858 1.00 61.12 H new ATOM 0 HG12 ILE A 102 7.344 -7.273 -6.667 1.00 61.10 H new ATOM 0 HG13 ILE A 102 6.428 -6.108 -7.603 1.00 61.10 H new ATOM 0 HG21 ILE A 102 6.200 -8.738 -5.252 1.00 53.54 H new ATOM 0 HG22 ILE A 102 4.423 -8.647 -5.222 1.00 53.54 H new ATOM 0 HG23 ILE A 102 5.280 -8.789 -6.775 1.00 53.54 H new ATOM 0 HD11 ILE A 102 8.304 -5.033 -6.459 1.00 62.32 H new ATOM 0 HD12 ILE A 102 6.755 -4.412 -5.839 1.00 62.32 H new ATOM 0 HD13 ILE A 102 7.685 -5.595 -4.888 1.00 62.32 H new ATOM 1652 N VAL A 103 2.177 -7.655 -6.296 1.00 43.13 N ATOM 1653 CA VAL A 103 0.959 -8.103 -5.633 1.00 74.35 C ATOM 1654 C VAL A 103 0.718 -9.590 -5.873 1.00 11.44 C ATOM 1655 O VAL A 103 0.636 -10.040 -7.014 1.00 71.15 O ATOM 1656 CB VAL A 103 -0.269 -7.311 -6.120 1.00 52.12 C ATOM 1657 CG1 VAL A 103 -1.534 -7.816 -5.443 1.00 21.03 C ATOM 1658 CG2 VAL A 103 -0.077 -5.823 -5.867 1.00 70.15 C ATOM 0 H VAL A 103 2.409 -8.170 -7.146 1.00 43.13 H new ATOM 0 HA VAL A 103 1.096 -7.927 -4.566 1.00 74.35 H new ATOM 0 HB VAL A 103 -0.375 -7.464 -7.194 1.00 52.12 H new ATOM 0 HG11 VAL A 103 -2.391 -7.244 -5.800 1.00 21.03 H new ATOM 0 HG12 VAL A 103 -1.677 -8.870 -5.680 1.00 21.03 H new ATOM 0 HG13 VAL A 103 -1.442 -7.696 -4.364 1.00 21.03 H new ATOM 0 HG21 VAL A 103 -0.954 -5.278 -6.217 1.00 70.15 H new ATOM 0 HG22 VAL A 103 0.055 -5.650 -4.799 1.00 70.15 H new ATOM 0 HG23 VAL A 103 0.805 -5.474 -6.403 1.00 70.15 H new ATOM 1668 N GLY A 104 0.605 -10.348 -4.786 1.00 51.21 N ATOM 1669 CA GLY A 104 0.374 -11.776 -4.899 1.00 22.11 C ATOM 1670 C GLY A 104 1.637 -12.542 -5.239 1.00 22.33 C ATOM 1671 O GLY A 104 2.608 -12.518 -4.483 1.00 5.11 O ATOM 0 H GLY A 104 0.669 -9.998 -3.830 1.00 51.21 H new ATOM 0 HA2 GLY A 104 -0.033 -12.151 -3.960 1.00 22.11 H new ATOM 0 HA3 GLY A 104 -0.377 -11.960 -5.667 1.00 22.11 H new ATOM 1675 N SER A 105 1.624 -13.226 -6.378 1.00 61.24 N ATOM 1676 CA SER A 105 2.775 -14.008 -6.814 1.00 44.11 C ATOM 1677 C SER A 105 3.353 -13.448 -8.110 1.00 42.13 C ATOM 1678 O SER A 105 4.280 -14.017 -8.687 1.00 31.51 O ATOM 1679 CB SER A 105 2.379 -15.473 -7.010 1.00 4.42 C ATOM 1680 OG SER A 105 1.767 -15.995 -5.844 1.00 35.40 O ATOM 0 H SER A 105 0.829 -13.255 -7.016 1.00 61.24 H new ATOM 0 HA SER A 105 3.539 -13.946 -6.039 1.00 44.11 H new ATOM 0 HB2 SER A 105 1.694 -15.558 -7.854 1.00 4.42 H new ATOM 0 HB3 SER A 105 3.262 -16.062 -7.256 1.00 4.42 H new ATOM 0 HG SER A 105 1.522 -16.932 -5.995 1.00 35.40 H new ATOM 1686 N ASP A 106 2.799 -12.329 -8.563 1.00 12.55 N ATOM 1687 CA ASP A 106 3.259 -11.689 -9.790 1.00 75.40 C ATOM 1688 C ASP A 106 3.658 -10.240 -9.531 1.00 60.03 C ATOM 1689 O ASP A 106 3.029 -9.546 -8.733 1.00 2.45 O ATOM 1690 CB ASP A 106 2.167 -11.747 -10.860 1.00 62.30 C ATOM 1691 CG ASP A 106 0.846 -11.187 -10.371 1.00 21.45 C ATOM 1692 OD1 ASP A 106 0.230 -11.811 -9.480 1.00 43.25 O ATOM 1693 OD2 ASP A 106 0.428 -10.125 -10.877 1.00 24.22 O ATOM 0 H ASP A 106 2.030 -11.846 -8.099 1.00 12.55 H new ATOM 0 HA ASP A 106 4.136 -12.230 -10.146 1.00 75.40 H new ATOM 0 HB2 ASP A 106 2.492 -11.188 -11.738 1.00 62.30 H new ATOM 0 HB3 ASP A 106 2.026 -12.781 -11.175 1.00 62.30 H new ATOM 1698 N ARG A 107 4.708 -9.791 -10.211 1.00 52.42 N ATOM 1699 CA ARG A 107 5.193 -8.425 -10.053 1.00 54.31 C ATOM 1700 C ARG A 107 5.254 -7.710 -11.400 1.00 35.10 C ATOM 1701 O ARG A 107 5.456 -8.338 -12.439 1.00 35.54 O ATOM 1702 CB ARG A 107 6.576 -8.424 -9.401 1.00 22.45 C ATOM 1703 CG ARG A 107 7.695 -8.830 -10.345 1.00 64.54 C ATOM 1704 CD ARG A 107 9.055 -8.741 -9.670 1.00 32.22 C ATOM 1705 NE ARG A 107 9.210 -7.501 -8.915 1.00 45.40 N ATOM 1706 CZ ARG A 107 9.335 -6.306 -9.482 1.00 54.13 C ATOM 1707 NH1 ARG A 107 9.321 -6.191 -10.803 1.00 51.11 N ATOM 1708 NH2 ARG A 107 9.472 -5.223 -8.728 1.00 23.00 N ATOM 0 H ARG A 107 5.239 -10.353 -10.876 1.00 52.42 H new ATOM 0 HA ARG A 107 4.495 -7.891 -9.409 1.00 54.31 H new ATOM 0 HB2 ARG A 107 6.784 -7.427 -9.012 1.00 22.45 H new ATOM 0 