USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=19 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 Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 MET CE :methyl 173:sc= 0 (180deg=-0.0052) USER MOD Single : A 20 GLN : amide:sc=-0.00242 X(o=-0.0024,f=-0.011) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot -4:sc= 0.783 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -169:sc= -0.121 (180deg=-0.345) USER MOD Single : A 70 THR OG1 : rot 140:sc= -0.715 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0337 USER MOD Single : A 74 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.011) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.586 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -44:sc= 0.868 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 150:sc= -0.098 USER MOD Single : A 93 ASN : amide:sc= -3.82 K(o=-3.8,f=-5.4) USER MOD Single : A 95 ASN : amide:sc= -0.816 K(o=-0.82,f=-5.8!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.336 K(o=-0.34,f=-6.2!) USER MOD Single : A 105 SER OG : rot 180:sc= 0.00602 USER MOD Single : A 111 MET CE :methyl -170:sc= -4.57 (180deg=-5.22) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 86:sc= 1.15 USER MOD Single : A 128 GLN : amide:sc= -0.0298 K(o=-0.03,f=-1.5) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.0895 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 3.854 4.596 -6.998 1.00 21.32 N ATOM 70 CA LYS A 4 5.244 5.036 -6.986 1.00 22.53 C ATOM 71 C LYS A 4 6.019 4.359 -5.859 1.00 51.50 C ATOM 72 O LYS A 4 6.654 5.027 -5.042 1.00 34.21 O ATOM 73 CB LYS A 4 5.318 6.556 -6.829 1.00 2.10 C ATOM 74 CG LYS A 4 4.517 7.086 -5.652 1.00 71.05 C ATOM 75 CD LYS A 4 5.028 8.442 -5.195 1.00 22.31 C ATOM 76 CE LYS A 4 4.400 8.857 -3.874 1.00 10.44 C ATOM 77 NZ LYS A 4 5.137 9.986 -3.240 1.00 33.22 N ATOM 0 HA LYS A 4 5.697 4.753 -7.936 1.00 22.53 H new ATOM 0 HB2 LYS A 4 6.361 6.850 -6.710 1.00 2.10 H new ATOM 0 HB3 LYS A 4 4.957 7.025 -7.744 1.00 2.10 H new ATOM 0 HG2 LYS A 4 3.467 7.168 -5.933 1.00 71.05 H new ATOM 0 HG3 LYS A 4 4.572 6.378 -4.825 1.00 71.05 H new ATOM 0 HD2 LYS A 4 6.112 8.407 -5.089 1.00 22.31 H new ATOM 0 HD3 LYS A 4 4.807 9.191 -5.956 1.00 22.31 H new ATOM 0 HE2 LYS A 4 3.363 9.148 -4.040 1.00 10.44 H new ATOM 0 HE3 LYS A 4 4.387 8.005 -3.195 1.00 10.44 H new ATOM 0 HZ1 LYS A 4 4.678 10.239 -2.342 1.00 33.22 H new ATOM 0 HZ2 LYS A 4 6.120 9.700 -3.058 1.00 33.22 H new ATOM 0 HZ3 LYS A 4 5.128 10.808 -3.877 1.00 33.22 H new ATOM 91 N ASP A 5 5.964 3.033 -5.823 1.00 32.35 N ATOM 92 CA ASP A 5 6.663 2.266 -4.797 1.00 54.34 C ATOM 93 C ASP A 5 8.132 2.081 -5.164 1.00 53.23 C ATOM 94 O ASP A 5 8.598 0.957 -5.350 1.00 61.14 O ATOM 95 CB ASP A 5 5.996 0.903 -4.607 1.00 1.05 C ATOM 96 CG ASP A 5 6.222 0.338 -3.218 1.00 71.51 C ATOM 97 OD1 ASP A 5 6.761 1.068 -2.360 1.00 62.31 O ATOM 98 OD2 ASP A 5 5.858 -0.835 -2.989 1.00 44.22 O ATOM 0 H ASP A 5 5.443 2.466 -6.492 1.00 32.35 H new ATOM 0 HA ASP A 5 6.608 2.822 -3.861 1.00 54.34 H new ATOM 0 HB2 ASP A 5 4.925 0.997 -4.788 1.00 1.05 H new ATOM 0 HB3 ASP A 5 6.385 0.205 -5.348 1.00 1.05 H new ATOM 103 N ILE A 6 8.855 3.191 -5.268 1.00 12.23 N ATOM 104 CA ILE A 6 10.270 3.151 -5.612 1.00 65.34 C ATOM 105 C ILE A 6 11.143 3.292 -4.370 1.00 1.32 C ATOM 106 O ILE A 6 10.641 3.521 -3.269 1.00 42.43 O ATOM 107 CB ILE A 6 10.638 4.262 -6.613 1.00 61.25 C ATOM 108 CG1 ILE A 6 10.237 5.631 -6.060 1.00 21.54 C ATOM 109 CG2 ILE A 6 9.966 4.010 -7.955 1.00 22.41 C ATOM 110 CD1 ILE A 6 10.964 6.784 -6.715 1.00 11.11 C ATOM 0 H ILE A 6 8.484 4.129 -5.119 1.00 12.23 H new ATOM 0 HA ILE A 6 10.454 2.181 -6.074 1.00 65.34 H new ATOM 0 HB ILE A 6 11.718 4.253 -6.761 1.00 61.25 H new ATOM 0 HG12 ILE A 6 9.164 5.767 -6.192 1.00 21.54 H new ATOM 0 HG13 ILE A 6 10.431 5.652 -4.988 1.00 21.54 H new ATOM 0 HG21 ILE A 6 10.236 4.804 -8.652 1.00 22.41 H new ATOM 0 HG22 ILE A 6 10.296 3.050 -8.353 1.00 22.41 H new ATOM 0 HG23 ILE A 6 8.884 3.995 -7.823 1.00 22.41 H new ATOM 0 HD11 ILE A 6 10.630 7.723 -6.273 1.00 11.11 H new ATOM 0 HD12 ILE A 6 12.037 6.672 -6.561 1.00 11.11 H new ATOM 0 HD13 ILE A 6 10.750 6.789 -7.784 1.00 11.11 H new ATOM 122 N ARG A 7 12.452 3.156 -4.554 1.00 42.22 N ATOM 123 CA ARG A 7 13.395 3.270 -3.448 1.00 63.43 C ATOM 124 C ARG A 7 14.031 4.657 -3.416 1.00 33.53 C ATOM 125 O ARG A 7 15.234 4.794 -3.197 1.00 24.14 O ATOM 126 CB ARG A 7 14.484 2.201 -3.567 1.00 14.05 C ATOM 127 CG ARG A 7 13.968 0.784 -3.378 1.00 64.51 C ATOM 128 CD ARG A 7 14.119 0.323 -1.937 1.00 21.03 C ATOM 129 NE ARG A 7 15.367 -0.405 -1.722 1.00 40.23 N ATOM 130 CZ ARG A 7 15.655 -1.056 -0.601 1.00 12.44 C ATOM 131 NH1 ARG A 7 14.788 -1.070 0.403 1.00 40.25 N ATOM 132 NH2 ARG A 7 16.812 -1.695 -0.481 1.00 54.31 N ATOM 0 H ARG A 7 12.884 2.967 -5.459 1.00 42.22 H new ATOM 0 HA ARG A 7 12.846 3.119 -2.518 1.00 63.43 H new ATOM 0 HB2 ARG A 7 14.954 2.280 -4.547 1.00 14.05 H new ATOM 0 HB3 ARG A 7 15.258 2.399 -2.826 1.00 14.05 H new ATOM 0 HG2 ARG A 7 12.918 0.736 -3.668 1.00 64.51 H new ATOM 0 HG3 ARG A 7 14.512 0.107 -4.037 1.00 64.51 H new ATOM 0 HD2 ARG A 7 14.085 1.188 -1.275 1.00 21.03 H new ATOM 0 HD3 ARG A 7 13.277 -0.315 -1.671 1.00 21.03 H new ATOM 0 HE ARG A 7 16.055 -0.414 -2.475 1.00 40.23 H new ATOM 0 HH11 ARG A 7 13.898 -0.580 0.315 1.00 40.25 H new ATOM 0 HH12 ARG A 7 15.012 -1.571 1.263 1.00 40.25 H new ATOM 0 HH21 ARG A 7 17.482 -1.687 -1.250 1.00 54.31 H new ATOM 0 HH22 ARG A 7 17.032 -2.195 0.381 1.00 54.31 H new ATOM 146 N ASP A 8 13.214 5.681 -3.636 1.00 20.14 N ATOM 147 CA ASP A 8 13.696 7.057 -3.631 1.00 14.41 C ATOM 148 C ASP A 8 14.707 7.283 -4.750 1.00 61.04 C ATOM 149 O ASP A 8 15.625 8.092 -4.617 1.00 43.44 O ATOM 150 CB ASP A 8 14.328 7.394 -2.280 1.00 1.42 C ATOM 151 CG ASP A 8 13.508 6.881 -1.113 1.00 1.05 C ATOM 152 OD1 ASP A 8 12.525 7.553 -0.737 1.00 41.34 O ATOM 153 OD2 ASP A 8 13.850 5.807 -0.574 1.00 11.35 O ATOM 0 H ASP A 8 12.215 5.584 -3.820 1.00 20.14 H new ATOM 0 HA ASP A 8 12.843 7.715 -3.798 1.00 14.41 H new ATOM 0 HB2 ASP A 8 15.329 6.965 -2.233 1.00 1.42 H new ATOM 0 HB3 ASP A 8 14.440 8.475 -2.194 1.00 1.42 H new ATOM 158 N TYR A 9 14.533 6.562 -5.852 1.00 71.32 N ATOM 159 CA TYR A 9 15.432 6.680 -6.994 1.00 3.44 C ATOM 160 C TYR A 9 16.861 6.315 -6.602 1.00 12.02 C ATOM 161 O TYR A 9 17.616 7.154 -6.113 1.00 0.10 O ATOM 162 CB TYR A 9 15.393 8.103 -7.554 1.00 65.04 C ATOM 163 CG TYR A 9 13.994 8.611 -7.819 1.00 44.44 C ATOM 164 CD1 TYR A 9 13.263 8.154 -8.908 1.00 73.35 C ATOM 165 CD2 TYR A 9 13.405 9.550 -6.982 1.00 35.22 C ATOM 166 CE1 TYR A 9 11.984 8.616 -9.155 1.00 63.21 C ATOM 167 CE2 TYR A 9 12.126 10.016 -7.220 1.00 3.31 C ATOM 168 CZ TYR A 9 11.420 9.547 -8.308 1.00 23.42 C ATOM 169 OH TYR A 9 10.147 10.010 -8.549 1.00 63.11 O ATOM 0 H TYR A 9 13.777 5.889 -5.979 1.00 71.32 H new ATOM 0 HA TYR A 9 15.096 5.984 -7.763 1.00 3.44 H new ATOM 0 HB2 TYR A 9 15.887 8.774 -6.852 1.00 65.04 H new ATOM 0 HB3 TYR A 9 15.964 8.135 -8.482 1.00 65.04 H new ATOM 0 HD1 TYR A 9 13.702 7.425 -9.573 1.00 73.35 H new ATOM 0 HD2 TYR A 9 13.956 9.922 -6.131 1.00 35.22 H new ATOM 0 HE1 TYR A 9 11.429 8.250 -10.006 1.00 63.21 H new ATOM 0 HE2 TYR A 9 11.681 10.744 -6.557 1.00 3.31 H new ATOM 0 HH TYR A 9 9.899 10.660 -7.859 1.00 63.11 H new ATOM 179 N ASN A 10 17.224 5.055 -6.821 1.00 52.54 N ATOM 180 CA ASN A 10 18.562 4.577 -6.492 1.00 15.01 C ATOM 181 C ASN A 10 18.792 3.177 -7.053 1.00 1.11 C ATOM 182 O ASN A 10 19.613 2.984 -7.950 1.00 3.04 O ATOM 183 CB ASN A 10 18.764 4.571 -4.975 1.00 64.34 C ATOM 184 CG ASN A 10 19.999 5.344 -4.554 1.00 51.20 C ATOM 185 OD1 ASN A 10 19.901 6.458 -4.038 1.00 62.23 O ATOM 186 ND2 ASN A 10 21.169 4.756 -4.773 1.00 30.42 N ATOM 0 H ASN A 10 16.611 4.347 -7.225 1.00 52.54 H new ATOM 0 HA ASN A 10 19.286 5.254 -6.946 1.00 15.01 H new ATOM 0 HB2 ASN A 10 17.887 5.002 -4.493 1.00 64.34 H new ATOM 0 HB3 ASN A 10 18.846 3.542 -4.626 1.00 64.34 H new ATOM 0 HD21 ASN A 10 22.034 5.228 -4.511 1.00 30.42 H new ATOM 0 HD22 ASN A 10 21.203 3.832 -5.203 1.00 30.42 H new ATOM 193 N ASP A 11 18.062 2.204 -6.519 1.00 54.42 N ATOM 194 CA ASP A 11 18.185 0.822 -6.967 1.00 53.03 C ATOM 195 C ASP A 11 16.821 0.139 -7.003 1.00 21.00 C ATOM 196 O ASP A 11 16.679 -1.008 -6.580 1.00 2.22 O ATOM 197 CB ASP A 11 19.133 0.048 -6.049 1.00 55.54 C ATOM 198 CG ASP A 11 20.009 -0.926 -6.811 1.00 44.33 C ATOM 199 OD1 ASP A 11 19.460 -1.745 -7.577 1.00 70.14 O ATOM 200 OD2 ASP A 11 21.245 -0.868 -6.642 1.00 62.22 O ATOM 0 H ASP A 11 17.379 2.347 -5.775 1.00 54.42 H new ATOM 0 HA ASP A 11 18.595 0.828 -7.977 1.00 53.03 H new ATOM 0 HB2 ASP A 11 19.764 0.752 -5.506 1.00 55.54 H new ATOM 0 HB3 ASP A 11 18.551 -0.496 -5.306 1.00 55.54 H new ATOM 205 N ALA A 12 15.821 0.852 -7.510 1.00 12.22 N ATOM 206 CA ALA A 12 14.469 0.315 -7.601 1.00 60.45 C ATOM 207 C ALA A 12 14.393 -0.808 -8.631 1.00 42.53 C ATOM 208 O ALA A 12 13.666 -1.784 -8.447 1.00 42.10 O ATOM 209 CB ALA A 12 13.484 1.420 -7.950 1.00 13.54 C ATOM 0 H ALA A 12 15.922 1.803 -7.864 1.00 12.22 H new ATOM 0 HA ALA A 12 14.203 -0.099 -6.629 1.00 60.45 H new ATOM 0 HB1 ALA A 12 12.479 1.004 -8.015 1.00 13.54 H new ATOM 0 HB2 ALA A 12 13.510 2.188 -7.177 1.00 13.54 H new ATOM 0 HB3 ALA A 12 13.757 1.861 -8.909 1.00 13.54 H new ATOM 215 N ASP A 13 15.147 -0.661 -9.715 1.00 62.41 N ATOM 216 CA ASP A 13 15.166 -1.663 -10.775 1.00 34.34 C ATOM 217 C ASP A 13 15.443 -3.051 -10.205 1.00 62.14 C ATOM 218 O ASP A 13 14.917 -4.050 -10.695 1.00 14.13 O ATOM 219 CB ASP A 13 16.221 -1.308 -11.823 1.00 73.24 C ATOM 220 CG ASP A 13 16.190 0.160 -12.201 1.00 61.44 C ATOM 221 OD1 ASP A 13 15.122 0.790 -12.049 1.00 64.24 O ATOM 222 OD2 ASP A 13 17.234 0.679 -12.649 1.00 21.55 O ATOM 0 H ASP A 13 15.753 0.142 -9.883 1.00 62.41 H new ATOM 0 HA ASP A 13 14.185 -1.674 -11.249 1.00 34.34 H new ATOM 0 HB2 ASP A 13 17.209 -1.561 -11.439 1.00 73.24 H new ATOM 0 HB3 ASP A 13 16.061 -1.913 -12.715 1.00 73.24 H new ATOM 227 N MET A 14 16.274 -3.105 -9.170 1.00 2.13 N ATOM 228 CA MET A 14 16.622 -4.371 -8.534 1.00 54.40 C ATOM 229 C MET A 14 15.367 -5.156 -8.166 1.00 20.34 C ATOM 230 O MET A 14 15.325 -6.378 -8.305 1.00 65.20 O ATOM 231 CB MET A 14 17.468 -4.123 -7.284 1.00 13.33 C ATOM 232 CG MET A 14 18.832 -4.791 -7.331 1.00 31.42 C ATOM 233 SD MET A 14 19.437 -5.251 -5.696 1.00 1.24 S ATOM 234 CE MET A 14 20.590 -6.555 -6.115 1.00 63.35 C ATOM 0 H MET A 14 16.719 -2.287 -8.753 1.00 2.13 H new ATOM 0 HA MET A 14 17.202 -4.959 -9.245 1.00 54.40 H new ATOM 0 HB2 MET A 14 17.603 -3.049 -7.154 1.00 13.33 H new ATOM 0 HB3 MET A 14 16.925 -4.485 -6.410 1.00 13.33 H new ATOM 0 HG2 MET A 14 18.775 -5.682 -7.957 1.00 31.42 H new ATOM 0 HG3 MET A 14 19.547 -4.116 -7.802 1.00 31.42 H new ATOM 0 HE1 MET A 14 21.138 -6.857 -5.222 1.00 63.35 H new ATOM 0 HE2 MET A 14 20.043 -7.410 -6.512 1.00 63.35 H new ATOM 0 HE3 MET A 14 21.292 -6.193 -6.866 1.00 63.35 H new ATOM 244 N ALA A 15 14.347 -4.447 -7.695 1.00 12.42 N ATOM 245 CA ALA A 15 13.091 -5.078 -7.308 1.00 41.22 C ATOM 246 C ALA A 15 12.563 -5.977 -8.421 1.00 51.52 C ATOM 247 O ALA A 15 11.889 -6.973 -8.160 1.00 53.10 O ATOM 248 CB ALA A 15 12.058 -4.021 -6.946 1.00 45.42 C ATOM 0 H ALA A 15 14.366 -3.435 -7.572 1.00 12.42 H new ATOM 0 HA ALA A 15 13.280 -5.700 -6.433 1.00 41.22 H new ATOM 0 HB1 ALA A 15 11.125 -4.507 -6.659 1.00 45.42 H new ATOM 0 HB2 ALA A 15 12.426 -3.422 -6.113 1.00 45.42 H new ATOM 0 HB3 ALA A 15 11.881 -3.375 -7.806 1.00 45.42 H new ATOM 254 N ARG A 16 12.873 -5.617 -9.663 1.00 20.53 N ATOM 255 CA ARG A 16 12.428 -6.391 -10.815 1.00 54.15 C ATOM 256 C ARG A 16 12.932 -7.829 -10.733 1.00 53.22 C ATOM 257 O ARG A 16 12.248 -8.763 -11.154 1.00 13.13 O ATOM 258 CB ARG A 16 12.916 -5.741 -12.112 1.00 31.43 C ATOM 259 CG ARG A 16 12.226 -6.274 -13.357 1.00 52.50 C ATOM 260 CD ARG A 16 12.980 -5.887 -14.620 1.00 31.12 C ATOM 261 NE ARG A 16 13.112 -7.010 -15.544 1.00 30.42 N ATOM 262 CZ ARG A 16 13.367 -6.870 -16.840 1.00 3.13 C ATOM 263 NH1 ARG A 16 13.518 -5.660 -17.362 1.00 33.42 N ATOM 264 NH2 ARG A 16 13.473 -7.941 -17.616 1.00 42.43 N ATOM 0 H ARG A 16 13.430 -4.795 -9.896 1.00 20.53 H new ATOM 0 HA ARG A 16 11.338 -6.406 -10.811 1.00 54.15 H new ATOM 0 HB2 ARG A 16 12.757 -4.664 -12.051 1.00 31.43 H new ATOM 0 HB3 ARG A 16 13.990 -5.899 -12.206 1.00 31.43 H new ATOM 0 HG2 ARG A 16 12.150 -7.360 -13.296 1.00 52.50 H new ATOM 0 HG3 ARG A 16 11.209 -5.885 -13.405 1.00 52.50 H new ATOM 0 HD2 ARG A 16 12.459 -5.068 -15.117 1.00 31.12 H new ATOM 0 HD3 ARG A 16 13.971 -5.519 -14.353 1.00 31.12 H new ATOM 0 HE ARG A 16 13.002 -7.954 -15.174 1.00 30.42 H new ATOM 0 HH11 ARG A 16 13.438 -4.835 -16.768 1.00 33.42 H new ATOM 0 HH12 ARG A 16 13.714 -5.555 -18.357 1.00 33.42 H new ATOM 0 HH21 ARG A 16 13.359 -8.873 -17.217 1.00 42.43 H new ATOM 0 HH22 ARG A 16 13.669 -7.832 -18.611 1.00 42.43 H new ATOM 278 N LEU A 17 14.132 -7.999 -10.190 1.00 32.14 N ATOM 279 CA LEU A 17 14.729 -9.323 -10.052 1.00 74.23 C ATOM 280 C LEU A 17 13.937 -10.178 -9.067 1.00 43.41 C ATOM 281 O LEU A 17 13.938 -11.406 -9.155 1.00 35.24 O ATOM 282 CB LEU A 17 16.181 -9.204 -9.589 1.00 45.20 C ATOM 283 CG LEU A 17 16.395 -9.054 -8.082 1.00 64.34 C ATOM 284 CD1 LEU A 17 16.582 -10.416 -7.432 1.00 21.30 C ATOM 285 CD2 LEU A 17 17.592 -8.158 -7.800 1.00 3.10 C ATOM 0 H LEU A 17 14.711 -7.237 -9.838 1.00 32.14 H new ATOM 0 HA LEU A 17 14.704 -9.809 -11.028 1.00 74.23 H new ATOM 0 HB2 LEU A 17 16.723 -10.088 -9.926 1.00 45.20 H new ATOM 0 HB3 LEU A 17 16.631 -8.345 -10.087 1.00 45.20 H new ATOM 0 HG LEU A 17 15.508 -8.588 -7.653 1.00 64.34 H new ATOM 0 HD11 LEU A 17 16.733 -10.290 -6.360 1.00 21.30 H new ATOM 0 HD12 LEU A 17 15.695 -11.026 -7.604 1.00 21.30 H new ATOM 0 HD13 LEU A 17 17.452 -10.910 -7.865 1.00 21.30 H new ATOM 0 HD21 LEU A 17 17.729 -8.063 -6.723 1.00 3.10 H new ATOM 0 HD22 LEU A 17 18.487 -8.596 -8.242 1.00 3.10 H new ATOM 0 HD23 LEU A 17 17.419 -7.173 -8.232 1.00 3.10 H new ATOM 297 N LEU A 18 13.262 -9.520 -8.131 1.00 51.33 N ATOM 298 CA LEU A 18 12.464 -10.219 -7.130 1.00 55.32 C ATOM 299 C LEU A 18 11.502 -11.202 -7.790 1.00 21.11 C ATOM 300 O LEU A 18 11.159 -12.232 -7.210 1.00 54.32 O ATOM 301 CB LEU A 18 11.681 -9.215 -6.281 1.00 44.24 C ATOM 302 CG LEU A 18 11.464 -9.599 -4.817 1.00 61.24 C ATOM 303 CD1 LEU A 18 10.623 -10.862 -4.716 1.00 54.13 C ATOM 304 CD2 LEU A 18 12.799 -9.788 -4.112 1.00 1.23 C ATOM 0 H LEU A 18 13.251 -8.504 -8.044 1.00 51.33 H new ATOM 0 HA LEU A 18 13.143 -10.779 -6.487 1.00 55.32 H new ATOM 0 HB2 LEU A 18 12.203 -8.259 -6.311 1.00 44.24 H new ATOM 0 HB3 LEU A 18 10.706 -9.061 -6.744 1.00 44.24 H new ATOM 0 HG LEU A 18 10.927 -8.789 -4.324 1.00 61.24 H new ATOM 0 HD11 LEU A 18 10.479 -11.120 -3.667 1.00 54.13 H new ATOM 0 HD12 LEU A 18 9.654 -10.692 -5.184 1.00 54.13 H new ATOM 0 HD13 LEU A 18 11.133 -11.680 -5.224 1.00 54.13 H new ATOM 0 HD21 LEU A 18 12.625 -10.061 -3.071 1.00 1.23 H new ATOM 0 HD22 LEU A 18 13.362 -10.580 -4.606 1.00 1.23 H new ATOM 0 HD23 LEU A 18 13.367 -8.859 -4.153 1.00 1.23 H new ATOM 316 N GLU A 19 11.074 -10.878 -9.006 1.00 12.31 N ATOM 317 CA GLU A 19 10.153 -11.734 -9.744 1.00 62.14 C ATOM 318 C GLU A 19 10.671 -13.168 -9.801 1.00 32.54 C ATOM 319 O GLU A 19 9.890 -14.118 -9.856 1.00 23.41 O ATOM 320 CB GLU A 19 9.949 -11.198 -11.163 1.00 5.21 C ATOM 321 CG GLU A 19 8.497 -10.902 -11.499 1.00 65.22 C ATOM 322 CD GLU A 19 8.107 -11.391 -12.881 1.00 24.25 C ATOM 323 OE1 GLU A 19 7.685 -12.560 -12.999 1.00 64.34 O ATOM 324 OE2 GLU A 19 8.224 -10.604 -13.843 1.00 1.42 O ATOM 0 H GLU A 19 11.350 -10.030 -9.500 1.00 12.31 H new ATOM 0 HA GLU A 19 9.197 -11.731 -9.221 1.00 62.14 H new ATOM 0 HB2 GLU A 19 10.535 -10.287 -11.286 1.00 5.21 H new ATOM 0 HB3 GLU A 19 10.337 -11.925 -11.876 1.00 5.21 H new ATOM 0 HG2 GLU A 19 7.853 -11.372 -10.756 1.00 65.22 H new ATOM 0 HG3 GLU A 19 8.325 -9.828 -11.436 1.00 65.22 H new ATOM 331 N GLN A 20 11.992 -13.316 -9.786 1.00 54.35 N ATOM 332 CA GLN A 20 12.613 -14.634 -9.837 1.00 45.42 C ATOM 333 C GLN A 20 12.090 -15.526 -8.717 1.00 34.20 C ATOM 334 O GLN A 20 12.083 -16.751 -8.838 1.00 62.21 O ATOM 335 CB GLN A 20 14.135 -14.507 -9.736 1.00 35.33 C ATOM 336 CG GLN A 20 14.864 -15.836 -9.846 1.00 61.42 C ATOM 337 CD GLN A 20 15.688 -16.154 -8.614 1.00 33.31 C ATOM 338 OE1 GLN A 20 15.421 -17.128 -7.909 1.00 14.34 O ATOM 339 NE2 GLN A 20 16.697 -15.333 -8.348 1.00 15.24 N ATOM 0 H GLN A 20 12.652 -12.540 -9.739 1.00 54.35 H new ATOM 0 HA GLN A 20 12.356 -15.093 -10.792 1.00 45.42 H new ATOM 0 HB2 GLN A 20 14.489 -13.841 -10.523 1.00 35.33 H new ATOM 0 HB3 GLN A 20 14.390 -14.040 -8.785 1.00 35.33 H new ATOM 0 HG2 GLN A 20 14.137 -16.632 -10.008 1.00 61.42 H new ATOM 0 HG3 GLN A 20 15.516 -15.817 -10.719 1.00 61.42 H new ATOM 0 HE21 GLN A 20 16.882 -14.538 -8.959 1.00 15.24 H new ATOM 0 HE22 GLN A 20 17.287 -15.497 -7.532 1.00 15.24 H new ATOM 348 N TRP A 21 11.652 -14.905 -7.628 1.00 52.41 N ATOM 349 CA TRP A 21 11.126 -15.643 -6.486 1.00 23.53 C ATOM 350 C TRP A 21 10.045 -16.626 -6.923 1.00 43.33 C ATOM 351 O TRP A 21 9.963 -17.740 -6.409 1.00 30.41 O ATOM 352 CB TRP A 21 10.563 -14.677 -5.443 1.00 33.13 C ATOM 353 CG TRP A 21 10.288 -15.325 -4.119 1.00 63.14 C ATOM 354 CD1 TRP A 21 11.151 -15.436 -3.066 1.00 50.44 C ATOM 355 CD2 TRP A 21 9.069 -15.953 -3.709 1.00 71.43 C ATOM 356 NE1 TRP A 21 10.541 -16.095 -2.026 1.00 42.14 N ATOM 357 CE2 TRP A 21 9.263 -16.422 -2.395 1.00 63.32 C ATOM 358 CE3 TRP A 21 7.831 -16.164 -4.323 1.00 43.21 C ATOM 359 CZ2 TRP A 21 8.266 -17.089 -1.688 1.00 3.31 C ATOM 360 CZ3 TRP A 21 6.843 -16.826 -3.620 1.00 11.41 C ATOM 361 CH2 TRP A 21 7.064 -17.281 -2.313 1.00 44.04 C ATOM 0 H TRP A 21 11.651 -13.892 -7.512 1.00 52.41 H new ATOM 0 HA TRP A 21 11.946 -16.208 -6.042 1.00 23.53 H new ATOM 0 HB2 TRP A 21 11.268 -13.858 -5.299 1.00 33.13 H new ATOM 0 HB3 TRP A 21 9.640 -14.240 -5.824 1.00 33.13 H new ATOM 0 HD1 TRP A 21 12.164 -15.061 -3.053 1.00 50.44 H new ATOM 0 HE1 TRP A 21 10.970 -16.306 -1.125 1.00 42.14 H new ATOM 0 HE3 TRP A 21 7.650 -15.816 -5.329 1.00 43.21 H new ATOM 0 HZ2 TRP A 21 8.435 -17.442 -0.682 1.00 3.31 H new ATOM 0 HZ3 TRP A 21 5.884 -16.996 -4.086 1.00 11.41 H new ATOM 0 HH2 TRP A 21 6.270 -17.793 -1.789 1.00 44.04 H new ATOM 372 N GLU A 22 9.219 -16.204 -7.876 1.00 31.25 N ATOM 373 CA GLU A 22 8.143 -17.048 -8.381 1.00 33.53 C ATOM 374 C GLU A 22 8.694 -18.158 -9.271 1.00 61.41 C ATOM 375 O GLU A 22 8.490 -19.343 -9.005 1.00 31.00 O ATOM 376 CB GLU A 22 7.130 -16.209 -9.162 1.00 13.11 C ATOM 377 CG GLU A 22 5.927 -17.001 -9.646 1.00 33.15 C ATOM 378 CD GLU A 22 4.760 -16.939 -8.679 1.00 0.51 C ATOM 379 OE1 GLU A 22 4.960 -16.473 -7.537 1.00 45.15 O ATOM 380 OE2 GLU A 22 3.647 -17.355 -9.063 1.00 64.12 O ATOM 0 H GLU A 22 9.275 -15.284 -8.313 1.00 31.25 H new ATOM 0 HA GLU A 22 7.644 -17.505 -7.527 1.00 33.53 H new ATOM 0 HB2 GLU A 22 6.785 -15.391 -8.530 1.00 13.11 H new ATOM 0 HB3 GLU A 22 7.628 -15.760 -10.021 1.00 13.11 H new ATOM 0 HG2 GLU A 22 5.611 -16.618 -10.616 1.00 33.15 H new ATOM 0 HG3 GLU A 22 6.217 -18.041 -9.793 1.00 33.15 H new ATOM 387 N LYS A 23 9.394 -17.766 -10.330 1.00 70.22 N ATOM 388 CA LYS A 23 9.976 -18.726 -11.261 1.00 44.40 C ATOM 389 C LYS A 23 8.908 -19.661 -11.818 1.00 30.24 C ATOM 390 O LYS A 23 9.204 -20.785 -12.223 1.00 60.22 O ATOM 391 CB LYS A 23 11.071 -19.540 -10.568 1.00 3.41 C ATOM 392 CG LYS A 23 11.979 -20.283 -11.532 1.00 45.32 C ATOM 393 CD LYS A 23 13.258 -20.743 -10.852 1.00 33.41 C ATOM 394 CE LYS A 23 14.177 -19.572 -10.542 1.00 22.24 C ATOM 395 NZ LYS A 23 15.613 -19.956 -10.628 1.00 63.35 N ATOM 0 H LYS A 23 9.572 -16.790 -10.565 1.00 70.22 H new ATOM 0 HA LYS A 23 10.414 -18.170 -12.090 1.00 44.40 H new ATOM 0 HB2 LYS A 23 11.675 -18.872 -9.955 1.00 3.41 H new ATOM 0 HB3 LYS A 23 10.606 -20.259 -9.893 1.00 3.41 H new ATOM 0 HG2 LYS A 23 11.451 -21.146 -11.938 1.00 45.32 H new ATOM 0 HG3 LYS A 23 12.226 -19.635 -12.373 1.00 45.32 H new ATOM 0 HD2 LYS A 23 13.012 -21.268 -9.929 1.00 33.41 H new ATOM 0 HD3 LYS A 23 13.777 -21.454 -11.494 1.00 33.41 H new ATOM 0 HE2 LYS A 23 13.976 -18.758 -11.239 1.00 22.24 H new ATOM 0 HE3 LYS A 23 13.961 -19.196 -9.542 1.00 22.24 H new ATOM 0 HZ1 LYS A 23 16.207 -19.130 -10.410 1.00 63.35 H new ATOM 0 HZ2 LYS A 23 15.811 -20.715 -9.945 1.00 63.35 H new ATOM 0 HZ3 LYS A 23 15.826 -20.291 -11.589 1.00 63.35 H new ATOM 409 N ASP A 24 7.666 -19.190 -11.835 1.00 42.40 N ATOM 410 CA ASP A 24 6.554 -19.983 -12.345 1.00 20.44 C ATOM 411 C ASP A 24 6.616 -20.093 -13.865 1.00 22.01 C ATOM 412 O ASP A 24 6.102 -21.046 -14.450 1.00 32.30 O ATOM 413 CB ASP A 24 5.221 -19.365 -11.919 1.00 63.05 C ATOM 414 CG ASP A 24 4.050 -19.915 -12.709 1.00 52.34 C ATOM 415 OD1 ASP A 24 3.977 -21.149 -12.880 1.00 62.42 O ATOM 416 OD2 ASP A 24 3.206 -19.110 -13.158 1.00 21.14 O ATOM 0 H ASP A 24 7.404 -18.262 -11.501 1.00 42.40 H new ATOM 0 HA ASP A 24 6.632 -20.985 -11.924 1.00 20.44 H new ATOM 0 HB2 ASP A 24 5.060 -19.552 -10.857 1.00 63.05 H new ATOM 0 HB3 ASP A 24 5.267 -18.284 -12.048 1.00 63.05 H new ATOM 421 N ASP A 25 7.248 -19.111 -14.498 1.00 60.02 N ATOM 422 CA ASP A 25 7.378 -19.097 -15.951 1.00 15.23 C ATOM 423 C ASP A 25 6.006 -19.085 -16.618 1.00 70.14 C ATOM 424 O ASP A 25 5.747 -19.859 -17.540 1.00 52.35 O ATOM 425 CB ASP A 25 8.179 -20.310 -16.424 1.00 72.45 C ATOM 426 CG ASP A 25 9.571 -20.354 -15.827 1.00 23.04 C ATOM 427 OD1 ASP A 25 10.168 -19.274 -15.635 1.00 65.33 O ATOM 428 OD2 ASP A 25 10.064 -21.468 -15.551 1.00 23.02 O ATOM 0 H ASP A 25 7.678 -18.314 -14.028 1.00 60.02 H new ATOM 0 HA ASP A 25 7.909 -18.188 -16.236 1.00 15.23 H new ATOM 0 HB2 ASP A 25 7.644 -21.221 -16.157 1.00 72.45 H new ATOM 0 HB3 ASP A 25 8.254 -20.291 -17.511 1.00 72.45 H new ATOM 433 N ASP A 26 5.131 -18.204 -16.146 1.00 44.22 N ATOM 434 CA ASP A 26 3.786 -18.091 -16.697 1.00 71.23 C ATOM 435 C ASP A 26 3.833 -17.679 -18.165 1.00 72.34 C ATOM 436 O ASP A 26 2.918 -17.979 -18.934 1.00 2.04 O ATOM 437 CB ASP A 26 2.967 -17.078 -15.896 1.00 52.24 C ATOM 438 CG ASP A 26 1.500 -17.452 -15.817 1.00 72.14 C ATOM 439 OD1 ASP A 26 1.187 -18.503 -15.219 1.00 15.43 O ATOM 440 OD2 ASP A 26 0.665 -16.694 -16.354 1.00 31.24 O ATOM 0 H ASP A 26 5.329 -17.557 -15.383 1.00 44.22 H new ATOM 0 HA ASP A 26 3.308 -19.068 -16.628 1.00 71.23 H new ATOM 0 HB2 ASP A 26 3.374 -17.002 -14.888 1.00 52.24 H new ATOM 0 HB3 ASP A 26 3.064 -16.094 -16.354 1.00 52.24 H new ATOM 445 N ILE A 27 4.903 -16.991 -18.547 1.00 52.45 N ATOM 446 CA ILE A 27 5.068 -16.538 -19.923 1.00 42.11 C ATOM 