USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=21 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+ -131:sc= 0.225 (180deg=-0.398) USER MOD Single : A 9 TYR OH : rot 167:sc= -0.893 USER MOD Single : A 10 ASN : amide:sc= -0.154 K(o=-0.15,f=-2.1!) USER MOD Single : A 14 MET CE :methyl -168:sc= -0.0405 (180deg=-0.305) USER MOD Single : A 20 GLN : amide:sc= -1.2 K(o=-1.2,f=-3.5) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.0421 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -134:sc= -4.22! (180deg=-7.6!) USER MOD Single : A 70 THR OG1 : rot 170:sc= -0.0352 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0624 USER MOD Single : A 74 ASN : amide:sc= -1.1 X(o=-1.1,f=-1.6) USER MOD Single : A 76 THR OG1 : rot -120:sc= -0.235 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -62:sc= 0.938 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= -0.394 X(o=-0.39,f=-0.66) USER MOD Single : A 90 SER OG : rot 151:sc= -1.82! USER MOD Single : A 93 ASN : amide:sc= -2.81 X(o=-2.8,f=-2.5) USER MOD Single : A 95 ASN : amide:sc= -0.271 K(o=-0.27,f=-1) USER MOD Single : A 96 TYR OH : rot 60:sc= -1.16 USER MOD Single : A 99 GLN : amide:sc= -0.356 X(o=-0.36,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0.0257 USER MOD Single : A 111 MET CE :methyl -110:sc= -2.58 (180deg=-6.66!) 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+ 167:sc=-0.000359 (180deg=-0.0526) USER MOD Single : A 127 SER OG : rot -94:sc= 0.693 USER MOD Single : A 128 GLN : amide:sc=-0.00527 K(o=-0.0053,f=-2!) USER MOD Single : A 131 CYS SG : rot 180:sc= -0.0533 USER MOD Single : A 135 THR OG1 : rot -149:sc= -0.487 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 4.487 4.629 -7.223 1.00 1.44 N ATOM 70 CA LYS A 4 5.779 5.300 -7.138 1.00 60.01 C ATOM 71 C LYS A 4 6.505 4.923 -5.851 1.00 33.34 C ATOM 72 O LYS A 4 6.705 5.761 -4.971 1.00 75.31 O ATOM 73 CB LYS A 4 5.594 6.818 -7.206 1.00 24.30 C ATOM 74 CG LYS A 4 4.596 7.355 -6.195 1.00 71.33 C ATOM 75 CD LYS A 4 3.204 7.470 -6.794 1.00 31.45 C ATOM 76 CE LYS A 4 3.108 8.638 -7.763 1.00 3.15 C ATOM 77 NZ LYS A 4 1.695 8.978 -8.084 1.00 74.21 N ATOM 0 HA LYS A 4 6.385 4.975 -7.984 1.00 60.01 H new ATOM 0 HB2 LYS A 4 6.558 7.301 -7.044 1.00 24.30 H new ATOM 0 HB3 LYS A 4 5.265 7.091 -8.209 1.00 24.30 H new ATOM 0 HG2 LYS A 4 4.566 6.697 -5.327 1.00 71.33 H new ATOM 0 HG3 LYS A 4 4.924 8.333 -5.843 1.00 71.33 H new ATOM 0 HD2 LYS A 4 2.952 6.545 -7.312 1.00 31.45 H new ATOM 0 HD3 LYS A 4 2.473 7.597 -5.996 1.00 31.45 H new ATOM 0 HE2 LYS A 4 3.602 9.509 -7.332 1.00 3.15 H new ATOM 0 HE3 LYS A 4 3.640 8.392 -8.682 1.00 3.15 H new ATOM 0 HZ1 LYS A 4 1.583 9.059 -9.115 1.00 74.21 H new ATOM 0 HZ2 LYS A 4 1.068 8.230 -7.725 1.00 74.21 H new ATOM 0 HZ3 LYS A 4 1.445 9.883 -7.636 1.00 74.21 H new ATOM 91 N ASP A 5 6.898 3.658 -5.747 1.00 71.04 N ATOM 92 CA ASP A 5 7.604 3.171 -4.568 1.00 60.53 C ATOM 93 C ASP A 5 9.066 2.878 -4.892 1.00 73.05 C ATOM 94 O ASP A 5 9.577 1.801 -4.583 1.00 13.32 O ATOM 95 CB ASP A 5 6.927 1.911 -4.026 1.00 72.35 C ATOM 96 CG ASP A 5 7.183 1.707 -2.546 1.00 60.32 C ATOM 97 OD1 ASP A 5 7.881 2.549 -1.944 1.00 21.42 O ATOM 98 OD2 ASP A 5 6.686 0.705 -1.990 1.00 62.43 O ATOM 0 H ASP A 5 6.739 2.951 -6.465 1.00 71.04 H new ATOM 0 HA ASP A 5 7.568 3.950 -3.806 1.00 60.53 H new ATOM 0 HB2 ASP A 5 5.853 1.976 -4.200 1.00 72.35 H new ATOM 0 HB3 ASP A 5 7.288 1.043 -4.577 1.00 72.35 H new ATOM 103 N ILE A 6 9.732 3.842 -5.518 1.00 41.31 N ATOM 104 CA ILE A 6 11.134 3.688 -5.884 1.00 65.30 C ATOM 105 C ILE A 6 12.029 3.701 -4.649 1.00 64.24 C ATOM 106 O ILE A 6 11.564 3.942 -3.535 1.00 61.05 O ATOM 107 CB ILE A 6 11.591 4.800 -6.847 1.00 30.40 C ATOM 108 CG1 ILE A 6 11.942 6.068 -6.066 1.00 53.05 C ATOM 109 CG2 ILE A 6 10.508 5.087 -7.876 1.00 32.30 C ATOM 110 CD1 ILE A 6 10.816 6.567 -5.187 1.00 44.14 C ATOM 0 H ILE A 6 9.323 4.738 -5.782 1.00 41.31 H new ATOM 0 HA ILE A 6 11.225 2.725 -6.386 1.00 65.30 H new ATOM 0 HB ILE A 6 12.484 4.461 -7.373 1.00 30.40 H new ATOM 0 HG12 ILE A 6 12.817 5.873 -5.446 1.00 53.05 H new ATOM 0 HG13 ILE A 6 12.219 6.853 -6.769 1.00 53.05 H new ATOM 0 HG21 ILE A 6 10.846 5.875 -8.549 1.00 32.30 H new ATOM 0 HG22 ILE A 6 10.302 4.183 -8.449 1.00 32.30 H new ATOM 0 HG23 ILE A 6 9.599 5.409 -7.368 1.00 32.30 H new ATOM 0 HD11 ILE A 6 11.135 7.468 -4.663 1.00 44.14 H new ATOM 0 HD12 ILE A 6 9.946 6.794 -5.804 1.00 44.14 H new ATOM 0 HD13 ILE A 6 10.554 5.798 -4.460 1.00 44.14 H new ATOM 122 N ARG A 7 13.317 3.442 -4.856 1.00 35.54 N ATOM 123 CA ARG A 7 14.277 3.424 -3.759 1.00 45.13 C ATOM 124 C ARG A 7 15.115 4.699 -3.750 1.00 41.53 C ATOM 125 O ARG A 7 16.342 4.649 -3.845 1.00 14.24 O ATOM 126 CB ARG A 7 15.191 2.202 -3.873 1.00 12.11 C ATOM 127 CG ARG A 7 15.887 1.839 -2.571 1.00 71.14 C ATOM 128 CD ARG A 7 14.915 1.236 -1.569 1.00 70.34 C ATOM 129 NE ARG A 7 14.551 -0.135 -1.917 1.00 23.31 N ATOM 130 CZ ARG A 7 15.313 -1.189 -1.645 1.00 30.10 C ATOM 131 NH1 ARG A 7 16.474 -1.030 -1.025 1.00 40.30 N ATOM 132 NH2 ARG A 7 14.913 -2.406 -1.993 1.00 44.40 N ATOM 0 H ARG A 7 13.719 3.242 -5.772 1.00 35.54 H new ATOM 0 HA ARG A 7 13.721 3.368 -2.823 1.00 45.13 H new ATOM 0 HB2 ARG A 7 14.603 1.349 -4.211 1.00 12.11 H new ATOM 0 HB3 ARG A 7 15.944 2.392 -4.637 1.00 12.11 H new ATOM 0 HG2 ARG A 7 16.690 1.130 -2.772 1.00 71.14 H new ATOM 0 HG3 ARG A 7 16.347 2.729 -2.143 1.00 71.14 H new ATOM 0 HD2 ARG A 7 15.363 1.251 -0.575 1.00 70.34 H new ATOM 0 HD3 ARG A 7 14.015 1.849 -1.523 1.00 70.34 H new ATOM 0 HE ARG A 7 13.664 -0.292 -2.395 1.00 23.31 H new ATOM 0 HH11 ARG A 7 16.785 -0.097 -0.755 1.00 40.30 H new ATOM 0 HH12 ARG A 7 17.057 -1.841 -0.818 1.00 40.30 H new ATOM 0 HH21 ARG A 7 14.020 -2.533 -2.470 1.00 44.40 H new ATOM 0 HH22 ARG A 7 15.499 -3.215 -1.784 1.00 44.40 H new ATOM 146 N ASP A 8 14.445 5.841 -3.637 1.00 35.42 N ATOM 147 CA ASP A 8 15.127 7.129 -3.615 1.00 14.41 C ATOM 148 C ASP A 8 16.083 7.258 -4.796 1.00 42.02 C ATOM 149 O ASP A 8 17.113 7.927 -4.704 1.00 70.31 O ATOM 150 CB ASP A 8 15.891 7.303 -2.302 1.00 5.41 C ATOM 151 CG ASP A 8 14.973 7.589 -1.130 1.00 71.21 C ATOM 152 OD1 ASP A 8 13.959 8.292 -1.328 1.00 23.52 O ATOM 153 OD2 ASP A 8 15.267 7.109 -0.016 1.00 31.33 O ATOM 0 H ASP A 8 13.430 5.900 -3.559 1.00 35.42 H new ATOM 0 HA ASP A 8 14.374 7.913 -3.694 1.00 14.41 H new ATOM 0 HB2 ASP A 8 16.466 6.400 -2.097 1.00 5.41 H new ATOM 0 HB3 ASP A 8 16.606 8.119 -2.407 1.00 5.41 H new ATOM 158 N TYR A 9 15.737 6.613 -5.904 1.00 74.23 N ATOM 159 CA TYR A 9 16.566 6.652 -7.103 1.00 2.12 C ATOM 160 C TYR A 9 17.968 6.125 -6.812 1.00 42.14 C ATOM 161 O TYR A 9 18.921 6.895 -6.695 1.00 74.13 O ATOM 162 CB TYR A 9 16.648 8.080 -7.645 1.00 61.12 C ATOM 163 CG TYR A 9 17.528 8.214 -8.867 1.00 61.24 C ATOM 164 CD1 TYR A 9 17.307 7.433 -9.996 1.00 12.24 C ATOM 165 CD2 TYR A 9 18.581 9.120 -8.894 1.00 61.30 C ATOM 166 CE1 TYR A 9 18.109 7.551 -11.114 1.00 54.54 C ATOM 167 CE2 TYR A 9 19.387 9.246 -10.009 1.00 31.31 C ATOM 168 CZ TYR A 9 19.147 8.459 -11.116 1.00 51.44 C ATOM 169 OH TYR A 9 19.948 8.581 -12.228 1.00 63.14 O ATOM 0 H TYR A 9 14.887 6.056 -5.997 1.00 74.23 H new ATOM 0 HA TYR A 9 16.105 6.011 -7.855 1.00 2.12 H new ATOM 0 HB2 TYR A 9 15.644 8.424 -7.891 1.00 61.12 H new ATOM 0 HB3 TYR A 9 17.027 8.736 -6.861 1.00 61.12 H new ATOM 0 HD1 TYR A 9 16.494 6.722 -9.999 1.00 12.24 H new ATOM 0 HD2 TYR A 9 18.773 9.737 -8.028 1.00 61.30 H new ATOM 0 HE1 TYR A 9 17.924 6.936 -11.982 1.00 54.54 H new ATOM 0 HE2 TYR A 9 20.200 9.957 -10.014 1.00 31.31 H new ATOM 0 HH TYR A 9 20.491 9.394 -12.153 1.00 63.14 H new ATOM 179 N ASN A 10 18.086 4.806 -6.698 1.00 55.22 N ATOM 180 CA ASN A 10 19.371 4.174 -6.422 1.00 15.33 C ATOM 181 C ASN A 10 19.432 2.777 -7.031 1.00 32.23 C ATOM 182 O ASN A 10 20.192 2.529 -7.967 1.00 4.24 O ATOM 183 CB ASN A 10 19.610 4.096 -4.912 1.00 54.05 C ATOM 184 CG ASN A 10 21.059 3.807 -4.571 1.00 34.21 C ATOM 185 OD1 ASN A 10 21.833 3.369 -5.422 1.00 20.22 O ATOM 186 ND2 ASN A 10 21.432 4.051 -3.320 1.00 55.20 N ATOM 0 H ASN A 10 17.307 4.154 -6.793 1.00 55.22 H new ATOM 0 HA ASN A 10 20.153 4.783 -6.876 1.00 15.33 H new ATOM 0 HB2 ASN A 10 19.312 5.037 -4.450 1.00 54.05 H new ATOM 0 HB3 ASN A 10 18.977 3.317 -4.486 1.00 54.05 H new ATOM 0 HD21 ASN A 10 22.394 3.875 -3.031 1.00 55.20 H new ATOM 0 HD22 ASN A 10 20.756 4.414 -2.648 1.00 55.20 H new ATOM 193 N ASP A 11 18.626 1.868 -6.494 1.00 32.33 N ATOM 194 CA ASP A 11 18.586 0.495 -6.985 1.00 5.12 C ATOM 195 C ASP A 11 17.147 0.007 -7.120 1.00 4.25 C ATOM 196 O ASP A 11 16.817 -1.104 -6.706 1.00 42.05 O ATOM 197 CB ASP A 11 19.365 -0.428 -6.046 1.00 43.40 C ATOM 198 CG ASP A 11 20.852 -0.130 -6.044 1.00 31.40 C ATOM 199 OD1 ASP A 11 21.489 -0.288 -7.106 1.00 43.30 O ATOM 200 OD2 ASP A 11 21.378 0.259 -4.980 1.00 62.51 O ATOM 0 H ASP A 11 17.991 2.057 -5.718 1.00 32.33 H new ATOM 0 HA ASP A 11 19.051 0.474 -7.971 1.00 5.12 H new ATOM 0 HB2 ASP A 11 18.975 -0.324 -5.033 1.00 43.40 H new ATOM 0 HB3 ASP A 11 19.205 -1.464 -6.345 1.00 43.40 H new ATOM 205 N ALA A 12 16.295 0.846 -7.699 1.00 43.22 N ATOM 206 CA ALA A 12 14.892 0.500 -7.889 1.00 42.01 C ATOM 207 C ALA A 12 14.738 -0.629 -8.902 1.00 35.41 C ATOM 208 O ALA A 12 13.914 -1.527 -8.724 1.00 71.00 O ATOM 209 CB ALA A 12 14.103 1.722 -8.334 1.00 15.22 C ATOM 0 H ALA A 12 16.552 1.771 -8.045 1.00 43.22 H new ATOM 0 HA ALA A 12 14.496 0.153 -6.934 1.00 42.01 H new ATOM 0 HB1 ALA A 12 13.057 1.449 -8.472 1.00 15.22 H new ATOM 0 HB2 ALA A 12 14.178 2.500 -7.574 1.00 15.22 H new ATOM 0 HB3 ALA A 12 14.508 2.094 -9.275 1.00 15.22 H new ATOM 215 N ASP A 13 15.534 -0.578 -9.964 1.00 74.21 N ATOM 216 CA ASP A 13 15.485 -1.598 -11.006 1.00 3.33 C ATOM 217 C ASP A 13 15.890 -2.960 -10.452 1.00 21.23 C ATOM 218 O ASP A 13 15.296 -3.982 -10.795 1.00 10.23 O ATOM 219 CB ASP A 13 16.402 -1.213 -12.168 1.00 73.23 C ATOM 220 CG ASP A 13 16.339 0.267 -12.490 1.00 74.13 C ATOM 221 OD1 ASP A 13 15.221 0.779 -12.706 1.00 53.44 O ATOM 222 OD2 ASP A 13 17.407 0.913 -12.527 1.00 61.40 O ATOM 0 H ASP A 13 16.221 0.158 -10.126 1.00 74.21 H new ATOM 0 HA ASP A 13 14.459 -1.664 -11.369 1.00 3.33 H new ATOM 0 HB2 ASP A 13 17.429 -1.485 -11.922 1.00 73.23 H new ATOM 0 HB3 ASP A 13 16.123 -1.786 -13.052 1.00 73.23 H new ATOM 227 N MET A 14 16.906 -2.967 -9.594 1.00 55.33 N ATOM 228 CA MET A 14 17.389 -4.204 -8.993 1.00 5.00 C ATOM 229 C MET A 14 16.250 -4.964 -8.321 1.00 42.21 C ATOM 230 O MET A 14 16.263 -6.193 -8.260 1.00 12.23 O ATOM 231 CB MET A 14 18.489 -3.904 -7.973 1.00 25.11 C ATOM 232 CG MET A 14 19.858 -4.422 -8.385 1.00 50.20 C ATOM 233 SD MET A 14 21.196 -3.323 -7.882 1.00 25.30 S ATOM 234 CE MET A 14 21.174 -3.553 -6.106 1.00 31.41 C ATOM 0 H MET A 14 17.410 -2.130 -9.300 1.00 55.33 H new ATOM 0 HA MET A 14 17.799 -4.828 -9.787 1.00 5.00 H new ATOM 0 HB2 MET A 14 18.548 -2.826 -7.821 1.00 25.11 H new ATOM 0 HB3 MET A 14 18.215 -4.346 -7.015 1.00 25.11 H new ATOM 0 HG2 MET A 14 20.017 -5.407 -7.945 1.00 50.20 H new ATOM 0 HG3 MET A 14 19.884 -4.548 -9.467 1.00 50.20 H new ATOM 0 HE1 MET A 14 21.792 -2.790 -5.633 1.00 31.41 H new ATOM 0 HE2 MET A 14 20.150 -3.469 -5.741 1.00 31.41 H new ATOM 0 HE3 MET A 14 21.566 -4.540 -5.862 1.00 31.41 H new ATOM 244 N ALA A 15 15.267 -4.224 -7.819 1.00 30.35 N ATOM 245 CA ALA A 15 14.120 -4.829 -7.153 1.00 12.11 C ATOM 246 C ALA A 15 13.386 -5.787 -8.085 1.00 41.24 C ATOM 247 O ALA A 15 12.663 -6.675 -7.634 1.00 70.22 O ATOM 248 CB ALA A 15 13.173 -3.750 -6.650 1.00 15.14 C ATOM 0 H ALA A 15 15.242 -3.205 -7.861 1.00 30.35 H new ATOM 0 HA ALA A 15 14.486 -5.402 -6.301 1.00 12.11 H new ATOM 0 HB1 ALA A 15 12.321 -4.216 -6.155 1.00 15.14 H new ATOM 0 HB2 ALA A 15 13.697 -3.107 -5.943 1.00 15.14 H new ATOM 0 HB3 ALA A 15 12.822 -3.153 -7.492 1.00 15.14 H new ATOM 254 N ARG A 16 13.576 -5.600 -9.387 1.00 44.23 N ATOM 255 CA ARG A 16 12.931 -6.447 -10.383 1.00 52.52 C ATOM 256 C ARG A 16 13.430 -7.885 -10.280 1.00 13.23 C ATOM 257 O ARG A 16 12.771 -8.817 -10.742 1.00 55.25 O ATOM 258 CB ARG A 16 13.191 -5.905 -11.790 1.00 61.00 C ATOM 259 CG ARG A 16 12.442 -6.655 -12.880 1.00 24.15 C ATOM 260 CD ARG A 16 12.874 -6.202 -14.265 1.00 51.44 C ATOM 261 NE ARG A 16 12.537 -7.184 -15.292 1.00 62.02 N ATOM 262 CZ ARG A 16 13.131 -7.239 -16.479 1.00 71.23 C ATOM 263 NH1 ARG A 16 14.086 -6.373 -16.787 1.00 64.22 N ATOM 264 NH2 ARG A 16 12.769 -8.163 -17.361 1.00 3.40 N ATOM 0 H ARG A 16 14.171 -4.869 -9.777 1.00 44.23 H new ATOM 0 HA ARG A 16 11.858 -6.439 -10.190 1.00 52.52 H new ATOM 0 HB2 ARG A 16 12.907 -4.853 -11.823 1.00 61.00 H new ATOM 0 HB3 ARG A 16 14.260 -5.953 -11.997 1.00 61.00 H new ATOM 0 HG2 ARG A 16 12.619 -7.725 -12.774 1.00 24.15 H new ATOM 0 HG3 ARG A 16 11.370 -6.496 -12.762 1.00 24.15 H new ATOM 0 HD2 ARG A 16 12.395 -5.252 -14.501 1.00 51.44 H new ATOM 0 HD3 ARG A 16 13.950 -6.027 -14.270 1.00 51.44 H new ATOM 0 HE ARG A 16 11.806 -7.865 -15.087 1.00 62.02 H new ATOM 0 HH11 ARG A 16 14.367 -5.662 -16.112 1.00 64.22 H new ATOM 0 HH12 ARG A 16 14.540 -6.418 -17.699 1.00 64.22 H new ATOM 0 HH21 ARG A 16 12.034 -8.831 -17.127 1.00 3.40 H new ATOM 0 HH22 ARG A 16 13.225 -8.205 -18.272 1.00 3.40 H new ATOM 278 N LEU A 17 14.597 -8.058 -9.671 1.00 5.14 N ATOM 279 CA LEU A 17 15.186 -9.383 -9.506 1.00 52.34 C ATOM 280 C LEU A 17 14.185 -10.349 -8.880 1.00 64.14 C ATOM 281 O LEU A 17 14.226 -11.554 -9.135 1.00 45.51 O ATOM 282 CB LEU A 17 16.443 -9.300 -8.639 1.00 64.05 C ATOM 283 CG LEU A 17 17.628 -8.547 -9.245 1.00 41.25 C ATOM 284 CD1 LEU A 17 18.527 -7.996 -8.150 1.00 1.43 C ATOM 285 CD2 LEU A 17 18.416 -9.455 -10.178 1.00 43.54 C ATOM 0 H LEU A 17 15.155 -7.298 -9.283 1.00 5.14 H new ATOM 0 HA LEU A 17 15.457 -9.759 -10.493 1.00 52.34 H new ATOM 0 HB2 LEU A 17 16.179 -8.822 -7.696 1.00 64.05 H new ATOM 0 HB3 LEU A 17 16.765 -10.314 -8.403 1.00 64.05 H new ATOM 0 HG LEU A 17 17.242 -7.709 -9.826 1.00 41.25 H new ATOM 0 HD11 LEU A 17 19.365 -7.463 -8.601 1.00 1.43 H new ATOM 0 HD12 LEU A 17 17.957 -7.311 -7.522 1.00 1.43 H new ATOM 0 HD13 LEU A 17 18.905 -8.818 -7.541 1.00 1.43 H new ATOM 0 HD21 LEU A 17 19.255 -8.903 -10.600 1.00 43.54 H new ATOM 0 HD22 LEU A 17 18.790 -10.313 -9.620 1.00 43.54 H new ATOM 0 HD23 LEU A 17 17.767 -9.800 -10.983 1.00 43.54 H new ATOM 297 N LEU A 18 13.286 -9.814 -8.062 1.00 43.41 N ATOM 298 CA LEU A 18 12.273 -10.628 -7.401 1.00 33.12 C ATOM 299 C LEU A 18 11.473 -11.435 -8.419 1.00 10.31 C ATOM 300 O LEU A 18 10.931 -12.492 -8.099 1.00 20.01 O ATOM 301 CB LEU A 18 11.332 -9.742 -6.583 1.00 12.31 C ATOM 302 CG LEU A 18 11.695 -9.557 -5.109 1.00 64.12 C ATOM 303 CD1 LEU A 18 11.492 -10.855 -4.343 1.00 14.44 C ATOM 304 CD2 LEU A 18 13.132 -9.074 -4.971 1.00 13.31 C ATOM 0 H LEU A 18 13.238 -8.819 -7.841 1.00 43.41 H new ATOM 0 HA LEU A 18 12.781 -11.323 -6.732 1.00 33.12 H new ATOM 0 HB2 LEU A 18 11.291 -8.759 -7.052 1.00 12.31 H new ATOM 0 HB3 LEU A 18 10.328 -10.164 -6.639 1.00 12.31 H new ATOM 0 HG LEU A 18 11.035 -8.801 -4.684 1.00 64.12 H new ATOM 0 HD11 LEU A 18 11.755 -10.705 -3.296 1.00 14.44 H new ATOM 0 HD12 LEU A 18 10.448 -11.160 -4.414 1.00 14.44 H new ATOM 0 HD13 LEU A 18 12.127 -11.632 -4.769 1.00 14.44 H new ATOM 0 HD21 LEU A 18 13.374 -8.948 -3.916 1.00 13.31 H new ATOM 0 HD22 LEU A 18 13.806 -9.808 -5.412 1.00 13.31 H new ATOM 0 HD23 LEU A 18 13.246 -8.120 -5.486 1.00 13.31 H new ATOM 316 N GLU A 19 11.406 -10.929 -9.646 1.00 42.34 N ATOM 317 CA GLU A 19 10.674 -11.604 -10.711 1.00 52.24 C ATOM 318 C GLU A 19 11.153 -13.043 -10.874 1.00 24.33 C ATOM 319 O GLU A 19 10.388 -13.922 -11.268 1.00 74.04 O ATOM 320 CB GLU A 19 10.838 -10.848 -12.032 1.00 34.13 C ATOM 321 CG GLU A 19 9.698 -11.077 -13.010 1.00 35.23 C ATOM 322 CD GLU A 19 8.548 -10.110 -12.803 1.00 2.12 C ATOM 323 OE1 GLU A 19 8.776 -8.887 -12.911 1.00 43.32 O ATOM 324 OE2 GLU A 19 7.422 -10.575 -12.532 1.00 74.44 O ATOM 0 H GLU A 19 11.849 -10.055 -9.927 1.00 42.34 H new ATOM 0 HA GLU A 19 9.619 -11.619 -10.438 1.00 52.24 H new ATOM 0 HB2 GLU A 19 10.917 -9.781 -11.823 1.00 34.13 H new ATOM 0 HB3 GLU A 19 11.774 -11.151 -12.501 1.00 34.13 H new ATOM 0 HG2 GLU A 19 10.073 -10.977 -14.029 1.00 35.23 H new ATOM 0 HG3 GLU A 19 9.333 -12.098 -12.903 1.00 35.23 H new ATOM 331 N GLN A 20 12.426 -13.275 -10.567 1.00 34.12 N ATOM 332 CA GLN A 20 13.008 -14.607 -10.680 1.00 32.12 C ATOM 333 C GLN A 20 12.445 -15.539 -9.612 1.00 24.51 C ATOM 334 O GLN A 20 12.381 -16.753 -9.806 1.00 31.43 O ATOM 335 CB GLN A 20 14.531 -14.533 -10.558 1.00 72.14 C ATOM 336 CG GLN A 20 15.018 -14.336 -9.132 1.00 45.42 C ATOM 337 CD GLN A 20 15.314 -15.646 -8.429 1.00 74.05 C ATOM 338 OE1 GLN A 20 14.987 -16.721 -8.933 1.00 61.13 O ATOM 339 NE2 GLN A 20 15.935 -15.564 -7.259 1.00 13.43 N ATOM 0 H GLN A 20 13.073 -12.558 -10.238 1.00 34.12 H new ATOM 0 HA GLN A 20 12.748 -15.008 -11.660 1.00 32.12 H new ATOM 0 HB2 GLN A 20 14.964 -15.450 -10.958 1.00 72.14 H new ATOM 0 HB3 GLN A 20 14.897 -13.712 -11.175 1.00 72.14 H new ATOM 0 HG2 GLN A 20 15.918 -13.722 -9.141 1.00 45.42 H new ATOM 0 HG3 GLN A 20 14.264 -13.788 -8.567 1.00 45.42 H new ATOM 0 HE21 GLN A 20 16.188 -14.652 -6.879 1.00 13.43 H new ATOM 0 HE22 GLN A 20 16.160 -16.413 -6.740 1.00 13.43 H new ATOM 348 N TRP A 21 12.040 -14.964 -8.486 1.00 23.24 N ATOM 349 CA TRP A 21 11.484 -15.745 -7.386 1.00 55.53 C ATOM 350 C TRP A 21 10.319 -16.605 -7.865 1.00 1.35 C ATOM 351 O TRP A 21 10.176 -17.755 -7.452 1.00 62.20 O ATOM 352 CB TRP A 21 11.021 -14.819 -6.260 1.00 22.13 C ATOM 353 CG TRP A 21 10.707 -15.544 -4.986 1.00 62.43 C ATOM 354 CD1 TRP A 21 9.553 -16.211 -4.686 1.00 4.54 C ATOM 355 CD2 TRP A 21 11.558 -15.675 -3.842 1.00 52.41 C ATOM 356 NE1 TRP A 21 9.636 -16.747 -3.423 1.00 53.12 N ATOM 357 CE2 TRP A 21 10.856 -16.433 -2.885 1.00 74.11 C ATOM 358 CE3 TRP A 21 12.845 -15.226 -3.534 1.00 31.24 C ATOM 359 CZ2 TRP A 21 11.399 -16.750 -1.643 1.00 34.22 C ATOM 360 CZ3 TRP A 21 13.382 -15.542 -2.300 1.00 42.51 C ATOM 361 CH2 TRP A 21 12.660 -16.298 -1.367 1.00 65.13 C ATOM 0 H TRP A 21 12.086 -13.960 -8.310 1.00 23.24 H new ATOM 0 HA TRP A 21 12.266 -16.403 -7.007 1.00 55.53 H new ATOM 0 HB2 TRP A 21 11.797 -14.078 -6.066 1.00 22.13 H new ATOM 0 HB3 TRP A 21 10.135 -14.275 -6.588 1.00 22.13 H new ATOM 0 HD1 TRP A 21 8.702 -16.303 -5.344 1.00 4.54 H new ATOM 0 HE1 TRP A 21 8.907 -17.291 -2.961 1.00 53.12 H new ATOM 0 HE3 TRP A 21 13.410 -14.643 -4.247 1.00 31.24 H new ATOM 0 HZ2 TRP A 21 10.844 -17.332 -0.923 1.00 34.22 H new ATOM 0 HZ3 TRP A 21 14.376 -15.200 -2.051 1.00 42.51 H new ATOM 0 HH2 TRP A 21 13.108 -16.528 -0.412 1.00 65.13 H new ATOM 372 N GLU A 22 9.490 -16.039 -8.736 1.00 70.34 N ATOM 373 CA GLU A 22 8.338 -16.756 -9.269 1.00 74.54 C ATOM 374 C GLU A 22 8.780 -17.874 -10.210 1.00 34.02 C ATOM 375 O GLU A 22 8.484 -19.047 -9.981 1.00 73.14 O ATOM 376 CB GLU A 22 7.406 -15.793 -10.007 1.00 53.21 C ATOM 377 CG GLU A 22 5.963 -16.265 -10.064 1.00 33.31 C ATOM 378 CD GLU A 22 5.397 -16.578 -8.692 1.00 71.13 C ATOM 379 OE1 GLU A 22 5.828 -15.937 -7.712 1.00 12.54 O ATOM 380 OE2 GLU A 22 4.522 -17.465 -8.600 1.00 43.12 O ATOM 0 H GLU A 22 9.594 -15.087 -9.087 1.00 70.34 H new ATOM 0 HA GLU A 22 7.800 -17.200 -8.431 1.00 74.54 H new ATOM 0 HB2 GLU A 22 7.442 -14.820 -9.518 1.00 53.21 H new ATOM 0 HB3 GLU A 22 7.774 -15.652 -11.023 1.00 53.21 H new ATOM 0 HG2 GLU A 22 5.352 -15.497 -10.538 1.00 33.31 H new ATOM 0 HG3 GLU A 22 5.900 -17.155 -10.691 1.00 33.31 H new ATOM 387 N LYS A 23 9.490 -17.501 -11.269 1.00 74.43 N ATOM 388 CA LYS A 23 9.974 -18.470 -12.246 1.00 20.05 C ATOM 389 C LYS A 23 8.900 -19.505 -12.564 1.00 22.54 C ATOM 390 O LYS A 23 9.199 -20.685 -12.754 1.00 54.43 O ATOM 391 CB LYS A 23 11.231 -19.168 -11.722 1.00 2.15 C ATOM 392 CG LYS A 23 10.979 -20.045 -10.508 1.00 34.33 C ATOM 393 CD LYS A 23 12.104 -21.045 -10.298 1.00 52.32 C ATOM 394 CE LYS A 23 11.568 -22.413 -9.905 1.00 40.11 C ATOM 395 NZ LYS A 23 12.616 -23.467 -9.998 1.00 41.34 N ATOM 0 H LYS A 23 9.743 -16.534 -11.473 1.00 74.43 H new ATOM 0 HA LYS A 23 10.219 -17.933 -13.163 1.00 20.05 H new ATOM 0 HB2 LYS A 23 11.656 -19.778 -12.519 1.00 2.15 H new ATOM 0 HB3 LYS A 23 11.975 -18.414 -11.467 1.00 2.15 H new ATOM 0 HG2 LYS A 23 10.877 -19.419 -9.621 1.00 34.33 H new ATOM 0 HG3 LYS A 23 10.036 -20.578 -10.632 1.00 34.33 H new ATOM 0 HD2 LYS A 23 12.690 -21.132 -11.213 1.00 52.32 H new ATOM 0 HD3 LYS A 23 12.777 -20.680 -9.522 1.00 52.32 H new ATOM 0 HE2 LYS A 23 11.183 -22.373 -8.886 1.00 40.11 H new ATOM 0 HE3 LYS A 23 10.731 -22.675 -10.552 1.00 40.11 H new ATOM 0 HZ1 LYS A 23 12.211 -24.384 -9.722 1.00 41.34 H new ATOM 0 HZ2 LYS A 23 12.966 -23.523 -10.976 1.00 41.34 H new ATOM 0 HZ3 LYS A 23 13.404 -23.231 -9.361 1.00 41.34 H new ATOM 409 N ASP A 24 7.651 -19.057 -12.621 1.00 20.14 N ATOM 410 CA ASP A 24 6.533 -19.945 -12.918 1.00 51.34 C ATOM 411 C ASP A 24 6.401 -20.166 -14.422 1.00 34.41 C ATOM 412 O ASP A 24 5.835 -21.166 -14.865 1.00 35.14 O ATOM 413 CB ASP A 24 5.232 -19.367 -12.359 1.00 40.52 C ATOM 414 CG ASP A 24 4.132 -20.405 -12.262 1.00 13.22 C ATOM 415 OD1 ASP A 24 3.472 -20.668 -13.289 1.00 11.42 O ATOM 416 OD2 ASP A 24 3.930 -20.954 -11.158 1.00 73.24 O ATOM 0 H ASP A 24 7.387 -18.084 -12.465 1.00 20.14 H new ATOM 0 HA ASP A 24 6.728 -20.906 -12.442 1.00 51.34 H new ATOM 0 HB2 ASP A 24 5.419 -18.947 -11.371 1.00 40.52 H new ATOM 0 HB3 ASP A 24 4.899 -18.547 -12.996 1.00 40.52 H new ATOM 421 N ASP A 25 6.925 -19.228 -15.202 1.00 4.55 N ATOM 422 CA ASP A 25 6.866 -19.320 -16.656 1.00 1.03 C ATOM 423 C ASP A 25 5.421 -19.282 -17.144 1.00 64.51 C ATOM 424 O ASP A 25 5.107 -19.787 -18.222 1.00 71.30 O ATOM 425 CB ASP A 25 7.546 -20.603 -17.135 1.00 23.54 C ATOM 426 CG ASP A 25 8.486 -20.361 -18.299 1.00 4.21 C ATOM 427 OD1 ASP A 25 8.022 -20.411 -19.457 1.00 61.33 O ATOM 428 OD2 ASP A 25 9.686 -20.119 -18.052 1.00 23.53 O ATOM 0 H ASP A 25 7.396 -18.394 -14.852 1.00 4.55 H new ATOM 0 HA ASP A 25 7.394 -18.462 -17.072 1.00 1.03 H new ATOM 0 HB2 ASP A 25 8.102 -21.046 -16.309 1.00 23.54 H new ATOM 0 HB3 ASP A 25 6.785 -21.325 -17.431 1.00 23.54 H new ATOM 433 N ASP A 26 4.547 -18.682 -16.344 1.00 23.42 N ATOM 434 CA ASP A 26 3.135 -18.579 -16.694 1.00 45.03 C ATOM 435 C ASP A 26 2.963 -17.967 -18.081 1.00 63.43 C ATOM 436 O ASP A 26 1.990 -18.253 -18.780 1.00 0.25 O ATOM 437 CB ASP A 26 2.391 -17.738 -15.656 1.00 53.15 C ATOM 438 CG ASP A 26 0.886 -17.816 -15.820 1.00 35.20 C ATOM 439 OD1 ASP A 26 0.352 -18.944 -15.861 1.00 74.13 O ATOM 440 OD2 ASP A 26 0.242 -16.750 -15.908 1.00 14.55 O ATOM 0 H ASP A 26 4.791 -18.259 -15.448 1.00 23.42 H new ATOM 0 HA ASP A 26 2.714 -19.584 -16.705 1.00 