Browse entries in the PDBbind-CN Database
HEADER 4DSU_COMPLEX COMPND 4DSU_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 61 SER THR GLU TYR LYS LEU VAL VAL VAL GLY ALA ASP GLY SEQRES 2 A 61 VAL GLY LYS SER ALA LEU THR ILE GLN LEU ILE GLN ASN SEQRES 3 A 61 HIS PHE VAL ASP GLU TYR ASP PRO THR ILE GLU ASP SER SEQRES 4 A 61 TYR ARG LYS GLN VAL VAL ILE ASP GLY GLU THR CYS LEU SEQRES 5 A 61 LEU ASP ILE LEU ASP THR ALA GLY GLN SEQRES 1 A 116 SER ALA MET ARG ASP GLN TYR MET ARG THR GLY GLU GLY SEQRES 2 A 116 PHE LEU CYS VAL PHE ALA ILE ASN ASN THR LYS SER PHE SEQRES 3 A 116 GLU ASP ILE HIS HIS TYR ARG GLU GLN ILE LYS ARG VAL SEQRES 4 A 116 LYS ASP SER GLU ASP VAL PRO MET VAL LEU VAL GLY ASN SEQRES 5 A 116 LYS CYS ASP LEU PRO SER ARG THR VAL ASP THR LYS GLN SEQRES 6 A 116 ALA GLN ASP LEU ALA ARG SER TYR GLY ILE PRO PHE ILE SEQRES 7 A 116 GLU THR SER ALA LYS THR ARG GLN GLY VAL ASP ASP ALA SEQRES 8 A 116 PHE TYR THR LEU VAL ARG GLU ILE ARG LYS HIS LYS GLU SEQRES 9 A 116 LYS MET SER LYS ASP GLY LYS LYS LYS LYS LYS LYS HET MG A 1 1 HET BZI A 242 15 ATOM 1 N SER A 1 38.324 17.246 2.734 1.00 67.01 N ATOM 2 CA SER A 1 38.318 18.654 3.113 1.00 65.42 C ATOM 3 C SER A 1 36.897 19.181 3.314 1.00 60.73 C ATOM 4 O SER A 1 36.545 19.622 4.407 1.00 60.72 O ATOM 5 CB SER A 1 39.058 19.497 2.069 1.00 67.71 C ATOM 6 OG SER A 1 40.388 19.036 1.893 1.00 69.45 O ATOM 7 HA SER A 1 38.839 18.737 4.067 1.00 0.00 H ATOM 8 HB2 SER A 1 39.081 20.535 2.400 1.00 0.00 H ATOM 9 HB3 SER A 1 38.529 19.432 1.118 1.00 0.00 H ATOM 10 HG SER A 1 40.843 19.596 1.215 1.00 0.00 H ATOM 11 HN3 SER A 1 37.801 17.126 1.843 1.00 0.00 H ATOM 12 HN2 SER A 1 37.870 16.685 3.482 1.00 0.00 H ATOM 13 HN1 SER A 1 39.306 16.927 2.607 1.00 0.00 H ATOM 14 N THR A 2 36.082 19.132 2.262 1.00 55.66 N ATOM 15 CA THR A 2 34.708 19.618 2.349 1.00 52.10 C ATOM 16 C THR A 2 33.798 18.561 2.973 1.00 49.45 C ATOM 17 O THR A 2 33.781 17.410 2.541 1.00 50.11 O ATOM 18 CB THR A 2 34.154 20.034 0.966 1.00 52.33 C ATOM 19 OG1 THR A 2 35.041 20.981 0.356 1.00 53.74 O ATOM 20 CG2 THR A 2 32.770 20.662 1.111 1.00 51.80 C ATOM 21 HA THR A 2 34.723 20.502 2.987 1.00 0.00 H ATOM 22 HB THR A 2 34.076 19.144 0.341 1.00 0.00 H ATOM 23 HG1 THR A 2 34.683 21.245 -0.529 1.00 0.00 H ATOM 24 HG23 THR A 2 32.093 19.944 1.575 1.00 0.00 H ATOM 25 HG21 THR A 2 32.840 21.553 1.735 1.00 0.00 H ATOM 26 HG22 THR A 2 32.392 20.936 0.126 1.00 0.00 H ATOM 27 H THR A 2 36.430 18.741 1.363 1.00 0.00 H ATOM 28 N GLU A 3 33.044 18.955 3.994 1.00 48.23 N ATOM 29 CA GLU A 3 32.126 18.035 4.652 1.00 47.20 C ATOM 30 C GLU A 3 30.711 18.134 4.078 1.00 43.36 C ATOM 31 O GLU A 3 30.247 19.217 3.729 1.00 43.74 O ATOM 32 CB GLU A 3 32.100 18.303 6.153 1.00 51.36 C ATOM 33 CG GLU A 3 31.147 17.419 6.925 1.00 55.56 C ATOM 34 CD GLU A 3 31.325 17.563 8.420 1.00 60.02 C ATOM 35 OE1 GLU A 3 32.479 17.752 8.863 1.00 62.26 O ATOM 36 OE2 GLU A 3 30.315 17.492 9.149 1.00 61.74 O ATOM 37 HA GLU A 3 32.488 17.023 4.469 1.00 0.00 H ATOM 38 HB2 GLU A 3 33.105 18.147 6.546 1.00 0.00 H ATOM 39 HB3 GLU A 3 31.807 19.341 6.310 1.00 0.00 H ATOM 40 HG2 GLU A 3 30.124 17.692 6.664 1.00 0.00 H ATOM 41 HG3 GLU A 3 31.327 16.380 6.647 1.00 0.00 H ATOM 42 H GLU A 3 33.110 19.937 4.329 1.00 0.00 H ATOM 43 N TYR A 4 30.036 16.993 3.983 1.00 40.03 N ATOM 44 CA TYR A 4 28.660 16.957 3.498 1.00 38.19 C ATOM 45 C TYR A 4 27.784 16.150 4.448 1.00 38.16 C ATOM 46 O TYR A 4 28.042 14.969 4.685 1.00 40.15 O ATOM 47 CB TYR A 4 28.607 16.355 2.089 1.00 38.00 C ATOM 48 CG TYR A 4 29.352 17.155 1.040 1.00 37.62 C ATOM 49 CD1 TYR A 4 28.696 18.108 0.273 1.00 40.12 C ATOM 50 CD2 TYR A 4 30.713 16.960 0.816 1.00 37.60 C ATOM 51 CE1 TYR A 4 29.366 18.846 -0.684 1.00 42.22 C ATOM 52 CE2 TYR A 4 31.391 17.693 -0.144 1.00 39.88 C ATOM 53 CZ TYR A 4 30.710 18.634 -0.891 1.00 41.93 C ATOM 54 OH TYR A 4 31.371 19.367 -1.849 1.00 45.16 O ATOM 55 HA TYR A 4 28.281 17.978 3.456 1.00 0.00 H ATOM 56 HB3 TYR A 4 27.562 16.285 1.787 1.00 0.00 H ATOM 57 HB2 TYR A 4 29.041 15.356 2.128 1.00 0.00 H ATOM 58 HD2 TYR A 4 31.253 16.219 1.405 1.00 0.00 H ATOM 59 HE2 TYR A 4 32.456 17.528 -0.309 1.00 0.00 H ATOM 