447 C ILE A 27 6.107 -17.379 -20.657 1.00 42.44 C ATOM 448 O ILE A 27 7.087 -17.828 -20.064 1.00 45.45 O ATOM 449 CB ILE A 27 5.488 -15.057 -19.982 1.00 32.20 C ATOM 450 CG1 ILE A 27 4.490 -14.191 -19.210 1.00 41.25 C ATOM 451 CG2 ILE A 27 5.593 -14.594 -21.427 1.00 44.32 C ATOM 452 CD1 ILE A 27 3.099 -14.196 -19.805 1.00 43.43 C ATOM 0 H ILE A 27 5.669 -16.735 -17.924 1.00 52.45 H new ATOM 0 HA ILE A 27 4.100 -16.652 -20.411 1.00 42.11 H new ATOM 0 HB ILE A 27 6.468 -14.953 -19.516 1.00 32.20 H new ATOM 0 HG12 ILE A 27 4.437 -14.543 -18.180 1.00 41.25 H new ATOM 0 HG13 ILE A 27 4.859 -13.166 -19.178 1.00 41.25 H new ATOM 0 HG21 ILE A 27 5.891 -13.546 -21.452 1.00 44.32 H new ATOM 0 HG22 ILE A 27 6.338 -15.195 -21.949 1.00 44.32 H new ATOM 0 HG23 ILE A 27 4.626 -14.709 -21.917 1.00 44.32 H new ATOM 0 HD11 ILE A 27 2.445 -13.562 -19.207 1.00 43.43 H new ATOM 0 HD12 ILE A 27 3.139 -13.816 -20.826 1.00 43.43 H new ATOM 0 HD13 ILE A 27 2.710 -15.214 -19.812 1.00 43.43 H new ATOM 1035 N THR A 64 18.782 3.720 -24.247 1.00 61.22 N ATOM 1036 CA THR A 64 17.522 4.206 -23.700 1.00 1.25 C ATOM 1037 C THR A 64 16.987 3.262 -22.629 1.00 72.02 C ATOM 1038 O THR A 64 17.498 2.155 -22.451 1.00 11.51 O ATOM 1039 CB THR A 64 16.458 4.372 -24.801 1.00 12.14 C ATOM 1040 OG1 THR A 64 16.911 3.765 -26.016 1.00 22.04 O ATOM 1041 CG2 THR A 64 16.156 5.843 -25.044 1.00 41.05 C ATOM 0 HA THR A 64 17.726 5.179 -23.253 1.00 1.25 H new ATOM 0 HB THR A 64 15.544 3.880 -24.469 1.00 12.14 H new ATOM 0 HG1 THR A 64 17.827 3.437 -25.896 1.00 22.04 H new ATOM 0 HG21 THR A 64 15.402 5.935 -25.826 1.00 41.05 H new ATOM 0 HG22 THR A 64 15.783 6.295 -24.125 1.00 41.05 H new ATOM 0 HG23 THR A 64 17.066 6.355 -25.356 1.00 41.05 H new ATOM 1049 N LEU A 65 15.955 3.704 -21.919 1.00 51.33 N ATOM 1050 CA LEU A 65 15.349 2.897 -20.866 1.00 11.42 C ATOM 1051 C LEU A 65 13.862 2.685 -21.130 1.00 14.44 C ATOM 1052 O LEU A 65 13.092 3.643 -21.205 1.00 21.20 O ATOM 1053 CB LEU A 65 15.547 3.568 -19.505 1.00 73.12 C ATOM 1054 CG LEU A 65 14.796 2.938 -18.331 1.00 51.42 C ATOM 1055 CD1 LEU A 65 15.774 2.349 -17.327 1.00 32.42 C ATOM 1056 CD2 LEU A 65 13.895 3.966 -17.661 1.00 44.04 C ATOM 0 H LEU A 65 15.520 4.617 -22.053 1.00 51.33 H new ATOM 0 HA LEU A 65 15.840 1.924 -20.860 1.00 11.42 H new ATOM 0 HB2 LEU A 65 16.612 3.566 -19.273 1.00 73.12 H new ATOM 0 HB3 LEU A 65 15.241 4.611 -19.588 1.00 73.12 H new ATOM 0 HG LEU A 65 14.171 2.132 -18.715 1.00 51.42 H new ATOM 0 HD11 LEU A 65 15.222 1.905 -16.499 1.00 32.42 H new ATOM 0 HD12 LEU A 65 16.377 1.582 -17.813 1.00 32.42 H new ATOM 0 HD13 LEU A 65 16.425 3.137 -16.948 1.00 32.42 H new ATOM 0 HD21 LEU A 65 13.368 3.500 -16.828 1.00 44.04 H new ATOM 0 HD22 LEU A 65 14.500 4.794 -17.291 1.00 44.04 H new ATOM 0 HD23 LEU A 65 13.171 4.341 -18.384 1.00 44.04 H new ATOM 1068 N MET A 66 13.464 1.425 -21.267 1.00 21.31 N ATOM 1069 CA MET A 66 12.068 1.087 -21.519 1.00 11.24 C ATOM 1070 C MET A 66 11.815 -0.398 -21.277 1.00 4.42 C ATOM 1071 O MET A 66 12.348 -1.251 -21.986 1.00 4.43 O ATOM 1072 CB MET A 66 11.683 1.455 -22.953 1.00 14.02 C ATOM 1073 CG MET A 66 10.281 2.030 -23.077 1.00 72.41 C ATOM 1074 SD MET A 66 10.190 3.389 -24.258 1.00 53.20 S ATOM 1075 CE MET A 66 8.849 2.836 -25.308 1.00 74.15 C ATOM 0 H MET A 66 14.088 0.621 -21.208 1.00 21.31 H new ATOM 0 HA MET A 66 11.451 1.660 -20.826 1.00 11.24 H new ATOM 0 HB2 MET A 66 12.400 2.180 -23.338 1.00 14.02 H new ATOM 0 HB3 MET A 66 11.760 0.567 -23.580 1.00 14.02 H new ATOM 0 HG2 MET A 66 9.595 1.241 -23.384 1.00 72.41 H new ATOM 0 HG3 MET A 66 9.948 2.380 -22.100 1.00 72.41 H new ATOM 0 HE1 MET A 66 8.672 3.574 -26.091 1.00 74.15 H new ATOM 0 HE2 MET A 66 9.113 1.881 -25.762 1.00 74.15 H new ATOM 0 HE3 MET A 66 7.945 2.716 -24.711 1.00 74.15 H new ATOM 1085 N MET A 67 11.000 -0.699 -20.272 1.00 12.55 N ATOM 1086 CA MET A 67 10.677 -2.081 -19.938 1.00 13.13 C ATOM 1087 C MET A 67 9.288 -2.179 -19.315 1.00 32.32 C ATOM 1088 O MET A 67 8.989 -1.504 -18.330 1.00 2.03 O ATOM 1089 CB MET A 67 11.721 -2.654 -18.977 1.00 51.54 C ATOM 1090 CG MET A 67 12.860 -3.375 -19.678 1.00 63.25 C ATOM 1091 SD MET A 67 14.474 -2.956 -18.992 1.00 63.52 S ATOM 1092 CE MET A 67 15.383 -2.559 -20.483 1.00 65.14 C ATOM 0 H MET A 67 10.551 -0.005 -19.675 1.00 12.55 H new ATOM 0 HA MET A 67 10.685 -2.662 -20.860 1.00 13.13 H new ATOM 0 HB2 MET A 67 12.131 -1.844 -18.374 1.00 51.54 H new ATOM 0 HB3 MET A 67 11.231 -3.346 -18.291 1.00 51.54 H new ATOM 0 HG2 MET A 67 12.705 -4.451 -19.601 1.00 63.25 H new ATOM 0 HG3 MET A 67 12.845 -3.125 -20.739 1.00 63.25 H new ATOM 0 HE1 MET A 67 16.444 -2.470 -20.250 1.00 65.14 H new ATOM 0 HE2 MET A 67 15.238 -3.350 -21.219 1.00 65.14 H new ATOM 0 HE3 MET A 67 15.021 -1.615 -20.889 1.00 65.14 H new ATOM 1102 N PHE A 68 8.442 -3.024 -19.896 1.00 23.24 N ATOM 1103 CA PHE A 68 7.084 -3.210 -19.398 1.00 2.32 C ATOM 1104 C PHE A 68 6.764 -4.692 -19.229 1.00 65.22 C ATOM 1105 O PHE A 68 6.796 -5.459 -20.192 1.00 32.13 O ATOM 1106 CB PHE A 68 6.076 -2.564 -20.351 1.00 63.32 C ATOM 1107 CG PHE A 68 6.541 -1.252 -20.916 1.00 73.41 C ATOM 1108 CD1 PHE A 68 6.927 -0.220 -20.077 1.00 13.40 C ATOM 1109 CD2 PHE A 68 6.592 -1.052 -22.286 1.00 72.11 C ATOM 1110 CE1 PHE A 68 7.354 0.989 -20.594 1.00 74.23 C ATOM 1111 CE2 PHE A 68 7.018 0.154 -22.809 1.00 43.13 C ATOM 1112 CZ PHE A 68 7.401 1.175 -21.962 1.00 53.51 C ATOM 0 H PHE A 68 8.673 -3.591 -20.712 1.00 23.24 H new ATOM 0 HA PHE A 68 7.012 -2.728 -18.423 1.00 2.32 H new ATOM 0 HB2 PHE A 68 5.871 -3.252 -21.172 1.00 63.32 H new ATOM 0 HB3 PHE A 68 5.135 -2.410 -19.822 1.00 63.32 H new ATOM 0 HD1 PHE A 68 6.894 -0.361 -19.007 1.00 13.40 H new ATOM 0 HD2 PHE A 68 6.295 -1.848 -22.953 1.00 72.11 H new ATOM 0 HE1 PHE A 68 7.650 1.787 -19.929 1.00 74.23 H new ATOM 0 HE2 PHE A 68 7.051 0.298 -23.879 1.00 43.13 H new ATOM 0 HZ PHE A 68 7.737 2.118 -22.368 1.00 53.51 H new ATOM 1122 N VAL A 69 6.457 -5.089 -17.998 1.00 44.12 N ATOM 1123 CA VAL A 69 6.131 -6.479 -17.702 1.00 4.22 C ATOM 1124 C VAL A 69 5.157 -6.578 -16.534 1.00 12.43 C ATOM 1125 O VAL A 69 5.177 -5.751 -15.621 1.00 51.54 O ATOM 1126 CB VAL A 69 7.396 -7.294 -17.372 1.00 11.25 C ATOM 1127 CG1 VAL A 69 7.039 -8.748 -17.105 1.00 64.31 C ATOM 1128 CG2 VAL A 69 8.410 -7.183 -18.500 1.00 5.15 C ATOM 0 H VAL A 69 6.427 -4.468 -17.190 1.00 44.12 H new ATOM 0 HA VAL A 69 5.665 -6.892 -18.596 1.00 4.22 H new ATOM 0 HB VAL A 69 7.847 -6.884 -16.468 1.00 11.25 H new ATOM 0 HG11 VAL A 69 7.945 -9.308 -16.874 1.00 64.31 H new ATOM 0 HG12 VAL A 69 6.352 -8.805 -16.261 1.00 64.31 H new ATOM 0 HG13 VAL A 69 6.564 -9.174 -17.989 1.00 64.31 H new ATOM 0 HG21 VAL A 69 9.297 -7.765 -18.250 1.00 5.15 H new ATOM 0 HG22 VAL A 69 7.972 -7.566 -19.422 1.00 5.15 H new ATOM 0 HG23 VAL A 69 8.688 -6.138 -18.638 1.00 5.15 H new ATOM 1138 N THR A 70 4.303 -7.596 -16.567 1.00 31.01 N ATOM 1139 CA THR A 70 3.319 -7.804 -15.512 1.00 3.43 C ATOM 1140 C THR A 70 2.856 -9.255 -15.470 1.00 33.10 C ATOM 1141 O THR A 70 1.866 -9.620 -16.105 1.00 43.14 O ATOM 1142 CB THR A 70 2.093 -6.890 -15.699 1.00 23.12 C ATOM 1143 OG1 THR A 70 1.039 -7.298 -14.819 1.00 65.24 O ATOM 1144 CG2 THR A 70 1.603 -6.930 -17.138 1.00 64.15 C ATOM 0 H THR A 70 4.273 -8.290 -17.314 1.00 31.01 H new ATOM 0 HA THR A 70 3.808 -7.555 -14.570 1.00 3.43 H new ATOM 0 HB THR A 70 2.389 -5.868 -15.461 1.00 23.12 H new ATOM 0 HG1 THR A 70 0.598 -6.506 -14.447 1.00 65.24 H new ATOM 0 HG21 THR A 70 0.737 -6.277 -17.246 1.00 64.15 H new ATOM 0 HG22 THR A 70 2.398 -6.591 -17.803 1.00 64.15 H new ATOM 0 HG23 THR A 70 1.323 -7.951 -17.399 1.00 64.15 H new ATOM 1152 N VAL A 71 3.576 -10.080 -14.717 1.00 62.31 N ATOM 1153 CA VAL A 71 3.237 -11.493 -14.591 1.00 2.20 C ATOM 1154 C VAL A 71 4.085 -12.168 -13.519 1.00 1.22 C ATOM 1155 O VAL A 71 5.143 -11.665 -13.142 1.00 4.22 O ATOM 1156 CB VAL A 71 3.429 -12.237 -15.926 1.00 33.34 C ATOM 1157 CG1 VAL A 71 4.908 -12.432 -16.221 1.00 21.31 C ATOM 1158 CG2 VAL A 71 2.701 -13.573 -15.899 1.00 63.03 C ATOM 0 H VAL A 71 4.398 -9.795 -14.185 1.00 62.31 H new ATOM 0 HA VAL A 71 2.187 -11.542 -14.304 1.00 2.20 H new ATOM 0 HB VAL A 71 3.001 -11.631 -16.725 1.00 33.34 H new ATOM 0 HG11 VAL A 71 5.024 -12.959 -17.168 1.00 21.31 H new ATOM 0 HG12 VAL A 71 5.398 -11.460 -16.285 1.00 21.31 H new ATOM 0 HG13 VAL A 71 5.364 -13.016 -15.422 1.00 21.31 H new ATOM 0 HG21 VAL A 71 2.847 -14.086 -16.850 1.00 63.03 H new ATOM 0 HG22 VAL A 71 3.098 -14.187 -15.091 1.00 63.03 H new ATOM 0 HG23 VAL A 71 1.636 -13.404 -15.737 1.00 63.03 H new ATOM 1168 N SER A 72 3.613 -13.311 -13.031 1.00 50.24 N ATOM 1169 CA SER A 72 4.326 -14.054 -11.999 1.00 62.35 C ATOM 1170 C SER A 72 5.336 -15.015 -12.621 1.00 54.43 C ATOM 1171 O SER A 72 4.996 -15.809 -13.496 1.00 75.55 O ATOM 1172 CB SER A 72 3.339 -14.830 -11.125 1.00 72.05 C ATOM 1173 OG SER A 72 2.307 -15.405 -11.909 1.00 10.34 O ATOM 0 H SER A 72 2.740 -13.742 -13.334 1.00 50.24 H new ATOM 0 HA SER A 72 4.865 -13.338 -11.378 1.00 62.35 H new ATOM 0 HB2 SER A 72 3.867 -15.614 -10.582 1.00 72.05 H new ATOM 0 HB3 SER A 72 2.905 -14.163 -10.380 1.00 72.05 H new ATOM 0 HG SER A 72 1.690 -15.897 -11.328 1.00 10.34 H new ATOM 1179 N GLY A 73 6.581 -14.934 -12.162 1.00 13.04 N ATOM 1180 CA GLY A 73 7.622 -15.800 -12.683 1.00 75.41 C ATOM 1181 C GLY A 73 8.401 -15.156 -13.812 1.00 51.31 C ATOM 1182 O GLY A 73 7.887 -14.999 -14.919 1.00 5.41 O ATOM 0 H GLY A 73 6.887 -14.284 -11.438 1.00 13.04 H new ATOM 0 HA2 GLY A 73 8.307 -16.064 -11.878 1.00 75.41 H new ATOM 0 HA3 GLY A 73 7.174 -16.728 -13.038 1.00 75.41 H new ATOM 1186 N ASN A 74 9.644 -14.780 -13.531 1.00 44.34 N ATOM 1187 CA ASN A 74 10.496 -14.146 -14.532 1.00 14.12 C ATOM 1188 C ASN A 74 11.902 -13.921 -13.986 1.00 2.25 C ATOM 1189 O ASN A 74 12.300 -12.799 -13.669 1.00 31.52 O ATOM 1190 CB ASN A 74 9.890 -12.813 -14.977 1.00 33.24 C ATOM 1191 CG ASN A 74 10.335 -12.412 -16.369 1.00 43.25 C ATOM 1192 OD1 ASN A 74 10.895 -11.333 -16.567 1.00 63.44 O ATOM 1193 ND2 ASN A 74 10.088 -13.280 -17.343 1.00 74.30 N ATOM 0 H ASN A 74 10.084 -14.903 -12.619 1.00 44.34 H new ATOM 0 HA ASN A 74 10.562 -14.813 -15.392 1.00 14.12 H new ATOM 0 HB2 ASN A 74 8.803 -12.885 -14.953 1.00 33.24 H new ATOM 0 HB3 ASN A 74 10.173 -12.034 -14.269 1.00 33.24 H new ATOM 0 HD21 ASN A 74 10.365 -13.064 -18.301 1.00 74.30 H new ATOM 0 HD22 ASN A 74 9.621 -14.163 -17.133 1.00 74.30 H new ATOM 1200 N PRO A 75 12.675 -15.012 -13.872 1.00 54.55 N ATOM 1201 CA PRO A 75 14.049 -14.959 -13.366 1.00 21.13 C ATOM 1202 C PRO A 75 14.999 -14.267 -14.337 1.00 41.02 C ATOM 1203 O PRO A 75 15.345 -14.818 -15.383 1.00 3.12 O ATOM 1204 CB PRO A 75 14.426 -16.434 -13.209 1.00 31.40 C ATOM 1205 CG PRO A 75 13.554 -17.153 -14.180 1.00 64.21 C ATOM 1206 CD PRO A 75 12.266 -16.380 -14.231 1.00 52.12 C ATOM 0 HA PRO A 75 14.121 -14.385 -12.442 1.00 21.13 H new ATOM 0 HB2 PRO A 75 15.481 -16.598 -13.427 1.00 31.40 H new ATOM 0 HB3 PRO A 75 14.254 -16.780 -12.190 1.00 31.40 H new ATOM 0 HG2 PRO A 75 14.021 -17.199 -15.164 1.00 64.21 H new ATOM 0 HG3 PRO A 75 13.380 -18.181 -13.861 1.00 64.21 H new ATOM 0 HD2 PRO A 75 11.814 -16.417 -15.222 1.00 52.12 H new ATOM 0 HD3 PRO A 75 11.531 -16.777 -13.530 1.00 52.12 H new ATOM 1214 N THR A 76 15.419 -13.055 -13.986 1.00 32.54 N ATOM 1215 CA THR A 76 16.328 -12.288 -14.827 1.00 4.23 C ATOM 1216 C THR A 76 17.040 -11.205 -14.022 1.00 75.55 C ATOM 1217 O THR A 76 17.100 -10.049 -14.439 1.00 34.20 O ATOM 1218 CB THR A 76 15.585 -11.631 -16.005 1.00 13.22 C ATOM 1219 OG1 THR A 76 14.430 -12.405 -16.348 1.00 14.44 O ATOM 1220 CG2 THR A 76 16.495 -11.505 -17.217 1.00 22.01 C ATOM 0 H THR A 76 15.143 -12.584 -13.124 1.00 32.54 H new ATOM 0 HA THR A 76 17.064 -12.990 -15.218 1.00 4.23 H new ATOM 0 HB THR A 76 15.275 -10.632 -15.698 1.00 13.22 H new ATOM 0 HG1 THR A 76 13.962 -11.980 -17.097 1.00 14.44 H new ATOM 0 HG21 THR A 76 15.948 -11.038 -18.036 1.00 22.01 H new ATOM 0 HG22 THR A 76 17.359 -10.891 -16.961 1.00 22.01 H new ATOM 0 HG23 THR A 76 16.832 -12.495 -17.524 1.00 22.01 H new ATOM 1228 N GLU A 77 17.577 -11.589 -12.869 1.00 4.02 N ATOM 1229 CA GLU A 77 18.285 -10.649 -12.007 1.00 34.33 C ATOM 1230 C GLU A 77 19.429 -9.976 -12.759 1.00 52.01 C ATOM 1231 O GLU A 77 19.851 -8.873 -12.412 1.00 44.22 O ATOM 1232 CB GLU A 77 18.826 -11.367 -10.769 1.00 24.13 C ATOM 1233 CG GLU A 77 19.713 -12.557 -11.094 1.00 63.04 C ATOM 1234 CD GLU A 77 20.611 -12.950 -9.937 1.00 13.10 C ATOM 1235 OE1 GLU A 77 20.110 -13.017 -8.795 1.00 14.41 O ATOM 1236 OE2 GLU A 77 21.813 -13.190 -10.173 1.00 21.23 O ATOM 0 H GLU A 77 17.536 -12.543 -12.510 1.00 4.02 H new ATOM 0 HA GLU A 77 17.579 -9.881 -11.693 1.00 34.33 H new ATOM 0 HB2 GLU A 77 19.392 -10.657 -10.166 1.00 24.13 H new ATOM 0 HB3 GLU A 77 17.988 -11.705 -10.160 1.00 24.13 H new ATOM 0 HG2 GLU A 77 19.088 -13.407 -11.368 1.00 63.04 H new ATOM 0 HG3 GLU A 77 20.328 -12.320 -11.962 1.00 63.04 H new ATOM 1243 N LYS A 78 19.927 -10.648 -13.791 1.00 72.24 N ATOM 1244 CA LYS A 78 21.021 -10.117 -14.595 1.00 4.12 C ATOM 1245 C LYS A 78 20.557 -8.927 -15.429 1.00 34.32 C ATOM 1246 O LYS A 78 21.206 -7.882 -15.450 1.00 74.12 O ATOM 1247 CB LYS A 78 21.585 -11.206 -15.510 1.00 73.14 C ATOM 1248 CG LYS A 78 23.016 -11.596 -15.183 1.00 34.25 C ATOM 1249 CD LYS A 78 23.070 -12.854 -14.332 1.00 72.44 C ATOM 1250 CE LYS A 78 24.504 -13.287 -14.067 1.00 52.43 C ATOM 1251 NZ LYS A 78 24.685 -14.753 -14.257 1.00 3.53 N ATOM 0 H LYS A 78 19.590 -11.563 -14.091 1.00 72.24 H new ATOM 0 HA LYS A 78 21.805 -9.779 -13.917 1.00 4.12 H new ATOM 0 HB2 LYS A 78 20.952 -12.090 -15.441 1.00 73.14 H new ATOM 0 HB3 LYS A 78 21.539 -10.861 -16.543 1.00 73.14 H new ATOM 0 HG2 LYS A 78 23.571 -11.757 -16.107 1.00 34.25 H new ATOM 0 HG3 LYS A 78 23.506 -10.777 -14.656 1.00 34.25 H new ATOM 0 HD2 LYS A 78 22.562 -12.676 -13.384 1.00 72.44 H new ATOM 0 HD3 LYS A 78 22.533 -13.658 -14.835 1.00 72.44 H new ATOM 0 HE2 LYS A 78 25.175 -12.749 -14.736 1.00 52.43 H new ATOM 0 HE3 LYS A 78 24.783 -13.016 -13.049 1.00 52.43 H new ATOM 0 HZ1 LYS A 78 25.675 -15.008 -14.067 1.00 3.53 H new ATOM 0 HZ2 LYS A 78 24.063 -15.267 -13.601 1.00 3.53 H new ATOM 0 HZ3 LYS A 78 24.443 -15.009 -15.236 1.00 3.53 H new ATOM 1265 N GLU A 79 19.429 -9.094 -16.113 1.00 32.14 N ATOM 1266 CA GLU A 79 18.878 -8.033 -16.947 1.00 42.41 C ATOM 1267 C GLU A 79 18.425 -6.850 -16.095 1.00 62.42 C ATOM 1268 O GLU A 79 18.584 -5.693 -16.484 1.00 1.43 O ATOM 1269 CB GLU A 79 17.703 -8.560 -17.773 1.00 30.43 C ATOM 1270 CG GLU A 79 17.180 -7.564 -18.793 1.00 52.43 C ATOM 1271 CD GLU A 79 17.279 -8.079 -20.216 1.00 33.11 C ATOM 1272 OE1 GLU A 79 18.367 -7.960 -20.816 1.00 60.53 O ATOM 1273 OE2 GLU A 79 16.267 -8.602 -20.729 1.00 13.45 O ATOM 0 H GLU A 79 18.880 -9.953 -16.106 1.00 32.14 H new ATOM 0 HA GLU A 79 19.663 -7.693 -17.622 1.00 42.41 H new ATOM 0 HB2 GLU A 79 18.012 -9.468 -18.290 1.00 30.43 H new ATOM 0 HB3 GLU A 79 16.892 -8.837 -17.100 1.00 30.43 H new ATOM 0 HG2 GLU A 79 16.140 -7.331 -18.567 1.00 52.43 H new ATOM 0 HG3 GLU A 79 17.741 -6.634 -18.708 1.00 52.43 H new ATOM 1280 N THR A 80 17.859 -7.150 -14.930 1.00 61.33 N ATOM 1281 CA THR A 80 17.381 -6.114 -14.024 1.00 21.35 C ATOM 1282 C THR A 80 18.492 -5.128 -13.682 1.00 13.51 C ATOM 1283 O THR A 80 18.282 -3.915 -13.696 1.00 22.14 O ATOM 1284 CB THR A 80 16.829 -6.720 -12.719 1.00 61.13 C ATOM 1285 OG1 THR A 80 17.904 -7.226 -11.921 1.00 25.23 O ATOM 1286 CG2 THR A 80 15.842 -7.839 -13.018 1.00 2.35 C ATOM 0 H THR A 80 17.721 -8.102 -14.592 1.00 61.33 H new ATOM 0 HA THR A 80 16.578 -5.588 -14.540 1.00 21.35 H new ATOM 0 HB THR A 80 16.309 -5.935 -12.171 1.00 61.13 H new ATOM 0 HG1 THR A 80 18.528 -7.722 -12.490 1.00 25.23 H new ATOM 0 HG21 THR A 80 15.465 -8.252 -12.082 1.00 2.35 H new ATOM 0 HG22 THR A 80 15.010 -7.444 -13.601 1.00 2.35 H new ATOM 0 HG23 THR A 80 16.343 -8.624 -13.585 1.00 2.35 H new ATOM 1294 N GLU A 81 19.673 -5.655 -13.376 1.00 71.45 N ATOM 1295 CA GLU A 81 20.816 -4.819 -13.031 1.00 64.02 C ATOM 1296 C GLU A 81 21.146 -3.853 -14.166 1.00 23.33 C ATOM 1297 O GLU A 81 21.366 -2.664 -13.938 1.00 34.24 O ATOM 1298 CB GLU A 81 22.036 -5.688 -12.716 1.00 35.21 C ATOM 1299 CG GLU A 81 23.075 -4.990 -11.855 1.00 13.20 C ATOM 1300 CD GLU A 81 24.473 -5.535 -12.071 1.00 20.11 C ATOM 1301 OE1 GLU A 81 24.853 -5.749 -13.241 1.00 32.51 O ATOM 1302 OE2 GLU A 81 25.188 -5.747 -11.069 1.00 33.12 O ATOM 0 H GLU A 81 19.863 -6.657 -13.360 1.00 71.45 H new ATOM 0 HA GLU A 81 20.554 -4.238 -12.146 1.00 64.02 H new ATOM 0 HB2 GLU A 81 21.705 -6.594 -12.208 1.00 35.21 H new ATOM 0 HB3 GLU A 81 22.501 -5.999 -13.651 1.00 35.21 H new ATOM 0 HG2 GLU A 81 23.067 -3.923 -12.076 1.00 13.20 H new ATOM 0 HG3 GLU A 81 22.804 -5.100 -10.805 1.00 13.20 H new ATOM 1309 N GLU A 82 21.180 -4.375 -15.388 1.00 51.21 N ATOM 1310 CA GLU A 82 21.485 -3.559 -16.558 1.00 35.12 C ATOM 1311 C GLU A 82 20.571 -2.338 -16.622 1.00 64.14 C ATOM 1312 O GLU A 82 20.934 -1.308 -17.192 1.00 22.34 O ATOM 1313 CB GLU A 82 21.339 -4.387 -17.836 1.00 53.24 C ATOM 1314 CG GLU A 82 22.517 -5.309 -18.102 1.00 34.32 C ATOM 1315 CD GLU A 82 22.225 -6.332 -19.183 1.00 35.15 C ATOM 1316 OE1 GLU A 82 21.033 -6.568 -19.471 1.00 13.41 O ATOM 1317 OE2 GLU A 82 23.189 -6.897 -19.740 1.00 31.00 O ATOM 0 H GLU A 82 21.000 -5.358 -15.594 1.00 51.21 H new ATOM 0 HA GLU A 82 22.516 -3.216 -16.472 1.00 35.12 H new ATOM 0 HB2 GLU A 82 20.429 -4.984 -17.770 1.00 53.24 H new ATOM 0 HB3 GLU A 82 21.218 -3.713 -18.684 1.00 53.24 H new ATOM 0 HG2 GLU A 82 23.381 -4.713 -18.395 1.00 34.32 H new ATOM 0 HG3 GLU A 82 22.784 -5.826 -17.180 1.00 34.32 H new ATOM 1324 N ILE A 83 19.386 -2.462 -16.036 1.00 14.12 N ATOM 1325 CA ILE A 83 18.421 -1.369 -16.026 1.00 71.21 C ATOM 1326 C ILE A 83 18.987 -0.143 -15.318 1.00 54.22 C ATOM 1327 O ILE A 83 18.771 0.991 -15.748 1.00 0.12 O ATOM 1328 CB ILE A 83 17.107 -1.784 -15.338 1.00 71.54 C ATOM 1329 CG1 ILE A 83 16.578 -3.087 -15.944 1.00 5.44 C ATOM 1330 CG2 ILE A 83 16.071 -0.677 -15.463 1.00 70.33 C ATOM 1331 CD1 ILE A 83 15.254 -3.530 -15.362 1.00 4.24 C ATOM 0 H ILE A 83 19.070 -3.308 -15.562 1.00 14.12 H new ATOM 0 HA ILE A 83 18.214 -1.121 -17.067 1.00 71.21 H new ATOM 0 HB ILE A 83 17.305 -1.951 -14.279 1.00 71.54 H new ATOM 0 HG12 ILE A 83 16.468 -2.959 -17.021 1.00 5.44 H new ATOM 0 HG13 ILE A 83 17.315 -3.875 -15.791 1.00 5.44 H new ATOM 0 HG21 ILE A 83 15.148 -0.985 -14.972 1.00 70.33 H new ATOM 0 HG22 ILE A 83 16.448 0.230 -14.990 1.00 70.33 H new ATOM 0 HG23 ILE A 83 15.873 -0.481 -16.517 1.00 70.33 H new ATOM 0 HD11 ILE A 83 14.940 -4.459 -15.838 1.00 4.24 H new ATOM 0 HD12 ILE A 83 15.363 -3.690 -14.289 1.00 4.24 H new ATOM 0 HD13 ILE A 83 14.503 -2.760 -15.539 1.00 4.24 H new ATOM 1343 N THR A 84 19.714 -0.377 -14.230 1.00 70.12 N ATOM 1344 CA THR A 84 20.312 0.708 -13.462 1.00 70.24 C ATOM 1345 C THR A 84 21.095 1.654 -14.365 1.00 63.33 C ATOM 1346 O THR A 84 21.156 2.858 -14.116 1.00 31.54 O ATOM 1347 CB THR A 84 21.250 0.169 -12.365 1.00 53.25 C ATOM 1348 OG1 THR A 84 21.462 1.173 -11.366 1.00 61.34 O ATOM 1349 CG2 THR A 84 22.585 -0.256 -12.956 1.00 65.03 C ATOM 0 H THR A 84 19.903 -1.309 -13.861 1.00 70.12 H new ATOM 0 HA THR A 84 19.493 1.253 -12.993 1.00 70.24 H new ATOM 0 HB THR A 84 20.779 -0.702 -11.910 1.00 53.25 H new ATOM 0 HG1 THR A 84 22.058 0.823 -10.671 1.00 61.34 H new ATOM 0 HG21 THR A 84 23.231 -0.633 -12.163 1.00 65.03 H new ATOM 0 HG22 THR A 84 22.422 -1.040 -13.695 1.00 65.03 H new ATOM 0 HG23 THR A 84 23.060 0.600 -13.434 1.00 65.03 H new ATOM 1357 N SER A 85 21.693 1.102 -15.416 1.00 64.42 N ATOM 1358 CA SER A 85 22.476 1.897 -16.355 1.00 60.43 C ATOM 1359 C SER A 85 21.571 2.793 -17.195 1.00 34.41 C ATOM 1360 O SER A 85 21.721 4.015 -17.201 1.00 54.24 O ATOM 1361 CB SER A 85 23.298 0.984 -17.268 1.00 35.12 C ATOM 1362 OG SER A 85 23.872 1.715 -18.337 1.00 4.32 O ATOM 0 H SER A 85 21.650 0.108 -15.639 1.00 64.42 H new ATOM 0 HA SER A 85 23.153 2.530 -15.781 1.00 60.43 H new ATOM 0 HB2 SER A 85 24.085 0.500 -16.690 1.00 35.12 H new ATOM 0 HB3 SER A 85 22.662 0.193 -17.665 1.00 35.12 H new ATOM 0 HG SER A 85 24.393 1.110 -18.905 1.00 4.32 H new ATOM 1368 N LEU A 86 20.631 2.176 -17.903 1.00 34.15 N ATOM 1369 CA LEU A 86 19.699 2.916 -18.747 1.00 3.22 C ATOM 1370 C LEU A 86 18.998 4.013 -17.952 1.00 43.54 C ATOM 1371 O LEU A 86 18.596 5.035 -18.508 1.00 42.55 O ATOM 1372 CB LEU A 86 18.663 1.967 -19.351 1.00 41.02 C ATOM 1373 CG LEU A 86 19.209 0.669 -19.948 1.00 0.32 C ATOM 1374 CD1 LEU A 86 18.096 -0.118 -20.621 1.00 32.40 C ATOM 1375 CD2 LEU A 86 20.328 0.966 -20.936 1.00 32.32 C ATOM 0 H LEU A 86 20.494 1.165 -17.909 1.00 34.15 H new ATOM 0 HA LEU A 86 20.268 3.382 -19.551 1.00 3.22 H new ATOM 0 HB2 LEU A 86 17.939 1.711 -18.577 1.00 41.02 H new ATOM 0 HB3 LEU A 86 18.121 2.502 -20.131 1.00 41.02 H new ATOM 0 HG LEU A 86 19.617 0.063 -19.139 1.00 0.32 H new ATOM 0 HD11 LEU A 86 18.503 -1.038 -21.040 1.00 32.40 H new ATOM 0 HD12 LEU A 86 17.328 -0.362 -19.887 1.00 32.40 H new ATOM 0 HD13 LEU A 86 17.658 0.481 -21.419 1.00 32.40 H new ATOM 0 HD21 LEU A 86 20.705 0.031 -21.351 1.00 32.32 H new ATOM 0 HD22 LEU A 86 19.945 1.592 -21.742 1.00 32.32 H new ATOM 0 HD23 LEU A 86 21.137 1.487 -20.424 1.00 32.32 H new ATOM 1387 N TRP A 87 18.857 3.795 -16.650 1.00 43.30 N ATOM 1388 CA TRP A 87 18.207 4.767 -15.778 1.00 53.14 C ATOM 1389 C TRP A 87 18.821 6.152 -15.952 1.00 64.53 C ATOM 1390 O TRP A 87 18.107 7.144 -16.088 1.00 12.23 O ATOM 1391 CB TRP A 87 18.316 4.327 -14.318 1.00 23.32 C ATOM 1392 CG TRP A 87 17.156 4.764 -13.477 1.00 15.33 C ATOM 1393 CD1 TRP A 87 16.203 5.684 -13.810 1.00 12.31 C ATOM 1394 CD2 TRP A 87 16.827 4.301 -12.162 1.00 52.34 C ATOM 1395 NE1 TRP A 87 15.302 5.821 -12.782 1.00 15.23 N ATOM 1396 CE2 TRP A 87 15.662 4.983 -11.760 1.00 34.01 C ATOM 1397 CE3 TRP A 87 17.402 3.376 -11.287 1.00 72.14 C ATOM 1398 CZ2 TRP A 87 15.064 4.768 -10.521 1.00 23.22 C ATOM 1399 CZ3 TRP A 87 16.808 3.164 -10.058 1.00 31.32 C ATOM 1400 CH2 TRP A 87 15.649 3.856 -9.684 1.00 14.31 C ATOM 0 H TRP A 87 19.184 2.954 -16.174 1.00 43.30 H new ATOM 0 HA TRP A 87 17.154 4.820 -16.056 1.00 53.14 H new ATOM 0 HB2 TRP A 87 18.395 3.241 -14.279 1.00 23.32 H new ATOM 0 HB3 TRP A 87 19.236 4.729 -13.893 1.00 23.32 H new ATOM 0 HD1 TRP A 87 16.164 6.224 -14.744 1.00 12.31 H new ATOM 0 HE1 TRP A 87 14.496 6.446 -12.780 1.00 15.23 H new ATOM 0 HE3 TRP A 87 18.295 2.836 -11.566 1.00 72.14 H new ATOM 0 HZ2 TRP A 87 14.171 5.301 -10.231 1.00 23.22 H new ATOM 0 