HB3 ARG A 107 6.567 -9.103 -8.549 1.00 22.45 H new ATOM 0 HG2 ARG A 107 7.527 -9.849 -10.693 1.00 64.54 H new ATOM 0 HG3 ARG A 107 7.682 -8.186 -11.225 1.00 64.54 H new ATOM 0 HD2 ARG A 107 9.184 -9.592 -9.001 1.00 32.22 H new ATOM 0 HD3 ARG A 107 9.839 -8.807 -10.424 1.00 32.22 H new ATOM 0 HE ARG A 107 9.223 -7.555 -7.897 1.00 45.40 H new ATOM 0 HH11 ARG A 107 9.214 -7.021 -11.386 1.00 51.11 H new ATOM 0 HH12 ARG A 107 9.417 -5.272 -11.236 1.00 51.11 H new ATOM 0 HH21 ARG A 107 9.481 -5.307 -7.712 1.00 23.00 H new ATOM 0 HH22 ARG A 107 9.568 -4.306 -9.165 1.00 23.00 H new ATOM 1722 N ALA A 108 5.077 -6.393 -11.374 1.00 32.22 N ATOM 1723 CA ALA A 108 5.113 -5.593 -12.592 1.00 21.23 C ATOM 1724 C ALA A 108 6.223 -4.549 -12.530 1.00 21.40 C ATOM 1725 O ALA A 108 6.507 -3.993 -11.468 1.00 74.44 O ATOM 1726 CB ALA A 108 3.767 -4.922 -12.823 1.00 22.23 C ATOM 0 H ALA A 108 4.907 -5.858 -10.523 1.00 32.22 H new ATOM 0 HA ALA A 108 5.323 -6.259 -13.429 1.00 21.23 H new ATOM 0 HB1 ALA A 108 3.809 -4.328 -13.736 1.00 22.23 H new ATOM 0 HB2 ALA A 108 2.993 -5.683 -12.920 1.00 22.23 H new ATOM 0 HB3 ALA A 108 3.534 -4.274 -11.978 1.00 22.23 H new ATOM 1732 N ILE A 109 6.848 -4.289 -13.673 1.00 50.22 N ATOM 1733 CA ILE A 109 7.927 -3.311 -13.748 1.00 74.30 C ATOM 1734 C ILE A 109 7.696 -2.325 -14.888 1.00 4.32 C ATOM 1735 O ILE A 109 7.388 -2.720 -16.012 1.00 51.34 O ATOM 1736 CB ILE A 109 9.293 -3.995 -13.944 1.00 11.53 C ATOM 1737 CG1 ILE A 109 10.418 -2.959 -13.886 1.00 62.32 C ATOM 1738 CG2 ILE A 109 9.325 -4.746 -15.266 1.00 34.51 C ATOM 1739 CD1 ILE A 109 10.675 -2.422 -12.496 1.00 32.45 C ATOM 0 H ILE A 109 6.626 -4.742 -14.560 1.00 50.22 H new ATOM 0 HA ILE A 109 7.932 -2.772 -12.800 1.00 74.30 H new ATOM 0 HB ILE A 109 9.443 -4.713 -13.138 1.00 11.53 H new ATOM 0 HG12 ILE A 109 11.335 -3.408 -14.268 1.00 62.32 H new ATOM 0 HG13 ILE A 109 10.170 -2.129 -14.547 1.00 62.32 H new ATOM 0 HG21 ILE A 109 10.297 -5.224 -15.390 1.00 34.51 H new ATOM 0 HG22 ILE A 109 8.544 -5.506 -15.272 1.00 34.51 H new ATOM 0 HG23 ILE A 109 9.157 -4.047 -16.086 1.00 34.51 H new ATOM 0 HD11 ILE A 109 11.485 -1.693 -12.531 1.00 32.45 H new ATOM 0 HD12 ILE A 109 9.772 -1.943 -12.118 1.00 32.45 H new ATOM 0 HD13 ILE A 109 10.954 -3.242 -11.835 1.00 32.45 H new ATOM 1751 N PHE A 110 7.850 -1.039 -14.590 1.00 0.31 N ATOM 1752 CA PHE A 110 7.660 0.006 -15.590 1.00 32.42 C ATOM 1753 C PHE A 110 8.800 1.019 -15.542 1.00 32.32 C ATOM 1754 O PHE A 110 9.026 1.666 -14.520 1.00 23.10 O ATOM 1755 CB PHE A 110 6.322 0.715 -15.369 1.00 3.22 C ATOM 1756 CG PHE A 110 6.150 1.946 -16.212 1.00 43.21 C ATOM 1757 CD1 PHE A 110 6.587 3.180 -15.758 1.00 22.04 C ATOM 1758 CD2 PHE A 110 5.551 1.870 -17.459 1.00 62.51 C ATOM 1759 CE1 PHE A 110 6.431 4.315 -16.531 1.00 72.32 C ATOM 1760 CE2 PHE A 110 5.392 3.001 -18.237 1.00 65.43 C ATOM 1761 CZ PHE A 110 5.832 4.225 -17.772 1.00 74.13 C ATOM 0 H PHE A 110 8.106 -0.695 -13.664 1.00 0.31 H new ATOM 0 HA PHE A 110 7.657 -0.463 -16.574 1.00 32.42 H new ATOM 0 HB2 PHE A 110 5.511 0.020 -15.586 1.00 3.22 H new ATOM 0 HB3 PHE A 110 6.234 0.989 -14.318 1.00 3.22 H new ATOM 0 HD1 PHE A 110 7.055 3.256 -14.788 1.00 22.04 H new ATOM 0 HD2 PHE A 110 5.204 0.916 -17.827 1.00 62.51 H new ATOM 0 HE1 PHE A 110 6.777 5.270 -16.165 1.00 72.32 H new ATOM 0 HE2 PHE A 110 4.924 2.928 -19.208 1.00 65.43 H new ATOM 0 HZ PHE A 110 5.708 5.110 -18.378 1.00 74.13 H new ATOM 1771 N MET A 111 9.515 1.149 -16.655 1.00 15.34 N ATOM 1772 CA MET A 111 10.631 2.084 -16.740 1.00 71.31 C ATOM 1773 C MET A 111 10.584 2.868 -18.047 1.00 43.34 C ATOM 1774 O MET A 111 10.540 2.286 -19.132 1.00 30.52 O ATOM 1775 CB MET A 111 11.960 1.335 -16.628 1.00 63.24 C ATOM 1776 CG MET A 111 12.038 0.100 -17.511 1.00 63.13 C ATOM 1777 SD MET A 111 13.439 0.145 -18.646 1.00 31.40 S ATOM 1778 CE MET A 111 14.143 -1.481 -18.379 1.00 54.34 C ATOM 0 H MET A 111 9.342 0.619 -17.509 1.00 15.34 H new ATOM 0 HA MET A 111 10.548 