45.03 H new ATOM 0 HB2 ASP A 26 2.663 -18.076 -14.656 1.00 53.15 H new ATOM 0 HB3 ASP A 26 2.709 -16.699 -15.739 1.00 53.15 H new ATOM 445 N ILE A 27 3.913 -17.125 -18.473 1.00 23.11 N ATOM 446 CA ILE A 27 3.866 -16.474 -19.776 1.00 2.40 C ATOM 447 C ILE A 27 4.971 -16.992 -20.690 1.00 62.10 C ATOM 448 O ILE A 27 6.045 -17.375 -20.226 1.00 74.11 O ATOM 449 CB ILE A 27 3.998 -14.945 -19.646 1.00 40.31 C ATOM 450 CG1 ILE A 27 3.017 -14.413 -18.599 1.00 21.50 C ATOM 451 CG2 ILE A 27 3.758 -14.276 -20.992 1.00 24.24 C ATOM 452 CD1 ILE A 27 1.573 -14.745 -18.901 1.00 35.41 C ATOM 0 H ILE A 27 4.725 -16.878 -17.907 1.00 23.11 H new ATOM 0 HA ILE A 27 2.896 -16.712 -20.212 1.00 2.40 H new ATOM 0 HB ILE A 27 5.011 -14.710 -19.320 1.00 40.31 H new ATOM 0 HG12 ILE A 27 3.280 -14.824 -17.624 1.00 21.50 H new ATOM 0 HG13 ILE A 27 3.125 -13.331 -18.528 1.00 21.50 H new ATOM 0 HG21 ILE A 27 3.855 -13.196 -20.884 1.00 24.24 H new ATOM 0 HG22 ILE A 27 4.492 -14.636 -21.713 1.00 24.24 H new ATOM 0 HG23 ILE A 27 2.755 -14.517 -21.344 1.00 24.24 H new ATOM 0 HD11 ILE A 27 0.934 -14.337 -18.118 1.00 35.41 H new ATOM 0 HD12 ILE A 27 1.293 -14.310 -19.861 1.00 35.41 H new ATOM 0 HD13 ILE A 27 1.450 -15.827 -18.943 1.00 35.41 H new ATOM 1035 N THR A 64 18.533 3.891 -24.873 1.00 25.44 N ATOM 1036 CA THR A 64 17.102 4.089 -24.681 1.00 5.05 C ATOM 1037 C THR A 64 16.565 3.184 -23.577 1.00 42.54 C ATOM 1038 O THR A 64 16.930 2.011 -23.490 1.00 11.23 O ATOM 1039 CB THR A 64 16.319 3.818 -25.978 1.00 75.14 C ATOM 1040 OG1 THR A 64 14.940 4.162 -25.799 1.00 61.50 O ATOM 1041 CG2 THR A 64 16.433 2.356 -26.385 1.00 3.43 C ATOM 0 HA THR A 64 16.963 5.131 -24.393 1.00 5.05 H new ATOM 0 HB THR A 64 16.747 4.433 -26.769 1.00 75.14 H new ATOM 0 HG1 THR A 64 14.449 3.988 -26.629 1.00 61.50 H new ATOM 0 HG21 THR A 64 15.871 2.189 -27.304 1.00 3.43 H new ATOM 0 HG22 THR A 64 17.481 2.105 -26.549 1.00 3.43 H new ATOM 0 HG23 THR A 64 16.029 1.725 -25.593 1.00 3.43 H new ATOM 1049 N LEU A 65 15.696 3.736 -22.737 1.00 64.04 N ATOM 1050 CA LEU A 65 15.107 2.978 -21.639 1.00 24.10 C ATOM 1051 C LEU A 65 13.603 2.819 -21.832 1.00 72.34 C ATOM 1052 O LEU A 65 12.867 3.803 -21.891 1.00 42.54 O ATOM 1053 CB LEU A 65 15.391 3.671 -20.305 1.00 61.01 C ATOM 1054 CG LEU A 65 14.548 3.209 -19.116 1.00 61.00 C ATOM 1055 CD1 LEU A 65 15.425 2.988 -17.894 1.00 23.14 C ATOM 1056 CD2 LEU A 65 13.453 4.222 -18.813 1.00 62.50 C ATOM 0 H LEU A 65 15.384 4.705 -22.795 1.00 64.04 H new ATOM 0 HA LEU A 65 15.560 1.987 -21.630 1.00 24.10 H new ATOM 0 HB2 LEU A 65 16.442 3.524 -20.058 1.00 61.01 H new ATOM 0 HB3 LEU A 65 15.242 4.743 -20.436 1.00 61.01 H new ATOM 0 HG LEU A 65 14.077 2.261 -19.376 1.00 61.00 H new ATOM 0 HD11 LEU A 65 14.808 2.660 -17.058 1.00 23.14 H new ATOM 0 HD12 LEU A 65 16.172 2.226 -18.115 1.00 23.14 H new ATOM 0 HD13 LEU A 65 15.925 3.920 -17.632 1.00 23.14 H new ATOM 0 HD21 LEU A 65 12.863 3.877 -17.964 1.00 62.50 H new ATOM 0 HD22 LEU A 65 13.904 5.185 -18.574 1.00 62.50 H new ATOM 0 HD23 LEU A 65 12.807 4.331 -19.684 1.00 62.50 H new ATOM 1068 N MET A 66 13.152 1.572 -21.928 1.00 44.15 N ATOM 1069 CA MET A 66 11.735 1.284 -22.112 1.00 15.24 C ATOM 1070 C MET A 66 11.439 -0.187 -21.838 1.00 72.13 C ATOM 1071 O MET A 66 11.970 -1.071 -22.509 1.00 24.40 O ATOM 1072 CB MET A 66 11.297 1.649 -23.532 1.00 4.04 C ATOM 1073 CG MET A 66 9.850 1.294 -23.832 1.00 64.53 C ATOM 1074 SD MET A 66 9.386 1.654 -25.537 1.00 65.40 S ATOM 1075 CE MET A 66 8.909 3.375 -25.402 1.00 23.33 C ATOM 0 H MET A 66 13.748 0.745 -21.881 1.00 44.15 H new ATOM 0 HA MET A 66 11.172 1.888 -21.400 1.00 15.24 H new ATOM 0 HB2 MET A 66 11.439 2.719 -23.683 1.00 4.04 H new ATOM 0 HB3 MET A 66 11.943 1.138 -24.245 1.00 4.04 H new ATOM 0 HG2 MET A 66 9.691 0.234 -23.632 1.00 64.53 H new ATOM 0 HG3 MET A 66 9.197 1.847 -23.157 1.00 64.53 H new ATOM 0 HE1 MET A 66 8.596 3.743 -26.379 1.00 23.33 H new ATOM 0 HE2 MET A 66 8.083 3.469 -24.697 1.00 23.33 H new ATOM 0 HE3 MET A 66 9.757 3.961 -25.048 1.00 23.33 H new ATOM 1085 N MET A 67 10.588 -0.441 -20.849 1.00 61.34 N ATOM 1086 CA MET A 67 10.222 -1.806 -20.489 1.00 33.01 C ATOM 1087 C MET A 67 8.856 -1.841 -19.810 1.00 70.15 C ATOM 1088 O MET A 67 8.520 -0.956 -19.024 1.00 14.40 O ATOM 1089 CB MET A 67 11.279 -2.413 -19.565 1.00 31.52 C ATOM 1090 CG MET A 67 11.528 -3.892 -19.816 1.00 3.22 C ATOM 1091 SD MET A 67 13.167 -4.421 -19.280 1.00 13.42 S ATOM 1092 CE MET A 67 14.209 -3.416 -20.335 1.00 73.11 C ATOM 0 H MET A 67 10.140 0.280 -20.283 1.00 61.34 H new ATOM 0 HA MET A 67 10.169 -2.395 -21.405 1.00 33.01 H new ATOM 0 HB2 MET A 67 12.215 -1.869 -19.690 1.00 31.52 H new ATOM 0 HB3 MET A 67 10.967 -2.276 -18.530 1.00 31.52 H new ATOM 0 HG2 MET A 67 10.772 -4.478 -19.293 1.00 3.22 H new ATOM 0 HG3 MET A 67 11.413 -4.101 -20.880 1.00 3.22 H new ATOM 0 HE1 MET A 67 14.997 -4.035 -20.765 1.00 73.11 H new ATOM 0 HE2 MET A 67 13.608 -2.986 -21.136 1.00 73.11 H new ATOM 0 HE3 MET A 67 14.657 -2.615 -19.747 1.00 73.11 H new ATOM 1102 N PHE A 68 8.073 -2.869 -20.120 1.00 73.10 N ATOM 1103 CA PHE A 68 6.743 -3.018 -19.541 1.00 33.41 C ATOM 1104 C PHE A 68 6.450 -4.481 -19.221 1.00 72.43 C ATOM 1105 O PHE A 68 6.447 -5.334 -20.109 1.00 61.12 O ATOM 1106 CB PHE A 68 5.682 -2.472 -20.499 1.00 0.44 C ATOM 1107 CG PHE A 68 6.061 -1.162 -21.129 1.00 3.13 C ATOM 1108 CD1 PHE A 68 6.132 -0.007 -20.367 1.00 44.41 C ATOM 1109 CD2 PHE A 68 6.347 -1.086 -22.482 1.00 62.33 C ATOM 1110 CE1 PHE A 68 6.480 1.200 -20.945 1.00 23.23 C ATOM 1111 CE2 PHE A 68 6.696 0.117 -23.065 1.00 42.43 C ATOM 1112 CZ PHE A 68 6.764 1.262 -22.295 1.00 72.31 C ATOM 0 H PHE A 68 8.336 -3.611 -20.769 1.00 73.10 H new ATOM 0 HA PHE A 68 6.713 -2.448 -18.613 1.00 33.41 H new ATOM 0 HB2 PHE A 68 5.502 -3.205 -21.285 1.00 0.44 H new ATOM 0 HB3 PHE A 68 4.744 -2.348 -19.957 1.00 0.44 H new ATOM 0 HD1 PHE A 68 5.913 -0.050 -19.310 1.00 44.41 H new ATOM 0 HD2 PHE A 68 6.297 -1.978 -23.089 1.00 62.33 H new ATOM 0 HE1 PHE A 68 6.530 2.094 -20.341 1.00 23.23 H new ATOM 0 HE2 PHE A 68 6.915 0.162 -24.122 1.00 42.43 H new ATOM 0 HZ PHE A 68 7.039 2.203 -22.748 1.00 72.31 H new ATOM 1122 N VAL A 69 6.204 -4.765 -17.946 1.00 11.50 N ATOM 1123 CA VAL A 69 5.909 -6.124 -17.508 1.00 2.53 C ATOM 1124 C VAL A 69 4.921 -6.124 -16.347 1.00 73.40 C ATOM 1125 O VAL A 69 4.880 -5.186 -15.550 1.00 74.14 O ATOM 1126 CB VAL A 69 7.189 -6.865 -17.078 1.00 42.41 C ATOM 1127 CG1 VAL A 69 6.888 -8.327 -16.788 1.00 71.24 C ATOM 1128 CG2 VAL A 69 8.264 -6.735 -18.147 1.00 12.31 C ATOM 0 H VAL A 69 6.203 -4.072 -17.198 1.00 11.50 H new ATOM 0 HA VAL A 69 5.466 -6.642 -18.359 1.00 2.53 H new ATOM 0 HB VAL A 69 7.563 -6.408 -16.162 1.00 42.41 H new ATOM 0 HG11 VAL A 69 7.804 -8.834 -16.486 1.00 71.24 H new ATOM 0 HG12 VAL A 69 6.154 -8.395 -15.985 1.00 71.24 H new ATOM 0 HG13 VAL A 69 6.490 -8.801 -17.685 1.00 71.24 H new ATOM 0 HG21 VAL A 69 9.161 -7.264 -17.827 1.00 12.31 H new ATOM 0 HG22 VAL A 69 7.902 -7.166 -19.081 1.00 12.31 H new ATOM 0 HG23 VAL A 69 8.499 -5.682 -18.300 1.00 12.31 H new ATOM 1138 N THR A 70 4.124 -7.185 -16.256 1.00 41.10 N ATOM 1139 CA THR A 70 3.135 -7.309 -15.193 1.00 54.42 C ATOM 1140 C THR A 70 2.509 -8.699 -15.184 1.00 12.54 C ATOM 1141 O THR A 70 1.416 -8.902 -15.712 1.00 54.11 O ATOM 1142 CB THR A 70 2.019 -6.257 -15.339 1.00 51.41 C ATOM 1143 OG1 THR A 70 0.940 -6.560 -14.448 1.00 73.33 O ATOM 1144 CG2 THR A 70 1.504 -6.209 -16.770 1.00 1.32 C ATOM 0 H THR A 70 4.145 -7.971 -16.906 1.00 41.10 H new ATOM 0 HA THR A 70 3.660 -7.144 -14.252 1.00 54.42 H new ATOM 0 HB THR A 70 2.435 -5.282 -15.086 1.00 51.41 H new ATOM 0 HG1 THR A 70 0.312 -5.808 -14.427 1.00 73.33 H new ATOM 0 HG21 THR A 70 0.717 -5.459 -16.848 1.00 1.32 H new ATOM 0 HG22 THR A 70 2.321 -5.949 -17.442 1.00 1.32 H new ATOM 0 HG23 THR A 70 1.104 -7.185 -17.046 1.00 1.32 H new ATOM 1152 N VAL A 71 3.208 -9.653 -14.579 1.00 23.43 N ATOM 1153 CA VAL A 71 2.720 -11.025 -14.499 1.00 11.23 C ATOM 1154 C VAL A 71 3.651 -11.892 -13.659 1.00 2.32 C ATOM 1155 O VAL A 71 4.809 -11.539 -13.434 1.00 30.44 O ATOM 1156 CB VAL A 71 2.576 -11.652 -15.898 1.00 52.21 C ATOM 1157 CG1 VAL A 71 3.941 -12.010 -16.466 1.00 33.41 C ATOM 1158 CG2 VAL A 71 1.674 -12.876 -15.843 1.00 0.31 C ATOM 0 H VAL A 71 4.115 -9.502 -14.137 1.00 23.43 H new ATOM 0 HA VAL A 71 1.740 -10.985 -14.024 1.00 11.23 H new ATOM 0 HB VAL A 71 2.115 -10.919 -16.560 1.00 52.21 H new ATOM 0 HG11 VAL A 71 3.819 -12.452 -17.455 1.00 33.41 H new ATOM 0 HG12 VAL A 71 4.550 -11.110 -16.543 1.00 33.41 H new ATOM 0 HG13 VAL A 71 4.433 -12.726 -15.807 1.00 33.41 H new ATOM 0 HG21 VAL A 71 1.583 -13.306 -16.840 1.00 0.31 H new ATOM 0 HG22 VAL A 71 2.104 -13.615 -15.167 1.00 0.31 H new ATOM 0 HG23 VAL A 71 0.687 -12.585 -15.482 1.00 0.31 H new ATOM 1168 N SER A 72 3.138 -13.028 -13.198 1.00 51.11 N ATOM 1169 CA SER A 72 3.923 -13.945 -12.380 1.00 14.24 C ATOM 1170 C SER A 72 4.690 -14.932 -13.254 1.00 5.23 C ATOM 1171 O SER A 72 4.098 -15.693 -14.017 1.00 63.41 O ATOM 1172 CB SER A 72 3.013 -14.704 -11.412 1.00 0.13 C ATOM 1173 OG SER A 72 1.748 -14.961 -11.996 1.00 60.32 O ATOM 0 H SER A 72 2.182 -13.336 -13.377 1.00 51.11 H new ATOM 0 HA SER A 72 4.642 -13.358 -11.808 1.00 14.24 H new ATOM 0 HB2 SER A 72 3.484 -15.645 -11.128 1.00 0.13 H new ATOM 0 HB3 SER A 72 2.884 -14.124 -10.498 1.00 0.13 H new ATOM 0 HG SER A 72 1.186 -15.448 -11.358 1.00 60.32 H new ATOM 1179 N GLY A 73 6.015 -14.912 -13.135 1.00 53.45 N ATOM 1180 CA GLY A 73 6.843 -15.808 -13.920 1.00 63.21 C ATOM 1181 C GLY A 73 7.656 -15.077 -14.970 1.00 5.24 C ATOM 1182 O GLY A 73 7.167 -14.805 -16.065 1.00 43.00 O ATOM 0 H GLY A 73 6.529 -14.291 -12.509 1.00 53.45 H new ATOM 0 HA2 GLY A 73 7.516 -16.350 -13.256 1.00 63.21 H new ATOM 0 HA3 GLY A 73 6.210 -16.550 -14.407 1.00 63.21 H new ATOM 1186 N ASN A 74 8.902 -14.756 -14.634 1.00 13.15 N ATOM 1187 CA ASN A 74 9.784 -14.049 -15.555 1.00 30.11 C ATOM 1188 C ASN A 74 11.203 -13.976 -15.000 1.00 44.53 C ATOM 1189 O ASN A 74 11.660 -12.933 -14.531 1.00 13.14 O ATOM 1190 CB ASN A 74 9.254 -12.638 -15.820 1.00 23.41 C ATOM 1191 CG ASN A 74 8.460 -12.552 -17.109 1.00 14.23 C ATOM 1192 OD1 ASN A 74 7.246 -12.345 -17.090 1.00 21.40 O ATOM 1193 ND2 ASN A 74 9.143 -12.710 -18.236 1.00 74.15 N ATOM 0 H ASN A 74 9.323 -14.974 -13.731 1.00 13.15 H new ATOM 0 HA ASN A 74 9.808 -14.603 -16.494 1.00 30.11 H new ATOM 0 HB2 ASN A 74 8.624 -12.327 -14.987 1.00 23.41 H new ATOM 0 HB3 ASN A 74 10.091 -11.941 -15.864 1.00 23.41 H new ATOM 0 HD21 ASN A 74 8.663 -12.662 -19.134 1.00 74.15 H new ATOM 0 HD22 ASN A 74 10.148 -12.880 -18.204 1.00 74.15 H new ATOM 1200 N PRO A 75 11.920 -15.108 -15.056 1.00 33.23 N ATOM 1201 CA PRO A 75 13.298 -15.198 -14.565 1.00 0.03 C ATOM 1202 C PRO A 75 14.276 -14.421 -15.439 1.00 5.12 C ATOM 1203 O PRO A 75 14.849 -14.965 -16.383 1.00 63.04 O ATOM 1204 CB PRO A 75 13.600 -16.697 -14.627 1.00 72.31 C ATOM 1205 CG PRO A 75 12.687 -17.224 -15.680 1.00 61.01 C ATOM 1206 CD PRO A 75 11.439 -16.388 -15.602 1.00 64.34 C ATOM 0 HA PRO A 75 13.404 -14.769 -13.569 1.00 0.03 H new ATOM 0 HB2 PRO A 75 14.644 -16.880 -14.880 1.00 72.31 H new ATOM 0 HB3 PRO A 75 13.416 -17.178 -13.666 1.00 72.31 H new ATOM 0 HG2 PRO A 75 13.145 -17.150 -16.666 1.00 61.01 H new ATOM 0 HG3 PRO A 75 12.463 -18.277 -15.511 1.00 61.01 H new ATOM 0 HD2 PRO A 75 10.979 -16.260 -16.582 1.00 64.34 H new ATOM 0 HD3 PRO A 75 10.689 -16.844 -14.956 1.00 64.34 H new ATOM 1214 N THR A 76 14.465 -13.144 -15.118 1.00 32.51 N ATOM 1215 CA THR A 76 15.374 -12.292 -15.874 1.00 75.32 C ATOM 1216 C THR A 76 16.209 -11.419 -14.945 1.00 63.04 C ATOM 1217 O THR A 76 16.398 -10.230 -15.200 1.00 73.02 O ATOM 1218 CB THR A 76 14.608 -11.389 -16.859 1.00 13.43 C ATOM 1219 OG1 THR A 76 13.785 -10.465 -16.137 1.00 74.14 O ATOM 1220 CG2 THR A 76 13.745 -12.219 -17.797 1.00 32.24 C ATOM 0 H THR A 76 14.000 -12.678 -14.339 1.00 32.51 H new ATOM 0 HA THR A 76 16.033 -12.953 -16.436 1.00 75.32 H new ATOM 0 HB THR A 76 15.336 -10.839 -17.454 1.00 13.43 H new ATOM 0 HG1 THR A 76 12.847 -10.599 -16.386 1.00 74.14 H new ATOM 0 HG21 THR A 76 13.214 -11.559 -18.483 1.00 32.24 H new ATOM 0 HG22 THR A 76 14.377 -12.900 -18.366 1.00 32.24 H new ATOM 0 HG23 THR A 76 13.024 -12.793 -17.215 1.00 32.24 H new ATOM 1228 N GLU A 77 16.708 -12.017 -13.868 1.00 64.22 N ATOM 1229 CA GLU A 77 17.524 -11.292 -12.902 1.00 5.23 C ATOM 1230 C GLU A 77 18.665 -10.555 -13.597 1.00 44.22 C ATOM 1231 O GLU A 77 19.057 -9.462 -13.186 1.00 35.32 O ATOM 1232 CB GLU A 77 18.088 -12.253 -11.853 1.00 61.32 C ATOM 1233 CG GLU A 77 18.660 -13.531 -12.444 1.00 1.10 C ATOM 1234 CD GLU A 77 19.683 -14.186 -11.537 1.00 24.12 C ATOM 1235 OE1 GLU A 77 19.272 -14.895 -10.594 1.00 61.25 O ATOM 1236 OE2 GLU A 77 20.895 -13.990 -11.769 1.00 15.15 O ATOM 0 H GLU A 77 16.561 -13.001 -13.643 1.00 64.22 H new ATOM 0 HA GLU A 77 16.888 -10.558 -12.407 1.00 5.23 H new ATOM 0 HB2 GLU A 77 18.868 -11.743 -11.287 1.00 61.32 H new ATOM 0 HB3 GLU A 77 17.299 -12.511 -11.147 1.00 61.32 H new ATOM 0 HG2 GLU A 77 17.849 -14.233 -12.637 1.00 1.10 H new ATOM 0 HG3 GLU A 77 19.123 -13.307 -13.405 1.00 1.10 H new ATOM 1243 N LYS A 78 19.196 -11.161 -14.654 1.00 10.21 N ATOM 1244 CA LYS A 78 20.291 -10.564 -15.409 1.00 25.03 C ATOM 1245 C LYS A 78 19.815 -9.339 -16.183 1.00 71.43 C ATOM 1246 O LYS A 78 20.552 -8.367 -16.338 1.00 3.43 O ATOM 1247 CB LYS A 78 20.891 -11.589 -16.374 1.00 23.33 C ATOM 1248 CG LYS A 78 22.346 -11.919 -16.084 1.00 54.45 C ATOM 1249 CD LYS A 78 23.286 -11.105 -16.958 1.00 12.01 C ATOM 1250 CE LYS A 78 24.623 -11.807 -17.142 1.00 53.30 C ATOM 1251 NZ LYS A 78 25.125 -11.685 -18.538 1.00 43.25 N ATOM 0 H LYS A 78 18.885 -12.066 -15.007 1.00 10.21 H new ATOM 0 HA LYS A 78 21.057 -10.249 -14.701 1.00 25.03 H new ATOM 0 HB2 LYS A 78 20.303 -12.506 -16.329 1.00 23.33 H new ATOM 0 HB3 LYS A 78 20.809 -11.208 -17.392 1.00 23.33 H new ATOM 0 HG2 LYS A 78 22.562 -11.723 -15.034 1.00 54.45 H new ATOM 0 HG3 LYS A 78 22.520 -12.982 -16.252 1.00 54.45 H new ATOM 0 HD2 LYS A 78 22.825 -10.936 -17.931 1.00 12.01 H new ATOM 0 HD3 LYS A 78 23.447 -10.126 -16.508 1.00 12.01 H new ATOM 0 HE2 LYS A 78 25.354 -11.382 -16.455 1.00 53.30 H new ATOM 0 HE3 LYS A 78 24.518 -12.861 -16.884 1.00 53.30 H new ATOM 0 HZ1 LYS A 78 26.038 -12.176 -18.623 1.00 43.25 H new ATOM 0 HZ2 LYS A 78 24.439 -12.113 -19.192 1.00 43.25 H new ATOM 0 HZ3 LYS A 78 25.249 -10.680 -18.776 1.00 43.25 H new ATOM 1265 N GLU A 79 18.578 -9.395 -16.666 1.00 54.24 N ATOM 1266 CA GLU A 79 18.004 -8.289 -17.424 1.00 51.10 C ATOM 1267 C GLU A 79 17.757 -7.083 -16.523 1.00 15.51 C ATOM 1268 O GLU A 79 17.932 -5.936 -16.937 1.00 62.25 O ATOM 1269 CB GLU A 79 16.694 -8.721 -18.087 1.00 44.02 C ATOM 1270 CG GLU A 79 16.348 -7.919 -19.330 1.00 51.41 C ATOM 1271 CD GLU A 79 15.384 -8.648 -20.246 1.00 21.24 C ATOM 1272 OE1 GLU A 79 14.339 -9.120 -19.753 1.00 34.25 O ATOM 1273 OE2 GLU A 79 15.676 -8.747 -21.456 1.00 1.30 O ATOM 0 H GLU A 79 17.955 -10.193 -16.546 1.00 54.24 H new ATOM 0 HA GLU A 79 18.717 -8.003 -18.197 1.00 51.10 H new ATOM 0 HB2 GLU A 79 16.762 -9.776 -18.353 1.00 44.02 H new ATOM 0 HB3 GLU A 79 15.883 -8.625 -17.366 1.00 44.02 H new ATOM 0 HG2 GLU A 79 15.910 -6.966 -19.033 1.00 51.41 H new ATOM 0 HG3 GLU A 79 17.263 -7.692 -19.878 1.00 51.41 H new ATOM 1280 N THR A 80 17.347 -7.349 -15.287 1.00 14.25 N ATOM 1281 CA THR A 80 17.073 -6.287 -14.327 1.00 0.14 C ATOM 1282 C THR A 80 18.305 -5.418 -14.102 1.00 41.10 C ATOM 1283 O THR A 80 18.209 -4.192 -14.047 1.00 63.45 O ATOM 1284 CB THR A 80 16.608 -6.858 -12.974 1.00 24.42 C ATOM 1285 OG1 THR A 80 17.719 -7.438 -12.279 1.00 54.25 O ATOM 1286 CG2 THR A 80 15.525 -7.907 -13.173 1.00 31.50 C ATOM 0 H THR A 80 17.197 -8.292 -14.927 1.00 14.25 H new ATOM 0 HA THR A 80 16.274 -5.678 -14.750 1.00 0.14 H new ATOM 0 HB THR A 80 16.196 -6.041 -12.382 1.00 24.42 H new ATOM 0 HG1 THR A 80 18.084 -8.179 -12.806 1.00 54.25 H new ATOM 0 HG21 THR A 80 15.213 -8.296 -12.204 1.00 31.50 H new ATOM 0 HG22 THR A 80 14.670 -7.456 -13.676 1.00 31.50 H new ATOM 0 HG23 THR A 80 15.916 -8.722 -13.782 1.00 31.50 H new ATOM 1294 N GLU A 81 19.462 -6.061 -13.973 1.00 54.22 N ATOM 1295 CA GLU A 81 20.713 -5.344 -13.754 1.00 73.53 C ATOM 1296 C GLU A 81 20.996 -4.380 -14.903 1.00 33.32 C ATOM 1297 O GLU A 81 21.335 -3.218 -14.681 1.00 72.43 O ATOM 1298 CB GLU A 81 21.872 -6.332 -13.605 1.00 42.24 C ATOM 1299 CG GLU A 81 23.115 -5.722 -12.979 1.00 15.44 C ATOM 1300 CD GLU A 81 24.160 -6.761 -12.625 1.00 22.21 C ATOM 1301 OE1 GLU A 81 24.636 -7.460 -13.544 1.00 51.14 O ATOM 1302 OE2 GLU A 81 24.503 -6.876 -11.430 1.00 34.53 O ATOM 0 H GLU A 81 19.559 -7.075 -14.016 1.00 54.22 H new ATOM 0 HA GLU A 81 20.616 -4.767 -12.834 1.00 73.53 H new ATOM 0 HB2 GLU A 81 21.544 -7.174 -12.995 1.00 42.24 H new ATOM 0 HB3 GLU A 81 22.128 -6.730 -14.587 1.00 42.24 H new ATOM 0 HG2 GLU A 81 23.547 -4.998 -13.670 1.00 15.44 H new ATOM 0 HG3 GLU A 81 22.833 -5.175 -12.079 1.00 15.44 H new ATOM 1309 N GLU A 82 20.854 -4.873 -16.130 1.00 1.55 N ATOM 1310 CA GLU A 82 21.096 -4.055 -17.313 1.00 11.05 C ATOM 1311 C GLU A 82 20.285 -2.763 -17.256 1.00 60.54 C ATOM 1312 O GLU A 82 20.669 -1.751 -17.844 1.00 32.44 O ATOM 1313 CB GLU A 82 20.744 -4.836 -18.580 1.00 62.33 C ATOM 1314 CG GLU A 82 21.957 -5.381 -19.315 1.00 61.54 C ATOM 1315 CD GLU A 82 21.614 -6.548 -20.221 1.00 64.23 C ATOM 1316 OE1 GLU A 82 20.597 -6.463 -20.940 1.00 33.22 O ATOM 1317 OE2 GLU A 82 22.365 -7.546 -20.211 1.00 71.45 O ATOM 0 H GLU A 82 20.573 -5.833 -16.330 1.00 1.55 H new ATOM 0 HA GLU A 82 22.155 -3.798 -17.336 1.00 11.05 H new ATOM 0 HB2 GLU A 82 20.087 -5.665 -18.315 1.00 62.33 H new ATOM 0 HB3 GLU A 82 20.183 -4.187 -19.253 1.00 62.33 H new ATOM 0 HG2 GLU A 82 22.406 -4.585 -19.909 1.00 61.54 H new ATOM 0 HG3 GLU A 82 22.706 -5.697 -18.589 1.00 61.54 H new ATOM 1324 N ILE A 83 19.162 -2.807 -16.547 1.00 24.20 N ATOM 1325 CA ILE A 83 18.298 -1.641 -16.414 1.00 32.34 C ATOM 1326 C ILE A 83 19.044 -0.473 -15.778 1.00 31.43 C ATOM 1327 O ILE A 83 18.880 0.678 -16.183 1.00 33.02 O ATOM 1328 CB ILE A 83 17.050 -1.960 -15.569 1.00 52.41 C ATOM 1329 CG1 ILE A 83 16.355 -3.215 -16.099 1.00 71.34 C ATOM 1330 CG2 ILE A 83 16.093 -0.777 -15.572 1.00 12.13 C ATOM 1331 CD1 ILE A 83 15.956 -3.116 -17.555 1.00 53.11 C ATOM 0 H ILE A 83 18.830 -3.637 -16.056 1.00 24.20 H new ATOM 0 HA ILE A 83 17.985 -1.363 -17.420 1.00 32.34 H new ATOM 0 HB ILE A 83 17.363 -2.148 -14.542 1.00 52.41 H new ATOM 0 HG12 ILE A 83 17.019 -4.070 -15.970 1.00 71.34 H new ATOM 0 HG13 ILE A 83 15.466 -3.409 -15.499 1.00 71.34 H new ATOM 0 HG21 ILE A 83 15.216 -1.017 -14.971 1.00 12.13 H new ATOM 0 HG22 ILE A 83 16.593 0.096 -15.152 1.00 12.13 H new ATOM 0 HG23 ILE A 83 15.784 -0.562 -16.595 1.00 12.13 H new ATOM 0 HD11 ILE A 83 15.469 -4.041 -17.862 1.00 53.11 H new ATOM 0 HD12 ILE A 83 15.267 -2.282 -17.688 1.00 53.11 H new ATOM 0 HD13 ILE A 83 16.844 -2.953 -18.165 1.00 53.11 H new ATOM 1343 N THR A 84 19.867 -0.777 -14.779 1.00 21.41 N ATOM 1344 CA THR A 84 20.640 0.246 -14.087 1.00 12.23 C ATOM 1345 C THR A 84 21.394 1.128 -15.075 1.00 52.32 C ATOM 1346 O THR A 84 21.592 2.319 -14.833 1.00 62.25 O ATOM 1347 CB THR A 84 21.646 -0.379 -13.103 1.00 24.13 C ATOM 1348 OG1 THR A 84 22.071 0.600 -12.148 1.00 33.13 O ATOM 1349 CG2 THR A 84 22.856 -0.930 -13.843 1.00 34.31 C ATOM 0 H THR A 84 20.015 -1.724 -14.431 1.00 21.41 H new ATOM 0 HA THR A 84 19.929 0.855 -13.529 1.00 12.23 H new ATOM 0 HB THR A 84 21.151 -1.200 -12.585 1.00 24.13 H new ATOM 0 HG1 THR A 84 22.709 0.194 -11.525 1.00 33.13 H new ATOM 0 HG21 THR A 84 23.553 -1.366 -13.127 1.00 34.31 H new ATOM 0 HG22 THR A 84 22.533 -1.696 -14.548 1.00 34.31 H new ATOM 0 HG23 THR A 84 23.350 -0.123 -14.384 1.00 34.31 H new ATOM 1357 N SER A 85 21.812 0.537 -16.190 1.00 34.21 N ATOM 1358 CA SER A 85 22.547 1.269 -17.214 1.00 60.13 C ATOM 1359 C SER A 85 21.637 2.260 -17.933 1.00 14.44 C ATOM 1360 O SER A 85 21.904 3.463 -17.955 1.00 74.30 O ATOM 1361 CB SER A 85 23.160 0.297 -18.225 1.00 13.22 C ATOM 1362 OG SER A 85 24.532 0.579 -18.436 1.00 3.31 O ATOM 0 H SER A 85 21.654 -0.447 -16.407 1.00 34.21 H new ATOM 0 HA SER A 85 23.346 1.825 -16.724 1.00 60.13 H new ATOM 0 HB2 SER A 85 23.047 -0.726 -17.866 1.00 13.22 H new ATOM 0 HB3 SER A 85 22.622 0.364 -19.171 1.00 13.22 H new ATOM 0 HG SER A 85 24.901 -0.057 -19.084 1.00 3.31 H new ATOM 1368 N LEU A 86 20.560 1.748 -18.519 1.00 24.22 N ATOM 1369 CA LEU A 86 19.609 2.587 -19.239 1.00 33.12 C ATOM 1370 C LEU A 86 19.039 3.669 -18.328 1.00 12.24 C ATOM 1371 O LEU A 86 18.568 4.705 -18.797 1.00 74.13 O ATOM 1372 CB LEU A 86 18.474 1.733 -19.807 1.00 31.10 C ATOM 1373 CG LEU A 86 18.889 0.418 -20.468 1.00 4.11 C ATOM 1374 CD1 LEU A 86 17.687 -0.265 -21.100 1.00 33.11 C ATOM 1375 CD2 LEU A 86 19.973 0.663 -21.508 1.00 3.05 C ATOM 0 H LEU A 86 20.324 0.756 -18.509 1.00 24.22 H new ATOM 0 HA LEU A 86 20.138 3.071 -20.060 1.00 33.12 H new ATOM 0 HB2 LEU A 86 17.778 1.507 -19.000 1.00 31.10 H new ATOM 0 HB3 LEU A 86 17.930 2.329 -20.540 1.00 31.10 H new ATOM 0 HG LEU A 86 19.292 -0.241 -19.699 1.00 4.11 H new ATOM 0 HD11 LEU A 86 18.002 -1.199 -21.565 1.00 33.11 H new ATOM 0 HD12 LEU A 86 16.943 -0.475 -20.332 1.00 33.11 H new ATOM 0 HD13 LEU A 86 17.253 0.389 -21.856 1.00 33.11 H new ATOM 0 HD21 LEU A 86 20.256 -0.284 -21.968 1.00 3.05 H new ATOM 0 HD22 LEU A 86 19.596 1.340 -22.274 1.00 3.05 H new ATOM 0 HD23 LEU A 86 20.844 1.108 -21.027 1.00 3.05 H new ATOM 1387 N TRP A 87 19.087 3.423 -17.024 1.00 23.25 N ATOM 1388 CA TRP A 87 18.578 4.378 -16.046 1.00 34.20 C ATOM 1389 C TRP A 87 19.162 5.766 -16.285 1.00 73.31 C ATOM 1390 O TRP A 87 18.428 6.749 -16.377 1.00 50.41 O ATOM 1391 CB TRP A 87 18.905 3.910 -14.627 1.00 4.50 C ATOM 1392 CG TRP A 87 17.696 3.772 -13.753 1.00 32.11 C ATOM 1393 CD1 TRP A 87 16.412 3.547 -14.160 1.00 71.41 C ATOM 1394 CD2 TRP A 87 17.657 3.852 -12.324 1.00 25.41 C ATOM 1395 NE1 TRP A 87 15.578 3.481 -13.070 1.00 54.52 N ATOM 1396 CE2 TRP A 87 16.317 3.665 -11.932 1.00 64.51 C ATOM 1397 CE3 TRP A 87 18.625 4.061 -11.337 1.00 73.42 C ATOM 1398 CZ2 TRP A 87 15.923 3.682 -10.597 1.00 23.02 C ATOM 1399 CZ3 TRP A 87 18.232 4.078 -10.012 1.00 72.15 C ATOM 1400 CH2 TRP A 87 16.891 3.889 -9.652 1.00 21.22 C ATOM 0 H TRP A 87 19.473 2.570 -16.619 1.00 23.25 H new ATOM 0 HA TRP A 87 17.496 4.436 -16.161 1.00 34.20 H new ATOM 0 HB2 TRP A 87 19.419 2.950 -14.678 1.00 4.50 H new ATOM 0 HB3 TRP A 87 19.596 4.617 -14.169 1.00 4.50 H new ATOM 0 HD1 TRP A 87 16.098 3.437 -15.188 1.00 71.41 H new ATOM 0 HE1 TRP A 87 