HZ3 TRP A 87 17.245 2.452 -9.373 1.00 31.32 H new ATOM 0 HH2 TRP A 87 15.208 3.666 -8.716 1.00 14.31 H new ATOM 1411 N GLN A 88 20.149 6.210 -15.948 1.00 22.33 N ATOM 1412 CA GLN A 88 20.859 7.474 -16.105 1.00 34.13 C ATOM 1413 C GLN A 88 20.365 8.226 -17.336 1.00 72.12 C ATOM 1414 O GLN A 88 20.302 9.455 -17.342 1.00 33.52 O ATOM 1415 CB GLN A 88 22.364 7.228 -16.212 1.00 45.05 C ATOM 1416 CG GLN A 88 23.205 8.284 -15.513 1.00 50.11 C ATOM 1417 CD GLN A 88 24.164 7.690 -14.500 1.00 14.21 C ATOM 1418 OE1 GLN A 88 23.749 7.198 -13.450 1.00 1.31 O ATOM 1419 NE2 GLN A 88 25.454 7.733 -14.810 1.00 21.32 N ATOM 0 H GLN A 88 20.755 5.397 -15.838 1.00 22.33 H new ATOM 0 HA GLN A 88 20.660 8.085 -15.225 1.00 34.13 H new ATOM 0 HB2 GLN A 88 22.595 6.251 -15.787 1.00 45.05 H new ATOM 0 HB3 GLN A 88 22.644 7.191 -17.265 1.00 45.05 H new ATOM 0 HG2 GLN A 88 23.770 8.844 -16.258 1.00 50.11 H new ATOM 0 HG3 GLN A 88 22.547 8.994 -15.012 1.00 50.11 H new ATOM 0 HE21 GLN A 88 25.753 8.150 -15.691 1.00 21.32 H new ATOM 0 HE22 GLN A 88 26.146 7.349 -14.167 1.00 21.32 H new ATOM 1428 N GLY A 89 20.016 7.479 -18.379 1.00 74.04 N ATOM 1429 CA GLY A 89 19.532 8.093 -19.603 1.00 24.45 C ATOM 1430 C GLY A 89 18.266 8.898 -19.386 1.00 63.54 C ATOM 1431 O GLY A 89 18.216 10.086 -19.705 1.00 20.53 O ATOM 0 H GLY A 89 20.060 6.460 -18.399 1.00 74.04 H new ATOM 0 HA2 GLY A 89 20.306 8.742 -20.011 1.00 24.45 H new ATOM 0 HA3 GLY A 89 19.343 7.317 -20.345 1.00 24.45 H new ATOM 1435 N SER A 90 17.240 8.249 -18.845 1.00 51.32 N ATOM 1436 CA SER A 90 15.965 8.911 -18.592 1.00 44.21 C ATOM 1437 C SER A 90 16.168 10.190 -17.785 1.00 63.11 C ATOM 1438 O SER A 90 15.388 11.137 -17.894 1.00 2.03 O ATOM 1439 CB SER A 90 15.017 7.970 -17.847 1.00 72.25 C ATOM 1440 OG SER A 90 13.914 8.678 -17.308 1.00 43.43 O ATOM 0 H SER A 90 17.266 7.266 -18.574 1.00 51.32 H new ATOM 0 HA SER A 90 15.523 9.174 -19.553 1.00 44.21 H new ATOM 0 HB2 SER A 90 14.659 7.196 -18.526 1.00 72.25 H new ATOM 0 HB3 SER A 90 15.556 7.466 -17.045 1.00 72.25 H new ATOM 0 HG SER A 90 13.132 8.089 -17.275 1.00 43.43 H new ATOM 1446 N LEU A 91 17.221 10.210 -16.975 1.00 42.04 N ATOM 1447 CA LEU A 91 17.529 11.372 -16.149 1.00 14.13 C ATOM 1448 C LEU A 91 17.454 12.657 -16.967 1.00 13.44 C ATOM 1449 O LEU A 91 16.661 13.551 -16.668 1.00 31.43 O ATOM 1450 CB LEU A 91 18.920 11.228 -15.530 1.00 11.45 C ATOM 1451 CG LEU A 91 19.097 11.822 -14.132 1.00 30.15 C ATOM 1452 CD1 LEU A 91 20.023 10.952 -13.296 1.00 2.23 C ATOM 1453 CD2 LEU A 91 19.633 13.244 -14.220 1.00 33.44 C ATOM 0 H LEU A 91 17.876 9.435 -16.873 1.00 42.04 H new ATOM 0 HA LEU A 91 16.788 11.427 -15.352 1.00 14.13 H new ATOM 0 HB2 LEU A 91 19.168 10.168 -15.487 1.00 11.45 H new ATOM 0 HB3 LEU A 91 19.643 11.698 -16.197 1.00 11.45 H new ATOM 0 HG LEU A 91 18.122 11.852 -13.645 1.00 30.15 H new ATOM 0 HD11 LEU A 91 20.137 11.390 -12.305 1.00 2.23 H new ATOM 0 HD12 LEU A 91 19.598 9.952 -13.204 1.00 2.23 H new ATOM 0 HD13 LEU A 91 20.998 10.889 -13.779 1.00 2.23 H new ATOM 0 HD21 LEU A 91 19.753 13.651 -13.216 1.00 33.44 H new ATOM 0 HD22 LEU A 91 20.598 13.238 -14.726 1.00 33.44 H new ATOM 0 HD23 LEU A 91 18.933 13.863 -14.781 1.00 33.44 H new ATOM 1465 N PHE A 92 18.283 12.743 -18.002 1.00 11.15 N ATOM 1466 CA PHE A 92 18.310 13.919 -18.864 1.00 60.41 C ATOM 1467 C PHE A 92 17.048 13.996 -19.718 1.00 70.32 C ATOM 1468 O PHE A 92 16.598 15.081 -20.082 1.00 54.13 O ATOM 1469 CB PHE A 92 19.547 13.889 -19.764 1.00 23.22 C ATOM 1470 CG PHE A 92 20.089 15.253 -20.084 1.00 31.24 C ATOM 1471 CD1 PHE A 92 19.379 16.121 -20.897 1.00 12.54 C ATOM 1472 CD2 PHE A 92 21.308 15.666 -19.571 1.00 12.41 C ATOM 1473 CE1 PHE A 92 19.875 17.377 -21.193 1.00 64.30 C ATOM 1474 CE2 PHE A 92 21.809 16.921 -19.863 1.00 63.25 C ATOM 1475 CZ PHE A 92 21.092 17.777 -20.675 1.00 15.31 C ATOM 0 H PHE A 92 18.945 12.013 -18.264 1.00 11.15 H new ATOM 0 HA PHE A 92 18.352 14.804 -18.229 1.00 60.41 H new ATOM 0 HB2 PHE A 92 20.326 13.302 -19.278 1.00 23.22 H new ATOM 0 HB3 PHE A 92 19.297 13.379 -20.694 1.00 23.22 H new ATOM 0 HD1 PHE A 92 18.427 15.813 -21.304 1.00 12.54 H new ATOM 0 HD2 PHE A 92 21.873 15.000 -18.936 1.00 12.41 H new ATOM 0 HE1 PHE A 92 19.312 18.045 -21.828 1.00 64.30 H new ATOM 0 HE2 PHE A 92 22.760 17.231 -19.456 1.00 63.25 H new ATOM 0 HZ PHE A 92 21.482 18.758 -20.905 1.00 15.31 H new ATOM 1485 N ASN A 93 16.483 12.835 -20.034 1.00 51.04 N ATOM 1486 CA ASN A 93 15.273 12.770 -20.847 1.00 3.03 C ATOM 1487 C ASN A 93 14.156 13.604 -20.227 1.00 22.13 C ATOM 1488 O ASN A 93 13.636 14.527 -20.853 1.00 23.12 O ATOM 1489 CB ASN A 93 14.815 11.318 -21.002 1.00 5.34 C ATOM 1490 CG ASN A 93 14.024 11.095 -22.276 1.00 32.45 C ATOM 1491 OD1 ASN A 93 14.489 10.428 -23.200 1.00 44.30 O ATOM 1492 ND2 ASN A 93 12.820 11.653 -22.329 1.00 71.44 N ATOM 0 H ASN A 93 16.843 11.927 -19.740 1.00 51.04 H new ATOM 0 HA ASN A 93 15.504 13.178 -21.831 1.00 3.03 H new ATOM 0 HB2 ASN A 93 15.686 10.663 -20.999 1.00 5.34 H new ATOM 0 HB3 ASN A 93 14.203 11.039 -20.144 1.00 5.34 H new ATOM 0 HD21 ASN A 93 12.240 11.537 -23.160 1.00 71.44 H new ATOM 0 HD22 ASN A 93 12.475 12.198 -21.539 1.00 71.44 H new ATOM 1499 N ALA A 94 13.793 13.272 -18.992 1.00 71.02 N ATOM 1500 CA ALA A 94 12.740 13.991 -18.286 1.00 51.43 C ATOM 1501 C ALA A 94 13.158 14.311 -16.855 1.00 33.31 C ATOM 1502 O ALA A 94 13.531 15.441 -16.545 1.00 1.10 O ATOM 1503 CB ALA A 94 11.451 13.182 -18.294 1.00 44.31 C ATOM 0 H ALA A 94 14.213 12.510 -18.460 1.00 71.02 H new ATOM 0 HA ALA A 94 12.567 14.934 -18.805 1.00 51.43 H new ATOM 0 HB1 ALA A 94 10.673 13.731 -17.763 1.00 44.31 H new ATOM 0 HB2 ALA A 94 11.136 13.010 -19.323 1.00 44.31 H new ATOM 0 HB3 ALA A 94 11.619 12.224 -17.801 1.00 44.31 H new ATOM 1509 N ASN A 95 13.091 13.307 -15.986 1.00 42.01 N ATOM 1510 CA ASN A 95 13.462 13.482 -14.586 1.00 74.04 C ATOM 1511 C ASN A 95 13.288 12.180 -13.811 1.00 25.50 C ATOM 1512 O ASN A 95 12.717 12.165 -12.721 1.00 12.34 O ATOM 1513 CB ASN A 95 12.616 14.585 -13.947 1.00 52.35 C ATOM 1514 CG ASN A 95 11.137 14.427 -14.246 1.00 65.22 C ATOM 1515 OD1 ASN A 95 10.708 14.548 -15.394 1.00 23.03 O ATOM 1516 ND2 ASN A 95 10.351 14.155 -13.212 1.00 32.54 N ATOM 0 H ASN A 95 12.784 12.365 -16.226 1.00 42.01 H new ATOM 0 HA ASN A 95 14.513 13.770 -14.547 1.00 74.04 H new ATOM 0 HB2 ASN A 95 12.768 14.577 -12.868 1.00 52.35 H new ATOM 0 HB3 ASN A 95 12.955 15.555 -14.309 1.00 52.35 H new ATOM 0 HD21 ASN A 95 9.347 14.037 -13.351 1.00 32.54 H new ATOM 0 HD22 ASN A 95 10.750 14.064 -12.278 1.00 32.54 H new ATOM 1523 N TYR A 96 13.786 11.088 -14.381 1.00 24.23 N ATOM 1524 CA TYR A 96 13.685 9.780 -13.744 1.00 65.24 C ATOM 1525 C TYR A 96 12.227 9.355 -13.601 1.00 22.13 C ATOM 1526 O TYR A 96 11.610 9.559 -12.555 1.00 73.44 O ATOM 1527 CB TYR A 96 14.359 9.804 -12.371 1.00 51.12 C ATOM 1528 CG TYR A 96 15.702 9.110 -12.343 1.00 72.10 C ATOM 1529 CD1 TYR A 96 16.590 9.230 -13.405 1.00 20.21 C ATOM 1530 CD2 TYR A 96 16.082 8.334 -11.255 1.00 62.44 C ATOM 1531 CE1 TYR A 96 17.818 8.597 -13.384 1.00 71.20 C ATOM 1532 CE2 TYR A 96 17.309 7.698 -11.225 1.00 55.43 C ATOM 1533 CZ TYR A 96 18.173 7.833 -12.292 1.00 33.21 C ATOM 1534 OH TYR A 96 19.395 7.200 -12.266 1.00 54.43 O ATOM 0 H TYR A 96 14.263 11.083 -15.282 1.00 24.23 H new ATOM 0 HA TYR A 96 14.195 9.055 -14.378 1.00 65.24 H new ATOM 0 HB2 TYR A 96 14.488 10.840 -12.057 1.00 51.12 H new ATOM 0 HB3 TYR A 96 13.700 9.330 -11.644 1.00 51.12 H new ATOM 0 HD1 TYR A 96 16.316 9.828 -14.261 1.00 20.21 H new ATOM 0 HD2 TYR A 96 15.407 8.226 -10.419 1.00 62.44 H new ATOM 0 HE1 TYR A 96 18.496 8.700 -14.218 1.00 71.20 H new ATOM 0 HE2 TYR A 96 17.590 7.099 -10.371 1.00 55.43 H new ATOM 0 HH TYR A 96 19.489 6.704 -11.426 1.00 54.43 H new ATOM 1544 N ASP A 97 11.684 8.763 -14.658 1.00 73.33 N ATOM 1545 CA ASP A 97 10.299 8.307 -14.651 1.00 74.54 C ATOM 1546 C ASP A 97 10.228 6.786 -14.558 1.00 31.53 C ATOM 1547 O ASP A 97 10.270 6.088 -15.571 1.00 75.02 O ATOM 1548 CB ASP A 97 9.575 8.787 -15.910 1.00 71.54 C ATOM 1549 CG ASP A 97 10.087 10.128 -16.397 1.00 10.03 C ATOM 1550 OD1 ASP A 97 10.002 11.109 -15.629 1.00 20.24 O ATOM 1551 OD2 ASP A 97 10.572 10.197 -17.546 1.00 11.44 O ATOM 0 H ASP A 97 12.181 8.587 -15.531 1.00 73.33 H new ATOM 0 HA ASP A 97 9.808 8.730 -13.775 1.00 74.54 H new ATOM 0 HB2 ASP A 97 9.697 8.046 -16.700 1.00 71.54 H new ATOM 0 HB3 ASP A 97 8.507 8.862 -15.705 1.00 71.54 H new ATOM 1556 N VAL A 98 10.122 6.277 -13.334 1.00 12.41 N ATOM 1557 CA VAL A 98 10.045 4.839 -13.107 1.00 44.14 C ATOM 1558 C VAL A 98 8.875 4.488 -12.196 1.00 75.34 C ATOM 1559 O VAL A 98 8.539 5.241 -11.283 1.00 22.12 O ATOM 1560 CB VAL A 98 11.346 4.299 -12.484 1.00 44.23 C ATOM 1561 CG1 VAL A 98 12.543 4.657 -13.353 1.00 30.53 C ATOM 1562 CG2 VAL A 98 11.523 4.836 -11.072 1.00 31.11 C ATOM 0 H VAL A 98 10.088 6.840 -12.484 1.00 12.41 H new ATOM 0 HA VAL A 98 9.896 4.373 -14.081 1.00 44.14 H new ATOM 0 HB VAL A 98 11.279 3.212 -12.429 1.00 44.23 H new ATOM 0 HG11 VAL A 98 13.453 4.267 -12.897 1.00 30.53 H new ATOM 0 HG12 VAL A 98 12.417 4.220 -14.343 1.00 30.53 H new ATOM 0 HG13 VAL A 98 12.617 5.741 -13.442 1.00 30.53 H new ATOM 0 HG21 VAL A 98 12.447 4.444 -10.647 1.00 31.11 H new ATOM 0 HG22 VAL A 98 11.569 5.925 -11.100 1.00 31.11 H new ATOM 0 HG23 VAL A 98 10.680 4.524 -10.456 1.00 31.11 H new ATOM 1572 N GLN A 99 8.257 3.339 -12.452 1.00 61.21 N ATOM 1573 CA GLN A 99 7.123 2.888 -11.654 1.00 71.25 C ATOM 1574 C GLN A 99 7.322 1.449 -11.190 1.00 72.32 C ATOM 1575 O GLN A 99 7.780 0.598 -11.953 1.00 21.10 O ATOM 1576 CB GLN A 99 5.828 3.002 -12.461 1.00 31.33 C ATOM 1577 CG GLN A 99 5.381 4.436 -12.694 1.00 34.30 C ATOM 1578 CD GLN A 99 5.776 4.955 -14.062 1.00 74.14 C ATOM 1579 OE1 GLN A 99 6.957 4.989 -14.409 1.00 74.42 O ATOM 1580 NE2 GLN A 99 4.787 5.363 -14.849 1.00 13.30 N ATOM 0 H GLN A 99 8.522 2.704 -13.205 1.00 61.21 H new ATOM 0 HA GLN A 99 7.052 3.527 -10.774 1.00 71.25 H new ATOM 0 HB2 GLN A 99 5.966 2.512 -13.425 1.00 31.33 H new ATOM 0 HB3 GLN A 99 5.036 2.463 -11.940 1.00 31.33 H new ATOM 0 HG2 GLN A 99 4.298 4.497 -12.585 1.00 34.30 H new ATOM 0 HG3 GLN A 99 5.815 5.077 -11.927 1.00 34.30 H new ATOM 0 HE21 GLN A 99 3.822 5.317 -14.521 1.00 13.30 H new ATOM 0 HE22 GLN A 99 4.992 5.722 -15.781 1.00 13.30 H new ATOM 1589 N ARG A 100 6.975 1.184 -9.935 1.00 73.20 N ATOM 1590 CA ARG A 100 7.117 -0.152 -9.369 1.00 32.22 C ATOM 1591 C ARG A 100 5.822 -0.598 -8.695 1.00 40.24 C ATOM 1592 O ARG A 100 5.179 0.178 -7.988 1.00 10.00 O ATOM 1593 CB ARG A 100 8.266 -0.182 -8.359 1.00 53.31 C ATOM 1594 CG ARG A 100 9.242 -1.325 -8.581 1.00 44.02 C ATOM 1595 CD ARG A 100 10.669 -0.910 -8.256 1.00 72.03 C ATOM 1596 NE ARG A 100 11.282 -0.158 -9.348 1.00 1.14 N ATOM 1597 CZ ARG A 100 11.822 -0.727 -10.420 1.00 11.22 C ATOM 1598 NH1 ARG A 100 11.824 -2.047 -10.544 1.00 14.21 N ATOM 1599 NH2 ARG A 100 12.361 0.025 -11.371 1.00 11.21 N ATOM 0 H ARG A 100 6.594 1.877 -9.291 1.00 73.20 H new ATOM 0 HA ARG A 100 7.339 -0.842 -10.183 1.00 32.22 H new ATOM 0 HB2 ARG A 100 8.808 0.762 -8.410 1.00 53.31 H new ATOM 0 HB3 ARG A 100 7.853 -0.259 -7.353 1.00 53.31 H new ATOM 0 HG2 ARG A 100 8.958 -2.174 -7.959 1.00 44.02 H new ATOM 0 HG3 ARG A 100 9.186 -1.657 -9.618 1.00 