2.788 -15.912 1.00 71.31 H new ATOM 0 HB2 MET A 111 12.773 2.012 -16.892 1.00 63.24 H new ATOM 0 HB3 MET A 111 12.115 1.040 -15.590 1.00 63.24 H new ATOM 0 HG2 MET A 111 12.113 -0.787 -16.882 1.00 63.13 H new ATOM 0 HG3 MET A 111 11.115 0.008 -18.083 1.00 63.13 H new ATOM 0 HE1 MET A 111 15.019 -1.397 -17.736 1.00 54.34 H new ATOM 0 HE2 MET A 111 13.403 -2.124 -17.902 1.00 54.34 H new ATOM 0 HE3 MET A 111 14.435 -1.913 -19.336 1.00 54.34 H new ATOM 1788 N LEU A 112 10.594 4.192 -17.938 1.00 41.13 N ATOM 1789 CA LEU A 112 10.553 5.057 -19.112 1.00 73.04 C ATOM 1790 C LEU A 112 11.278 6.372 -18.846 1.00 10.12 C ATOM 1791 O LEU A 112 11.328 6.846 -17.711 1.00 21.35 O ATOM 1792 CB LEU A 112 9.103 5.333 -19.516 1.00 3.43 C ATOM 1793 CG LEU A 112 8.744 5.039 -20.973 1.00 2.14 C ATOM 1794 CD1 LEU A 112 7.449 4.247 -21.053 1.00 73.44 C ATOM 1795 CD2 LEU A 112 8.630 6.333 -21.766 1.00 25.14 C ATOM 0 H LEU A 112 10.630 4.690 -17.049 1.00 41.13 H new ATOM 0 HA LEU A 112 11.060 4.543 -19.929 1.00 73.04 H new ATOM 0 HB2 LEU A 112 8.450 4.741 -18.875 1.00 3.43 H new ATOM 0 HB3 LEU A 112 8.884 6.381 -19.313 1.00 3.43 H new ATOM 0 HG LEU A 112 9.542 4.438 -21.410 1.00 2.14 H new ATOM 0 HD11 LEU A 112 7.209 4.047 -22.097 1.00 73.44 H new ATOM 0 HD12 LEU A 112 7.566 3.303 -20.520 1.00 73.44 H new ATOM 0 HD13 LEU A 112 6.642 4.822 -20.599 1.00 73.44 H new ATOM 0 HD21 LEU A 112 8.374 6.104 -22.801 1.00 25.14 H new ATOM 0 HD22 LEU A 112 7.852 6.960 -21.330 1.00 25.14 H new ATOM 0 HD23 LEU A 112 9.582 6.863 -21.736 1.00 25.14 H new ATOM 1807 N ARG A 113 11.837 6.958 -19.900 1.00 32.12 N ATOM 1808 CA ARG A 113 12.558 8.219 -19.780 1.00 3.03 C ATOM 1809 C ARG A 113 11.589 9.386 -19.614 1.00 44.11 C ATOM 1810 O ARG A 113 11.947 10.431 -19.070 1.00 24.32 O ATOM 1811 CB ARG A 113 13.441 8.445 -21.009 1.00 13.33 C ATOM 1812 CG ARG A 113 12.656 8.616 -22.299 1.00 33.00 C ATOM 1813 CD ARG A 113 13.031 7.557 -23.324 1.00 2.13 C ATOM 1814 NE ARG A 113 13.965 8.069 -24.323 1.00 4.13 N ATOM 1815 CZ ARG A 113 13.594 8.786 -25.377 1.00 54.41 C ATOM 1816 NH1 ARG A 113 12.314 9.075 -25.569 1.00 12.23 N ATOM 1817 NH2 ARG A 113 14.503 9.217 -26.242 1.00 71.23 N ATOM 0 H ARG A 113 11.804 6.579 -20.847 1.00 32.12 H new ATOM 0 HA ARG A 113 13.189 8.165 -18.893 1.00 3.03 H new ATOM 0 HB2 ARG A 113 14.055 9.331 -20.847 1.00 13.33 H new ATOM 0 HB3 ARG A 113 14.122 7.601 -21.117 1.00 13.33 H new ATOM 0 HG2 ARG A 113 11.588 8.557 -22.087 1.00 33.00 H new ATOM 0 HG3 ARG A 113 12.845 9.607 -22.712 1.00 33.00 H new ATOM 0 HD2 ARG A 113 13.477 6.702 -22.816 1.00 2.13 H new ATOM 0 HD3 ARG A 113 12.130 7.198 -23.821 1.00 2.13 H new ATOM 0 HE ARG A 113 14.957 7.864 -24.204 1.00 4.13 H new ATOM 0 HH11 ARG A 113 11.612 8.746 -24.906 1.00 12.23 H new ATOM 0 HH12 ARG A 113 12.032 9.626 -26.380 1.00 12.23 H new ATOM 0 HH21 ARG A 113 15.489 8.998 -26.098 1.00 71.23 H new ATOM 0 HH22 ARG A 113 14.216 9.768 -27.051 1.00 71.23 H new ATOM 1831 N ASP A 114 10.362 9.201 -20.087 1.00 61.14 N ATOM 1832 CA ASP A 114 9.341 10.238 -19.991 1.00 60.35 C ATOM 1833 C ASP A 114 8.703 10.245 -18.606 1.00 55.11 C ATOM 1834 O ASP A 114 8.987 11.116 -17.785 1.00 54.21 O ATOM 1835 CB ASP A 114 8.268 10.027 -21.060 1.00 75.33 C ATOM 1836 CG ASP A 114 8.374 11.028 -22.193 1.00 51.33 C ATOM 1837 OD1 ASP A 114 9.501 11.253 -22.684 1.00 35.52 O ATOM 1838 OD2 ASP A 114 7.330 11.587 -22.590 1.00 44.33 O ATOM 0 H ASP A 114 10.050 8.343 -20.541 1.00 61.14 H new ATOM 0 HA ASP A 114 9.821 11.203 -20.155 1.00 60.35 H new ATOM 0 HB2 ASP A 114 8.354 9.017 -21.462 1.00 75.33 H new ATOM 0 HB3 ASP A 114 7.282 10.105 -20.601 1.00 75.33 H new ATOM 1843 N GLY A 115 7.837 9.268 -18.354 1.00 32.05 N ATOM 1844 CA GLY A 115 7.171 9.181 -17.067 1.00 55.22 C ATOM 1845 C GLY A 115 5.711 9.582 -17.142 1.00 53.32 C ATOM 1846 O GLY A 115 4.827 8.727 -17.194 1.00 51.14 O ATOM 0 H GLY A 115 7.585 8.536 -19.018 1.00 32.05 H new ATOM 0 HA2 GLY A 115 7.246 8.161 -16.691 1.00 