60 HE1 TYR A 4 28.833 19.593 -1.272 1.00 0.00 H ATOM 61 HD1 TYR A 4 27.631 18.278 0.429 1.00 0.00 H ATOM 62 HH TYR A 4 31.752 18.754 -2.527 1.00 0.00 H ATOM 63 H TYR A 4 30.500 16.104 4.261 1.00 0.00 H ATOM 64 N LYS A 5 26.761 16.798 5.001 1.00 36.15 N ATOM 65 CA LYS A 5 25.791 16.144 5.876 1.00 35.28 C ATOM 66 C LYS A 5 24.689 15.553 5.031 1.00 30.43 C ATOM 67 O LYS A 5 23.898 16.298 4.462 1.00 31.61 O ATOM 68 CB LYS A 5 25.138 17.164 6.801 1.00 40.88 C ATOM 69 CG LYS A 5 25.192 16.803 8.257 1.00 48.44 C ATOM 70 CD LYS A 5 26.489 17.299 8.846 1.00 50.38 C ATOM 71 CE LYS A 5 26.598 18.801 8.641 1.00 53.93 C ATOM 72 NZ LYS A 5 27.621 19.416 9.531 1.00 53.99 N ATOM 73 HA LYS A 5 26.311 15.382 6.456 1.00 0.00 H ATOM 74 HB2 LYS A 5 25.645 18.120 6.667 1.00 0.00 H ATOM 75 HB3 LYS A 5 24.092 17.265 6.513 1.00 0.00 H ATOM 76 HG2 LYS A 5 24.354 17.266 8.779 1.00 0.00 H ATOM 77 HG3 LYS A 5 25.133 15.720 8.366 1.00 0.00 H ATOM 78 HD2 LYS A 5 26.513 17.075 9.912 1.00 0.00 H ATOM 79 HD3 LYS A 5 27.325 16.803 8.353 1.00 0.00 H ATOM 80 HE2 LYS A 5 25.630 19.256 8.851 1.00 0.00 H ATOM 81 HE3 LYS A 5 26.872 18.995 7.604 1.00 0.00 H ATOM 82 HZ1 LYS A 5 27.365 19.242 10.524 1.00 0.00 H ATOM 83 HZ2 LYS A 5 28.550 18.993 9.333 1.00 0.00 H ATOM 84 HZ3 LYS A 5 27.660 20.440 9.356 1.00 0.00 H ATOM 85 H LYS A 5 26.648 17.812 4.802 1.00 0.00 H ATOM 86 N LEU A 6 24.624 14.226 4.963 1.00 27.88 N ATOM 87 CA LEU A 6 23.603 13.557 4.167 1.00 27.25 C ATOM 88 C LEU A 6 22.624 12.809 5.059 1.00 28.00 C ATOM 89 O LEU A 6 23.015 12.201 6.063 1.00 29.93 O ATOM 90 CB LEU A 6 24.240 12.562 3.196 1.00 26.36 C ATOM 91 CG LEU A 6 25.435 13.072 2.405 1.00 28.07 C ATOM 92 CD1 LEU A 6 25.922 12.000 1.435 1.00 29.27 C ATOM 93 CD2 LEU A 6 25.063 14.338 1.664 1.00 28.77 C ATOM 94 HA LEU A 6 23.070 14.326 3.607 1.00 0.00 H ATOM 95 HB2 LEU A 6 24.566 11.696 3.772 1.00 0.00 H ATOM 96 HB3 LEU A 6 23.475 12.255 2.483 1.00 0.00 H ATOM 97 HG LEU A 6 26.247 13.302 3.095 1.00 0.00 H ATOM 98 HD21 LEU A 6 24.242 14.128 0.979 1.00 0.00 H ATOM 99 HD22 LEU A 6 24.755 15.100 2.380 1.00 0.00 H ATOM 100 HD23 LEU A 6 25.925 14.695 1.101 1.00 0.00 H ATOM 101 HD11 LEU A 6 26.217 11.112 1.995 1.00 0.00 H ATOM 102 HD12 LEU A 6 25.119 11.745 0.744 1.00 0.00 H ATOM 103 HD13 LEU A 6 26.777 12.379 0.876 1.00 0.00 H ATOM 104 H LEU A 6 25.316 13.654 5.489 1.00 0.00 H ATOM 105 N VAL A 7 21.353 12.835 4.677 1.00 25.28 N ATOM 106 CA VAL A 7 20.327 12.119 5.420 1.00 26.46 C ATOM 107 C VAL A 7 19.604 11.162 4.489 1.00 25.81 C ATOM 108 O VAL A 7 19.097 11.575 3.447 1.00 26.23 O ATOM 109 CB VAL A 7 19.317 13.091 6.044 1.00 27.54 C ATOM 110 CG1 VAL A 7 18.262 12.329 6.830 1.00 28.50 C ATOM 111 CG2 VAL A 7 20.048 14.097 6.931 1.00 29.61 C ATOM 112 HA VAL A 7 20.809 11.563 6.225 1.00 0.00 H ATOM 113 HB VAL A 7 18.808 13.638 5.250 1.00 0.00 H ATOM 114 HG11 VAL A 7 17.734 11.649 6.162 1.00 0.00 H ATOM 115 HG12 VAL A 7 18.744 11.759 7.624 1.00 0.00 H ATOM 116 HG13 VAL A 7 17.555 13.035 7.265 1.00 0.00 H ATOM 117 HG21 VAL A 7 20.575 13.565 7.723 1.00 0.00 H ATOM 118 HG22 VAL A 7 20.764 14.657 6.329 1.00 0.00 H ATOM 119 HG23 VAL A 7 19.325 14.784 7.371 1.00 0.00 H ATOM 120 H VAL A 7 21.085 13.377 3.831 1.00 0.00 H ATOM 121 N VAL A 8 19.583 9.883 4.858 1.00 23.53 N ATOM 122 CA VAL A 8 18.886 8.865 4.081 1.00 22.82 C ATOM 123 C VAL A 8 17.489 8.696 4.673 1.00 25.81 C ATOM 124 O VAL A 8 17.344 8.304 5.836 1.00 25.93 O ATOM 125 CB VAL A 8 19.632 7.508 4.102 1.00 24.18 C ATOM 126 CG1 VAL A 8 18.934 6.506 3.170 1.00 23.18 C ATOM 127 CG2 VAL A 8 21.102 7.683 3.697 1.00 24.28 C ATOM 128 HA VAL A 8 18.836 9.187 3.041 1.00 0.00 H ATOM 129 HB VAL A 8 19.607 7.119 5.120 1.00 0.00 H ATOM 130 HG11 VAL A 8 17.907 6.355 3.504 1.00 0.00 H ATOM 131 HG12 VAL A 8 18.933 6.898 2.153 1.00 0.00 H ATOM 132 HG13 VAL A 8 19.468 5.556 3.194 1.00 0.00 H ATOM 133 HG21 VAL A 8 21.153 8.096 2.689 1.00 0.00 H ATOM 134 HG22 VAL A 8 21.591 8.363 4.395 1.00 0.00 H ATOM 135 HG23 VAL A 8 21.602 6.715 3.720 1.00 0.00 H ATOM 136 H VAL A 8 20.079 9.601 5.727 1.00 0.00 H ATOM 137 N VAL A 9 16.466 9.010 3.882 1.00 22.58 N ATOM 138 CA VAL A 9 15.081 8.917 4.349 1.00 25.13 