44.02 H new ATOM 0 HD2 ARG A 100 10.673 -0.303 -7.351 1.00 72.03 H new ATOM 0 HD3 ARG A 100 11.266 -1.798 -8.047 1.00 72.03 H new ATOM 0 HE ARG A 100 11.296 0.860 -9.284 1.00 1.14 H new ATOM 0 HH11 ARG A 100 11.410 -2.628 -9.815 1.00 14.21 H new ATOM 0 HH12 ARG A 100 12.239 -2.481 -11.368 1.00 14.21 H new ATOM 0 HH21 ARG A 100 12.361 1.041 -11.279 1.00 11.21 H new ATOM 0 HH22 ARG A 100 12.775 -0.413 -12.194 1.00 11.21 H new ATOM 1613 N PHE A 101 5.445 -1.852 -8.921 1.00 22.02 N ATOM 1614 CA PHE A 101 4.227 -2.401 -8.337 1.00 54.25 C ATOM 1615 C PHE A 101 4.366 -3.901 -8.099 1.00 32.44 C ATOM 1616 O PHE A 101 4.587 -4.671 -9.034 1.00 32.52 O ATOM 1617 CB PHE A 101 3.030 -2.127 -9.251 1.00 63.24 C ATOM 1618 CG PHE A 101 1.746 -1.901 -8.506 1.00 40.12 C ATOM 1619 CD1 PHE A 101 1.452 -0.659 -7.967 1.00 4.14 C ATOM 1620 CD2 PHE A 101 0.832 -2.930 -8.346 1.00 2.13 C ATOM 1621 CE1 PHE A 101 0.272 -0.448 -7.280 1.00 33.42 C ATOM 1622 CE2 PHE A 101 -0.350 -2.725 -7.660 1.00 75.12 C ATOM 1623 CZ PHE A 101 -0.631 -1.482 -7.127 1.00 74.34 C ATOM 0 H PHE A 101 5.965 -2.507 -9.504 1.00 22.02 H new ATOM 0 HA PHE A 101 4.062 -1.913 -7.377 1.00 54.25 H new ATOM 0 HB2 PHE A 101 3.244 -1.251 -9.864 1.00 63.24 H new ATOM 0 HB3 PHE A 101 2.903 -2.969 -9.931 1.00 63.24 H new ATOM 0 HD1 PHE A 101 2.153 0.154 -8.085 1.00 4.14 H new ATOM 0 HD2 PHE A 101 1.046 -3.903 -8.762 1.00 2.13 H new ATOM 0 HE1 PHE A 101 0.056 0.525 -6.863 1.00 33.42 H new ATOM 0 HE2 PHE A 101 -1.053 -3.536 -7.541 1.00 75.12 H new ATOM 0 HZ PHE A 101 -1.555 -1.319 -6.592 1.00 74.34 H new ATOM 1633 N ILE A 102 4.236 -4.309 -6.841 1.00 14.34 N ATOM 1634 CA ILE A 102 4.346 -5.716 -6.479 1.00 22.34 C ATOM 1635 C ILE A 102 3.172 -6.154 -5.609 1.00 65.33 C ATOM 1636 O ILE A 102 2.963 -5.625 -4.518 1.00 31.13 O ATOM 1637 CB ILE A 102 5.661 -6.003 -5.729 1.00 73.21 C ATOM 1638 CG1 ILE A 102 6.856 -5.498 -6.540 1.00 22.51 C ATOM 1639 CG2 ILE A 102 5.796 -7.492 -5.447 1.00 74.23 C ATOM 1640 CD1 ILE A 102 7.535 -4.293 -5.928 1.00 63.05 C ATOM 0 H ILE A 102 4.054 -3.684 -6.055 1.00 14.34 H new ATOM 0 HA ILE A 102 4.336 -6.283 -7.410 1.00 22.34 H new ATOM 0 HB ILE A 102 5.642 -5.473 -4.776 1.00 73.21 H new ATOM 0 HG12 ILE A 102 7.584 -6.303 -6.640 1.00 22.51 H new ATOM 0 HG13 ILE A 102 6.521 -5.245 -7.546 1.00 22.51 H new ATOM 0 HG21 ILE A 102 6.730 -7.679 -4.917 1.00 74.23 H new ATOM 0 HG22 ILE A 102 4.958 -7.824 -4.834 1.00 74.23 H new ATOM 0 HG23 ILE A 102 5.797 -8.042 -6.388 1.00 74.23 H new ATOM 0 HD11 ILE A 102 8.373 -3.990 -6.556 1.00 63.05 H new ATOM 0 HD12 ILE A 102 6.822 -3.472 -5.853 1.00 63.05 H new ATOM 0 HD13 ILE A 102 7.901 -4.548 -4.933 1.00 63.05 H new ATOM 1652 N VAL A 103 2.410 -7.126 -6.100 1.00 72.21 N ATOM 1653 CA VAL A 103 1.258 -7.638 -5.367 1.00 62.30 C ATOM 1654 C VAL A 103 1.002 -9.104 -5.700 1.00 40.34 C ATOM 1655 O VAL A 103 1.100 -9.515 -6.856 1.00 1.22 O ATOM 1656 CB VAL A 103 -0.012 -6.823 -5.676 1.00 64.31 C ATOM 1657 CG1 VAL A 103 0.065 -5.449 -5.028 1.00 73.31 C ATOM 1658 CG2 VAL A 103 -0.214 -6.703 -7.179 1.00 10.51 C ATOM 0 H VAL A 103 2.569 -7.575 -7.002 1.00 72.21 H new ATOM 0 HA VAL A 103 1.491 -7.545 -4.306 1.00 62.30 H new ATOM 0 HB VAL A 103 -0.871 -7.347 -5.258 1.00 64.31 H new ATOM 0 HG11 VAL A 103 -0.841 -4.887 -5.257 1.00 73.31 H new ATOM 0 HG12 VAL A 103 0.159 -5.561 -3.948 1.00 73.31 H new ATOM 0 HG13 VAL A 103 0.932 -4.913 -5.414 1.00 73.31 H new ATOM 0 HG21 VAL A 103 -1.116 -6.124 -7.380 1.00 10.51 H new ATOM 0 HG22 VAL A 103 0.646 -6.201 -7.623 1.00 10.51 H new ATOM 0 HG23 VAL A 103 -0.317 -7.698 -7.613 1.00 10.51 H new ATOM 1668 N GLY A 104 0.672 -9.889 -4.679 1.00 2.40 N ATOM 1669 CA GLY A 104 0.406 -11.300 -4.884 1.00 63.50 C ATOM 1670 C GLY A 104 1.655 -12.079 -5.247 1.00 42.25 C ATOM 1671 O GLY A 104 2.744 -11.785 -4.754 1.00 33.05 O ATOM 0 H GLY A 104 0.584 -9.572 -3.713 1.00 2.40 H new ATOM 0 HA2 GLY A 104 -0.030 -11.720 -3.977 1.00 63.50 H new ATOM 0 HA3 GLY A 104 -0.334 -11.416 -5.676 1.00 63.50 H new ATOM 1675 N SER A 105 1.499 -13.076 -6.113 1.00 15.25 N ATOM 1676 CA SER A 105 2.622 -13.903 -6.538 1.00 11.35 C ATOM 1677 C SER A 105 3.191 -13.406 -7.863 1.00 72.43 C ATOM 1678 O SER A 105 4.081 -14.030 -8.441 1.00 43.35 O ATOM 1679 CB SER A 105 2.186 -15.363 -6.671 1.00 54.05 C ATOM 1680 OG SER A 105 0.869 -15.549 -6.181 1.00 41.03 O ATOM 0 H SER A 105 0.605 -13.330 -6.534 1.00 15.25 H new ATOM 0 HA SER A 105 3.401 -13.833 -5.779 1.00 11.35 H new ATOM 0 HB2 SER A 105 2.234 -15.666 -7.717 1.00 54.05 H new ATOM 0 HB3 SER A 105 2.876 -16.003 -6.121 1.00 54.05 H new ATOM 0 HG SER A 105 0.613 -16.490 -6.279 1.00 41.03 H new ATOM 1686 N ASP A 106 2.670 -12.281 -8.339 1.00 12.21 N ATOM 1687 CA ASP A 106 3.125 -11.699 -9.596 1.00 4.31 C ATOM 1688 C ASP A 106 3.601 -10.264 -9.390 1.00 22.05 C ATOM 1689 O ASP A 106 3.036 -9.522 -8.586 1.00 5.03 O ATOM 1690 CB ASP A 106 2.003 -11.733 -10.635 1.00 2.54 C ATOM 1691 CG ASP A 106 0.956 -10.663 -10.391 1.00 23.41 C ATOM 1692 OD1 ASP A 106 0.184 -10.800 -9.419 1.00 53.30 O ATOM 1693 OD2 ASP A 106 0.910 -9.690 -11.172 1.00 21.04 O ATOM 0 H ASP A 106 1.932 -11.753 -7.873 1.00 12.21 H new ATOM 0 HA ASP A 106 3.964 -12.293 -9.959 1.00 4.31 H new ATOM 0 HB2 ASP A 106 2.429 -11.601 -11.630 1.00 2.54 H new ATOM 0 HB3 ASP A 106 1.527 -12.713 -10.620 1.00 2.54 H new ATOM 1698 N ARG A 107 4.643 -9.881 -10.120 1.00 4.24 N ATOM 1699 CA ARG A 107 5.197 -8.536 -10.015 1.00 34.02 C ATOM 1700 C ARG A 107 5.262 -7.867 -11.385 1.00 4.14 C ATOM 1701 O ARG A 107 5.656 -8.488 -12.371 1.00 52.05 O ATOM 1702 CB ARG A 107 6.593 -8.583 -9.391 1.00 15.02 C ATOM 1703 CG ARG A 107 7.336 -7.259 -9.461 1.00 60.13 C ATOM 1704 CD ARG A 107 8.516 -7.333 -10.418 1.00 32.12 C ATOM 1705 NE ARG A 107 8.110 -7.122 -11.805 1.00 1.33 N ATOM 1706 CZ ARG A 107 8.804 -7.562 -12.849 1.00 11.44 C ATOM 1707 NH1 ARG A 107 9.932 -8.234 -12.664 1.00 15.04 N ATOM 1708 NH2 ARG A 107 8.370 -7.330 -14.081 1.00 14.42 N ATOM 0 H ARG A 107 5.121 -10.483 -10.791 1.00 4.24 H new ATOM 0 HA ARG A 107 4.540 -7.948 -9.373 1.00 34.02 H new ATOM 0 HB2 ARG A 107 6.505 -8.886 -8.348 1.00 15.02 H new ATOM 0 HB3 ARG A 107 7.182 -9.348 -9.897 1.00 15.02 H new ATOM 0 HG2 ARG A 107 6.653 -6.474 -9.784 1.00 60.13 H new ATOM 0 HG3 ARG A 107 7.689 -6.985 -8.467 1.00 60.13 H new ATOM 0 HD2 ARG A 107 9.256 -6.583 -10.139 1.00 32.12 H new ATOM 0 HD3 ARG A 107 8.997 -8.307 -10.325 1.00 32.12 H new ATOM 0 HE ARG A 107 7.246 -6.609 -11.982 1.00 1.33 H new ATOM 0 HH11 ARG A 107 10.269 -8.414 -11.718 1.00 15.04 H new ATOM 0 HH12 ARG A 107 10.463 -8.571 -13.467 1.00 15.04 H new ATOM 0 HH21 ARG A 107 7.503 -6.813 -14.227 1.00 14.42 H new ATOM 0 HH22 ARG A 107 8.904 -7.668 -14.882 1.00 14.42 H new ATOM 1722 N ALA A 108 4.874 -6.597 -11.436 1.00 72.04 N ATOM 1723 CA ALA A 108 4.890 -5.843 -12.684 1.00 60.50 C ATOM 1724 C ALA A 108 5.808 -4.630 -12.580 1.00 55.14 C ATOM 1725 O ALA A 108 5.913 -4.009 -11.522 1.00 44.35 O ATOM 1726 CB ALA A 108 3.480 -5.411 -13.058 1.00 30.22 C ATOM 0 H ALA A 108 4.545 -6.069 -10.628 1.00 72.04 H new ATOM 0 HA ALA A 108 5.278 -6.493 -13.468 1.00 60.50 H new ATOM 0 HB1 ALA A 108 3.507 -4.849 -13.992 1.00 30.22 H new ATOM 0 HB2 ALA A 108 2.851 -6.292 -13.183 1.00 30.22 H new ATOM 0 HB3 ALA A 108 3.071 -4.782 -12.268 1.00 30.22 H new ATOM 1732 N ILE A 109 6.469 -4.298 -13.684 1.00 70.20 N ATOM 1733 CA ILE A 109 7.377 -3.159 -13.716 1.00 41.54 C ATOM 1734 C ILE A 109 7.118 -2.284 -14.938 1.00 40.32 C ATOM 1735 O ILE A 109 6.774 -2.782 -16.010 1.00 44.04 O ATOM 1736 CB ILE A 109 8.849 -3.612 -13.726 1.00 40.42 C ATOM 1737 CG1 ILE A 109 9.779 -2.398 -13.681 1.00 43.32 C ATOM 1738 CG2 ILE A 109 9.134 -4.459 -14.957 1.00 61.01 C ATOM 1739 CD1 ILE A 109 11.248 -2.761 -13.685 1.00 34.32 C ATOM 0 H ILE A 109 6.392 -4.802 -14.568 1.00 70.20 H new ATOM 0 HA ILE A 109 7.190 -2.581 -12.811 1.00 41.54 H new ATOM 0 HB ILE A 109 9.033 -4.220 -12.840 1.00 40.42 H new ATOM 0 HG12 ILE A 109 9.569 -1.758 -14.538 1.00 43.32 H new ATOM 0 HG13 ILE A 109 9.560 -1.815 -12.786 1.00 43.32 H new ATOM 0 HG21 ILE A 109 10.178 -4.772 -14.950 1.00 61.01 H new ATOM 0 HG22 ILE A 109 8.492 -5.340 -14.949 1.00 61.01 H new ATOM 0 HG23 ILE A 109 8.937 -3.874 -15.855 1.00 61.01 H new ATOM 0 HD11 ILE A 109 11.848 -1.851 -13.652 1.00 34.32 H new ATOM 0 HD12 ILE A 109 11.473 -3.376 -12.814 1.00 34.32 H new ATOM 0 HD13 ILE A 109 11.483 -3.317 -14.592 1.00 34.32 H new ATOM 1751 N PHE A 110 7.287 -0.976 -14.770 1.00 32.45 N ATOM 1752 CA PHE A 110 7.072 -0.031 -15.859 1.00 1.01 C ATOM 1753 C PHE A 110 8.039 1.145 -15.757 1.00 64.22 C ATOM 1754 O PHE A 110 8.044 1.875 -14.766 1.00 72.53 O ATOM 1755 CB PHE A 110 5.629 0.478 -15.844 1.00 4.23 C ATOM 1756 CG PHE A 110 5.319 1.434 -16.960 1.00 4.42 C ATOM 1757 CD1 PHE A 110 5.643 2.777 -16.849 1.00 52.22 C ATOM 1758 CD2 PHE A 110 4.705 0.990 -18.120 1.00 1.43 C ATOM 1759 CE1 PHE A 110 5.358 3.659 -17.874 1.00 52.24 C ATOM 1760 CE2 PHE A 110 4.418 1.868 -19.148 1.00 61.25 C ATOM 1761 CZ PHE A 110 4.746 3.204 -19.026 1.00 30.31 C ATOM 0 H PHE A 110 7.572 -0.547 -13.890 1.00 32.45 H new ATOM 0 HA PHE A 110 7.257 -0.550 -16.799 1.00 1.01 H new ATOM 0 HB2 PHE A 110 4.951 -0.373 -15.907 1.00 4.23 H new ATOM 0 HB3 PHE A 110 5.436 0.970 -14.891 1.00 4.23 H new ATOM 0 HD1 PHE A 110 6.123 3.138 -15.952 1.00 52.22 H new ATOM 0 HD2 PHE A 110 4.448 -0.054 -18.222 1.00 1.43 H new ATOM 0 HE1 PHE A 110 5.614 4.704 -17.775 1.00 52.24 H new ATOM 0 HE2 PHE A 110 3.937 1.510 -20.046 1.00 61.25 H new ATOM 0 HZ PHE A 110 4.525 3.891 -19.829 1.00 30.31 H new ATOM 1771 N MET A 111 8.858 1.321 -16.789 1.00 70.33 N ATOM 1772 CA MET A 111 9.830 2.408 -16.817 1.00 33.12 C ATOM 1773 C MET A 111 9.864 3.072 -18.190 1.00 21.43 C ATOM 1774 O MET A 111 9.750 2.402 -19.217 1.00 40.03 O ATOM 1775 CB MET A 111 11.221 1.886 -16.455 1.00 24.22 C ATOM 1776 CG MET A 111 11.215 0.878 -15.316 1.00 45.44 C ATOM 1777 SD MET A 111 12.869 0.293 -14.899 1.00 32.24 S ATOM 1778 CE MET A 111 13.628 1.808 -14.319 1.00 63.12 C ATOM 0 H MET A 111 8.868 0.725 -17.617 1.00 70.33 H new ATOM 0 HA MET A 111 9.527 3.152 -16.081 1.00 33.12 H new ATOM 0 HB2 MET A 111 11.667 1.424 -17.336 1.00 24.22 H new ATOM 0 HB3 MET A 111 11.856 2.728 -16.180 1.00 24.22 H new ATOM 0 HG2 MET A 111 10.762 1.333 -14.435 1.00 45.44 H new ATOM 0 HG3 MET A 111 10.592 0.027 -15.592 1.00 45.44 H new ATOM 0 HE1 MET A 111 14.699 1.653 -14.192 1.00 63.12 H new ATOM 0 HE2 MET A 111 13.460 2.601 -15.048 1.00 63.12 H new ATOM 0 HE3 MET A 111 13.187 2.093 -13.364 1.00 63.12 H new ATOM 1788 N LEU A 112 10.021 4.391 -18.200 1.00 64.43 N ATOM 1789 CA LEU A 112 10.071 5.145 -19.448 1.00 14.32 C ATOM 1790 C LEU A 112 10.939 6.390 -19.297 1.00 50.33 C ATOM 1791 O LEU A 112 11.040 6.961 -18.211 1.00 53.22 O ATOM 1792 CB LEU A 112 8.659 5.544 -19.882 1.00 31.32 C ATOM 1793 CG LEU A 112 8.348 5.396 -21.372 1.00 33.45 C ATOM 1794 CD1 LEU A 112 7.125 4.515 -21.576 1.00 53.24 C ATOM 1795 CD2 LEU A 112 8.138 6.760 -22.011 1.00 12.42 C ATOM 0 H LEU A 112 10.116 4.960 -17.359 1.00 64.43 H new ATOM 0 HA LEU A 112 10.513 4.506 -20.213 1.00 14.32 H new ATOM 0 HB2 LEU A 112 7.944 4.942 -19.321 1.00 31.32 H new ATOM 0 HB3 LEU A 112 8.493 6.583 -19.598 1.00 31.32 H new ATOM 0 HG LEU A 112 9.200 4.918 -21.856 1.00 33.45 H new