55.22 H new ATOM 0 HA3 GLY A 115 7.685 9.823 -16.351 1.00 55.22 H new ATOM 1850 N SER A 116 5.456 10.887 -17.146 1.00 64.10 N ATOM 1851 CA SER A 116 4.093 11.400 -17.209 1.00 72.24 C ATOM 1852 C SER A 116 3.426 11.008 -18.524 1.00 74.32 C ATOM 1853 O SER A 116 2.368 10.378 -18.533 1.00 14.02 O ATOM 1854 CB SER A 116 4.090 12.922 -17.057 1.00 44.12 C ATOM 1855 OG SER A 116 3.166 13.522 -17.948 1.00 15.25 O ATOM 0 H SER A 116 6.176 11.608 -17.106 1.00 64.10 H new ATOM 0 HA SER A 116 3.527 10.959 -16.388 1.00 72.24 H new ATOM 0 HB2 SER A 116 3.835 13.188 -16.031 1.00 44.12 H new ATOM 0 HB3 SER A 116 5.090 13.312 -17.248 1.00 44.12 H new ATOM 0 HG SER A 116 3.182 14.495 -17.830 1.00 15.25 H new ATOM 1861 N TYR A 117 4.052 11.385 -19.633 1.00 73.23 N ATOM 1862 CA TYR A 117 3.519 11.076 -20.955 1.00 34.43 C ATOM 1863 C TYR A 117 3.274 9.577 -21.107 1.00 12.45 C ATOM 1864 O TYR A 117 2.240 9.155 -21.624 1.00 0.34 O ATOM 1865 CB TYR A 117 4.480 11.559 -22.042 1.00 0.34 C ATOM 1866 CG TYR A 117 3.835 12.476 -23.056 1.00 41.13 C ATOM 1867 CD1 TYR A 117 3.595 13.813 -22.761 1.00 24.54 C ATOM 1868 CD2 TYR A 117 3.464 12.006 -24.310 1.00 44.11 C ATOM 1869 CE1 TYR A 117 3.006 14.654 -23.684 1.00 73.11 C ATOM 1870 CE2 TYR A 117 2.876 12.841 -25.240 1.00 74.53 C ATOM 1871 CZ TYR A 117 2.648 14.163 -24.923 1.00 2.43 C ATOM 1872 OH TYR A 117 2.061 14.997 -25.846 1.00 54.41 O ATOM 0 H TYR A 117 4.929 11.905 -19.643 1.00 73.23 H new ATOM 0 HA TYR A 117 2.567 11.595 -21.065 1.00 34.43 H new ATOM 0 HB2 TYR A 117 5.314 12.080 -21.572 1.00 0.34 H new ATOM 0 HB3 TYR A 117 4.895 10.694 -22.559 1.00 0.34 H new ATOM 0 HD1 TYR A 117 3.874 14.201 -21.792 1.00 24.54 H new ATOM 0 HD2 TYR A 117 3.638 10.970 -24.562 1.00 44.11 H new ATOM 0 HE1 TYR A 117 2.826 15.690 -23.438 1.00 73.11 H new ATOM 0 HE2 TYR A 117 2.596 12.460 -26.211 1.00 74.53 H new ATOM 0 HH TYR A 117 1.872 14.496 -26.667 1.00 54.41 H new ATOM 1882 N ALA A 118 4.233 8.779 -20.651 1.00 24.30 N ATOM 1883 CA ALA A 118 4.122 7.328 -20.733 1.00 24.41 C ATOM 1884 C ALA A 118 3.057 6.804 -19.776 1.00 72.41 C ATOM 1885 O ALA A 118 2.430 5.776 -20.033 1.00 62.31 O ATOM 1886 CB ALA A 118 5.466 6.678 -20.437 1.00 30.05 C ATOM 0 H ALA A 118 5.096 9.113 -20.221 1.00 24.30 H new ATOM 0 HA ALA A 118 3.821 7.068 -21.748 1.00 24.41 H new ATOM 0 HB1 ALA A 118 5.368 5.594 -20.502 1.00 30.05 H new ATOM 0 HB2 ALA A 118 6.203 7.020 -21.163 1.00 30.05 H new ATOM 0 HB3 ALA A 118 5.790 6.954 -19.434 1.00 30.05 H new ATOM 1892 N TRP A 119 2.858 7.516 -18.673 1.00 75.21 N ATOM 1893 CA TRP A 119 1.868 7.121 -17.677 1.00 55.23 C ATOM 1894 C TRP A 119 0.505 6.896 -18.324 1.00 21.13 C ATOM 1895 O TRP A 119 -0.299 6.102 -17.836 1.00 42.20 O ATOM 1896 CB TRP A 119 1.758 8.188 -16.586 1.00 61.34 C ATOM 1897 CG TRP A 119 0.970 7.738 -15.393 1.00 45.31 C ATOM 1898 CD1 TRP A 119 -0.383 7.813 -15.229 1.00 73.22 C ATOM 1899 CD2 TRP A 119 1.489 7.147 -14.197 1.00 25.10 C ATOM 1900 NE1 TRP A 119 -0.737 7.303 -14.003 1.00 51.31 N ATOM 1901 CE2 TRP A 119 0.393 6.887 -13.351 1.00 44.41 C ATOM 1902 CE3 TRP A 119 2.773 6.809 -13.759 1.00 52.30 C ATOM 1903 CZ2 TRP A 119 0.544 6.308 -12.094 1.00 64.11 C ATOM 1904 CZ3 TRP A 119 2.921 6.235 -12.511 1.00 61.52 C ATOM 1905 CH2 TRP A 119 1.812 5.988 -11.691 1.00 23.32 C ATOM 0 H TRP A 119 3.368 8.369 -18.445 1.00 75.21 H new ATOM 0 HA TRP A 119 2.196 6.184 -17.227 1.00 55.23 H new ATOM 0 HB2 TRP A 119 2.760 8.473 -16.264 1.00 61.34 H new ATOM 0 HB3 TRP A 119 1.292 9.080 -17.005 1.00 61.34 H new ATOM 0 HD1 TRP A 119 -1.074 8.214 -15.956 1.00 73.22 H new ATOM 0 HE1 TRP A 119 -1.688 7.244 -13.638 1.00 51.31 H new ATOM 0 HE3 TRP A 119 3.634 6.993 -14.385 1.00 52.30 H new ATOM 0 HZ2 TRP A 119 -0.309 6.118 -11.460 1.00 64.11 H new ATOM 0 HZ3 TRP A 119 3.908 5.972 -12.161 1.00 61.52 H new ATOM 0 HH2 TRP A 119 1.961 5.536 -10.721 1.00 23.32 H new ATOM 1916 N GLU A 120 0.253 7.599 -19.423 1.00 50.04 N ATOM 1917 CA GLU A 120 -1.014 7.475 -20.135 