C ATOM 139 C VAL A 9 14.258 7.999 3.458 1.00 23.68 C ATOM 140 O VAL A 9 14.629 7.724 2.309 1.00 23.34 O ATOM 141 CB VAL A 9 14.392 10.294 4.405 1.00 28.81 C ATOM 142 CG1 VAL A 9 15.204 11.252 5.256 1.00 28.88 C ATOM 143 CG2 VAL A 9 14.173 10.852 2.995 1.00 30.87 C ATOM 144 HA VAL A 9 15.130 8.506 5.357 1.00 0.00 H ATOM 145 HB VAL A 9 13.412 10.175 4.867 1.00 0.00 H ATOM 146 HG11 VAL A 9 15.290 10.854 6.267 1.00 0.00 H ATOM 147 HG12 VAL A 9 16.198 11.367 4.824 1.00 0.00 H ATOM 148 HG13 VAL A 9 14.705 12.221 5.287 1.00 0.00 H ATOM 149 HG21 VAL A 9 15.135 10.961 2.495 1.00 0.00 H ATOM 150 HG22 VAL A 9 13.543 10.167 2.428 1.00 0.00 H ATOM 151 HG23 VAL A 9 13.685 11.824 3.062 1.00 0.00 H ATOM 152 H VAL A 9 16.654 9.329 2.910 1.00 0.00 H ATOM 153 N GLY A 10 13.137 7.529 3.998 1.00 22.90 N ATOM 154 CA GLY A 10 12.262 6.628 3.273 1.00 24.86 C ATOM 155 C GLY A 10 11.557 5.670 4.219 1.00 26.77 C ATOM 156 O GLY A 10 11.922 5.538 5.392 1.00 27.15 O ATOM 157 HA3 GLY A 10 12.854 6.054 2.560 1.00 0.00 H ATOM 158 HA2 GLY A 10 11.515 7.212 2.736 1.00 0.00 H ATOM 159 H GLY A 10 12.881 7.815 4.965 1.00 0.00 H ATOM 160 N ALA A 11 10.536 4.996 3.707 1.00 25.87 N ATOM 161 CA ALA A 11 9.765 4.047 4.508 1.00 26.69 C ATOM 162 C ALA A 11 10.630 2.901 5.051 1.00 30.50 C ATOM 163 O ALA A 11 11.675 2.560 4.479 1.00 28.24 O ATOM 164 CB ALA A 11 8.599 3.499 3.682 1.00 25.90 C ATOM 165 HA ALA A 11 9.377 4.584 5.374 1.00 0.00 H ATOM 166 HB1 ALA A 11 7.953 4.322 3.377 1.00 0.00 H ATOM 167 HB2 ALA A 11 8.988 2.993 2.798 1.00 0.00 H ATOM 168 HB3 ALA A 11 8.029 2.792 4.285 1.00 0.00 H ATOM 169 H ALA A 11 10.278 5.146 2.711 1.00 0.00 H ATOM 170 N ASP A 12 10.195 2.315 6.164 1.00 32.98 N ATOM 171 CA ASP A 12 10.856 1.129 6.703 1.00 36.76 C ATOM 172 C ASP A 12 10.918 0.028 5.656 1.00 33.33 C ATOM 173 O ASP A 12 9.968 -0.177 4.894 1.00 33.42 O ATOM 174 CB ASP A 12 10.103 0.600 7.927 1.00 45.32 C ATOM 175 CG ASP A 12 10.401 1.383 9.184 1.00 52.59 C ATOM 176 OD1 ASP A 12 10.074 0.885 10.278 1.00 58.32 O ATOM 177 OD2 ASP A 12 10.960 2.491 9.087 1.00 54.89 O ATOM 178 HA ASP A 12 11.867 1.417 6.992 1.00 0.00 H ATOM 179 HB2 ASP A 12 9.033 0.655 7.728 1.00 0.00 H ATOM 180 HB3 ASP A 12 10.388 -0.440 8.089 1.00 0.00 H ATOM 181 H ASP A 12 9.369 2.709 6.659 1.00 0.00 H ATOM 182 N GLY A 13 12.040 -0.678 5.620 1.00 28.79 N ATOM 183 CA GLY A 13 12.162 -1.864 4.795 1.00 27.26 C ATOM 184 C GLY A 13 12.525 -1.634 3.340 1.00 26.26 C ATOM 185 O GLY A 13 12.465 -2.574 2.546 1.00 29.08 O ATOM 186 HA3 GLY A 13 11.206 -2.387 4.821 1.00 0.00 H ATOM 187 HA2 GLY A 13 12.933 -2.497 5.234 1.00 0.00 H ATOM 188 H GLY A 13 12.851 -0.374 6.196 1.00 0.00 H ATOM 189 N VAL A 14 12.904 -0.408 2.973 1.00 22.07 N ATOM 190 CA VAL A 14 13.222 -0.145 1.565 1.00 21.48 C ATOM 191 C VAL A 14 14.692 -0.391 1.247 1.00 23.43 C ATOM 192 O VAL A 14 15.073 -0.466 0.076 1.00 22.17 O ATOM 193 CB VAL A 14 12.843 1.284 1.118 1.00 21.84 C ATOM 194 CG1 VAL A 14 11.345 1.520 1.296 1.00 22.82 C ATOM 195 CG2 VAL A 14 13.666 2.328 1.891 1.00 21.18 C ATOM 196 HA VAL A 14 12.612 -0.854 1.005 1.00 0.00 H ATOM 197 HB VAL A 14 13.077 1.391 0.059 1.00 0.00 H ATOM 198 HG11 VAL A 14 10.791 0.801 0.693 1.00 0.00 H ATOM 199 HG12 VAL A 14 11.081 1.395 2.346 1.00 0.00 H ATOM 200 HG13 VAL A 14 11.097 2.532 0.976 1.00 0.00 H ATOM 201 HG21 VAL A 14 13.469 2.227 2.958 1.00 0.00 H ATOM 202 HG22 VAL A 14 14.727 2.167 1.700 1.00 0.00 H ATOM 203 HG23 VAL A 14 13.384 3.328 1.561 1.00 0.00 H ATOM 204 H VAL A 14 12.973 0.353 3.678 1.00 0.00 H ATOM 205 N GLY A 15 15.507 -0.511 2.294 1.00 24.13 N ATOM 206 CA GLY A 15 16.936 -0.740 2.143 1.00 23.27 C ATOM 207 C GLY A 15 17.830 0.442 2.494 1.00 21.50 C ATOM 208 O GLY A 15 18.965 0.511 2.044 1.00 23.55 O ATOM 209 HA3 GLY A 15 17.126 -1.008 1.104 1.00 0.00 H ATOM 210 HA2 GLY A 15 17.213 -1.574 2.788 1.00 0.00 H ATOM 211 H GLY A 15 15.108 -0.439 3.252 1.00 0.00 H ATOM 212 N LYS A 16 17.332 1.382 3.288 1.00 23.13 N ATOM 213 CA LYS A 16 18.159 2.522 3.710 1.00 23.34 C ATOM 214 C LYS A 16 19.443 2.059 4.402 1.00 25.64 C ATOM 215 O LYS A 16 20.542 2.536 4.100 1.00 27.48 O ATOM 216 CB LYS A 16 17.371 3.439 4.649 1.00 23.72 