ATOM 0 HD11 LEU A 112 6.918 4.421 -22.642 1.00 53.24 H new ATOM 0 HD12 LEU A 112 7.313 3.528 -21.154 1.00 53.24 H new ATOM 0 HD13 LEU A 112 6.266 4.964 -21.078 1.00 53.24 H new ATOM 0 HD21 LEU A 112 7.918 6.635 -23.071 1.00 12.42 H new ATOM 0 HD22 LEU A 112 7.304 7.265 -21.524 1.00 12.42 H new ATOM 0 HD23 LEU A 112 9.042 7.359 -21.896 1.00 12.42 H new ATOM 1807 N ARG A 113 11.563 6.807 -20.395 1.00 35.35 N ATOM 1808 CA ARG A 113 12.421 7.985 -20.385 1.00 24.33 C ATOM 1809 C ARG A 113 11.590 9.264 -20.391 1.00 72.03 C ATOM 1810 O ARG A 113 12.037 10.310 -19.921 1.00 24.35 O ATOM 1811 CB ARG A 113 13.360 7.968 -21.592 1.00 62.35 C ATOM 1812 CG ARG A 113 12.653 8.205 -22.917 1.00 1.22 C ATOM 1813 CD ARG A 113 13.459 7.659 -24.085 1.00 23.44 C ATOM 1814 NE ARG A 113 12.629 6.898 -25.014 1.00 60.53 N ATOM 1815 CZ ARG A 113 11.770 7.457 -25.860 1.00 24.34 C ATOM 1816 NH1 ARG A 113 11.630 8.775 -25.892 1.00 63.34 N ATOM 1817 NH2 ARG A 113 11.050 6.697 -26.675 1.00 1.01 N ATOM 0 H ARG A 113 11.490 6.346 -21.302 1.00 35.35 H new ATOM 0 HA ARG A 113 13.015 7.963 -19.471 1.00 24.33 H new ATOM 0 HB2 ARG A 113 14.126 8.732 -21.457 1.00 62.35 H new ATOM 0 HB3 ARG A 113 13.872 7.006 -21.630 1.00 62.35 H new ATOM 0 HG2 ARG A 113 11.672 7.730 -22.897 1.00 1.22 H new ATOM 0 HG3 ARG A 113 12.487 9.273 -23.056 1.00 1.22 H new ATOM 0 HD2 ARG A 113 13.933 8.485 -24.615 1.00 23.44 H new ATOM 0 HD3 ARG A 113 14.258 7.021 -23.707 1.00 23.44 H new ATOM 0 HE ARG A 113 12.713 5.881 -25.014 1.00 60.53 H new ATOM 0 HH11 ARG A 113 12.182 9.362 -25.267 1.00 63.34 H new ATOM 0 HH12 ARG A 113 10.970 9.202 -26.542 1.00 63.34 H new ATOM 0 HH21 ARG A 113 11.155 5.683 -26.653 1.00 1.01 H new ATOM 0 HH22 ARG A 113 10.391 7.127 -27.324 1.00 1.01 H new ATOM 1831 N ASP A 114 10.378 9.173 -20.928 1.00 61.22 N ATOM 1832 CA ASP A 114 9.483 10.322 -20.996 1.00 3.41 C ATOM 1833 C ASP A 114 8.773 10.538 -19.663 1.00 24.41 C ATOM 1834 O ASP A 114 8.919 11.584 -19.032 1.00 62.22 O ATOM 1835 CB ASP A 114 8.454 10.130 -22.111 1.00 21.53 C ATOM 1836 CG ASP A 114 9.060 9.518 -23.359 1.00 1.33 C ATOM 1837 OD1 ASP A 114 10.260 9.755 -23.613 1.00 72.13 O ATOM 1838 OD2 ASP A 114 8.335 8.802 -24.080 1.00 51.54 O ATOM 0 H ASP A 114 9.993 8.315 -21.323 1.00 61.22 H new ATOM 0 HA ASP A 114 10.083 11.205 -21.215 1.00 3.41 H new ATOM 0 HB2 ASP A 114 7.648 9.491 -21.751 1.00 21.53 H new ATOM 0 HB3 ASP A 114 8.010 11.093 -22.361 1.00 21.53 H new ATOM 1843 N GLY A 115 8.003 9.540 -19.240 1.00 61.43 N ATOM 1844 CA GLY A 115 7.281 9.640 -17.986 1.00 11.15 C ATOM 1845 C GLY A 115 5.848 10.096 -18.176 1.00 50.32 C ATOM 1846 O GLY A 115 4.919 9.292 -18.104 1.00 53.23 O ATOM 0 H GLY A 115 7.867 8.664 -19.744 1.00 61.43 H new ATOM 0 HA2 GLY A 115 7.287 8.670 -17.489 1.00 11.15 H new ATOM 0 HA3 GLY A 115 7.797 10.339 -17.328 1.00 11.15 H new ATOM 1850 N SER A 116 5.668 11.391 -18.418 1.00 71.23 N ATOM 1851 CA SER A 116 4.337 11.954 -18.614 1.00 62.12 C ATOM 1852 C SER A 116 3.568 11.173 -19.675 1.00 73.02 C ATOM 1853 O SER A 116 2.444 10.727 -19.441 1.00 22.11 O ATOM 1854 CB SER A 116 4.438 13.425 -19.021 1.00 13.44 C ATOM 1855 OG SER A 116 3.663 14.245 -18.163 1.00 4.43 O ATOM 0 H SER A 116 6.427 12.070 -18.483 1.00 71.23 H new ATOM 0 HA SER A 116 3.796 11.881 -17.671 1.00 62.12 H new ATOM 0 HB2 SER A 116 5.480 13.743 -18.990 1.00 13.44 H new ATOM 0 HB3 SER A 116 4.098 13.545 -20.050 1.00 13.44 H new ATOM 0 HG SER A 116 3.745 15.181 -18.443 1.00 4.43 H new ATOM 1861 N TYR A 117 4.181 11.012 -20.843 1.00 33.04 N ATOM 1862 CA TYR A 117 3.554 10.287 -21.942 1.00 14.44 C ATOM 1863 C TYR A 117 3.472 8.795 -21.634 1.00 12.30 C ATOM 1864 O TYR A 117 2.563 8.105 -22.093 1.00 34.41 O ATOM 1865 CB TYR A 117 4.334 10.510 -23.238 1.00 41.11 C ATOM 1866 CG TYR A 117 3.452 10.710 -24.449 1.00 55.24 C ATOM 1867 CD1 TYR A 117 2.690 11.863 -24.596 1.00 2.55 C ATOM 1868 CD2 TYR A 117 3.378 9.746 -25.447 1.00 41.21 C ATOM 1869 CE1 TYR A 117 1.882 12.051 -25.700 1.00 71.51 C ATOM 1870 CE2 TYR A 117 2.574 9.925 -26.556 1.00 13.43 C ATOM 1871 CZ TYR A 117 1.827 11.079 -26.678 1.00 24.14 C ATOM 1872 OH TYR A 117 1.024 11.261 -27.780 1.00 32.52 O ATOM 0 H TYR A 117 5.111 11.374 -21.053 1.00 33.04 H new ATOM 0 HA TYR A 117 2.541 10.670 -22.065 1.00 14.44 H new ATOM 0 HB2 TYR A 117 4.977 11.382 -23.120 1.00 41.11 H new ATOM 0 HB3 TYR A 117 4.986 9.654 -23.411 1.00 41.11 H new ATOM 0 HD1 TYR A 117 2.731 12.626 -23.833 1.00 2.55 H new ATOM 0 HD2 TYR A 117 3.959 8.841 -25.354 1.00 41.21 H new ATOM 0 HE1 TYR A 117 1.297 12.953 -25.797 1.00 71.51 H new ATOM 0 HE2 TYR A 117 2.530 9.166 -27.323 1.00 13.43 H new ATOM 0 HH TYR A 117 1.101 10.484 -28.373 1.00 32.52 H new ATOM 1882 N ALA A 118 4.429 8.306 -20.853 1.00 20.40 N ATOM 1883 CA ALA A 118 4.465 6.897 -20.481 1.00 21.32 C ATOM 1884 C ALA A 118 3.142 6.458 -19.863 1.00 53.02 C ATOM 1885 O ALA A 118 2.622 5.388 -20.181 1.00 41.42 O ATOM 1886 CB ALA A 118 5.612 6.635 -19.516 1.00 64.13 C ATOM 0 H ALA A 118 5.190 8.864 -20.466 1.00 20.40 H new ATOM 0 HA ALA A 118 4.625 6.312 -21.387 1.00 21.32 H new ATOM 0 HB1 ALA A 118 5.627 5.579 -19.247 1.00 64.13 H new ATOM 0 HB2 ALA A 118 6.556 6.901 -19.992 1.00 64.13 H new ATOM 0 HB3 ALA A 118 5.476 7.237 -18.617 1.00 64.13 H new ATOM 1892 N TRP A 119 2.602 7.290 -18.979 1.00 65.34 N ATOM 1893 CA TRP A 119 1.339 6.986 -18.317 1.00 1.45 C ATOM 1894 C TRP A 119 0.261 6.632 -19.335 1.00 64.20 C ATOM 1895 O TRP A 119 -0.647 5.854 -19.045 1.00 1.24 O ATOM 1896 CB TRP A 119 0.886 8.176 -17.469 1.00 13.11 C ATOM 1897 CG TRP A 119 -0.147 7.816 -16.444 1.00 24.02 C ATOM 1898 CD1 TRP A 119 -1.503 7.839 -16.603 1.00 2.50 C ATOM 1899 CD2 TRP A 119 0.094 7.381 -15.101 1.00 62.43 C ATOM 1900 NE1 TRP A 119 -2.120 7.445 -15.440 1.00 64.12 N ATOM 1901 CE2 TRP A 119 -1.162 7.157 -14.504 1.00 41.11 C ATOM 1902 CE3 TRP A 119 1.248 7.156 -14.346 1.00 64.33 C ATOM 1903 CZ2 TRP A 119 -1.293 6.721 -13.188 1.00 52.53 C ATOM 1904 CZ3 TRP A 119 1.116 6.724 -13.040 1.00 63.33 C ATOM 1905 CH2 TRP A 119 -0.146 6.509 -12.472 1.00 55.52 C ATOM 0 H TRP A 119 3.019 8.180 -18.705 1.00 65.34 H new ATOM 0 HA TRP A 119 1.496 6.124 -17.668 1.00 1.45 H new ATOM 0 HB2 TRP A 119 1.752 8.605 -16.966 1.00 13.11 H new ATOM 0 HB3 TRP A 119 0.483 8.948 -18.125 1.00 13.11 H new ATOM 0 HD1 TRP A 119 -2.015 8.125 -17.510 1.00 2.50 H new ATOM 0 HE1 TRP A 119 -3.128 7.378 -15.297 1.00 64.12 H new ATOM 0 HE3 TRP A 119 2.226 7.317 -14.775 1.00 64.33 H new ATOM 0 HZ2 TRP A 119 -2.265 6.556 -12.748 1.00 52.53 H new ATOM 0 HZ3 TRP A 119 2.002 6.549 -12.447 1.00 63.33 H new ATOM 0 HH2 TRP A 119 -0.215 6.169 -11.449 1.00 55.52 H new ATOM 1916 N GLU A 120 0.369 7.207 -20.529 1.00 30.02 N ATOM 1917 CA GLU A 120 -0.598 6.951 -21.589 1.00 73.44 C ATOM 1918 C GLU A 120 -0.607 5.473 -21.972 1.00 55.40 C ATOM 1919 O GLU A 120 -1.632 4.800 -21.863 1.00 34.41 O ATOM 1920 CB GLU A 120 -0.280 7.805 -22.818 1.00 63.01 C ATOM 1921 CG GLU A 120 -1.512 8.233 -23.598 1.00 5.01 C ATOM 1922 CD GLU A 120 -1.327 8.102 -25.097 1.00 53.43 C ATOM 1923 OE1 GLU A 120 -0.338 8.654 -25.623 1.00 41.31 O ATOM 1924 OE2 GLU A 120 -2.172 7.449 -25.745 1.00 2.22 O ATOM 0 H GLU A 120 1.116 7.852 -20.786 1.00 30.02 H new ATOM 0 HA GLU A 120 -1.587 7.219 -21.216 1.00 73.44 H new ATOM 0 HB2 GLU A 120 0.266 8.694 -22.501 1.00 63.01 H new ATOM 0 HB3 GLU A 120 0.381 7.244 -23.479 1.00 63.01 H new ATOM 0 HG2 GLU A 120 -2.363 7.628 -23.286 1.00 5.01 H new ATOM 0 HG3 GLU A 120 -1.751 9.268 -23.354 1.00 5.01 H new ATOM 1931 N ILE A 121 0.541 4.978 -22.421 1.00 34.51 N ATOM 1932 CA ILE A 121 0.665 3.581 -22.819 1.00 62.02 C ATOM 1933 C ILE A 121 0.591 2.656 -21.610 1.00 33.45 C ATOM 1934 O ILE A 121 0.102 1.529 -21.704 1.00 51.51 O ATOM 1935 CB ILE A 121 1.987 3.325 -23.567 1.00 20.41 C ATOM 1936 CG1 ILE A 121 2.077 4.215 -24.808 1.00 5.33 C ATOM 1937 CG2 ILE A 121 2.102 1.857 -23.952 1.00 54.21 C ATOM 1938 CD1 ILE A 121 3.258 5.161 -24.788 1.00 30.11 C ATOM 0 H ILE A 121 1.398 5.523 -22.518 1.00 34.51 H new ATOM 0 HA ILE A 121 -0.169 3.368 -23.487 1.00 62.02 H new ATOM 0 HB ILE A 121 2.816 3.573 -22.904 1.00 20.41 H new ATOM 0 HG12 ILE A 121 2.142 3.584 -25.694 1.00 5.33 H new ATOM 0 HG13 ILE A 121 1.158 4.795 -24.897 1.00 5.33 H new ATOM 0 HG21 ILE A 121 3.041 1.692 -24.480 1.00 54.21 H new ATOM 0 HG22 ILE A 121 2.078 1.242 -23.052 1.00 54.21 H new ATOM 0 HG23 ILE A 121 1.269 1.584 -24.600 1.00 54.21 H new ATOM 0 HD11 ILE A 121 3.259 5.761 -25.698 1.00 30.11 H new ATOM 0 HD12 ILE A 121 3.184 5.817 -23.921 1.00 30.11 H new ATOM 0 HD13 ILE A 121 4.183 4.587 -24.731 1.00 30.11 H new ATOM 1950 N LYS A 122 1.077 3.139 -20.471 1.00 62.53 N ATOM 1951 CA LYS A 122 1.064 2.357 -19.240 1.00 53.23 C ATOM 1952 C LYS A 122 -0.333 1.816 -18.955 1.00 34.41 C ATOM 1953 O LYS A 122 -0.489 0.687 -18.489 1.00 25.23 O ATOM 1954 CB LYS A 122 1.541 3.212 -18.064 1.00 51.11 C ATOM 1955 CG LYS A 122 2.100 2.400 -16.909 1.00 33.41 C ATOM 1956 CD LYS A 122 1.130 2.352 -15.740 1.00 51.01 C ATOM 1957 CE LYS A 122 1.642 3.160 -14.557 1.00 63.54 C ATOM 1958 NZ LYS A 122 2.423 2.319 -13.608 1.00 64.24 N ATOM 0 H LYS A 122 1.485 4.069 -20.375 1.00 62.53 H new ATOM 0 HA LYS A 122 1.743 1.513 -19.367 1.00 53.23 H new ATOM 0 HB2 LYS A 122 2.307 3.903 -18.415 1.00 51.11 H new ATOM 0 HB3 LYS A 122 0.708 3.816 -17.703 1.00 51.11 H new ATOM 0 HG2 LYS A 122 2.315 1.386 -17.246 1.00 33.41 H new ATOM 0 HG3 LYS A 122 3.045 2.834 -16.582 1.00 33.41 H new ATOM 0 HD2 LYS A 122 0.161 2.739 -16.054 1.00 51.01 H new ATOM 0 HD3 LYS A 122 0.976 1.317 -15.436 1.00 51.01 H new ATOM 0 HE2 LYS A 122 2.267 3.976 -14.918 1.00 63.54 H new ATOM 0 HE3 LYS A 122 0.799 3.611 -14.033 1.00 63.54 H new ATOM 0 HZ1 LYS A 122 2.754 2.906 -12.816 1.00 64.24 H new ATOM 0 HZ2 LYS A 122 1.819 1.555 -13.244 1.00 64.24 H new ATOM 0 HZ3 LYS A 122 3.242 1.908 -14.101 1.00 64.24 H new ATOM 1972 N ASP A 123 -1.347 2.626 -19.239 1.00 4.52 N ATOM 1973 CA ASP A 123 -2.731 2.227 -19.015 1.00 12.41 C ATOM 1974 C ASP A 123 -3.029 0.894 -19.694 1.00 51.31 C ATOM 1975 O ASP A 123 -3.449 -0.064 -19.046 1.00 33.41 O ATOM 1976 CB ASP A 123 -3.685 3.304 -19.536 1.00 31.44 C ATOM 1977 CG ASP A 123 -4.909 3.467 -18.656 1.00 1.31 C ATOM 1978 OD1 ASP A 123 -5.267 2.500 -17.951 1.00 50.30 O ATOM 1979 OD2 ASP A 123 -5.508 4.563 -18.672 1.00 31.44 O ATOM 0 H ASP A 123 -1.236 3.564 -19.625 1.00 4.52 H new ATOM 0 HA ASP A 123 -2.880 2.109 -17.942 1.00 12.41 H new ATOM 0 HB2 ASP A 123 -3.156 4.255 -19.598 1.00 31.44 H new ATOM 0 HB3 ASP A 123 -4.000 3.048 -20.548 1.00 31.44 H new ATOM 1984 N PHE A 124 -2.810 0.841 -21.004 1.00 4.23 N ATOM 1985 CA PHE A 124 -3.056 -0.374 -21.772 1.00 15.34 C ATOM 1986 C PHE A 124 -2.036 -1.454 -21.424 1.00 50.40 C ATOM 1987 O PHE A 124 -2.371 -2.636 -21.339 1.00 63.03 O ATOM 1988 CB PHE A 124 -3.007 -0.073 -23.271 1.00 73.41 C ATOM 1989 CG PHE A 124 -4.363 0.117 -23.889 1.00 60.42 C ATOM 1990 CD1 PHE A 124 -4.956 1.369 -23.919 1.00 60.52 C ATOM 1991 CD2 PHE A 124 -5.044 -0.957 -24.441 1.00 11.52 C ATOM 1992 CE1 PHE A 124 -6.204 1.546 -24.487 1.00 24.34 C ATOM 1993 CE2 PHE A 124 -6.292 -0.785 -25.010 1.00 61.30 C ATOM 1994 CZ PHE A 124 -6.872 0.468 -25.034 1.00 21.12 C ATOM 0 H PHE A 124 -2.463 1.625 -21.556 1.00 4.23 H new ATOM 0 HA PHE A 124 -4.049 -0.742 -21.515 