1.00 64.42 C ATOM 1918 C GLU A 120 -1.109 6.127 -20.845 1.00 44.12 C ATOM 1919 O GLU A 120 -2.092 5.402 -20.693 1.00 71.15 O ATOM 1920 CB GLU A 120 -1.168 8.610 -21.149 1.00 62.24 C ATOM 1921 CG GLU A 120 -2.564 8.713 -21.739 1.00 52.43 C ATOM 1922 CD GLU A 120 -2.618 8.276 -23.190 1.00 55.43 C ATOM 1923 OE1 GLU A 120 -2.377 9.125 -24.074 1.00 41.12 O ATOM 1924 OE2 GLU A 120 -2.902 7.087 -23.442 1.00 75.11 O ATOM 0 H GLU A 120 0.909 8.260 -19.840 1.00 50.04 H new ATOM 0 HA GLU A 120 -1.820 7.539 -19.404 1.00 64.42 H new ATOM 0 HB2 GLU A 120 -0.916 9.554 -20.666 1.00 62.24 H new ATOM 0 HB3 GLU A 120 -0.451 8.464 -21.957 1.00 62.24 H new ATOM 0 HG2 GLU A 120 -3.248 8.099 -21.153 1.00 52.43 H new ATOM 0 HG3 GLU A 120 -2.912 9.743 -21.660 1.00 52.43 H new ATOM 1931 N ILE A 121 -0.080 5.800 -21.620 1.00 73.24 N ATOM 1932 CA ILE A 121 -0.047 4.540 -22.353 1.00 53.33 C ATOM 1933 C ILE A 121 0.142 3.359 -21.408 1.00 20.02 C ATOM 1934 O ILE A 121 -0.318 2.250 -21.682 1.00 3.14 O ATOM 1935 CB ILE A 121 1.080 4.529 -23.403 1.00 14.11 C ATOM 1936 CG1 ILE A 121 1.058 3.218 -24.192 1.00 42.41 C ATOM 1937 CG2 ILE A 121 2.430 4.728 -22.732 1.00 25.42 C ATOM 1938 CD1 ILE A 121 1.978 2.158 -23.628 1.00 42.41 C ATOM 0 H ILE A 121 0.741 6.389 -21.756 1.00 73.24 H new ATOM 0 HA ILE A 121 -1.007 4.445 -22.861 1.00 53.33 H new ATOM 0 HB ILE A 121 0.918 5.352 -24.099 1.00 14.11 H new ATOM 0 HG12 ILE A 121 0.039 2.831 -24.210 1.00 42.41 H new ATOM 0 HG13 ILE A 121 1.340 3.420 -25.225 1.00 42.41 H new ATOM 0 HG21 ILE A 121 3.216 4.718 -23.487 1.00 25.42 H new ATOM 0 HG22 ILE A 121 2.440 5.685 -22.211 1.00 25.42 H new ATOM 0 HG23 ILE A 121 2.603 3.924 -22.017 1.00 25.42 H new ATOM 0 HD11 ILE A 121 1.911 1.257 -24.237 1.00 42.41 H new ATOM 0 HD12 ILE A 121 3.004 2.525 -23.635 1.00 42.41 H new ATOM 0 HD13 ILE A 121 1.683 1.927 -22.604 1.00 42.41 H new ATOM 1950 N LYS A 122 0.821 3.604 -20.292 1.00 52.12 N ATOM 1951 CA LYS A 122 1.069 2.562 -19.303 1.00 3.43 C ATOM 1952 C LYS A 122 -0.231 1.878 -18.895 1.00 73.42 C ATOM 1953 O LYS A 122 -0.233 0.711 -18.503 1.00 20.32 O ATOM 1954 CB LYS A 122 1.754 3.155 -18.069 1.00 42.01 C ATOM 1955 CG LYS A 122 0.784 3.593 -16.986 1.00 54.00 C ATOM 1956 CD LYS A 122 0.518 2.476 -15.990 1.00 44.42 C ATOM 1957 CE LYS A 122 -0.841 2.633 -15.326 1.00 1.21 C ATOM 1958 NZ LYS A 122 -0.944 1.830 -14.076 1.00 63.34 N ATOM 0 H LYS A 122 1.209 4.516 -20.050 1.00 52.12 H new ATOM 0 HA LYS A 122 1.725 1.817 -19.754 1.00 3.43 H new ATOM 0 HB2 LYS A 122 2.439 2.416 -17.654 1.00 42.01 H new ATOM 0 HB3 LYS A 122 2.355 4.011 -18.374 1.00 42.01 H new ATOM 0 HG2 LYS A 122 1.189 4.459 -16.463 1.00 54.00 H new ATOM 0 HG3 LYS A 122 -0.155 3.906 -17.442 1.00 54.00 H new ATOM 0 HD2 LYS A 122 0.566 1.514 -16.500 1.00 44.42 H new ATOM 0 HD3 LYS A 122 1.298 2.473 -15.229 1.00 44.42 H new ATOM 0 HE2 LYS A 122 -1.014 3.685 -15.097 1.00 1.21 H new ATOM 0 HE3 LYS A 122 -1.622 2.325 -16.021 1.00 1.21 H new ATOM 0 HZ1 LYS A 122 -1.936 1.799 -13.764 1.00 63.34 H new ATOM 0 HZ2 LYS A 122 -0.607 0.863 -14.256 1.00 63.34 H new ATOM 0 HZ3 LYS A 122 -0.361 2.267 -13.334 1.00 63.34 H new ATOM 1972 N ASP A 123 -1.336 2.610 -18.992 1.00 65.33 N ATOM 1973 CA ASP A 123 -2.643 2.072 -18.636 1.00 74.32 C ATOM 1974 C ASP A 123 -3.054 0.960 -19.597 1.00 43.11 C ATOM 1975 O ASP A 123 -3.693 -0.014 -19.199 1.00 50.03 O ATOM 1976 CB ASP A 123 -3.695 3.183 -18.643 1.00 64.40 C ATOM 1977 CG ASP A 123 -5.008 2.740 -18.029 1.00 55.24 C ATOM 1978 OD1 ASP A 123 -4.989 2.236 -16.887 1.00 54.13 O ATOM 1979 OD2 ASP A 123 -6.056 2.897 -18.692 1.00 2.23 O ATOM 0 H ASP A 123 -1.352 3.578 -19.314 1.00 65.33 H new ATOM 0 HA ASP A 123 -2.574 1.653 -17.632 1.00 74.32 H new ATOM 0 HB2 ASP A 123 -3.313 4.044 -18.095 1.00 64.40 H new ATOM 0 HB3 ASP A 123 -3.868 3.509 -19.669 1.00 64.40 H new ATOM 1984 N PHE A 124 -2.683 1.113 -20.864 1.00 3.31 N ATOM 1985 CA PHE A 124 -3.014 0.124 -21.882 1.00 62.45 C ATOM 1986 C PHE A 124 -2.220 -1.162 -21.670 1.00 60.10 C ATOM 1987 O PHE A 124 -2.758 -2.264 -21.785 1.00 14.03 O ATOM 1988 CB PHE A 124 -2.734 0.684 -23.278 1.00 53.24 C ATOM 1989 CG PHE A 124 -3.759 0.284 -24.301 1.00 50.42 C ATOM 1990 CD1 PHE A 124 -3.759 -0.992 -24.839 1.00 63.33 C ATOM 1991 CD2 PHE A 124 -4.722 1.186 -24.725 1.00 33.20 C ATOM 1992 CE1 PHE A 124 -4.701 -1.364 -25.780 1.00 45.44 C ATOM 1993 CE2 PHE A 124 -5.667 0.820 -25.665 1.00 42.14 C ATOM 1994 CZ PHE A 124 -5.655 -0.456 -26.195 1.00 12.43 C ATOM 0 H PHE A 124 -2.153 1.913 -21.210 1.00 3.31 H new ATOM 0 HA PHE A 124 -4.076 -0.107 -21.796 1.00 62.45 H new ATOM 0 HB2 PHE A 124 -2.693 1.772 -23.223 1.00 53.24 H new ATOM 0 HB3 PHE A 124 -1.752 0.344 -23.607 1.00 53.24 H new ATOM 0 HD1 PHE A 124 -3.014 -1.705 -24.519 1.00 63.33 H new ATOM 0 HD2 PHE A 124 -4.734 2.186 -24.317 1.00 33.20 H new ATOM 0 HE1 PHE A 124 -4.691 -2.363 -26.190 1.00 45.44 H new ATOM 0 HE2 PHE A 124 -6.414 1.531 -25.985 1.00 42.14 H new ATOM 0 HZ PHE A 124 -6.390 -0.743 -26.932 1.00 12.43 H new ATOM 2004 N LEU A 125 -0.937 -1.013 -21.360 1.00 63.44 N ATOM 2005 CA LEU A 125 -0.067 -2.162 -21.132 1.00 43.11 C ATOM 2006 C LEU A 125 -0.438 -2.877 -19.837 1.00 71.42 C ATOM 2007 O LEU A 125 -0.718 -4.076 -19.836 1.00 64.41 O ATOM 2008 CB LEU A 125 1.396 -1.717 -21.081 1.00 12.43 C ATOM 2009 CG LEU A 125 2.365 -2.493 -21.973 1.00 5.43 C ATOM 2010 CD1 LEU A 125 2.267 -3.985 -21.696 1.00 44.22 C ATOM 2011 CD2 LEU A 125 2.090 -2.201 -23.440 1.00 75.05 C ATOM 0 H LEU A 125 -0.476 -0.109 -21.261 1.00 63.44 H new ATOM 0 HA LEU A 125 -0.200 -2.857 -21.961 1.00 43.11 H new ATOM 0 HB2 LEU A 125 1.444 -0.664 -21.357 1.00 12.43 H new ATOM 0 HB3 LEU A 125 1.742 -1.793 -20.050 1.00 12.43 H new ATOM 0 HG LEU A 125 3.380 -2.168 -21.743 1.00 5.43 H new ATOM 0 HD11 LEU A 125 2.964 -4.521 -22.340 1.00 44.22 H new ATOM 0 HD12 LEU A 125 2.515 -4.178 -20.652 1.00 44.22 H new ATOM 0 HD13 LEU A 125 1.251 -4.326 -21.897 1.00 44.22 H new ATOM 0 HD21 LEU A 125 2.789 -2.762 -24.060 1.00 75.05 H new ATOM 0 HD22 LEU A 125 1.070 -2.497 -23.685 1.00 75.05 H new ATOM 0 HD23 LEU A 125 2.213 -1.134 -23.628 1.00 75.05 H new ATOM 2023 N VAL A 126 -0.441 -2.133 -18.736 1.00 30.33 N ATOM 2024 CA VAL A 126 -0.781 -2.695 -17.434 1.00 75.42 C ATOM 2025 C VAL A 126 -2.138 -3.389 -17.473 1.00 73.42 C ATOM 2026 O VAL A 126 -2.379 -4.346 -16.737 1.00 13.22 O ATOM 2027 CB VAL A 126 -0.804 -1.609 -16.342 1.00 62.42 C ATOM 2028 CG1 VAL A 126 -1.943 -0.631 -16.585 1.00 43.13 C ATOM 2029 CG2 VAL A 126 -0.919 -2.243 -14.964 1.00 11.31 C ATOM 0 H VAL A 126 -0.212 -1.139 -18.719 1.00 30.33 H new ATOM 0 HA VAL A 126 -0.009 -3.425 -17.193 1.00 75.42 H new ATOM 0 HB VAL A 126 0.133 -1.055 -16.385 1.00 62.42 H new ATOM 0 HG11 VAL A 126 -1.943 0.129 -15.803 1.00 43.13 H new ATOM 0 HG12 VAL A 126 -1.811 -0.153 -17.556 1.00 43.13 H new ATOM 0 HG13 VAL A 126 -2.892 -1.167 -16.570 1.00 43.13 H new ATOM 0 HG21 VAL A 126 -0.934 -1.462 -14.204 1.00 11.31 H new ATOM 0 HG22 VAL A 126 -1.840 -2.823 -14.906 1.00 11.31 H new ATOM 0 HG23 VAL A 126 -0.066 -2.899 -14.793 1.00 11.31 H new ATOM 2039 N SER A 127 -3.022 -2.901 -18.338 1.00 61.20 N ATOM 2040 CA SER A 127 -4.357 -3.472 -18.471 1.00 61.44 C ATOM 2041 C SER A 127 -4.284 -4.982 -18.682 1.00 45.31 C ATOM 2042 O SER A 127 -5.184 -5.719 -18.281 1.00 43.13 O ATOM 2043 CB SER A 127 -5.100 -2.819 -19.638 1.00 11.30 C ATOM 2044 OG SER A 127 -6.408 -3.347 -19.770 1.00 33.53 O ATOM 0 H SER A 127 -2.837 -2.112 -18.957 1.00 61.20 H new ATOM 0 HA SER A 127 -4.902 -3.277 -17.547 1.00 61.44 H new ATOM 0 HB2 SER A 127 -5.154 -1.742 -19.482 1.00 11.30 H new ATOM 0 HB3 SER A 127 -4.545 -2.980 -20.562 1.00 11.30 H new ATOM 0 HG SER A 127 -6.862 -2.912 -20.522 1.00 33.53 H new ATOM 2050 N GLN A 128 -3.205 -5.433 -19.314 1.00 3.21 N ATOM 2051 CA GLN A 128 -3.014 -6.854 -19.579 1.00 4.21 C ATOM 2052 C GLN A 128 -2.987 -7.651 -18.279 1.00 71.21 C ATOM 2053 O GLN A 128 -3.715 -8.632 -18.126 