C ATOM 217 CG LYS A 16 16.146 4.062 3.997 1.00 24.17 C ATOM 218 CD LYS A 16 15.428 5.069 4.921 1.00 27.14 C ATOM 219 CE LYS A 16 14.997 4.457 6.248 1.00 30.44 C ATOM 220 NZ LYS A 16 14.070 3.322 6.074 1.00 30.65 N ATOM 221 HA LYS A 16 18.434 3.075 2.812 1.00 0.00 H ATOM 222 HB2 LYS A 16 17.045 2.855 5.510 1.00 0.00 H ATOM 223 HB3 LYS A 16 18.030 4.240 4.983 1.00 0.00 H ATOM 224 HG2 LYS A 16 16.459 4.581 3.091 1.00 0.00 H ATOM 225 HG3 LYS A 16 15.447 3.267 3.736 1.00 0.00 H ATOM 226 HD2 LYS A 16 16.105 5.898 5.124 1.00 0.00 H ATOM 227 HD3 LYS A 16 14.543 5.443 4.407 1.00 0.00 H ATOM 228 HE2 LYS A 16 14.502 5.225 6.843 1.00 0.00 H ATOM 229 HE3 LYS A 16 15.884 4.106 6.776 1.00 0.00 H ATOM 230 HZ1 LYS A 16 13.215 3.647 5.579 1.00 0.00 H ATOM 231 HZ2 LYS A 16 14.535 2.579 5.515 1.00 0.00 H ATOM 232 HZ3 LYS A 16 13.809 2.943 7.007 1.00 0.00 H ATOM 233 H LYS A 16 16.347 1.311 3.615 1.00 0.00 H ATOM 234 N SER A 17 19.299 1.128 5.334 1.00 27.24 N ATOM 235 CA SER A 17 20.459 0.607 6.056 1.00 28.27 C ATOM 236 C SER A 17 21.389 -0.189 5.158 1.00 26.91 C ATOM 237 O SER A 17 22.607 -0.032 5.221 1.00 30.10 O ATOM 238 CB SER A 17 20.011 -0.256 7.231 1.00 30.24 C ATOM 239 OG SER A 17 19.423 0.556 8.223 1.00 31.63 O ATOM 240 HA SER A 17 21.016 1.468 6.425 1.00 0.00 H ATOM 241 HB2 SER A 17 20.874 -0.773 7.651 1.00 0.00 H ATOM 242 HB3 SER A 17 19.283 -0.989 6.885 1.00 0.00 H ATOM 243 HG SER A 17 20.085 1.221 8.538 1.00 0.00 H ATOM 244 H SER A 17 18.350 0.764 5.554 1.00 0.00 H ATOM 245 N ALA A 18 20.817 -1.063 4.337 1.00 27.44 N ATOM 246 CA ALA A 18 21.621 -1.883 3.439 1.00 27.85 C ATOM 247 C ALA A 18 22.434 -1.021 2.476 1.00 27.28 C ATOM 248 O ALA A 18 23.606 -1.302 2.216 1.00 27.11 O ATOM 249 CB ALA A 18 20.745 -2.861 2.682 1.00 27.72 C ATOM 250 HA ALA A 18 22.326 -2.452 4.046 1.00 0.00 H ATOM 251 HB1 ALA A 18 20.232 -3.511 3.391 1.00 0.00 H ATOM 252 HB2 ALA A 18 20.010 -2.310 2.095 1.00 0.00 H ATOM 253 HB3 ALA A 18 21.365 -3.463 2.018 1.00 0.00 H ATOM 254 H ALA A 18 19.782 -1.164 4.335 1.00 0.00 H ATOM 255 N LEU A 19 21.815 0.032 1.949 1.00 25.90 N ATOM 256 CA LEU A 19 22.520 0.960 1.064 1.00 24.58 C ATOM 257 C LEU A 19 23.674 1.632 1.798 1.00 26.01 C ATOM 258 O LEU A 19 24.787 1.739 1.280 1.00 27.84 O ATOM 259 CB LEU A 19 21.556 2.034 0.546 1.00 24.38 C ATOM 260 CG LEU A 19 20.619 1.559 -0.567 1.00 25.73 C ATOM 261 CD1 LEU A 19 19.554 2.609 -0.896 1.00 24.84 C ATOM 262 CD2 LEU A 19 21.408 1.182 -1.822 1.00 28.02 C ATOM 263 HA LEU A 19 22.917 0.390 0.223 1.00 0.00 H ATOM 264 HB2 LEU A 19 20.946 2.377 1.382 1.00 0.00 H ATOM 265 HB3 LEU A 19 22.146 2.866 0.163 1.00 0.00 H ATOM 266 HG LEU A 19 20.106 0.670 -0.201 1.00 0.00 H ATOM 267 HD21 LEU A 19 21.961 2.052 -2.177 1.00 0.00 H ATOM 268 HD22 LEU A 19 22.105 0.379 -1.584 1.00 0.00 H ATOM 269 HD23 LEU A 19 20.718 0.848 -2.597 1.00 0.00 H ATOM 270 HD11 LEU A 19 18.957 2.810 -0.006 1.00 0.00 H ATOM 271 HD12 LEU A 19 20.040 3.528 -1.224 1.00 0.00 H ATOM 272 HD13 LEU A 19 18.909 2.234 -1.691 1.00 0.00 H ATOM 273 H LEU A 19 20.812 0.199 2.170 1.00 0.00 H ATOM 274 N THR A 20 23.401 2.106 3.005 1.00 25.90 N ATOM 275 CA THR A 20 24.426 2.819 3.758 1.00 26.83 C ATOM 276 C THR A 20 25.566 1.895 4.161 1.00 28.62 C ATOM 277 O THR A 20 26.734 2.268 4.078 1.00 30.20 O ATOM 278 CB THR A 20 23.838 3.495 5.003 1.00 27.06 C ATOM 279 OG1 THR A 20 22.738 4.312 4.602 1.00 30.08 O ATOM 280 CG2 THR A 20 24.874 4.368 5.669 1.00 27.59 C ATOM 281 HA THR A 20 24.823 3.591 3.099 1.00 0.00 H ATOM 282 HB THR A 20 23.515 2.728 5.707 1.00 0.00 H ATOM 283 HG1 THR A 20 22.050 3.748 4.168 1.00 0.00 H ATOM 284 HG23 THR A 20 25.719 3.754 5.980 1.00 0.00 H ATOM 285 HG21 THR A 20 25.214 5.127 4.965 1.00 0.00 H ATOM 286 HG22 THR A 20 24.434 4.851 6.542 1.00 0.00 H ATOM 287 H THR A 20 22.455 1.969 3.415 1.00 0.00 H ATOM 288 N ILE A 21 25.225 0.687 4.588 1.00 29.73 N ATOM 289 CA ILE A 21 26.237 -0.287 4.986 1.00 32.63 C ATOM 290 C ILE A 21 27.078 -0.746 3.793 1.00 34.76 C ATOM 291 O ILE A 21 28.272 -1.019 3.934 1.00 36.75 O ATOM 292 CB ILE A 21 25.597 -1.497 5.679 1.00 37.04 C ATOM 293 CG1 ILE A 21 25.047 -1.074 7.035 1.00 38.22 C ATOM 294 CG2 ILE A 21 