14.571 3.321 -13.103 1.00 54.52 H new ATOM 0 HE3 TRP A 87 19.661 4.207 -11.605 1.00 73.42 H new ATOM 0 HZ2 TRP A 87 14.890 3.537 -10.317 1.00 23.02 H new ATOM 0 HZ3 TRP A 87 18.971 4.240 -9.241 1.00 72.15 H new ATOM 0 HH2 TRP A 87 16.616 3.907 -8.608 1.00 21.22 H new ATOM 1411 N GLN A 88 20.485 5.837 -16.385 1.00 22.01 N ATOM 1412 CA GLN A 88 21.166 7.106 -16.613 1.00 23.10 C ATOM 1413 C GLN A 88 20.604 7.812 -17.842 1.00 10.40 C ATOM 1414 O GLN A 88 20.531 9.040 -17.886 1.00 31.33 O ATOM 1415 CB GLN A 88 22.669 6.879 -16.784 1.00 23.52 C ATOM 1416 CG GLN A 88 23.042 6.252 -18.118 1.00 1.11 C ATOM 1417 CD GLN A 88 24.250 5.342 -18.018 1.00 4.00 C ATOM 1418 OE1 GLN A 88 25.090 5.501 -17.131 1.00 60.14 O ATOM 1419 NE2 GLN A 88 24.345 4.381 -18.929 1.00 73.32 N ATOM 0 H GLN A 88 21.106 5.032 -16.312 1.00 22.01 H new ATOM 0 HA GLN A 88 20.998 7.741 -15.743 1.00 23.10 H new ATOM 0 HB2 GLN A 88 23.186 7.833 -16.683 1.00 23.52 H new ATOM 0 HB3 GLN A 88 23.025 6.237 -15.978 1.00 23.52 H new ATOM 0 HG2 GLN A 88 22.193 5.683 -18.497 1.00 1.11 H new ATOM 0 HG3 GLN A 88 23.245 7.041 -18.842 1.00 1.11 H new ATOM 0 HE21 GLN A 88 23.626 4.285 -19.646 1.00 73.32 H new ATOM 0 HE22 GLN A 88 25.137 3.738 -18.912 1.00 73.32 H new ATOM 1428 N GLY A 89 20.208 7.028 -18.840 1.00 53.20 N ATOM 1429 CA GLY A 89 19.657 7.597 -20.057 1.00 25.34 C ATOM 1430 C GLY A 89 18.468 8.497 -19.789 1.00 52.23 C ATOM 1431 O GLY A 89 18.456 9.659 -20.196 1.00 62.12 O ATOM 0 H GLY A 89 20.259 6.009 -18.828 1.00 53.20 H new ATOM 0 HA2 GLY A 89 20.431 8.166 -20.571 1.00 25.34 H new ATOM 0 HA3 GLY A 89 19.356 6.792 -20.727 1.00 25.34 H new ATOM 1435 N SER A 90 17.463 7.960 -19.105 1.00 0.13 N ATOM 1436 CA SER A 90 16.260 8.722 -18.788 1.00 63.44 C ATOM 1437 C SER A 90 16.616 10.051 -18.129 1.00 65.25 C ATOM 1438 O SER A 90 15.931 11.056 -18.321 1.00 75.21 O ATOM 1439 CB SER A 90 15.346 7.912 -17.867 1.00 71.33 C ATOM 1440 OG SER A 90 15.453 6.524 -18.134 1.00 54.14 O ATOM 0 H SER A 90 17.457 7.000 -18.760 1.00 0.13 H new ATOM 0 HA SER A 90 15.734 8.928 -19.720 1.00 63.44 H new ATOM 0 HB2 SER A 90 15.608 8.107 -16.827 1.00 71.33 H new ATOM 0 HB3 SER A 90 14.313 8.233 -18.001 1.00 71.33 H new ATOM 0 HG SER A 90 15.269 6.018 -17.315 1.00 54.14 H new ATOM 1446 N LEU A 91 17.694 10.048 -17.352 1.00 53.41 N ATOM 1447 CA LEU A 91 18.143 11.253 -16.664 1.00 10.54 C ATOM 1448 C LEU A 91 18.278 12.419 -17.638 1.00 42.11 C ATOM 1449 O LEU A 91 17.908 13.551 -17.324 1.00 70.52 O ATOM 1450 CB LEU A 91 19.481 10.998 -15.967 1.00 51.04 C ATOM 1451 CG LEU A 91 19.732 11.790 -14.684 1.00 14.13 C ATOM 1452 CD1 LEU A 91 18.807 11.314 -13.574 1.00 1.32 C ATOM 1453 CD2 LEU A 91 21.187 11.668 -14.257 1.00 62.51 C ATOM 0 H LEU A 91 18.273 9.225 -17.183 1.00 53.41 H new ATOM 0 HA LEU A 91 17.394 11.514 -15.916 1.00 10.54 H new ATOM 0 HB2 LEU A 91 19.549 9.936 -15.733 1.00 51.04 H new ATOM 0 HB3 LEU A 91 20.283 11.222 -16.671 1.00 51.04 H new ATOM 0 HG LEU A 91 19.520 12.841 -14.881 1.00 14.13 H new ATOM 0 HD11 LEU A 91 19.000 11.889 -12.668 1.00 1.32 H new ATOM 0 HD12 LEU A 91 17.770 11.454 -13.879 1.00 1.32 H new ATOM 0 HD13 LEU A 91 18.988 10.257 -13.378 1.00 1.32 H new ATOM 0 HD21 LEU A 91 21.347 12.238 -13.342 1.00 62.51 H new ATOM 0 HD22 LEU A 91 21.427 10.620 -14.078 1.00 62.51 H new ATOM 0 HD23 LEU A 91 21.831 12.058 -15.045 1.00 62.51 H new ATOM 1465 N PHE A 92 18.809 12.135 -18.823 1.00 21.43 N ATOM 1466 CA PHE A 92 18.992 13.159 -19.844 1.00 50.03 C ATOM 1467 C PHE A 92 17.648 13.607 -20.412 1.00 3.32 C ATOM 1468 O PHE A 92 17.386 14.802 -20.543 1.00 74.23 O ATOM 1469 CB PHE A 92 19.884 12.633 -20.971 1.00 30.35 C ATOM 1470 CG PHE A 92 20.187 13.659 -22.025 1.00 35.31 C ATOM 1471 CD1 PHE A 92 19.276 13.922 -23.035 1.00 53.42 C ATOM 1472 CD2 PHE A 92 21.381 14.360 -22.005 1.00 64.14 C ATOM 1473 CE1 PHE A 92 19.552 14.866 -24.007 1.00 21.50 C ATOM 1474 CE2 PHE A 92 21.663 15.305 -22.974 1.00 61.53 C ATOM 1475 CZ PHE A 92 20.747 15.558 -23.976 1.00 14.32 C ATOM 0 H PHE A 92 19.120 11.204 -19.099 1.00 21.43 H new ATOM 0 HA PHE A 92 19.475 14.018 -19.378 1.00 50.03 H new ATOM 0 HB2 PHE A 92 20.821 12.274 -20.545 1.00 30.35 H new ATOM 0 HB3 PHE A 92 19.398 11.776 -21.438 1.00 30.35 H new ATOM 0 HD1 PHE A 92 18.340 13.384 -23.064 1.00 53.42 H new ATOM 0 HD2 PHE A 92 22.100 14.166 -21.223 1.00 64.14 H new ATOM 0 HE1 PHE A 92 18.834 15.062 -24.790 1.00 21.50 H new ATOM 0 HE2 PHE A 92 22.598 15.844 -22.947 1.00 61.53 H new ATOM 0 HZ PHE A 92 20.965 16.296 -24.734 1.00 14.32 H new ATOM 1485 N ASN A 93 16.802 12.639 -20.747 1.00 14.02 N ATOM 1486 CA ASN A 93 15.485 12.933 -21.301 1.00 62.04 C ATOM 1487 C ASN A 93 14.731 13.922 -20.418 1.00 21.02 C ATOM 1488 O ASN A 93 14.370 15.013 -20.858 1.00 72.10 O ATOM 1489 CB ASN A 93 14.673 11.645 -21.453 1.00 24.15 C ATOM 1490 CG ASN A 93 13.369 11.867 -22.193 1.00 52.32 C ATOM 1491 OD1 ASN A 93 13.230 11.489 -23.357 1.00 5.43 O ATOM 1492 ND2 ASN A 93 12.404 12.484 -21.520 1.00 62.22 N ATOM 0 H ASN A 93 17.004 11.645 -20.645 1.00 14.02 H new ATOM 0 HA ASN A 93 15.625 13.384 -22.283 1.00 62.04 H new ATOM 0 HB2 ASN A 93 15.269 10.904 -21.987 1.00 24.15 H new ATOM 0 HB3 ASN A 93 14.462 11.233 -20.466 1.00 24.15 H new ATOM 0 HD21 ASN A 93 11.504 12.662 -21.966 1.00 62.22 H new ATOM 0 HD22 ASN A 93 12.563 12.780 -20.557 1.00 62.22 H new ATOM 1499 N ALA A 94 14.498 13.532 -19.169 1.00 14.42 N ATOM 1500 CA ALA A 94 13.789 14.385 -18.222 1.00 42.14 C ATOM 1501 C ALA A 94 14.528 14.459 -16.891 1.00 2.24 C ATOM 1502 O ALA A 94 15.230 15.431 -16.613 1.00 32.33 O ATOM 1503 CB ALA A 94 12.370 13.877 -18.013 1.00 65.25 C ATOM 0 H ALA A 94 14.790 12.631 -18.789 1.00 14.42 H new ATOM 0 HA ALA A 94 13.745 15.391 -18.640 1.00 42.14 H new ATOM 0 HB1 ALA A 94 11.853 14.523 -17.304 1.00 65.25 H new ATOM 0 HB2 ALA A 94 11.838 13.883 -18.964 1.00 65.25 H new ATOM 0 HB3 ALA A 94 12.402 12.860 -17.621 1.00 65.25 H new ATOM 1509 N ASN A 95 14.365 13.426 -16.070 1.00 52.32 N ATOM 1510 CA ASN A 95 15.016 13.376 -14.766 1.00 71.42 C ATOM 1511 C ASN A 95 14.648 12.094 -14.024 1.00 41.30 C ATOM 1512 O ASN A 95 13.988 12.134 -12.986 1.00 34.23 O ATOM 1513 CB ASN A 95 14.623 14.594 -13.929 1.00 14.22 C ATOM 1514 CG ASN A 95 13.180 15.007 -14.151 1.00 45.31 C ATOM 1515 OD1 ASN A 95 12.894 15.895 -14.955 1.00 62.51 O ATOM 1516 ND2 ASN A 95 12.264 14.364 -13.437 1.00 1.00 N ATOM 0 H ASN A 95 13.788 12.613 -16.285 1.00 52.32 H new ATOM 0 HA ASN A 95 16.094 13.386 -14.925 1.00 71.42 H new ATOM 0 HB2 ASN A 95 14.776 14.371 -12.873 1.00 14.22 H new ATOM 0 HB3 ASN A 95 15.279 15.429 -14.176 1.00 14.22 H new ATOM 0 HD21 ASN A 95 11.277 14.599 -13.543 1.00 1.00 H new ATOM 0 HD22 ASN A 95 12.547 13.635 -12.782 1.00 1.00 H new ATOM 1523 N TYR A 96 15.080 10.960 -14.563 1.00 45.13 N ATOM 1524 CA TYR A 96 14.796 9.667 -13.954 1.00 35.42 C ATOM 1525 C TYR A 96 13.291 9.431 -13.853 1.00 45.22 C ATOM 1526 O TYR A 96 12.629 9.952 -12.956 1.00 11.40 O ATOM 1527 CB TYR A 96 15.430 9.583 -12.565 1.00 21.05 C ATOM 1528 CG TYR A 96 14.815 8.521 -11.681 1.00 2.32 C ATOM 1529 CD1 TYR A 96 14.723 7.202 -12.108 1.00 51.31 C ATOM 1530 CD2 TYR A 96 14.326 8.837 -10.419 1.00 71.05 C ATOM 1531 CE1 TYR A 96 14.161 6.229 -11.305 1.00 23.15 C ATOM 1532 CE2 TYR A 96 13.764 7.870 -9.609 1.00 21.14 C ATOM 1533 CZ TYR A 96 13.684 6.568 -10.056 1.00 32.54 C ATOM 1534 OH TYR A 96 13.124 5.602 -9.251 1.00 74.44 O ATOM 0 H TYR A 96 15.629 10.910 -15.421 1.00 45.13 H new ATOM 0 HA TYR A 96 15.226 8.893 -14.590 1.00 35.42 H new ATOM 0 HB2 TYR A 96 16.496 9.381 -12.673 1.00 21.05 H new ATOM 0 HB3 TYR A 96 15.337 10.551 -12.073 1.00 21.05 H new ATOM 0 HD1 TYR A 96 15.097 6.933 -13.085 1.00 51.31 H new ATOM 0 HD2 TYR A 96 14.387 9.856 -10.066 1.00 71.05 H new ATOM 0 HE1 TYR A 96 14.095 5.209 -11.653 1.00 23.15 H new ATOM 0 HE2 TYR A 96 13.389 8.132 -8.631 1.00 21.14 H new ATOM 0 HH TYR A 96 13.786 4.902 -9.071 1.00 74.44 H new ATOM 1544 N ASP A 97 12.760 8.642 -14.780 1.00 53.11 N ATOM 1545 CA ASP A 97 11.334 8.335 -14.796 1.00 62.14 C ATOM 1546 C ASP A 97 11.104 6.828 -14.850 1.00 73.25 C ATOM 1547 O ASP A 97 10.921 6.255 -15.925 1.00 11.31 O ATOM 1548 CB ASP A 97 10.659 9.010 -15.991 1.00 70.24 C ATOM 1549 CG ASP A 97 10.425 10.490 -15.764 1.00 45.42 C ATOM 1550 OD1 ASP A 97 9.452 10.837 -15.063 1.00 11.14 O ATOM 1551 OD2 ASP A 97 11.217 11.302 -16.287 1.00 53.51 O ATOM 0 H ASP A 97 13.295 8.203 -15.530 1.00 53.11 H new ATOM 0 HA ASP A 97 10.894 8.719 -13.876 1.00 62.14 H new ATOM 0 HB2 ASP A 97 11.278 8.875 -16.878 1.00 70.24 H new ATOM 0 HB3 ASP A 97 9.706 8.521 -16.190 1.00 70.24 H new ATOM 1556 N VAL A 98 11.115 6.190 -13.684 1.00 51.31 N ATOM 1557 CA VAL A 98 10.907 4.750 -13.598 1.00 61.22 C ATOM 1558 C VAL A 98 10.248 4.367 -12.278 1.00 1.33 C ATOM 1559 O VAL A 98 10.560 4.934 -11.231 1.00 12.12 O ATOM 1560 CB VAL A 98 12.235 3.982 -13.738 1.00 30.10 C ATOM 1561 CG1 VAL A 98 12.000 2.483 -13.627 1.00 55.23 C ATOM 1562 CG2 VAL A 98 12.914 4.327 -15.055 1.00 12.53 C ATOM 0 H VAL A 98 11.266 6.648 -12.785 1.00 51.31 H new ATOM 0 HA VAL A 98 10.248 4.476 -14.422 1.00 61.22 H new ATOM 0 HB VAL A 98 12.896 4.283 -12.925 1.00 30.10 H new ATOM 0 HG11 VAL A 98 12.949 1.957 -13.728 1.00 55.23 H new ATOM 0 HG12 VAL A 98 11.561 2.255 -12.656 1.00 55.23 H new ATOM 0 HG13 VAL A 98 11.321 2.162 -14.417 1.00 55.23 H new ATOM 0 HG21 VAL A 98 13.851 3.775 -15.137 1.00 12.53 H new ATOM 0 HG22 VAL A 98 12.260 4.056 -15.884 1.00 12.53 H new ATOM 0 HG23 VAL A 98 13.119 5.397 -15.089 1.00 12.53 H new ATOM 1572 N GLN A 99 9.336 3.402 -12.336 1.00 1.24 N ATOM 1573 CA GLN A 99 8.633 2.944 -11.143 1.00 53.13 C ATOM 1574 C GLN A 99 8.571 1.421 -11.099 1.00 72.13 C ATOM 1575 O GLN A 99 8.457 0.765 -12.135 1.00 33.54 O ATOM 1576 CB GLN A 99 7.218 3.525 -11.105 1.00 43.21 C ATOM 1577 CG GLN A 99 7.183 5.024 -10.851 1.00 32.52 C ATOM 1578 CD GLN A 99 6.550 5.794 -11.993 1.00 2.44 C ATOM 1579 OE1 GLN A 99 5.370 6.144 -11.943 1.00 25.15 O ATOM 1580 NE2 GLN A 99 7.333 6.064 -13.031 1.00 2.45 N ATOM 0 H GLN A 99 9.067 2.923 -13.195 1.00 1.24 H new ATOM 0 HA GLN A 99 9.185 3.292 -10.270 1.00 53.13 H new ATOM 0 HB2 GLN A 99 6.722 3.314 -12.052 1.00 43.21 H new ATOM 0 HB3 GLN A 99 6.647 3.019 -10.326 1.00 43.21 H new ATOM 0 HG2 GLN A 99 6.628 5.220 -9.934 1.00 32.52 H new ATOM 0 HG3 GLN A 99 8.199 5.386 -10.693 1.00 32.52 H new ATOM 0 HE21 GLN A 99 8.305 5.755 -13.031 1.00 2.45 H new ATOM 0 HE22 GLN A 99 6.962 6.581 -13.829 1.00 2.45 H new ATOM 1589 N ARG A 100 8.647 0.865 -9.895 1.00 1.04 N ATOM 1590 CA ARG A 100 8.601 -0.581 -9.716 1.00 62.22 C ATOM 1591 C ARG A 100 7.574 -0.966 -8.655 1.00 44.20 C ATOM 1592 O ARG A 100 7.493 -0.338 -7.599 1.00 31.52 O ATOM 1593 CB ARG A 100 9.981 -1.112 -9.322 1.00 51.21 C ATOM 1594 CG ARG A 100 9.986 -2.590 -8.967 1.00 4.30 C ATOM 1595 CD ARG A 100 10.231 -2.805 -7.482 1.00 12.34 C ATOM 1596 NE ARG A 100 8.997 -2.714 -6.705 1.00 42.21 N ATOM 1597 CZ ARG A 100 8.967 -2.476 -5.399 1.00 10.24 C ATOM 1598 NH1 ARG A 100 10.097 -2.305 -4.726 1.00 71.22 N ATOM 1599 NH2 ARG A 100 7.805 -2.407 -4.762 1.00 73.42 N ATOM 0 H ARG A 100 8.741 1.394 -9.028 1.00 1.04 H new ATOM 0 HA ARG A 100 8.304 -1.029 -10.664 1.00 62.22 H new ATOM 0 HB2 ARG A 100 10.675 -0.942 -10.145 1.00 51.21 H new ATOM 0 HB3 ARG A 100 10.351 -0.541 -8.470 1.00 51.21 