1.00 15.34 H new ATOM 0 HB2 PHE A 124 -2.413 0.826 -23.434 1.00 73.41 H new ATOM 0 HB3 PHE A 124 -2.495 -0.889 -23.781 1.00 73.41 H new ATOM 0 HD1 PHE A 124 -4.438 2.216 -23.494 1.00 60.52 H new ATOM 0 HD2 PHE A 124 -4.595 -1.939 -24.426 1.00 11.52 H new ATOM 0 HE1 PHE A 124 -6.656 2.527 -24.503 1.00 24.34 H new ATOM 0 HE2 PHE A 124 -6.813 -1.630 -25.435 1.00 61.30 H new ATOM 0 HZ PHE A 124 -7.846 0.605 -25.480 1.00 21.12 H new ATOM 2004 N LEU A 125 -0.790 -1.039 -21.224 1.00 41.03 N ATOM 2005 CA LEU A 125 0.281 -1.970 -20.886 1.00 42.12 C ATOM 2006 C LEU A 125 -0.067 -2.769 -19.635 1.00 20.43 C ATOM 2007 O LEU A 125 -0.146 -3.997 -19.672 1.00 33.33 O ATOM 2008 CB LEU A 125 1.593 -1.213 -20.673 1.00 2.21 C ATOM 2009 CG LEU A 125 2.837 -1.831 -21.313 1.00 54.02 C ATOM 2010 CD1 LEU A 125 2.972 -3.292 -20.914 1.00 61.21 C ATOM 2011 CD2 LEU A 125 2.781 -1.693 -22.828 1.00 2.23 C ATOM 0 H LEU A 125 -0.496 -0.064 -21.290 1.00 41.03 H new ATOM 0 HA LEU A 125 0.401 -2.665 -21.717 1.00 42.12 H new ATOM 0 HB2 LEU A 125 1.473 -0.202 -21.062 1.00 2.21 H new ATOM 0 HB3 LEU A 125 1.767 -1.123 -19.601 1.00 2.21 H new ATOM 0 HG LEU A 125 3.714 -1.294 -20.951 1.00 54.02 H new ATOM 0 HD11 LEU A 125 3.863 -3.715 -21.379 1.00 61.21 H new ATOM 0 HD12 LEU A 125 3.058 -3.367 -19.830 1.00 61.21 H new ATOM 0 HD13 LEU A 125 2.092 -3.843 -21.247 1.00 61.21 H new ATOM 0 HD21 LEU A 125 3.674 -2.138 -23.267 1.00 2.23 H new ATOM 0 HD22 LEU A 125 1.896 -2.205 -23.207 1.00 2.23 H new ATOM 0 HD23 LEU A 125 2.733 -0.637 -23.096 1.00 2.23 H new ATOM 2023 N VAL A 126 -0.276 -2.064 -18.527 1.00 71.34 N ATOM 2024 CA VAL A 126 -0.619 -2.708 -17.265 1.00 14.42 C ATOM 2025 C VAL A 126 -2.000 -3.351 -17.334 1.00 23.35 C ATOM 2026 O VAL A 126 -2.264 -4.351 -16.665 1.00 42.33 O ATOM 2027 CB VAL A 126 -0.591 -1.703 -16.097 1.00 61.52 C ATOM 2028 CG1 VAL A 126 -1.708 -0.682 -16.244 1.00 35.13 C ATOM 2029 CG2 VAL A 126 -0.694 -2.432 -14.766 1.00 34.01 C ATOM 0 H VAL A 126 -0.214 -1.047 -18.478 1.00 71.34 H new ATOM 0 HA VAL A 126 0.130 -3.480 -17.089 1.00 14.42 H new ATOM 0 HB VAL A 126 0.360 -1.170 -16.121 1.00 61.52 H new ATOM 0 HG11 VAL A 126 -1.672 0.019 -15.410 1.00 35.13 H new ATOM 0 HG12 VAL A 126 -1.583 -0.139 -17.181 1.00 35.13 H new ATOM 0 HG13 VAL A 126 -2.670 -1.194 -16.247 1.00 35.13 H new ATOM 0 HG21 VAL A 126 -0.673 -1.708 -13.952 1.00 34.01 H new ATOM 0 HG22 VAL A 126 -1.628 -2.992 -14.729 1.00 34.01 H new ATOM 0 HG23 VAL A 126 0.145 -3.120 -14.662 1.00 34.01 H new ATOM 2039 N SER A 127 -2.877 -2.772 -18.147 1.00 10.23 N ATOM 2040 CA SER A 127 -4.233 -3.287 -18.301 1.00 5.12 C ATOM 2041 C SER A 127 -4.214 -4.778 -18.623 1.00 24.12 C ATOM 2042 O SER A 127 -5.134 -5.512 -18.264 1.00 62.33 O ATOM 2043 CB SER A 127 -4.968 -2.525 -19.405 1.00 11.54 C ATOM 2044 OG SER A 127 -5.711 -1.443 -18.869 1.00 44.34 O ATOM 0 H SER A 127 -2.673 -1.946 -18.710 1.00 10.23 H new ATOM 0 HA SER A 127 -4.759 -3.143 -17.357 1.00 5.12 H new ATOM 0 HB2 SER A 127 -4.249 -2.151 -20.134 1.00 11.54 H new ATOM 0 HB3 SER A 127 -5.637 -3.202 -19.936 1.00 11.54 H new ATOM 0 HG SER A 127 -5.133 -0.655 -18.794 1.00 44.34 H new ATOM 2050 N GLN A 128 -3.159 -5.217 -19.302 1.00 24.14 N ATOM 2051 CA GLN A 128 -3.020 -6.620 -19.673 1.00 23.31 C ATOM 2052 C GLN A 128 -2.916 -7.504 -18.434 1.00 3.41 C ATOM 2053 O GLN A 128 -3.631 -8.497 -18.306 1.00 61.43 O ATOM 2054 CB GLN A 128 -1.788 -6.816 -20.558 1.00 44.11 C ATOM 2055 CG GLN A 128 -2.106 -6.855 -22.044 1.00 51.41 C ATOM 2056 CD GLN A 128 -2.525 -8.233 -22.515 1.00 64.35 C ATOM 2057 OE1 GLN A 128 -2.665 -9.159 -21.716 1.00 62.31 O ATOM 2058 NE2 GLN A 128 -2.727 -8.377 -23.820 1.00 22.10 N ATOM 0 H GLN A 128 -2.389 -4.622 -19.606 1.00 24.14 H new ATOM 0 HA GLN A 128 -3.910 -6.911 -20.231 1.00 23.31 H new ATOM 0 HB2 GLN A 128 -1.082 -6.008 -20.367 1.00 44.11 H new ATOM 0 HB3 GLN A 128 -1.293 -7.745 -20.276 1.00 44.11 H new ATOM 0 HG2 GLN A 128 -2.903 -6.144 -22.260 1.00 51.41 H new ATOM 0 HG3 GLN A 128 -1.230 -6.533 -22.608 1.00 51.41 H new ATOM 0 HE21 GLN A 128 -2.599 -7.582 -24.447 1.00 22.10 H new ATOM 0 HE22 GLN A 128 -3.010 -9.282 -24.195 1.00 22.10 H new ATOM 2067 N ASP A 129 -2.021 -7.135 -17.524 1.00 43.22 N ATOM 2068 CA ASP A 129 -1.823 -7.893 -16.294 1.00 74.34 C ATOM 2069 C ASP A 129 -1.319 -9.301 -16.599 1.00 12.51 C ATOM 2070 O ASP A 129 -1.459 -10.211 -15.782 1.00 3.22 O ATOM 2071 CB ASP A 129 -3.128 -7.966 -15.500 1.00 73.41 C ATOM 2072 CG ASP A 129 -2.897 -7.931 -14.002 1.00 71.52 C ATOM 2073 OD1 ASP A 129 -2.041 -8.700 -13.516 1.00 41.54 O ATOM 2074 OD2 ASP A 129 -3.573 -7.137 -13.315 1.00 40.45 O ATOM 0 H ASP A 129 -1.421 -6.315 -17.615 1.00 43.22 H new ATOM 0 HA ASP A 129 -1.071 -7.379 -15.696 1.00 74.34 H new ATOM 0 HB2 ASP A 129 -3.770 -7.133 -15.785 1.00 73.41 H new ATOM 0 HB3 ASP A 129 -3.658 -8.882 -15.762 1.00 73.41 H new ATOM 2079 N ARG A 130 -0.734 -9.471 -17.780 1.00 30.32 N ATOM 2080 CA ARG A 130 -0.211 -10.768 -18.193 1.00 74.11 C ATOM 2081 C ARG A 130 0.527 -10.658 -19.524 1.00 5.54 C ATOM 2082 O ARG A 130 0.182 -11.331 -20.495 1.00 33.42 O ATOM 2083 CB ARG A 130 -1.348 -11.786 -18.312 1.00 3.54 C ATOM 2084 CG ARG A 130 -0.869 -13.208 -18.550 1.00 61.21 C ATOM 2085 CD ARG A 130 -1.922 -14.226 -18.143 1.00 34.34 C ATOM 2086 NE ARG A 130 -3.024 -14.287 -19.100 1.00 22.32 N ATOM 2087 CZ ARG A 130 -4.076 -15.085 -18.959 1.00 73.32 C ATOM 2088 NH1 ARG A 130 -4.170 -15.885 -17.906 1.00 30.12 N ATOM 2089 NH2 ARG A 130 -5.038 -15.084 -19.873 1.00 53.11 N ATOM 0 H ARG A 130 -0.610 -8.728 -18.467 1.00 30.32 H new ATOM 0 HA ARG A 130 0.493 -11.106 -17.433 1.00 74.11 H new ATOM 0 HB2 ARG A 130 -1.944 -11.760 -17.400 1.00 3.54 H new ATOM 0 HB3 ARG A 130 -2.004 -11.491 -19.131 1.00 3.54 H new ATOM 0 HG2 ARG A 130 -0.623 -13.339 -19.604 1.00 61.21 H new ATOM 0 HG3 ARG A 130 0.046 -13.384 -17.985 1.00 61.21 H new ATOM 0 HD2 ARG A 130 -1.461 -15.210 -18.058 1.00 34.34 H new ATOM 0 HD3 ARG A 130 -2.311 -13.970 -17.158 1.00 34.34 H new ATOM 0 HE ARG A 130 -2.983 -13.684 -19.921 1.00 22.32 H new ATOM 0 HH11 ARG A 130 -3.433 -15.889 -17.201 1.00 30.12 H new ATOM 0 HH12 ARG A 130 -4.979 -16.497 -17.801 1.00 30.12 H new ATOM 0 HH21 ARG A 130 -4.970 -14.470 -20.685 1.00 53.11 H new ATOM 0 HH22 ARG A 130 -5.846 -15.697 -19.764 1.00 53.11 H new ATOM 2103 N CYS A 131 1.545 -9.804 -19.560 1.00 54.02 N ATOM 2104 CA CYS A 131 2.332 -9.604 -20.772 1.00 13.12 C ATOM 2105 C CYS A 131 3.768 -9.220 -20.430 1.00 55.51 C ATOM 2106 O CYS A 131 4.017 -8.521 -19.448 1.00 54.44 O ATOM 2107 CB CYS A 131 1.695 -8.522 -21.645 1.00 43.05 C ATOM 2108 SG CYS A 131 2.173 -8.604 -23.387 1.00 71.24 S ATOM 0 H CYS A 131 1.844 -9.240 -18.765 1.00 54.02 H new ATOM 0 HA CYS A 131 2.349 -10.543 -21.325 1.00 13.12 H new ATOM 0 HB2 CYS A 131 0.610 -8.603 -21.573 1.00 43.05 H new ATOM 0 HB3 CYS A 131 1.968 -7.544 -21.250 1.00 43.05 H new ATOM 0 HG CYS A 131 1.582 -7.651 -24.044 1.00 71.24 H new ATOM 2114 N ALA A 132 4.709 -9.682 -21.246 1.00 73.53 N ATOM 2115 CA ALA A 132 6.120 -9.387 -21.031 1.00 13.12 C ATOM 2116 C ALA A 132 6.726 -8.689 -22.243 1.00 52.24 C ATOM 2117 O ALA A 132 6.790 -9.260 -23.331 1.00 62.23 O ATOM 2118 CB ALA A 132 6.885 -10.664 -20.718 1.00 34.34 C ATOM 0 H ALA A 132 4.520 -10.263 -22.063 1.00 73.53 H new ATOM 0 HA ALA A 132 6.198 -8.712 -20.179 1.00 13.12 H new ATOM 0 HB1 ALA A 132 7.937 -10.428 -20.560 1.00 34.34 H new ATOM 0 HB2 ALA A 132 6.476 -11.121 -19.817 1.00 34.34 H new ATOM 0 HB3 ALA A 132 6.790 -11.359 -21.553 1.00 34.34 H new ATOM 2124 N GLU A 133 7.168 -7.450 -22.048 1.00 60.50 N ATOM 2125 CA GLU A 133 7.767 -6.675 -23.128 1.00 5.14 C ATOM 2126 C GLU A 133 8.997 -5.917 -22.635 1.00 61.13 C ATOM 2127 O GLU A 133 9.043 -5.461 -21.493 1.00 11.22 O ATOM 2128 CB GLU A 133 6.747 -5.692 -23.707 1.00 25.42 C ATOM 2129 CG GLU A 133 5.441 -6.346 -24.123 1.00 73.51 C ATOM 2130 CD GLU A 133 4.749 -5.604 -25.250 1.00 5.31 C ATOM 2131 OE1 GLU A 133 5.454 -5.106 -26.153 1.00 14.43 O ATOM 2132 OE2 GLU A 133 3.503 -5.521 -25.228 1.00 64.05 O ATOM 0 H GLU A 133 7.122 -6.962 -21.153 1.00 60.50 H new ATOM 0 HA GLU A 133 8.077 -7.368 -23.910 1.00 5.14 H new ATOM 0 HB2 GLU A 133 6.537 -4.920 -22.966 1.00 25.42 H new ATOM 0 HB3 GLU A 133 7.186 -5.193 -24.571 1.00 25.42 H new ATOM 0 HG2 GLU A 133 5.636 -7.372 -24.435 1.00 73.51 H new ATOM 0 HG3 GLU A 133 4.774 -6.396 -23.262 1.00 73.51 H new ATOM 2139 N VAL A 134 9.993 -5.788 -23.506 1.00 41.51 N ATOM 2140 CA VAL A 134 11.223 -5.085 -23.161 1.00 64.15 C ATOM 2141 C VAL A 134 11.777 -4.325 -24.361 1.00 53.15 C ATOM 2142 O VAL A 134 11.815 -4.845 -25.477 1.00 63.20 O ATOM 2143 CB VAL A 134 12.299 -6.058 -22.644 1.00 21.42 C ATOM 2144 CG1 VAL A 134 12.678 -7.059 -23.724 1.00 65.35 C ATOM 2145 CG2 VAL A 134 13.522 -5.293 -22.162 1.00 10.24 C ATOM 0 H VAL A 134 9.972 -6.161 -24.455 1.00 41.51 H new ATOM 0 HA VAL A 134 10.972 -4.378 -22.370 1.00 64.15 H new ATOM 0 HB VAL A 134 11.888 -6.610 -21.799 1.00 21.42 H new ATOM 0 HG11 VAL A 134 13.439 -7.738 -23.340 1.00 65.35 H new ATOM 0 HG12 VAL A 134 11.797 -7.630 -24.016 1.00 65.35 H new ATOM 0 HG13 VAL A 134 13.070 -6.528 -24.591 1.00 65.35 H new ATOM 0 HG21 VAL A 134 14.272 -5.996 -21.800 1.00 10.24 H new ATOM 0 HG22 VAL A 134 13.937 -4.713 -22.986 1.00 10.24 H new ATOM 0 HG23 VAL A 134 13.235 -4.621 -21.353 1.00 10.24 H new ATOM 2155 N THR A 135 12.206 -3.089 -24.126 1.00 12.24 N ATOM 2156 CA THR A 135 12.757 -2.256 -25.187 1.00 11.53 C ATOM 2157 C THR A 135 14.095 -1.654 -24.774 1.00 44.12 C ATOM 2158 O THR A 135 14.179 -0.915 -23.792 1.00 64.20 O ATOM 2159 CB THR A 135 11.791 -1.118 -25.566 1.00 53.44 C ATOM 2160 OG1 THR A 135 10.588 -1.219 -24.797 1.00 35.13 O ATOM 2161 CG2 THR A 135 11.455 -1.165 -27.050 1.00 4.25 C ATOM 0 H THR A 135 12.182 -2.643 -23.209 1.00 12.24 H new ATOM 0 HA THR A 135 12.904 -2.902 -26.052 1.00 11.53 H new ATOM 0 HB THR A 135 12.281 -0.169 -25.350 1.00 53.44 H new ATOM 0 HG1 THR A 135 9.980 -0.491 -25.043 1.00 35.13 H new ATOM 0 HG21 THR A 135 10.771 -0.352 -27.294 1.00 4.25 H new ATOM 0 HG22 THR A 135 12.369 -1.058 -27.634 1.00 4.25 H new ATOM 0 HG23 THR A 135 10.983 -2.119 -27.286 1.00 4.25 H new ATOM 2169 N LEU A 136 15.140 -1.973 -25.530 1.00 22.32 N ATOM 2170 CA LEU A 136 16.476 -1.463 -25.243 1.00 24.11 C ATOM 2171 C LEU A 136 17.293 -1.325 -26.524 1.00 23.43 C ATOM 2172 O LEU A 136 17.528 -2.306 -27.229 1.00 45.20 O ATOM 2173 CB LEU A 136 17.198 -2.389 -24.262 1.00 15.13 C ATOM 2174 CG LEU A 136 17.341 -3.848 -24.697 1.00 15.21 C ATOM 2175 CD1 LEU A 136 18.800 -4.186 -24.960 1.00 12.23 C ATOM 2176 CD2 LEU A 136 16.757 -4.778 -23.644 1.00 31.24 C ATOM 0 H LEU A 136 15.088 -2.582 -26.346 1.00 22.32 H new ATOM 0 HA LEU A 136 16.372 -0.476 -24.792 1.00 24.11 H new ATOM 0 HB2 LEU A 136 18.194 -1.986 -24.079 1.00 15.13 H new ATOM 0 HB3 LEU A 136 16.665 -2.365 -23.311 1.00 15.13 H new ATOM 0 HG LEU A 136 16.785 -3.987 -25.624 1.00 15.21 H new ATOM 0 HD11 LEU A 136 18.882 -5.228 -25.268 1.00 12.23 H new ATOM 0 HD12 LEU A 136 19.186 -3.542 -25.750 1.00 12.23 H new ATOM 0 HD13 LEU A 136 19.379 -4.030 -24.050 1.00 12.23 H new ATOM 0 HD21 LEU A 136 16.867 -5.812 -23.970 1.00 31.24 H new ATOM 0 HD22 LEU A 136 17.285 -4.637 -22.701 1.00 31.24 H new ATOM 0 HD23 LEU A 136 15.700 -4.552 -23.505 1.00 31.24 H new