26.601 -2.626 5.833 1.00 38.59 C ATOM 295 CD1 ILE A 21 26.003 -0.189 7.800 1.00 44.80 C ATOM 296 HA ILE A 21 26.899 0.210 5.695 1.00 0.00 H ATOM 297 HB ILE A 21 24.778 -1.866 5.062 1.00 0.00 H ATOM 298 HG12 ILE A 21 24.115 -0.530 6.880 1.00 0.00 H ATOM 299 HG13 ILE A 21 24.850 -1.968 7.626 1.00 0.00 H ATOM 300 HD11 ILE A 21 26.936 -0.726 7.970 1.00 0.00 H ATOM 301 HD12 ILE A 21 26.201 0.714 7.222 1.00 0.00 H ATOM 302 HD13 ILE A 21 25.559 0.081 8.758 1.00 0.00 H ATOM 303 HG21 ILE A 21 26.956 -2.932 4.849 1.00 0.00 H ATOM 304 HG22 ILE A 21 27.443 -2.282 6.433 1.00 0.00 H ATOM 305 HG23 ILE A 21 26.122 -3.471 6.327 1.00 0.00 H ATOM 306 H ILE A 21 24.219 0.429 4.640 1.00 0.00 H ATOM 307 N GLN A 22 26.461 -0.835 2.619 1.00 33.33 N ATOM 308 CA GLN A 22 27.223 -1.138 1.410 1.00 33.73 C ATOM 309 C GLN A 22 28.232 -0.038 1.117 1.00 34.30 C ATOM 310 O GLN A 22 29.390 -0.316 0.785 1.00 35.36 O ATOM 311 CB GLN A 22 26.305 -1.353 0.206 1.00 35.82 C ATOM 312 CG GLN A 22 25.835 -2.772 0.055 1.00 37.98 C ATOM 313 CD GLN A 22 26.914 -3.690 -0.487 1.00 39.51 C ATOM 314 OE1 GLN A 22 28.111 -3.434 -0.323 1.00 38.93 O ATOM 315 NE2 GLN A 22 26.496 -4.767 -1.143 1.00 41.23 N ATOM 316 HA GLN A 22 27.763 -2.068 1.589 1.00 0.00 H ATOM 317 HB2 GLN A 22 25.432 -0.710 0.319 1.00 0.00 H ATOM 318 HB3 GLN A 22 26.848 -1.071 -0.696 1.00 0.00 H ATOM 319 HG2 GLN A 22 25.520 -3.141 1.031 1.00 0.00 H ATOM 320 HG3 GLN A 22 24.987 -2.788 -0.629 1.00 0.00 H ATOM 321 HE22 GLN A 22 25.477 -4.943 -1.257 1.00 0.00 H ATOM 322 HE21 GLN A 22 27.187 -5.434 -1.542 1.00 0.00 H ATOM 323 H GLN A 22 25.433 -0.689 2.561 1.00 0.00 H ATOM 324 N LEU A 23 27.799 1.211 1.244 1.00 31.76 N ATOM 325 CA LEU A 23 28.696 2.334 0.999 1.00 31.85 C ATOM 326 C LEU A 23 29.875 2.320 1.965 1.00 35.10 C ATOM 327 O LEU A 23 31.023 2.506 1.556 1.00 35.79 O ATOM 328 CB LEU A 23 27.954 3.668 1.111 1.00 31.92 C ATOM 329 CG LEU A 23 28.805 4.903 0.782 1.00 33.92 C ATOM 330 CD1 LEU A 23 28.906 5.129 -0.721 1.00 36.67 C ATOM 331 CD2 LEU A 23 28.266 6.155 1.465 1.00 34.36 C ATOM 332 HA LEU A 23 29.075 2.227 -0.017 1.00 0.00 H ATOM 333 HB2 LEU A 23 27.108 3.645 0.424 1.00 0.00 H ATOM 334 HB3 LEU A 23 27.588 3.769 2.133 1.00 0.00 H ATOM 335 HG LEU A 23 29.805 4.707 1.168 1.00 0.00 H ATOM 336 HD21 LEU A 23 27.246 6.340 1.129 1.00 0.00 H ATOM 337 HD22 LEU A 23 28.273 6.010 2.545 1.00 0.00 H ATOM 338 HD23 LEU A 23 28.895 7.007 1.208 1.00 0.00 H ATOM 339 HD11 LEU A 23 29.366 4.258 -1.188 1.00 0.00 H ATOM 340 HD12 LEU A 23 27.908 5.278 -1.133 1.00 0.00 H ATOM 341 HD13 LEU A 23 29.516 6.012 -0.914 1.00 0.00 H ATOM 342 H LEU A 23 26.812 1.389 1.520 1.00 0.00 H ATOM 343 N ILE A 24 29.590 2.103 3.247 1.00 36.37 N ATOM 344 CA ILE A 24 30.619 2.210 4.284 1.00 38.41 C ATOM 345 C ILE A 24 31.453 0.937 4.438 1.00 41.49 C ATOM 346 O ILE A 24 32.687 0.993 4.508 1.00 43.58 O ATOM 347 CB ILE A 24 30.003 2.537 5.659 1.00 39.11 C ATOM 348 CG1 ILE A 24 29.151 3.807 5.590 1.00 40.98 C ATOM 349 CG2 ILE A 24 31.099 2.652 6.720 1.00 39.21 C ATOM 350 CD1 ILE A 24 29.924 5.055 5.201 1.00 41.74 C ATOM 351 HA ILE A 24 31.269 3.019 3.952 1.00 0.00 H ATOM 352 HB ILE A 24 29.342 1.719 5.946 1.00 0.00 H ATOM 353 HG12 ILE A 24 28.362 3.650 4.854 1.00 0.00 H ATOM 354 HG13 ILE A 24 28.704 3.973 6.570 1.00 0.00 H ATOM 355 HD11 ILE A 24 30.711 5.236 5.933 1.00 0.00 H ATOM 356 HD12 ILE A 24 30.368 4.913 4.216 1.00 0.00 H ATOM 357 HD13 ILE A 24 29.246 5.908 5.176 1.00 0.00 H ATOM 358 HG21 ILE A 24 31.638 1.707 6.787 1.00 0.00 H ATOM 359 HG22 ILE A 24 31.790 3.447 6.442 1.00 0.00 H ATOM 360 HG23 ILE A 24 30.647 2.883 7.684 1.00 0.00 H ATOM 361 H ILE A 24 28.618 1.853 3.518 1.00 0.00 H ATOM 362 N GLN A 25 30.779 -0.209 4.504 1.00 43.34 N ATOM 363 CA GLN A 25 31.442 -1.462 4.877 1.00 46.32 C ATOM 364 C GLN A 25 31.628 -2.446 3.717 1.00 48.21 C ATOM 365 O GLN A 25 32.310 -3.466 3.864 1.00 50.35 O ATOM 366 CB GLN A 25 30.711 -2.121 6.054 1.00 46.27 C ATOM 367 CG GLN A 25 30.626 -1.222 7.288 1.00 51.41 C ATOM 368 CD GLN A 25 29.924 -1.873 8.472 1.00 55.43 C ATOM 369 OE1 GLN A 25 29.706 -3.085 8.495 1.00 58.53 O ATOM 370 NE2 GLN A 25 29.569 -1.062 9.466 1.00 55.42 N ATOM 