H new ATOM 0 HG2 ARG A 100 9.032 -3.036 -9.248 1.00 4.30 H new ATOM 0 HG3 ARG A 100 10.758 -3.101 -9.542 1.00 4.30 H new ATOM 0 HD2 ARG A 100 10.685 -3.784 -7.327 1.00 12.34 H new ATOM 0 HD3 ARG A 100 10.943 -2.063 -7.121 1.00 12.34 H new ATOM 0 HE ARG A 100 8.110 -2.840 -7.192 1.00 42.21 H new ATOM 0 HH11 ARG A 100 10.993 -2.356 -5.212 1.00 71.22 H new ATOM 0 HH12 ARG A 100 10.070 -2.122 -3.723 1.00 71.22 H new ATOM 0 HH21 ARG A 100 6.933 -2.537 -5.276 1.00 73.42 H new ATOM 0 HH22 ARG A 100 7.783 -2.224 -3.759 1.00 73.42 H new ATOM 1613 N PHE A 101 6.792 -2.001 -8.944 1.00 1.44 N ATOM 1614 CA PHE A 101 5.769 -2.468 -8.015 1.00 64.13 C ATOM 1615 C PHE A 101 5.791 -3.990 -7.904 1.00 13.22 C ATOM 1616 O PHE A 101 5.816 -4.696 -8.912 1.00 62.21 O ATOM 1617 CB PHE A 101 4.386 -1.998 -8.469 1.00 33.13 C ATOM 1618 CG PHE A 101 3.307 -2.244 -7.453 1.00 54.12 C ATOM 1619 CD1 PHE A 101 3.432 -1.763 -6.160 1.00 35.12 C ATOM 1620 CD2 PHE A 101 2.167 -2.956 -7.792 1.00 64.21 C ATOM 1621 CE1 PHE A 101 2.440 -1.987 -5.223 1.00 22.20 C ATOM 1622 CE2 PHE A 101 1.173 -3.183 -6.860 1.00 33.03 C ATOM 1623 CZ PHE A 101 1.310 -2.699 -5.573 1.00 72.03 C ATOM 0 H PHE A 101 6.847 -2.532 -9.813 1.00 1.44 H new ATOM 0 HA PHE A 101 5.984 -2.046 -7.033 1.00 64.13 H new ATOM 0 HB2 PHE A 101 4.428 -0.932 -8.692 1.00 33.13 H new ATOM 0 HB3 PHE A 101 4.124 -2.507 -9.396 1.00 33.13 H new ATOM 0 HD1 PHE A 101 4.314 -1.207 -5.880 1.00 35.12 H new ATOM 0 HD2 PHE A 101 2.055 -3.338 -8.796 1.00 64.21 H new ATOM 0 HE1 PHE A 101 2.549 -1.605 -4.219 1.00 22.20 H new ATOM 0 HE2 PHE A 101 0.289 -3.738 -7.137 1.00 33.03 H new ATOM 0 HZ PHE A 101 0.535 -2.877 -4.842 1.00 72.03 H new ATOM 1633 N ILE A 102 5.781 -4.487 -6.672 1.00 13.14 N ATOM 1634 CA ILE A 102 5.798 -5.924 -6.428 1.00 4.21 C ATOM 1635 C ILE A 102 4.700 -6.329 -5.451 1.00 21.30 C ATOM 1636 O ILE A 102 4.669 -5.870 -4.309 1.00 40.12 O ATOM 1637 CB ILE A 102 7.159 -6.384 -5.873 1.00 3.03 C ATOM 1638 CG1 ILE A 102 8.280 -6.032 -6.853 1.00 60.22 C ATOM 1639 CG2 ILE A 102 7.140 -7.880 -5.596 1.00 41.14 C ATOM 1640 CD1 ILE A 102 9.665 -6.149 -6.255 1.00 54.43 C ATOM 0 H ILE A 102 5.761 -3.916 -5.827 1.00 13.14 H new ATOM 0 HA ILE A 102 5.623 -6.409 -7.388 1.00 4.21 H new ATOM 0 HB ILE A 102 7.346 -5.863 -4.934 1.00 3.03 H new ATOM 0 HG12 ILE A 102 8.211 -6.687 -7.721 1.00 60.22 H new ATOM 0 HG13 ILE A 102 8.132 -5.013 -7.210 1.00 60.22 H new ATOM 0 HG21 ILE A 102 8.109 -8.190 -5.204 1.00 41.14 H new ATOM 0 HG22 ILE A 102 6.364 -8.105 -4.864 1.00 41.14 H new ATOM 0 HG23 ILE A 102 6.933 -8.419 -6.521 1.00 41.14 H new ATOM 0 HD11 ILE A 102 10.409 -5.885 -7.006 1.00 54.43 H new ATOM 0 HD12 ILE A 102 9.752 -5.473 -5.404 1.00 54.43 H new ATOM 0 HD13 ILE A 102 9.833 -7.174 -5.923 1.00 54.43 H new ATOM 1652 N VAL A 103 3.800 -7.195 -5.907 1.00 1.12 N ATOM 1653 CA VAL A 103 2.701 -7.666 -5.072 1.00 51.54 C ATOM 1654 C VAL A 103 2.282 -9.079 -5.461 1.00 53.34 C ATOM 1655 O VAL A 103 2.172 -9.402 -6.643 1.00 43.14 O ATOM 1656 CB VAL A 103 1.479 -6.733 -5.175 1.00 3.01 C ATOM 1657 CG1 VAL A 103 0.971 -6.674 -6.607 1.00 72.32 C ATOM 1658 CG2 VAL A 103 0.380 -7.190 -4.228 1.00 72.13 C ATOM 0 H VAL A 103 3.810 -7.584 -6.850 1.00 1.12 H new ATOM 0 HA VAL A 103 3.062 -7.668 -4.044 1.00 51.54 H new ATOM 0 HB VAL A 103 1.784 -5.728 -4.883 1.00 3.01 H new ATOM 0 HG11 VAL A 103 0.108 -6.010 -6.660 1.00 72.32 H new ATOM 0 HG12 VAL A 103 1.760 -6.296 -7.258 1.00 72.32 H new ATOM 0 HG13 VAL A 103 0.681 -7.673 -6.932 1.00 72.32 H new ATOM 0 HG21 VAL A 103 -0.476 -6.520 -4.313 1.00 72.13 H new ATOM 0 HG22 VAL A 103 0.075 -8.204 -4.487 1.00 72.13 H new ATOM 0 HG23 VAL A 103 0.752 -7.174 -3.204 1.00 72.13 H new ATOM 1668 N GLY A 104 2.047 -9.918 -4.457 1.00 65.43 N ATOM 1669 CA GLY A 104 1.642 -11.288 -4.715 1.00 3.13 C ATOM 1670 C GLY A 104 2.761 -12.122 -5.308 1.00 13.32 C ATOM 1671 O GLY A 104 3.921 -11.981 -4.922 1.00 10.33 O ATOM 0 H GLY A 104 2.130 -9.674 -3.470 1.00 65.43 H new ATOM 0 HA2 GLY A 104 1.306 -11.746 -3.785 1.00 3.13 H new ATOM 0 HA3 GLY A 104 0.791 -11.290 -5.397 1.00 3.13 H new ATOM 1675 N SER A 105 2.412 -12.994 -6.248 1.00 33.22 N ATOM 1676 CA SER A 105 3.394 -13.858 -6.891 1.00 63.25 C ATOM 1677 C SER A 105 3.810 -13.293 -8.246 1.00 61.02 C ATOM 1678 O SER A 105 4.569 -13.920 -8.986 1.00 52.52 O ATOM 1679 CB SER A 105 2.828 -15.268 -7.067 1.00 34.53 C ATOM 1680 OG SER A 105 1.421 -15.278 -6.891 1.00 65.51 O ATOM 0 H SER A 105 1.456 -13.121 -6.581 1.00 33.22 H new ATOM 0 HA SER A 105 4.274 -13.905 -6.250 1.00 63.25 H new ATOM 0 HB2 SER A 105 3.076 -15.642 -8.060 1.00 34.53 H new ATOM 0 HB3 SER A 105 3.293 -15.942 -6.348 1.00 34.53 H new ATOM 0 HG SER A 105 1.083 -16.190 -7.010 1.00 65.51 H new ATOM 1686 N ASP A 106 3.308 -12.105 -8.564 1.00 34.13 N ATOM 1687 CA ASP A 106 3.627 -11.453 -9.829 1.00 34.24 C ATOM 1688 C ASP A 106 4.206 -10.062 -9.592 1.00 63.11 C ATOM 1689 O ASP A 106 3.786 -9.351 -8.679 1.00 25.11 O ATOM 1690 CB ASP A 106 2.378 -11.356 -10.706 1.00 73.42 C ATOM 1691 CG ASP A 106 1.257 -10.588 -10.035 1.00 54.50 C ATOM 1692 OD1 ASP A 106 0.545 -11.185 -9.201 1.00 54.31 O ATOM 1693 OD2 ASP A 106 1.091 -9.389 -10.344 1.00 53.23 O ATOM 0 H ASP A 106 2.678 -11.573 -7.963 1.00 34.13 H new ATOM 0 HA ASP A 106 4.376 -12.056 -10.342 1.00 34.24 H new ATOM 0 HB2 ASP A 106 2.635 -10.869 -11.647 1.00 73.42 H new ATOM 0 HB3 ASP A 106 2.031 -12.360 -10.951 1.00 73.42 H new ATOM 1698 N ARG A 107 5.174 -9.681 -10.420 1.00 34.10 N ATOM 1699 CA ARG A 107 5.813 -8.376 -10.299 1.00 75.23 C ATOM 1700 C ARG A 107 5.730 -7.607 -11.614 1.00 53.43 C ATOM 1701 O ARG A 107 5.778 -8.196 -12.694 1.00 13.33 O ATOM 1702 CB ARG A 107 7.275 -8.538 -9.882 1.00 3.43 C ATOM 1703 CG ARG A 107 7.454 -9.251 -8.552 1.00 31.14 C ATOM 1704 CD ARG A 107 7.465 -10.762 -8.727 1.00 12.43 C ATOM 1705 NE ARG A 107 8.259 -11.426 -7.697 1.00 34.32 N ATOM 1706 CZ ARG A 107 7.900 -11.489 -6.419 1.00 62.42 C ATOM 1707 NH1 ARG A 107 6.767 -10.931 -6.017 1.00 31.22 N ATOM 1708 NH2 ARG A 107 8.676 -12.112 -5.541 1.00 60.32 N ATOM 0 H ARG A 107 5.533 -10.257 -11.181 1.00 34.10 H new ATOM 0 HA ARG A 107 5.284 -7.809 -9.532 1.00 75.23 H new ATOM 0 HB2 ARG A 107 7.805 -9.093 -10.656 1.00 3.43 H new ATOM 0 HB3 ARG A 107 7.738 -7.553 -9.822 1.00 3.43 H new ATOM 0 HG2 ARG A 107 8.387 -8.930 -8.089 1.00 31.14 H new ATOM 0 HG3 ARG A 107 6.648 -8.968 -7.875 1.00 31.14 H new ATOM 0 HD2 ARG A 107 6.442 -11.138 -8.695 1.00 12.43 H new ATOM 0 HD3 ARG A 107 7.866 -11.010 -9.710 1.00 12.43 H new ATOM 0 HE ARG A 107 9.137 -11.865 -7.973 1.00 34.32 H new ATOM 0 HH11 ARG A 107 6.168 -10.452 -6.689 1.00 31.22 H new ATOM 0 HH12 ARG A 107 6.494 -10.981 -5.035 1.00 31.22 H new ATOM 0 HH21 ARG A 107 9.548 -12.543 -5.847 1.00 60.32 H new ATOM 0 HH22 ARG A 107 8.400 -12.160 -4.560 1.00 60.32 H new ATOM 1722 N ALA A 108 5.605 -6.287 -11.515 1.00 34.31 N ATOM 1723 CA ALA A 108 5.517 -5.437 -12.696 1.00 34.23 C ATOM 1724 C ALA A 108 6.610 -4.374 -12.690 1.00 22.52 C ATOM 1725 O ALA A 108 6.981 -3.858 -11.635 1.00 54.43 O ATOM 1726 CB ALA A 108 4.144 -4.785 -12.775 1.00 44.23 C ATOM 0 H ALA A 108 5.562 -5.784 -10.629 1.00 34.31 H new ATOM 0 HA ALA A 108 5.661 -6.064 -13.576 1.00 34.23 H new ATOM 0 HB1 ALA A 108 4.092 -4.153 -13.662 1.00 44.23 H new ATOM 0 HB2 ALA A 108 3.377 -5.557 -12.834 1.00 44.23 H new ATOM 0 HB3 ALA A 108 3.978 -4.177 -11.886 1.00 44.23 H new ATOM 1732 N ILE A 109 7.123 -4.054 -13.873 1.00 3.43 N ATOM 1733 CA ILE A 109 8.174 -3.052 -14.003 1.00 23.13 C ATOM 1734 C ILE A 109 7.827 -2.027 -15.077 1.00 63.44 C ATOM 1735 O ILE A 109 7.476 -2.386 -16.202 1.00 11.33 O ATOM 1736 CB ILE A 109 9.529 -3.699 -14.345 1.00 24.23 C ATOM 1737 CG1 ILE A 109 10.627 -2.635 -14.404 1.00 51.22 C ATOM 1738 CG2 ILE A 109 9.440 -4.450 -15.665 1.00 13.21 C ATOM 1739 CD1 ILE A 109 11.708 -2.823 -13.364 1.00 25.24 C ATOM 0 H ILE A 109 6.828 -4.474 -14.755 1.00 3.43 H new ATOM 0 HA ILE A 109 8.253 -2.551 -13.038 1.00 23.13 H new ATOM 0 HB ILE A 109 9.782 -4.412 -13.560 1.00 24.23 H new ATOM 0 HG12 ILE A 109 11.081 -2.648 -15.395 1.00 51.22 H new ATOM 0 HG13 ILE A 109 10.176 -1.651 -14.273 1.00 51.22 H new ATOM 0 HG21 ILE A 109 10.406 -4.901 -15.893 1.00 13.21 H new ATOM 0 HG22 ILE A 109 8.683 -5.231 -15.589 1.00 13.21 H new ATOM 0 HG23 ILE A 109 9.167 -3.757 -16.460 1.00 13.21 H new ATOM 0 HD11 ILE A 109 12.452 -2.033 -13.466 1.00 25.24 H new ATOM 0 HD12 ILE A 109 11.266 -2.780 -12.368 1.00 25.24 H new ATOM 0 HD13 ILE A 109 12.186 -3.792 -13.507 1.00 25.24 H new ATOM 1751 N PHE A 110 7.930 -0.750 -14.725 1.00 31.34 N ATOM 1752 CA PHE A 110 7.628 0.328 -15.659 1.00 71.42 C ATOM 1753 C PHE A 110 8.757 1.353 -15.690 1.00 44.11 C ATOM 1754 O PHE A 110 9.084 1.964 -14.673 1.00 34.44 O ATOM 1755 CB PHE A 110 6.314 1.011 -15.275 1.00 72.01 C ATOM 1756 CG PHE A 110 5.830 1.998 -16.299 1.00 33.33 C ATOM 1757 CD1 PHE A 110 5.155 1.568 -17.430 1.00 64.32 C ATOM 1758 CD2 PHE A 110 6.049 3.355 -16.130 1.00 4.32 C ATOM 1759 CE1 PHE A 110 4.708 2.473 -18.374 1.00 42.10 C ATOM 1760 CE2 PHE A 110 5.604 4.265 -17.070 1.00 2.31 C ATOM 1761 CZ PHE A 110 4.934 3.824 -18.194 1.00 30.31 C ATOM 0 H PHE A 110 8.221 -0.436 -13.799 1.00 31.34 H new ATOM 0 HA PHE A 110 7.527 -0.105 -16.654 1.00 71.42 H new ATOM 0 HB2 PHE A 110 5.548 0.250 -15.125 1.00 72.01 H new ATOM 0 HB3 PHE A 110 6.445 1.523 -14.322 1.00 72.01 H new ATOM 0 HD1 PHE A 110 4.976 0.513 -17.576 1.00 64.32 H new ATOM 0 HD2 PHE A 110 6.574 3.706 -15.254 1.00 4.32 H new ATOM 0 HE1 PHE A 110 4.183 2.125 -19.251 1.00 42.10 H new ATOM 0 HE2 PHE A 110 5.780 5.321 -16.926 1.00 2.31 H new ATOM 0 HZ PHE A 110 4.587 4.534 -18.931 1.00 30.31 H new ATOM 1771 N MET A 111 9.351 1.536 -16.865 1.00 75.23 N ATOM 1772 CA MET A 111 10.443 2.488 -17.030 1.00 22.54 C ATOM 1773 C MET A 111 10.317 3.237 -18.352 1.00 63.12 C ATOM 1774 O MET A 111 10.083 2.633 -19.400 1.00 34.23 O ATOM 1775 CB MET A 111 11.791 1.766 -16.965 1.00 74.32 C ATOM 1776 CG MET A 111 12.082 0.913 -18.189 1.00 43.04 C ATOM 1777 SD MET A 111 13.548 -0.117 -17.985 1.00 44.43 S ATOM 1778 CE MET A 111 12.919 -1.390 -16.895 1.00 33.05 C ATOM 0 H MET A 111 9.094 1.037 -17.717 1.00 75.23 H new ATOM 0 HA MET A 111 10.387 3.212 -16.217 1.00 22.54 H new ATOM 0 HB2 MET A 111 12.584 2.504 -16.850 1.00 74.32 H new ATOM 0 HB3 MET A 111 11.813 1.133 -16.078 1.00 74.32 H new ATOM 0 HG2 MET A 111 11.222 0.277 -18.397 1.00 43.04 H new ATOM 0 HG3 MET A 111 12.216 1.561 -19.055 1.00 43.04 H new ATOM 0 HE1 MET A 111 13.369 -1.279 -15.908 1.00 33.05 H new ATOM 0 HE2 MET A 111 11.836 -1.296 -16.813 1.00 33.05 H new ATOM 0 HE3 MET A 111 13.169 -2.371 -17.299 1.00 33.05 H new ATOM 1788 N LEU A 112 10.474 4.555 -18.297 1.00 62.25 N ATOM 1789 CA LEU A 112 10.378 5.387 -19.492 1.00 12.12 C ATOM 1790 C LEU A 112 11.289 6.605 -19.382 1.00 4.02 C ATOM 1791 O LEU A 112 11.538 7.110 -18.287 1.00 33.01 O ATOM 1792 CB LEU A 112 8.932 5.836 -19.709 1.00 13.20 C ATOM 1793 CG LEU A 112 8.323 5.502 -21.071 1.00 53.53 C ATOM 1794 CD1 LEU A 112 9.229 5.984 -22.194 1.00 11.35 C ATOM 1795 CD2 LEU A 112 8.072 4.006 -21.191 1.00 55.42 C ATOM 0 H LEU A 112 10.668 5.071 -17.439 1.00 62.25 H new ATOM 0 HA LEU A 112 10.700 4.792 -20.346 1.00 12.12 H new ATOM 0 HB2 LEU A 112 8.312 5.383 -18.935 1.00 13.20 H new ATOM 0 HB3 LEU A 112 8.882 6.915 -19.566 1.00 