1.00 55.10 O ATOM 2054 CB GLN A 128 -1.715 -7.079 -20.356 1.00 34.22 C ATOM 2055 CG GLN A 128 -1.867 -6.901 -21.858 1.00 24.11 C ATOM 2056 CD GLN A 128 -2.361 -5.518 -22.235 1.00 22.42 C ATOM 2057 OE1 GLN A 128 -1.568 -4.615 -22.502 1.00 53.24 O ATOM 2058 NE2 GLN A 128 -3.677 -5.346 -22.258 1.00 53.02 N ATOM 0 H GLN A 128 -2.450 -4.835 -19.652 1.00 3.21 H new ATOM 0 HA GLN A 128 -3.854 -7.202 -20.180 1.00 4.21 H new ATOM 0 HB2 GLN A 128 -0.958 -6.385 -19.991 1.00 34.22 H new ATOM 0 HB3 GLN A 128 -1.349 -8.086 -20.153 1.00 34.22 H new ATOM 0 HG2 GLN A 128 -0.907 -7.084 -22.341 1.00 24.11 H new ATOM 0 HG3 GLN A 128 -2.563 -7.648 -22.240 1.00 24.11 H new ATOM 0 HE21 GLN A 128 -4.297 -6.123 -22.029 1.00 53.02 H new ATOM 0 HE22 GLN A 128 -4.068 -4.437 -22.504 1.00 53.02 H new ATOM 2067 N ASP A 129 -2.143 -7.224 -17.346 1.00 73.21 N ATOM 2068 CA ASP A 129 -2.022 -7.898 -16.058 1.00 73.15 C ATOM 2069 C ASP A 129 -1.509 -9.323 -16.237 1.00 64.32 C ATOM 2070 O ASP A 129 -1.620 -10.152 -15.333 1.00 40.42 O ATOM 2071 CB ASP A 129 -3.372 -7.916 -15.339 1.00 41.41 C ATOM 2072 CG ASP A 129 -3.322 -7.210 -13.998 1.00 55.33 C ATOM 2073 OD1 ASP A 129 -2.791 -6.081 -13.942 1.00 32.24 O ATOM 2074 OD2 ASP A 129 -3.814 -7.786 -13.005 1.00 73.24 O ATOM 0 H ASP A 129 -1.533 -6.414 -17.457 1.00 73.21 H new ATOM 0 HA ASP A 129 -1.304 -7.345 -15.453 1.00 73.15 H new ATOM 0 HB2 ASP A 129 -4.123 -7.440 -15.970 1.00 41.41 H new ATOM 0 HB3 ASP A 129 -3.688 -8.949 -15.191 1.00 41.41 H new ATOM 2079 N ARG A 130 -0.947 -9.602 -17.409 1.00 40.10 N ATOM 2080 CA ARG A 130 -0.418 -10.928 -17.707 1.00 54.50 C ATOM 2081 C ARG A 130 0.239 -10.954 -19.084 1.00 13.10 C ATOM 2082 O ARG A 130 -0.107 -11.778 -19.932 1.00 2.41 O ATOM 2083 CB ARG A 130 -1.535 -11.971 -17.643 1.00 21.31 C ATOM 2084 CG ARG A 130 -1.062 -13.342 -17.186 1.00 10.44 C ATOM 2085 CD ARG A 130 -2.169 -14.379 -17.298 1.00 5.34 C ATOM 2086 NE ARG A 130 -2.887 -14.551 -16.038 1.00 10.32 N ATOM 2087 CZ ARG A 130 -4.008 -15.254 -15.921 1.00 63.31 C ATOM 2088 NH1 ARG A 130 -4.535 -15.849 -16.983 1.00 2.44 N ATOM 2089 NH2 ARG A 130 -4.603 -15.365 -14.741 1.00 12.25 N ATOM 0 H ARG A 130 -0.846 -8.928 -18.168 1.00 40.10 H new ATOM 0 HA ARG A 130 0.337 -11.168 -16.959 1.00 54.50 H new ATOM 0 HB2 ARG A 130 -2.311 -11.619 -16.964 1.00 21.31 H new ATOM 0 HB3 ARG A 130 -1.992 -12.063 -18.628 1.00 21.31 H new ATOM 0 HG2 ARG A 130 -0.208 -13.653 -17.788 1.00 10.44 H new ATOM 0 HG3 ARG A 130 -0.719 -13.284 -16.153 1.00 10.44 H new ATOM 0 HD2 ARG A 130 -2.870 -14.078 -18.077 1.00 5.34 H new ATOM 0 HD3 ARG A 130 -1.742 -15.334 -17.605 1.00 5.34 H new ATOM 0 HE ARG A 130 -2.507 -14.107 -15.202 1.00 10.32 H new ATOM 0 HH11 ARG A 130 -4.079 -15.767 -17.892 1.00 2.44 H new ATOM 0 HH12 ARG A 130 -5.396 -16.388 -16.891 1.00 2.44 H new ATOM 0 HH21 ARG A 130 -4.200 -14.910 -13.922 1.00 12.25 H new ATOM 0 HH22 ARG A 130 -5.464 -15.905 -14.653 1.00 12.25 H new ATOM 2103 N CYS A 131 1.186 -10.048 -19.299 1.00 10.11 N ATOM 2104 CA CYS A 131 1.891 -9.966 -20.573 1.00 73.24 C ATOM 2105 C CYS A 131 3.310 -9.443 -20.377 1.00 52.34 C ATOM 2106 O CYS A 131 3.558 -8.600 -19.516 1.00 15.32 O ATOM 2107 CB CYS A 131 1.130 -9.061 -21.544 1.00 32.44 C ATOM 2108 SG CYS A 131 1.151 -9.634 -23.258 1.00 62.34 S ATOM 0 H CYS A 131 1.483 -9.360 -18.607 1.00 10.11 H new ATOM 0 HA CYS A 131 1.948 -10.970 -20.993 1.00 73.24 H new ATOM 0 HB2 CYS A 131 0.095 -8.979 -21.212 1.00 32.44 H new ATOM 0 HB3 CYS A 131 1.558 -8.060 -21.502 1.00 32.44 H new ATOM 0 HG CYS A 131 0.480 -8.805 -24.001 1.00 62.34 H new ATOM 2114 N ALA A 132 4.238 -9.950 -21.182 1.00 3.51 N ATOM 2115 CA ALA A 132 5.633 -9.533 -21.097 1.00 55.12 C ATOM 2116 C ALA A 132 6.018 -8.660 -22.287 1.00 12.35 C ATOM 2117 O ALA A 132 5.667 -8.960 -23.427 1.00 51.41 O ATOM 2118 CB ALA A 132 6.543 -10.749 -21.016 1.00 71.43 C ATOM 0 H ALA A 132 4.050 -10.650 -21.900 1.00 3.51 H new ATOM 0 HA ALA A 132 5.755 -8.941 -20.190 1.00 55.12 