371 HA GLN A 25 32.452 -1.191 5.183 1.00 0.00 H ATOM 372 HB2 GLN A 25 29.699 -2.372 5.737 1.00 0.00 H ATOM 373 HB3 GLN A 25 31.242 -3.033 6.325 1.00 0.00 H ATOM 374 HG2 GLN A 25 31.639 -0.957 7.591 1.00 0.00 H ATOM 375 HG3 GLN A 25 30.080 -0.318 7.019 1.00 0.00 H ATOM 376 HE22 GLN A 25 29.773 -0.044 9.405 1.00 0.00 H ATOM 377 HE21 GLN A 25 29.088 -1.446 10.304 1.00 0.00 H ATOM 378 H GLN A 25 29.762 -0.215 4.287 1.00 0.00 H ATOM 379 N ASN A 26 31.035 -2.131 2.568 1.00 49.17 N ATOM 380 CA ASN A 26 31.221 -2.925 1.350 1.00 50.88 C ATOM 381 C ASN A 26 30.718 -4.371 1.434 1.00 50.57 C ATOM 382 O ASN A 26 31.287 -5.269 0.813 1.00 51.73 O ATOM 383 CB ASN A 26 32.689 -2.895 0.898 1.00 53.67 C ATOM 384 CG ASN A 26 33.116 -1.527 0.378 1.00 58.85 C ATOM 385 OD1 ASN A 26 32.482 -0.960 -0.510 1.00 61.34 O ATOM 386 ND2 ASN A 26 34.197 -0.991 0.939 1.00 59.99 N ATOM 387 HA ASN A 26 30.589 -2.443 0.604 1.00 0.00 H ATOM 388 HB2 ASN A 26 33.321 -3.159 1.746 1.00 0.00 H ATOM 389 HB3 ASN A 26 32.825 -3.629 0.103 1.00 0.00 H ATOM 390 HD22 ASN A 26 34.704 -1.505 1.688 1.00 0.00 H ATOM 391 HD21 ASN A 26 34.535 -0.058 0.629 1.00 0.00 H ATOM 392 H ASN A 26 30.419 -1.294 2.533 1.00 0.00 H ATOM 393 N HIS A 27 29.649 -4.590 2.194 1.00 48.37 N ATOM 394 CA HIS A 27 29.003 -5.900 2.242 1.00 48.63 C ATOM 395 C HIS A 27 27.494 -5.754 2.390 1.00 46.00 C ATOM 396 O HIS A 27 27.007 -4.730 2.867 1.00 45.18 O ATOM 397 CB HIS A 27 29.568 -6.755 3.380 1.00 50.24 C ATOM 398 CG HIS A 27 29.276 -6.214 4.743 1.00 52.89 C ATOM 399 ND1 HIS A 27 28.231 -6.670 5.517 1.00 55.15 N ATOM 400 CD2 HIS A 27 29.885 -5.244 5.467 1.00 52.05 C ATOM 401 CE1 HIS A 27 28.213 -6.010 6.662 1.00 55.33 C ATOM 402 NE2 HIS A 27 29.207 -5.141 6.658 1.00 52.91 N ATOM 403 HA HIS A 27 29.213 -6.406 1.300 1.00 0.00 H ATOM 404 HB2 HIS A 27 29.137 -7.754 3.307 1.00 0.00 H ATOM 405 HB3 HIS A 27 30.649 -6.817 3.259 1.00 0.00 H ATOM 406 HD2 HIS A 27 30.750 -4.656 5.162 1.00 0.00 H ATOM 407 HE1 HIS A 27 27.499 -6.158 7.472 1.00 0.00 H ATOM 408 H HIS A 27 29.264 -3.812 2.767 1.00 0.00 H ATOM 409 N PHE A 28 26.758 -6.779 1.974 1.00 44.33 N ATOM 410 CA PHE A 28 25.300 -6.738 2.019 1.00 46.13 C ATOM 411 C PHE A 28 24.751 -7.397 3.275 1.00 51.56 C ATOM 412 O PHE A 28 25.056 -8.550 3.569 1.00 51.07 O ATOM 413 CB PHE A 28 24.703 -7.402 0.776 1.00 41.98 C ATOM 414 CG PHE A 28 23.202 -7.479 0.787 1.00 40.24 C ATOM 415 CD1 PHE A 28 22.437 -6.331 0.934 1.00 40.07 C ATOM 416 CD2 PHE A 28 22.554 -8.696 0.622 1.00 40.11 C ATOM 417 CE1 PHE A 28 21.054 -6.395 0.933 1.00 38.37 C ATOM 418 CE2 PHE A 28 21.165 -8.766 0.618 1.00 39.58 C ATOM 419 CZ PHE A 28 20.416 -7.611 0.775 1.00 39.64 C ATOM 420 HA PHE A 28 25.009 -5.688 2.039 1.00 0.00 H ATOM 421 HB2 PHE A 28 25.011 -6.831 -0.100 1.00 0.00 H ATOM 422 HB3 PHE A 28 25.098 -8.415 0.705 1.00 0.00 H ATOM 423 HD2 PHE A 28 23.140 -9.606 0.494 1.00 0.00 H ATOM 424 HE2 PHE A 28 20.667 -9.727 0.492 1.00 0.00 H ATOM 425 HZ PHE A 28 19.327 -7.661 0.774 1.00 0.00 H ATOM 426 HE1 PHE A 28 20.467 -5.485 1.057 1.00 0.00 H ATOM 427 HD1 PHE A 28 22.931 -5.367 1.052 1.00 0.00 H ATOM 428 H PHE A 28 27.232 -7.630 1.608 1.00 0.00 H ATOM 429 N VAL A 29 23.937 -6.651 4.013 1.00 57.27 N ATOM 430 CA VAL A 29 23.271 -7.186 5.191 1.00 61.93 C ATOM 431 C VAL A 29 21.871 -7.685 4.840 1.00 66.51 C ATOM 432 O VAL A 29 20.933 -6.896 4.696 1.00 63.18 O ATOM 433 CB VAL A 29 23.196 -6.140 6.317 1.00 63.41 C ATOM 434 CG1 VAL A 29 24.560 -5.971 6.969 1.00 63.48 C ATOM 435 CG2 VAL A 29 22.696 -4.810 5.773 1.00 63.66 C ATOM 436 HA VAL A 29 23.864 -8.027 5.550 1.00 0.00 H ATOM 437 HB VAL A 29 22.491 -6.489 7.072 1.00 0.00 H ATOM 438 HG11 VAL A 29 24.882 -6.924 7.388 1.00 0.00 H ATOM 439 HG12 VAL A 29 25.280 -5.640 6.221 1.00 0.00 H ATOM 440 HG13 VAL A 29 24.492 -5.228 7.764 1.00 0.00 H ATOM 441 HG21 VAL A 29 23.379 -4.454 5.002 1.00 0.00 H ATOM 442 HG22 VAL A 29 21.702 -4.944 5.346 1.00 0.00 H ATOM 443 HG23 VAL A 29 22.649 -4.082 6.583 1.00 0.00 H ATOM 444 H VAL A 29 23.772 -5.661 3.742 1.00 0.00 H ATOM 445 N ASP A 30 21.739 -8.999 4.682 1.00 72.76 N ATOM 446 CA ASP A 30 20.432 -9.598 4.462 1.00 78.62 C ATOM 447 C ASP A 30 