13.20 H new ATOM 0 HG LEU A 112 7.367 6.019 -21.156 1.00 53.53 H new ATOM 0 HD11 LEU A 112 8.779 5.737 -23.156 1.00 11.35 H new ATOM 0 HD12 LEU A 112 9.358 7.064 -22.120 1.00 11.35 H new ATOM 0 HD13 LEU A 112 10.200 5.497 -22.112 1.00 11.35 H new ATOM 0 HD21 LEU A 112 7.638 3.787 -22.167 1.00 55.42 H new ATOM 0 HD22 LEU A 112 9.015 3.469 -21.084 1.00 55.42 H new ATOM 0 HD23 LEU A 112 7.383 3.689 -20.408 1.00 55.42 H new ATOM 1807 N ARG A 113 11.783 7.073 -20.523 1.00 64.14 N ATOM 1808 CA ARG A 113 12.667 8.232 -20.555 1.00 54.44 C ATOM 1809 C ARG A 113 11.897 9.511 -20.237 1.00 40.03 C ATOM 1810 O ARG A 113 12.448 10.453 -19.668 1.00 13.51 O ATOM 1811 CB ARG A 113 13.334 8.354 -21.927 1.00 1.05 C ATOM 1812 CG ARG A 113 14.799 7.948 -21.929 1.00 72.10 C ATOM 1813 CD ARG A 113 15.229 7.424 -23.290 1.00 43.02 C ATOM 1814 NE ARG A 113 15.001 8.402 -24.350 1.00 42.33 N ATOM 1815 CZ ARG A 113 15.116 8.124 -25.644 1.00 43.21 C ATOM 1816 NH1 ARG A 113 15.454 6.903 -26.036 1.00 4.43 N ATOM 1817 NH2 ARG A 113 14.892 9.068 -26.549 1.00 44.24 N ATOM 0 H ARG A 113 11.586 6.667 -21.438 1.00 64.14 H new ATOM 0 HA ARG A 113 13.436 8.092 -19.796 1.00 54.44 H new ATOM 0 HB2 ARG A 113 12.793 7.734 -22.641 1.00 1.05 H new ATOM 0 HB3 ARG A 113 13.251 9.385 -22.272 1.00 1.05 H new ATOM 0 HG2 ARG A 113 15.416 8.804 -21.656 1.00 72.10 H new ATOM 0 HG3 ARG A 113 14.966 7.181 -21.173 1.00 72.10 H new ATOM 0 HD2 ARG A 113 16.287 7.162 -23.260 1.00 43.02 H new ATOM 0 HD3 ARG A 113 14.680 6.510 -23.516 1.00 43.02 H new ATOM 0 HE ARG A 113 14.739 9.351 -24.082 1.00 42.33 H new ATOM 0 HH11 ARG A 113 15.626 6.174 -25.343 1.00 4.43 H new ATOM 0 HH12 ARG A 113 15.542 6.692 -27.030 1.00 4.43 H new ATOM 0 HH21 ARG A 113 14.631 10.008 -26.251 1.00 44.24 H new ATOM 0 HH22 ARG A 113 14.981 8.854 -27.542 1.00 44.24 H new ATOM 1831 N ASP A 114 10.622 9.536 -20.609 1.00 70.22 N ATOM 1832 CA ASP A 114 9.776 10.698 -20.363 1.00 42.12 C ATOM 1833 C ASP A 114 9.109 10.604 -18.995 1.00 14.53 C ATOM 1834 O ASP A 114 9.304 11.465 -18.137 1.00 63.42 O ATOM 1835 CB ASP A 114 8.713 10.822 -21.456 1.00 1.23 C ATOM 1836 CG ASP A 114 9.318 10.975 -22.837 1.00 71.55 C ATOM 1837 OD1 ASP A 114 10.177 11.864 -23.015 1.00 21.43 O ATOM 1838 OD2 ASP A 114 8.933 10.204 -23.741 1.00 53.25 O ATOM 0 H ASP A 114 10.151 8.765 -21.082 1.00 70.22 H new ATOM 0 HA ASP A 114 10.407 11.587 -20.379 1.00 42.12 H new ATOM 0 HB2 ASP A 114 8.073 9.940 -21.438 1.00 1.23 H new ATOM 0 HB3 ASP A 114 8.077 11.681 -21.244 1.00 1.23 H new ATOM 1843 N GLY A 115 8.318 9.554 -18.798 1.00 30.40 N ATOM 1844 CA GLY A 115 7.632 9.368 -17.533 1.00 24.35 C ATOM 1845 C GLY A 115 6.278 10.047 -17.502 1.00 34.12 C ATOM 1846 O GLY A 115 5.246 9.384 -17.397 1.00 13.15 O ATOM 0 H GLY A 115 8.140 8.828 -19.492 1.00 30.40 H new ATOM 0 HA2 GLY A 115 7.505 8.302 -17.346 1.00 24.35 H new ATOM 0 HA3 GLY A 115 8.251 9.761 -16.727 1.00 24.35 H new ATOM 1850 N SER A 116 6.280 11.373 -17.592 1.00 71.03 N ATOM 1851 CA SER A 116 5.042 12.143 -17.569 1.00 32.12 C ATOM 1852 C SER A 116 4.051 11.610 -18.599 1.00 33.52 C ATOM 1853 O SER A 116 2.917 11.264 -18.265 1.00 60.01 O ATOM 1854 CB SER A 116 5.330 13.621 -17.839 1.00 62.25 C ATOM 1855 OG SER A 116 4.970 14.423 -16.728 1.00 23.41 O ATOM 0 H SER A 116 7.125 11.937 -17.682 1.00 71.03 H new ATOM 0 HA SER A 116 4.599 12.042 -16.578 1.00 32.12 H new ATOM 0 HB2 SER A 116 6.389 13.754 -18.059 1.00 62.25 H new ATOM 0 HB3 SER A 116 4.778 13.947 -18.721 1.00 62.25 H new ATOM 0 HG SER A 116 5.166 15.363 -16.926 1.00 23.41 H new ATOM 1861 N TYR A 117 4.487 11.546 -19.852 1.00 33.31 N ATOM 1862 CA TYR A 117 3.638 11.057 -20.932 1.00 43.14 C ATOM 1863 C TYR A 117 3.404 9.555 -20.804 1.00 71.02 C ATOM 1864 O TYR A 117 2.363 9.041 -21.213 1.00 22.24 O ATOM 1865 CB TYR A 117 4.272 11.372 -22.289 1.00 31.34 C ATOM 1866 CG TYR A 117 3.449 12.315 -23.137 1.00 3.11 C ATOM 1867 CD1 TYR A 117 3.555 13.692 -22.981 1.00 32.12 C ATOM 1868 CD2 TYR A 117 2.566 11.830 -24.093 1.00 42.25 C ATOM 1869 CE1 TYR A 117 2.805 14.558 -23.753 1.00 72.20 C ATOM 1870 CE2 TYR A 117 1.813 12.689 -24.871 1.00 65.41 C ATOM 1871 CZ TYR A 117 1.936 14.051 -24.697 1.00 41.41 C ATOM 1872 OH TYR A 117 1.187 14.910 -25.469 1.00 31.22 O ATOM 0 H TYR A 117 5.423 11.826 -20.145 1.00 33.31 H new ATOM 0 HA TYR A 117 2.675 11.563 -20.861 1.00 43.14 H new ATOM 0 HB2 TYR A 117 5.258 11.808 -22.128 1.00 31.34 H new ATOM 0 HB3 TYR A 117 4.421 10.441 -22.836 1.00 31.34 H new ATOM 0 HD1 TYR A 117 4.235 14.092 -22.244 1.00 32.12 H new ATOM 0 HD2 TYR A 117 2.466 10.763 -24.231 1.00 42.25 H new ATOM 0 HE1 TYR A 117 2.898 15.625 -23.618 1.00 72.20 H new ATOM 0 HE2 TYR A 117 1.132 12.295 -25.611 1.00 65.41 H new ATOM 0 HH TYR A 117 0.627 14.393 -26.085 1.00 31.22 H new ATOM 1882 N ALA A 118 4.380 8.857 -20.233 1.00 1.10 N ATOM 1883 CA ALA A 118 4.281 7.415 -20.048 1.00 35.24 C ATOM 1884 C ALA A 118 3.119 7.059 -19.126 1.00 72.43 C ATOM 1885 O ALA A 118 2.521 5.990 -19.251 1.00 21.33 O ATOM 1886 CB ALA A 118 5.585 6.863 -19.493 1.00 22.42 C ATOM 0 H ALA A 118 5.249 9.267 -19.890 1.00 1.10 H new ATOM 0 HA ALA A 118 4.092 6.961 -21.021 1.00 35.24 H new ATOM 0 HB1 ALA A 118 5.496 5.785 -19.360 1.00 22.42 H new ATOM 0 HB2 ALA A 118 6.396 7.077 -20.189 1.00 22.42 H new ATOM 0 HB3 ALA A 118 5.798 7.331 -18.532 1.00 22.42 H new ATOM 1892 N TRP A 119 2.805 7.960 -18.202 1.00 62.45 N ATOM 1893 CA TRP A 119 1.715 7.739 -17.259 1.00 53.13 C ATOM 1894 C TRP A 119 0.434 7.349 -17.989 1.00 63.31 C ATOM 1895 O TRP A 119 -0.386 6.598 -17.462 1.00 51.11 O ATOM 1896 CB TRP A 119 1.476 8.996 -16.421 1.00 53.34 C ATOM 1897 CG TRP A 119 0.589 8.761 -15.236 1.00 72.44 C ATOM 1898 CD1 TRP A 119 -0.775 8.826 -15.208 1.00 11.14 C ATOM 1899 CD2 TRP A 119 1.004 8.424 -13.908 1.00 64.24 C ATOM 1900 NE1 TRP A 119 -1.232 8.550 -13.942 1.00 13.35 N ATOM 1901 CE2 TRP A 119 -0.161 8.299 -13.126 1.00 45.33 C ATOM 1902 CE3 TRP A 119 2.247 8.213 -13.304 1.00 52.24 C ATOM 1903 CZ2 TRP A 119 -0.117 7.975 -11.773 1.00 0.21 C ATOM 1904 CZ3 TRP A 119 2.288 7.892 -11.961 1.00 63.10 C ATOM 1905 CH2 TRP A 119 1.113 7.775 -11.207 1.00 71.44 C ATOM 0 H TRP A 119 3.290 8.850 -18.086 1.00 62.45 H new ATOM 0 HA TRP A 119 1.999 6.919 -16.599 1.00 53.13 H new ATOM 0 HB2 TRP A 119 2.435 9.382 -16.077 1.00 53.34 H new ATOM 0 HB3 TRP A 119 1.031 9.765 -17.052 1.00 53.34 H new ATOM 0 HD1 TRP A 119 -1.402 9.060 -16.056 1.00 11.14 H new ATOM 0 HE1 TRP A 119 -2.211 8.535 -13.656 1.00 13.35 H new ATOM 0 HE3 TRP A 119 3.158 8.299 -13.877 1.00 52.24 H new ATOM 0 HZ2 TRP A 119 -1.022 7.885 -11.190 1.00 0.21 H new ATOM 0 HZ3 TRP A 119 3.243 7.728 -11.484 1.00 63.10 H new ATOM 0 HH2 TRP A 119 1.179 7.522 -10.159 1.00 71.44 H new ATOM 1916 N GLU A 120 0.270 7.863 -19.204 1.00 63.31 N ATOM 1917 CA GLU A 120 -0.912 7.567 -20.005 1.00 21.32 C ATOM 1918 C GLU A 120 -0.899 6.116 -20.479 1.00 1.22 C ATOM 1919 O GLU A 120 -1.808 5.344 -20.172 1.00 24.01 O ATOM 1920 CB GLU A 120 -0.988 8.508 -21.209 1.00 71.41 C ATOM 1921 CG GLU A 120 -2.407 8.785 -21.676 1.00 72.31 C ATOM 1922 CD GLU A 120 -2.465 9.264 -23.113 1.00 52.35 C ATOM 1923 OE1 GLU A 120 -2.516 8.409 -24.022 1.00 70.20 O ATOM 1924 OE2 GLU A 120 -2.459 10.494 -23.330 1.00 14.00 O ATOM 0 H GLU A 120 0.940 8.486 -19.655 1.00 63.31 H new ATOM 0 HA GLU A 120 -1.791 7.718 -19.379 1.00 21.32 H new ATOM 0 HB2 GLU A 120 -0.508 9.452 -20.952 1.00 71.41 H new ATOM 0 HB3 GLU A 120 -0.421 8.076 -22.034 1.00 71.41 H new ATOM 0 HG2 GLU A 120 -3.002 7.878 -21.575 1.00 72.31 H new ATOM 0 HG3 GLU A 120 -2.859 9.536 -21.028 1.00 72.31 H new ATOM 1931 N ILE A 121 0.137 5.754 -21.228 1.00 52.33 N ATOM 1932 CA ILE A 121 0.269 4.397 -21.744 1.00 54.42 C ATOM 1933 C ILE A 121 0.334 3.382 -20.609 1.00 24.42 C ATOM 1934 O ILE A 121 -0.090 2.236 -20.760 1.00 64.34 O ATOM 1935 CB ILE A 121 1.524 4.249 -22.624 1.00 51.11 C ATOM 1936 CG1 ILE A 121 1.489 5.258 -23.774 1.00 24.10 C ATOM 1937 CG2 ILE A 121 1.630 2.829 -23.161 1.00 11.53 C ATOM 1938 CD1 ILE A 121 2.753 6.080 -23.895 1.00 4.14 C ATOM 0 H ILE A 121 0.897 6.381 -21.491 1.00 52.33 H new ATOM 0 HA ILE A 121 -0.615 4.203 -22.352 1.00 54.42 H new ATOM 0 HB ILE A 121 2.404 4.452 -22.014 1.00 51.11 H new ATOM 0 HG12 ILE A 121 1.321 4.725 -24.710 1.00 24.10 H new ATOM 0 HG13 ILE A 121 0.641 5.928 -23.633 1.00 24.10 H new ATOM 0 HG21 ILE A 121 2.522 2.740 -23.781 1.00 11.53 H new ATOM 0 HG22 ILE A 121 1.696 2.129 -22.328 1.00 11.53 H new ATOM 0 HG23 ILE A 121 0.748 2.599 -23.759 1.00 11.53 H new ATOM 0 HD11 ILE A 121 2.657 6.773 -24.731 1.00 4.14 H new ATOM 0 HD12 ILE A 121 2.912 6.641 -22.974 1.00 4.14 H new ATOM 0 HD13 ILE A 121 3.602 5.419 -24.068 1.00 4.14 H new ATOM 1950 N LYS A 122 0.868 3.810 -19.470 1.00 35.35 N ATOM 1951 CA LYS A 122 0.987 2.940 -18.306 1.00 32.35 C ATOM 1952 C LYS A 122 -0.350 2.281 -17.980 1.00 23.25 C ATOM 1953 O LYS A 122 -0.460 1.055 -17.961 1.00 61.33 O ATOM 1954 CB LYS A 122 1.483 3.736 -17.097 1.00 1.14 C ATOM 1955 CG LYS A 122 1.374 2.980 -15.784 1.00 22.02 C ATOM 1956 CD LYS A 122 2.098 1.645 -15.847 1.00 40.52 C ATOM 1957 CE LYS A 122 3.076 1.487 -14.693 1.00 62.43 C ATOM 1958 NZ LYS A 122 2.384 1.495 -13.375 1.00 24.44 N ATOM 0 H LYS A 122 1.225 4.755 -19.328 1.00 35.35 H new ATOM 0 HA LYS A 122 1.710 2.159 -18.540 1.00 32.35 H new ATOM 0 HB2 LYS A 122 2.524 4.017 -17.260 1.00 1.14 H new ATOM 0 HB3 LYS A 122 0.911 4.661 -17.022 1.00 1.14 H new ATOM 0 HG2 LYS A 122 1.793 3.584 -14.979 1.00 22.02 H new ATOM 0 HG3 LYS A 122 0.324 2.814 -15.545 1.00 22.02 H new ATOM 0 HD2 LYS A 122 1.370 0.834 -15.823 1.00 40.52 H new ATOM 0 HD3 LYS A 122 2.634 1.564 -16.793 1.00 40.52 H new ATOM 0 HE2 LYS A 122 3.626 0.553 -14.809 1.00 62.43 H new ATOM 0 HE3 LYS A 122 3.808 2.294 -14.724 1.00 62.43 H new ATOM 0 HZ1 LYS A 122 3.040 1.169 -12.637 1.00 24.44 H new ATOM 0 HZ2 LYS A 122 2.068 2.461 -13.155 1.00 24.44 H new ATOM 0 HZ3 LYS A 122 1.561 0.861 -13.411 1.00 24.44 H new ATOM 1972 N ASP A 123 -1.362 3.102 -17.724 1.00 72.03 N ATOM 1973 CA ASP A 123 -2.692 2.599 -17.402 1.00 33.43 C ATOM 1974 C ASP A 123 -3.160 1.590 -18.446 1.00 42.14 C ATOM 1975 O ASP A 123 -3.850 0.622 -18.125 1.00 41.42 O ATOM 1976 CB ASP A 123 -3.690 3.754 -17.308 1.00 44.44 C ATOM 1977 CG ASP A 123 -4.888 3.416 -16.444 1.00 55.42 C ATOM 1978 OD1 ASP A 123 -4.696 2.786 -15.384 1.00 31.31 O ATOM 1979 OD2 ASP A 123 -6.019 3.782 -16.829 1.00 34.34 O ATOM 0 H ASP A 123 -1.287 4.119 -17.733 1.00 72.03 H new ATOM 0 HA ASP A 123 -2.638 2.097 -16.436 1.00 33.43 H new ATOM 0 HB2 ASP A 123 -3.188 4.632 -16.900 1.00 44.44 H new ATOM 0 HB3 ASP A 123 -4.031 4.018 -18.309 1.00 44.44 H new ATOM 1984 N PHE A 124 -2.780 1.824 -19.698 1.00 73.24 N ATOM 1985 CA PHE A 124 -3.162 0.937 -20.791 1.00 54.12 C ATOM 1986 C PHE A 124 -2.430 -0.398 -20.690 1.00 45.53 C ATOM 1987 O PHE A 124 -3.051 -1.461 -20.677 1.00 11.12 O ATOM 1988 CB PHE A 124 -2.862 1.596 -22.139 1.00 74.23 C ATOM 1989 CG PHE A 124 -4.094 1.912 -22.939 1.00 42.11 C ATOM 1990 CD1 PHE A 124 -4.940 2.940 -22.555 1.00 34.50 C ATOM 1991 CD2 PHE A 124 -4.404 1.182 -24.075 1.00 54.42 C ATOM 1992 CE1 PHE A 124 -6.074 3.232 -23.289 1.00 14.02 C ATOM 1993 CE2 PHE A 124 -5.537 1.471 -24.813 1.00 70.43 C ATOM 1994 CZ PHE A 124 -6.372 2.498 -24.420 1.00 35.40 C ATOM 0 H PHE A 124 -2.208 2.620 -19.981 1.00 73.24 H new