H new ATOM 0 HB1 ALA A 132 7.581 -10.423 -20.953 1.00 71.43 H new ATOM 0 HB2 ALA A 132 6.292 -11.333 -20.131 1.00 71.43 H new ATOM 0 HB3 ALA A 132 6.409 -11.364 -21.906 1.00 71.43 H new ATOM 2124 N GLU A 133 6.741 -7.578 -22.011 1.00 74.45 N ATOM 2125 CA GLU A 133 7.171 -6.661 -23.060 1.00 64.42 C ATOM 2126 C GLU A 133 8.491 -5.991 -22.689 1.00 22.54 C ATOM 2127 O GLU A 133 8.710 -5.623 -21.534 1.00 62.35 O ATOM 2128 CB GLU A 133 6.100 -5.598 -23.311 1.00 31.15 C ATOM 2129 CG GLU A 133 4.824 -6.152 -23.921 1.00 34.21 C ATOM 2130 CD GLU A 133 3.902 -5.063 -24.435 1.00 21.21 C ATOM 2131 OE1 GLU A 133 4.415 -4.029 -24.912 1.00 61.44 O ATOM 2132 OE2 GLU A 133 2.669 -5.244 -24.359 1.00 71.15 O ATOM 0 H GLU A 133 7.040 -7.316 -21.072 1.00 74.45 H new ATOM 0 HA GLU A 133 7.320 -7.238 -23.973 1.00 64.42 H new ATOM 0 HB2 GLU A 133 5.859 -5.108 -22.368 1.00 31.15 H new ATOM 0 HB3 GLU A 133 6.507 -4.833 -23.973 1.00 31.15 H new ATOM 0 HG2 GLU A 133 5.079 -6.823 -24.741 1.00 34.21 H new ATOM 0 HG3 GLU A 133 4.297 -6.746 -23.175 1.00 34.21 H new ATOM 2139 N VAL A 134 9.368 -5.837 -23.676 1.00 23.34 N ATOM 2140 CA VAL A 134 10.666 -5.212 -23.454 1.00 5.31 C ATOM 2141 C VAL A 134 11.156 -4.501 -24.711 1.00 14.34 C ATOM 2142 O VAL A 134 11.047 -5.028 -25.818 1.00 51.34 O ATOM 2143 CB VAL A 134 11.721 -6.247 -23.019 1.00 43.53 C ATOM 2144 CG1 VAL A 134 13.086 -5.591 -22.877 1.00 42.52 C ATOM 2145 CG2 VAL A 134 11.305 -6.917 -21.719 1.00 31.11 C ATOM 0 H VAL A 134 9.203 -6.137 -24.637 1.00 23.34 H new ATOM 0 HA VAL A 134 10.533 -4.482 -22.655 1.00 5.31 H new ATOM 0 HB VAL A 134 11.792 -7.014 -23.790 1.00 43.53 H new ATOM 0 HG11 VAL A 134 13.818 -6.337 -22.569 1.00 42.52 H new ATOM 0 HG12 VAL A 134 13.385 -5.162 -23.834 1.00 42.52 H new ATOM 0 HG13 VAL A 134 13.034 -4.802 -22.126 1.00 42.52 H new ATOM 0 HG21 VAL A 134 12.062 -7.645 -21.427 1.00 31.11 H new ATOM 0 HG22 VAL A 134 11.205 -6.164 -20.937 1.00 31.11 H new ATOM 0 HG23 VAL A 134 10.350 -7.423 -21.860 1.00 31.11 H new ATOM 2155 N THR A 135 11.696 -3.299 -24.532 1.00 21.31 N ATOM 2156 CA THR A 135 12.202 -2.515 -25.651 1.00 50.40 C ATOM 2157 C THR A 135 13.483 -1.780 -25.273 1.00 12.42 C ATOM 2158 O THR A 135 13.492 -0.961 -24.353 1.00 3.42 O ATOM 2159 CB THR A 135 11.159 -1.489 -26.135 1.00 62.52 C ATOM 2160 OG1 THR A 135 10.243 -1.186 -25.078 1.00 11.14 O ATOM 2161 CG2 THR A 135 10.395 -2.022 -27.338 1.00 50.20 C ATOM 0 H THR A 135 11.794 -2.848 -23.622 1.00 21.31 H new ATOM 0 HA THR A 135 12.413 -3.216 -26.458 1.00 50.40 H new ATOM 0 HB THR A 135 11.684 -0.581 -26.431 1.00 62.52 H new ATOM 0 HG1 THR A 135 10.701 -1.268 -24.215 1.00 11.14 H new ATOM 0 HG21 THR A 135 9.664 -1.281 -27.662 1.00 50.20 H new ATOM 0 HG22 THR A 135 11.092 -2.224 -28.151 1.00 50.20 H new ATOM 0 HG23 THR A 135 9.881 -2.943 -27.063 1.00 50.20 H new ATOM 2169 N LEU A 136 14.562 -2.076 -25.988 1.00 25.13 N ATOM 2170 CA LEU A 136 15.850 -1.442 -25.727 1.00 63.23 C ATOM 2171 C LEU A 136 16.676 -1.341 -27.006 1.00 30.31 C ATOM 2172 O LEU A 136 16.657 -2.245 -27.841 1.00 30.13 O ATOM 2173 CB LEU A 136 16.624 -2.230 -24.668 1.00 54.41 C ATOM 2174 CG LEU A 136 17.149 -3.599 -25.100 1.00 45.34 C ATOM 2175 CD1 LEU A 136 18.610 -3.503 -25.515 1.00 33.34 C ATOM 2176 CD2 LEU A 136 16.976 -4.614 -23.981 1.00 22.54 C ATOM 0 H LEU A 136 14.571 -2.751 -26.753 1.00 25.13 H new ATOM 0 HA LEU A 136 15.662 -0.434 -25.356 1.00 63.23 H new ATOM 0 HB2 LEU A 136 17.470 -1.626 -24.341 1.00 54.41 H new ATOM 0 HB3 LEU A 136 15.977 -2.368 -23.802 1.00 54.41 H new ATOM 0 HG LEU A 136 16.569 -3.935 -25.960 1.00 45.34 H new ATOM 0 HD11 LEU A 136 18.967 -4.487 -25.819 1.00 33.34 H new ATOM 0 HD12 LEU A 136 18.706 -2.808 -26.349 1.00 33.34 H new ATOM 0 HD13 LEU A 136 19.204 -3.145 -24.674 1.00 33.34 H new ATOM 0 HD21 LEU A 136 17.355 -5.583 -24.307 1.00 22.54 H new ATOM 0 HD22 LEU A 136 17.530 -4.284 -23.102 1.00 22.54 H new ATOM 0 HD23 LEU A 136 15.919 -4.704 -23.731 1.00 22.54 H new