19.704 -9.597 5.798 1.00 82.75 C ATOM 448 O ASP A 30 18.501 -9.858 5.873 1.00 82.42 O ATOM 449 CB ASP A 30 20.561 -11.016 3.907 1.00 80.12 C ATOM 450 CG ASP A 30 19.306 -11.474 3.184 1.00 81.21 C ATOM 451 OD1 ASP A 30 18.531 -10.606 2.721 1.00 80.63 O ATOM 452 OD2 ASP A 30 19.097 -12.702 3.074 1.00 82.28 O ATOM 453 HA ASP A 30 19.872 -9.026 3.722 1.00 0.00 H ATOM 454 HB2 ASP A 30 21.397 -11.044 3.208 1.00 0.00 H ATOM 455 HB3 ASP A 30 20.757 -11.699 4.734 1.00 0.00 H ATOM 456 H ASP A 30 22.582 -9.607 4.716 1.00 0.00 H ATOM 457 N GLU A 31 20.456 -9.291 6.851 1.00 86.88 N ATOM 458 CA GLU A 31 19.896 -9.098 8.180 1.00 90.03 C ATOM 459 C GLU A 31 18.954 -7.896 8.175 1.00 92.33 C ATOM 460 O GLU A 31 18.352 -7.576 7.149 1.00 92.87 O ATOM 461 CB GLU A 31 21.013 -8.905 9.211 1.00 90.55 C ATOM 462 CG GLU A 31 21.964 -10.094 9.339 1.00 91.16 C ATOM 463 CD GLU A 31 21.430 -11.188 10.253 1.00 91.72 C ATOM 464 OE1 GLU A 31 21.284 -12.339 9.787 1.00 91.75 O ATOM 465 OE2 GLU A 31 21.168 -10.899 11.441 1.00 91.65 O ATOM 466 HA GLU A 31 19.330 -9.987 8.458 1.00 0.00 H ATOM 467 HB2 GLU A 31 21.596 -8.031 8.923 1.00 0.00 H ATOM 468 HB3 GLU A 31 20.553 -8.729 10.184 1.00 0.00 H ATOM 469 HG2 GLU A 31 22.126 -10.518 8.348 1.00 0.00 H ATOM 470 HG3 GLU A 31 22.913 -9.738 9.740 1.00 0.00 H ATOM 471 H GLU A 31 21.482 -9.186 6.720 1.00 0.00 H ATOM 472 N TYR A 32 18.836 -7.225 9.317 1.00 93.56 N ATOM 473 CA TYR A 32 17.795 -6.219 9.500 1.00 94.08 C ATOM 474 C TYR A 32 17.771 -5.685 10.926 1.00 93.18 C ATOM 475 O TYR A 32 18.160 -6.381 11.865 1.00 93.57 O ATOM 476 CB TYR A 32 16.430 -6.838 9.183 1.00 95.19 C ATOM 477 CG TYR A 32 16.427 -8.346 9.326 1.00 96.01 C ATOM 478 CD1 TYR A 32 16.004 -9.163 8.285 1.00 96.54 C ATOM 479 CD2 TYR A 32 16.887 -8.952 10.489 1.00 96.20 C ATOM 480 CE1 TYR A 32 16.016 -10.540 8.408 1.00 96.82 C ATOM 481 CE2 TYR A 32 16.906 -10.327 10.620 1.00 96.45 C ATOM 482 CZ TYR A 32 16.469 -11.116 9.578 1.00 96.69 C ATOM 483 OH TYR A 32 16.486 -12.486 9.706 1.00 96.56 O ATOM 484 HA TYR A 32 18.011 -5.390 8.826 1.00 0.00 H ATOM 485 HB3 TYR A 32 16.161 -6.584 8.158 1.00 0.00 H ATOM 486 HB2 TYR A 32 15.690 -6.421 9.866 1.00 0.00 H ATOM 487 HD2 TYR A 32 17.239 -8.331 11.313 1.00 0.00 H ATOM 488 HE2 TYR A 32 17.264 -10.785 11.542 1.00 0.00 H ATOM 489 HE1 TYR A 32 15.670 -11.167 7.586 1.00 0.00 H ATOM 490 HD1 TYR A 32 15.657 -8.711 7.356 1.00 0.00 H ATOM 491 HH TYR A 32 16.143 -12.898 8.874 1.00 0.00 H ATOM 492 H TYR A 32 19.498 -7.421 10.095 1.00 0.00 H ATOM 493 N ASP A 33 17.310 -4.447 11.075 1.00 91.62 N ATOM 494 CA ASP A 33 17.010 -3.866 12.382 1.00 90.25 C ATOM 495 C ASP A 33 16.414 -2.481 12.169 1.00 88.84 C ATOM 496 O ASP A 33 17.109 -1.473 12.285 1.00 88.05 O ATOM 497 CB ASP A 33 18.254 -3.788 13.268 1.00 89.78 C ATOM 498 CG ASP A 33 17.915 -3.822 14.748 1.00 89.17 C ATOM 499 OD1 ASP A 33 18.164 -4.861 15.394 1.00 89.00 O ATOM 500 OD2 ASP A 33 17.385 -2.815 15.262 1.00 88.90 O ATOM 501 HA ASP A 33 16.296 -4.507 12.900 1.00 0.00 H ATOM 502 HB2 ASP A 33 18.902 -4.634 13.038 1.00 0.00 H ATOM 503 HB3 ASP A 33 18.781 -2.859 13.051 1.00 0.00 H ATOM 504 H ASP A 33 17.156 -3.867 10.225 1.00 0.00 H ATOM 505 N PRO A 34 15.108 -2.434 11.871 1.00 88.56 N ATOM 506 CA PRO A 34 14.413 -1.243 11.371 1.00 87.83 C ATOM 507 C PRO A 34 14.175 -0.167 12.428 1.00 86.76 C ATOM 508 O PRO A 34 13.605 0.879 12.108 1.00 86.10 O ATOM 509 CB PRO A 34 13.064 -1.799 10.877 1.00 88.25 C ATOM 510 CG PRO A 34 13.070 -3.288 11.193 1.00 88.79 C ATOM 511 CD PRO A 34 14.169 -3.525 12.172 1.00 88.80 C ATOM 512 HA PRO A 34 15.010 -0.742 10.609 1.00 0.00 H ATOM 513 HD3 PRO A 34 13.804 -3.459 13.197 1.00 0.00 H ATOM 514 HD2 PRO A 34 14.633 -4.499 12.015 1.00 0.00 H ATOM 515 HG3 PRO A 34 13.248 -3.863 10.284 1.00 0.00 H ATOM 516 HG2 PRO A 34 12.114 -3.582 11.626 1.00 0.00 H ATOM 517 HB2 PRO A 34 12.241 -1.307 11.395 1.00 0.00 H ATOM 518 HB3 PRO A 34 12.962 -1.642 9.803 1.00 0.00 H ATOM 519 N THR A 35 14.612 -0.409 13.660 1.00 86.03 N ATOM 520 CA THR A 35 14.273 0.479 14.771 1.00 84.96 C ATOM 521 C THR A 35 15.326 1.542 15.091 1.00 84.29 C ATOM 522 O THR A 35 14.983 2.661 15.474 1.00 84.42 O ATOM 