ATOM 0 HA PHE A 124 -4.233 0.750 -20.716 1.00 54.12 H new ATOM 0 HB2 PHE A 124 -2.303 2.516 -21.968 1.00 74.23 H new ATOM 0 HB3 PHE A 124 -2.219 0.936 -22.722 1.00 74.23 H new ATOM 0 HD1 PHE A 124 -4.711 3.519 -21.673 1.00 34.50 H new ATOM 0 HD2 PHE A 124 -3.754 0.378 -24.388 1.00 54.42 H new ATOM 0 HE1 PHE A 124 -6.727 4.034 -22.978 1.00 14.02 H new ATOM 0 HE2 PHE A 124 -5.769 0.894 -25.696 1.00 70.43 H new ATOM 0 HZ PHE A 124 -7.256 2.727 -24.996 1.00 35.40 H new ATOM 2004 N LEU A 125 -1.105 -0.334 -20.620 1.00 45.01 N ATOM 2005 CA LEU A 125 -0.285 -1.537 -20.521 1.00 10.21 C ATOM 2006 C LEU A 125 -0.642 -2.337 -19.273 1.00 21.44 C ATOM 2007 O LEU A 125 -1.013 -3.508 -19.358 1.00 72.01 O ATOM 2008 CB LEU A 125 1.199 -1.166 -20.496 1.00 31.10 C ATOM 2009 CG LEU A 125 2.016 -1.585 -21.719 1.00 11.13 C ATOM 2010 CD1 LEU A 125 3.062 -0.531 -22.048 1.00 23.52 C ATOM 2011 CD2 LEU A 125 2.673 -2.937 -21.483 1.00 43.04 C ATOM 0 H LEU A 125 -0.575 0.538 -20.630 1.00 45.01 H new ATOM 0 HA LEU A 125 -0.483 -2.156 -21.396 1.00 10.21 H new ATOM 0 HB2 LEU A 125 1.281 -0.085 -20.382 1.00 31.10 H new ATOM 0 HB3 LEU A 125 1.650 -1.615 -19.611 1.00 31.10 H new ATOM 0 HG LEU A 125 1.341 -1.675 -22.570 1.00 11.13 H new ATOM 0 HD11 LEU A 125 3.634 -0.846 -22.921 1.00 23.52 H new ATOM 0 HD12 LEU A 125 2.569 0.417 -22.260 1.00 23.52 H new ATOM 0 HD13 LEU A 125 3.734 -0.408 -21.199 1.00 23.52 H new ATOM 0 HD21 LEU A 125 3.250 -3.220 -22.363 1.00 43.04 H new ATOM 0 HD22 LEU A 125 3.335 -2.874 -20.620 1.00 43.04 H new ATOM 0 HD23 LEU A 125 1.905 -3.687 -21.297 1.00 43.04 H new ATOM 2023 N VAL A 126 -0.529 -1.697 -18.113 1.00 22.51 N ATOM 2024 CA VAL A 126 -0.843 -2.349 -16.847 1.00 3.53 C ATOM 2025 C VAL A 126 -2.224 -2.993 -16.888 1.00 3.14 C ATOM 2026 O VAL A 126 -2.473 -3.994 -16.217 1.00 22.44 O ATOM 2027 CB VAL A 126 -0.788 -1.351 -15.674 1.00 70.31 C ATOM 2028 CG1 VAL A 126 -1.873 -0.295 -15.820 1.00 71.31 C ATOM 2029 CG2 VAL A 126 -0.919 -2.083 -14.347 1.00 14.43 C ATOM 0 H VAL A 126 -0.223 -0.728 -18.024 1.00 22.51 H new ATOM 0 HA VAL A 126 -0.090 -3.122 -16.693 1.00 3.53 H new ATOM 0 HB VAL A 126 0.179 -0.848 -15.692 1.00 70.31 H new ATOM 0 HG11 VAL A 126 -1.819 0.401 -14.983 1.00 71.31 H new ATOM 0 HG12 VAL A 126 -1.728 0.249 -16.754 1.00 71.31 H new ATOM 0 HG13 VAL A 126 -2.851 -0.777 -15.828 1.00 71.31 H new ATOM 0 HG21 VAL A 126 -0.878 -1.364 -13.529 1.00 14.43 H new ATOM 0 HG22 VAL A 126 -1.871 -2.614 -14.317 1.00 14.43 H new ATOM 0 HG23 VAL A 126 -0.102 -2.797 -14.243 1.00 14.43 H new ATOM 2039 N SER A 127 -3.119 -2.412 -17.680 1.00 43.31 N ATOM 2040 CA SER A 127 -4.477 -2.927 -17.807 1.00 22.35 C ATOM 2041 C SER A 127 -4.464 -4.422 -18.114 1.00 12.35 C ATOM 2042 O SER A 127 -5.368 -5.155 -17.713 1.00 65.42 O ATOM 2043 CB SER A 127 -5.230 -2.176 -18.906 1.00 10.33 C ATOM 2044 OG SER A 127 -5.295 -2.943 -20.095 1.00 53.24 O ATOM 0 H SER A 127 -2.928 -1.584 -18.244 1.00 43.31 H new ATOM 0 HA SER A 127 -4.988 -2.773 -16.857 1.00 22.35 H new ATOM 0 HB2 SER A 127 -6.238 -1.942 -18.565 1.00 10.33 H new ATOM 0 HB3 SER A 127 -4.733 -1.227 -19.108 1.00 10.33 H new ATOM 0 HG SER A 127 -4.555 -2.692 -20.687 1.00 53.24 H new ATOM 2050 N GLN A 128 -3.434 -4.864 -18.827 1.00 24.24 N ATOM 2051 CA GLN A 128 -3.303 -6.271 -19.188 1.00 52.33 C ATOM 2052 C GLN A 128 -3.213 -7.147 -17.943 1.00 50.13 C ATOM 2053 O GLN A 128 -3.885 -8.174 -17.845 1.00 65.12 O ATOM 2054 CB GLN A 128 -2.068 -6.481 -20.065 1.00 64.21 C ATOM 2055 CG GLN A 128 -2.068 -5.638 -21.330 1.00 10.43 C ATOM 2056 CD GLN A 128 -2.526 -6.414 -22.549 1.00 11.52 C ATOM 2057 OE1 GLN A 128 -2.010 -7.493 -22.842 1.00 14.40 O ATOM 2058 NE2 GLN A 128 -3.500 -5.867 -23.267 1.00 71.11 N ATOM 0 H GLN A 128 -2.678 -4.269 -19.166 1.00 24.24 H new ATOM 0 HA GLN A 128 -4.192 -6.560 -19.749 1.00 52.33 H new ATOM 0 HB2 GLN A 128 -1.176 -6.248 -19.483 1.00 64.21 H new ATOM 0 HB3 GLN A 128 -2.003 -7.534 -20.340 1.00 64.21 H new ATOM 0 HG2 GLN A 128 -2.719 -4.776 -21.187 1.00 10.43 H new ATOM 0 HG3 GLN A 128 -1.063 -5.253 -21.505 1.00 10.43 H new ATOM 0 HE21 GLN A 128 -3.898 -4.971 -22.987 1.00 71.11 H new ATOM 0 HE22 GLN A 128 -3.850 -6.343 -24.099 1.00 71.11 H new ATOM 2067 N ASP A 129 -2.379 -6.734 -16.995 1.00 32.50 N ATOM 2068 CA ASP A 129 -2.202 -7.482 -15.755 1.00 45.52 C ATOM 2069 C ASP A 129 -1.699 -8.894 -16.039 1.00 13.20 C ATOM 2070 O ASP A 129 -1.842 -9.792 -15.209 1.00 64.13 O ATOM 2071 CB ASP A 129 -3.517 -7.541 -14.978 1.00 33.42 C ATOM 2072 CG ASP A 129 -3.313 -7.397 -13.482 1.00 74.25 C ATOM 2073 OD1 ASP A 129 -3.109 -8.429 -12.809 1.00 64.10 O ATOM 2074 OD2 ASP A 129 -3.358 -6.253 -12.986 1.00 3.43 O ATOM 0 H ASP A 129 -1.815 -5.886 -17.061 1.00 32.50 H new ATOM 0 HA ASP A 129 -1.456 -6.965 -15.151 1.00 45.52 H new ATOM 0 HB2 ASP A 129 -4.179 -6.749 -15.329 1.00 33.42 H new ATOM 0 HB3 ASP A 129 -4.015 -8.488 -15.184 1.00 33.42 H new ATOM 2079 N ARG A 130 -1.113 -9.082 -17.216 1.00 65.24 N ATOM 2080 CA ARG A 130 -0.591 -10.386 -17.611 1.00 14.55 C ATOM 2081 C ARG A 130 0.033 -10.323 -19.001 1.00 63.43 C ATOM 2082 O ARG A 130 -0.396 -11.026 -19.917 1.00 52.45 O ATOM 2083 CB ARG A 130 -1.706 -11.433 -17.587 1.00 14.31 C ATOM 2084 CG ARG A 130 -2.981 -10.981 -18.281 1.00 62.14 C ATOM 2085 CD ARG A 130 -3.677 -12.140 -18.977 1.00 31.53 C ATOM 2086 NE ARG A 130 -5.050 -12.315 -18.509 1.00 4.31 N ATOM 2087 CZ ARG A 130 -6.028 -11.454 -18.765 1.00 53.15 C ATOM 2088 NH1 ARG A 130 -5.787 -10.365 -19.482 1.00 41.03 N ATOM 2089 NH2 ARG A 130 -7.252 -11.682 -18.305 1.00 3.10 N ATOM 0 H ARG A 130 -0.987 -8.348 -17.914 1.00 65.24 H new ATOM 0 HA ARG A 130 0.182 -10.672 -16.898 1.00 14.55 H new ATOM 0 HB2 ARG A 130 -1.347 -12.345 -18.064 1.00 14.31 H new ATOM 0 HB3 ARG A 130 -1.935 -11.684 -16.551 1.00 14.31 H new ATOM 0 HG2 ARG A 130 -3.656 -10.536 -17.550 1.00 62.14 H new ATOM 0 HG3 ARG A 130 -2.745 -10.206 -19.010 1.00 62.14 H new ATOM 0 HD2 ARG A 130 -3.680 -11.967 -20.053 1.00 31.53 H new ATOM 0 HD3 ARG A 130 -3.115 -13.058 -18.803 1.00 31.53 H new ATOM 0 HE ARG A 130 -5.269 -13.143 -17.956 1.00 4.31 H new ATOM 0 HH11 ARG A 130 -4.848 -10.187 -19.839 1.00 41.03 H new ATOM 0 HH12 ARG A 130 -6.540 -9.706 -19.677 1.00 41.03 H new ATOM 0 HH21 ARG A 130 -7.442 -12.519 -17.754 1.00 3.10 H new ATOM 0 HH22 ARG A 130 -8.002 -11.020 -18.502 1.00 3.10 H new ATOM 2103 N CYS A 131 1.048 -9.479 -19.151 1.00 72.11 N ATOM 2104 CA CYS A 131 1.731 -9.324 -20.430 1.00 70.14 C ATOM 2105 C CYS A 131 3.193 -8.941 -20.223 1.00 73.13 C ATOM 2106 O CYS A 131 3.528 -8.213 -19.290 1.00 15.14 O ATOM 2107 CB CYS A 131 1.029 -8.265 -21.282 1.00 4.01 C ATOM 2108 SG CYS A 131 1.734 -8.061 -22.935 1.00 34.33 S ATOM 0 H CYS A 131 1.416 -8.892 -18.403 1.00 72.11 H new ATOM 0 HA CYS A 131 1.695 -10.281 -20.951 1.00 70.14 H new ATOM 0 HB2 CYS A 131 -0.024 -8.531 -21.378 1.00 4.01 H new ATOM 0 HB3 CYS A 131 1.070 -7.309 -20.761 1.00 4.01 H new ATOM 0 HG CYS A 131 1.072 -7.146 -23.579 1.00 34.33 H new ATOM 2114 N ALA A 132 4.059 -9.438 -21.100 1.00 22.32 N ATOM 2115 CA ALA A 132 5.485 -9.148 -21.013 1.00 70.13 C ATOM 2116 C ALA A 132 5.967 -8.392 -22.247 1.00 22.51 C ATOM 2117 O ALA A 132 5.714 -8.807 -23.377 1.00 62.15 O ATOM 2118 CB ALA A 132 6.276 -10.436 -20.838 1.00 1.10 C ATOM 0 H ALA A 132 3.798 -10.043 -21.879 1.00 22.32 H new ATOM 0 HA ALA A 132 5.649 -8.513 -20.142 1.00 70.13 H new ATOM 0 HB1 ALA A 132 7.339 -10.204 -20.775 1.00 1.10 H new ATOM 0 HB2 ALA A 132 5.958 -10.937 -19.923 1.00 1.10 H new ATOM 0 HB3 ALA A 132 6.098 -11.091 -21.691 1.00 1.10 H new ATOM 2124 N GLU A 133 6.662 -7.282 -22.021 1.00 41.10 N ATOM 2125 CA GLU A 133 7.178 -6.468 -23.116 1.00 31.43 C ATOM 2126 C GLU A 133 8.468 -5.762 -22.708 1.00 71.41 C ATOM 2127 O GLU A 133 8.633 -5.364 -21.555 1.00 22.21 O ATOM 2128 CB GLU A 133 6.134 -5.437 -23.550 1.00 3.14 C ATOM 2129 CG GLU A 133 6.148 -5.148 -25.041 1.00 52.23 C ATOM 2130 CD GLU A 133 6.010 -3.670 -25.350 1.00 54.24 C ATOM 2131 OE1 GLU A 133 7.035 -2.958 -25.313 1.00 63.10 O ATOM 2132 OE2 GLU A 133 4.877 -3.225 -25.629 1.00 53.32 O ATOM 0 H GLU A 133 6.881 -6.926 -21.091 1.00 41.10 H new ATOM 0 HA GLU A 133 7.396 -7.129 -23.955 1.00 31.43 H new ATOM 0 HB2 GLU A 133 5.144 -5.794 -23.267 1.00 3.14 H new ATOM 0 HB3 GLU A 133 6.305 -4.508 -23.007 1.00 3.14 H new ATOM 0 HG2 GLU A 133 7.078 -5.520 -25.471 1.00 52.23 H new ATOM 0 HG3 GLU A 133 5.335 -5.693 -25.521 1.00 52.23 H new ATOM 2139 N VAL A 134 9.380 -5.611 -23.663 1.00 62.40 N ATOM 2140 CA VAL A 134 10.655 -4.954 -23.405 1.00 5.41 C ATOM 2141 C VAL A 134 11.178 -4.258 -24.657 1.00 2.24 C ATOM 2142 O VAL A 134 11.003 -4.748 -25.773 1.00 14.23 O ATOM 2143 CB VAL A 134 11.714 -5.956 -22.908 1.00 71.33 C ATOM 2144 CG1 VAL A 134 11.871 -7.101 -23.898 1.00 11.04 C ATOM 2145 CG2 VAL A 134 13.044 -5.255 -22.676 1.00 72.31 C ATOM 0 H VAL A 134 9.259 -5.935 -24.623 1.00 62.40 H new ATOM 0 HA VAL A 134 10.476 -4.211 -22.627 1.00 5.41 H new ATOM 0 HB VAL A 134 11.378 -6.372 -21.958 1.00 71.33 H new ATOM 0 HG11 VAL A 134 12.623 -7.799 -23.531 1.00 11.04 H new ATOM 0 HG12 VAL A 134 10.918 -7.619 -24.009 1.00 11.04 H new ATOM 0 HG13 VAL A 134 12.184 -6.706 -24.864 1.00 11.04 H new ATOM 0 HG21 VAL A 134 13.780 -5.978 -22.325 1.00 72.31 H new ATOM 0 HG22 VAL A 134 13.389 -4.810 -23.610 1.00 72.31 H new ATOM 0 HG23 VAL A 134 12.918 -4.473 -21.927 1.00 72.31 H new ATOM 2155 N THR A 135 11.823 -3.111 -24.464 1.00 70.12 N ATOM 2156 CA THR A 135 12.371 -2.347 -25.577 1.00 44.42 C ATOM 2157 C THR A 135 13.730 -1.754 -25.221 1.00 13.35 C ATOM 2158 O THR A 135 13.848 -0.967 -24.280 1.00 73.10 O ATOM 2159 CB THR A 135 11.422 -1.209 -25.999 1.00 63.11 C ATOM 2160 OG1 THR A 135 10.170 -1.338 -25.318 1.00 35.14 O ATOM 2161 CG2 THR A 135 11.192 -1.226 -27.503 1.00 34.44 C ATOM 0 H THR A 135 11.978 -2.692 -23.547 1.00 70.12 H new ATOM 0 HA THR A 135 12.487 -3.041 -26.409 1.00 44.42 H new ATOM 0 HB THR A 135 11.885 -0.260 -25.729 1.00 63.11 H new ATOM 0 HG1 THR A 135 9.452 -0.987 -25.885 1.00 35.14 H new ATOM 0 HG21 THR A 135 10.519 -0.414 -27.777 1.00 34.44 H new ATOM 0 HG22 THR A 135 12.144 -1.098 -28.018 1.00 34.44 H new ATOM 0 HG23 THR A 135 10.748 -2.178 -27.792 1.00 34.44 H new ATOM 2169 N LEU A 136 14.753 -2.135 -25.977 1.00 1.31 N ATOM 2170 CA LEU A 136 16.105 -1.640 -25.741 1.00 11.40 C ATOM 2171 C LEU A 136 16.899 -1.583 -27.042 1.00 52.42 C ATOM 2172 O LEU A 136 16.676 -2.382 -27.951 1.00 43.51 O ATOM 2173 CB LEU A 136 16.826 -2.531 -24.729 1.00 23.13 C ATOM 2174 CG LEU A 136 17.277 -3.899 -25.241 1.00 65.41 C ATOM 2175 CD1 LEU A 136 18.793 -3.953 -25.356 1.00 70.12 C ATOM 2176 CD2 LEU A 136 16.771 -5.005 -24.326 1.00 53.04 C ATOM 0 H LEU A 136 14.673 -2.785 -26.759 1.00 1.31 H new ATOM 0 HA LEU A 136 16.030 -0.630 -25.338 1.00 11.40 H new ATOM 0 HB2 LEU A 136 17.702 -1.996 -24.363 1.00 23.13 H new ATOM 0 HB3 LEU A 136 16.166 -2.684 -23.875 1.00 23.13 H new ATOM 0 HG LEU A 136 16.852 -4.052 -26.233 1.00 65.41 H new ATOM 0 HD11 LEU A 136 19.095 -4.934 -25.722 1.00 70.12 H new ATOM 0 HD12 LEU A 136 19.133 -3.186 -26.052 1.00 70.12 H new ATOM 0 HD13 LEU A 136 19.239 -3.778 -24.377 1.00 70.12 H new ATOM 0 HD21 LEU A 136 17.102 -5.972 -24.706 1.00 53.04 H new ATOM 0 HD22 LEU A 136 17.167 -4.856 -23.321 1.00 53.04 H new ATOM 0 HD23 LEU A 136 15.682 -4.981 -24.294 1.00 53.04 H new