523 CB THR A 35 13.963 -0.318 16.057 1.00 84.42 C ATOM 524 OG1 THR A 35 13.521 0.579 17.083 1.00 84.11 O ATOM 525 CG2 THR A 35 15.198 -1.068 16.538 1.00 84.05 C ATOM 526 HA THR A 35 13.386 1.008 14.423 1.00 0.00 H ATOM 527 HB THR A 35 13.179 -1.042 15.835 1.00 0.00 H ATOM 528 HG1 THR A 35 14.232 1.242 17.269 1.00 0.00 H ATOM 529 HG23 THR A 35 15.534 -1.750 15.757 1.00 0.00 H ATOM 530 HG21 THR A 35 15.990 -0.354 16.764 1.00 0.00 H ATOM 531 HG22 THR A 35 14.951 -1.635 17.436 1.00 0.00 H ATOM 532 H THR A 35 15.205 -1.245 13.837 1.00 0.00 H ATOM 533 N ILE A 36 16.601 1.198 14.939 1.00 82.84 N ATOM 534 CA ILE A 36 17.671 2.094 15.369 1.00 80.71 C ATOM 535 C ILE A 36 18.176 3.016 14.261 1.00 76.63 C ATOM 536 O ILE A 36 18.121 2.677 13.076 1.00 76.34 O ATOM 537 CB ILE A 36 18.860 1.318 15.989 1.00 82.03 C ATOM 538 CG1 ILE A 36 20.120 1.470 15.135 1.00 82.69 C ATOM 539 CG2 ILE A 36 18.505 -0.149 16.179 1.00 82.17 C ATOM 540 CD1 ILE A 36 21.347 0.814 15.744 1.00 83.61 C ATOM 541 HA ILE A 36 17.220 2.725 16.135 1.00 0.00 H ATOM 542 HB ILE A 36 19.068 1.746 16.969 1.00 0.00 H ATOM 543 HG12 ILE A 36 19.934 1.017 14.161 1.00 0.00 H ATOM 544 HG13 ILE A 36 20.324 2.533 15.007 1.00 0.00 H ATOM 545 HD11 ILE A 36 21.554 1.264 16.715 1.00 0.00 H ATOM 546 HD12 ILE A 36 21.163 -0.253 15.868 1.00 0.00 H ATOM 547 HD13 ILE A 36 22.202 0.962 15.084 1.00 0.00 H ATOM 548 HG21 ILE A 36 17.645 -0.230 16.844 1.00 0.00 H ATOM 549 HG22 ILE A 36 18.261 -0.591 15.213 1.00 0.00 H ATOM 550 HG23 ILE A 36 19.355 -0.674 16.616 1.00 0.00 H ATOM 551 H ILE A 36 16.839 0.281 14.509 1.00 0.00 H ATOM 552 N GLU A 37 18.658 4.189 14.664 1.00 71.88 N ATOM 553 CA GLU A 37 19.263 5.134 13.735 1.00 67.73 C ATOM 554 C GLU A 37 20.777 5.183 13.908 1.00 61.85 C ATOM 555 O GLU A 37 21.288 5.538 14.973 1.00 62.22 O ATOM 556 CB GLU A 37 18.669 6.530 13.913 1.00 69.25 C ATOM 557 CG GLU A 37 17.200 6.620 13.559 1.00 70.42 C ATOM 558 CD GLU A 37 16.720 8.049 13.462 1.00 71.15 C ATOM 559 OE1 GLU A 37 15.644 8.276 12.870 1.00 70.21 O ATOM 560 OE2 GLU A 37 17.423 8.945 13.979 1.00 71.64 O ATOM 561 HA GLU A 37 19.043 4.788 12.725 1.00 0.00 H ATOM 562 HB2 GLU A 37 18.790 6.825 14.955 1.00 0.00 H ATOM 563 HB3 GLU A 37 19.219 7.222 13.275 1.00 0.00 H ATOM 564 HG2 GLU A 37 17.040 6.130 12.598 1.00 0.00 H ATOM 565 HG3 GLU A 37 16.622 6.107 14.328 1.00 0.00 H ATOM 566 H GLU A 37 18.601 4.438 15.672 1.00 0.00 H ATOM 567 N ASP A 38 21.486 4.813 12.850 1.00 55.60 N ATOM 568 CA ASP A 38 22.940 4.828 12.848 1.00 51.97 C ATOM 569 C ASP A 38 23.443 6.012 12.041 1.00 46.62 C ATOM 570 O ASP A 38 22.766 6.490 11.137 1.00 46.47 O ATOM 571 CB ASP A 38 23.483 3.541 12.220 1.00 52.69 C ATOM 572 CG ASP A 38 23.148 2.304 13.031 1.00 53.94 C ATOM 573 OD1 ASP A 38 23.769 2.107 14.098 1.00 53.25 O ATOM 574 OD2 ASP A 38 22.271 1.526 12.592 1.00 53.91 O ATOM 575 HA ASP A 38 23.285 4.906 13.879 1.00 0.00 H ATOM 576 HB2 ASP A 38 23.054 3.431 11.224 1.00 0.00 H ATOM 577 HB3 ASP A 38 24.567 3.623 12.140 1.00 0.00 H ATOM 578 H ASP A 38 20.985 4.502 11.993 1.00 0.00 H ATOM 579 N SER A 39 24.636 6.487 12.362 1.00 44.19 N ATOM 580 CA SER A 39 25.308 7.435 11.488 1.00 42.27 C ATOM 581 C SER A 39 26.713 6.930 11.184 1.00 41.78 C ATOM 582 O SER A 39 27.323 6.226 11.991 1.00 45.46 O ATOM 583 CB SER A 39 25.351 8.831 12.106 1.00 44.09 C ATOM 584 OG SER A 39 26.035 8.816 13.339 1.00 44.99 O ATOM 585 HA SER A 39 24.745 7.515 10.558 1.00 0.00 H ATOM 586 HB2 SER A 39 24.332 9.181 12.268 1.00 0.00 H ATOM 587 HB3 SER A 39 25.863 9.508 11.422 1.00 0.00 H ATOM 588 HG SER A 39 26.049 9.730 13.718 1.00 0.00 H ATOM 589 H SER A 39 25.095 6.181 13.244 1.00 0.00 H ATOM 590 N TYR A 40 27.210 7.278 10.006 1.00 38.08 N ATOM 591 CA TYR A 40 28.522 6.837 9.584 1.00 36.64 C ATOM 592 C TYR A 40 29.270 7.974 8.928 1.00 35.85 C ATOM 593 O TYR A 40 28.670 8.899 8.371 1.00 35.71 O ATOM 594 CB TYR A 40 28.417 5.679 8.595 1.00 37.63 C ATOM 595 CG TYR A 40 27.548 4.537 9.052 1.00 41.89 C ATOM 596 CD1 TYR A 40 26.176 4.571 8.852 1.00 44.59 C ATOM 597 CD2 TYR A 40 28.100 3.412 9.662 1.00 43.64 C ATOM 598 CE1 TYR A 40 25.370 3.529 9.252 1.00 46.36 C ATOM 599 CE2 TYR A 40 27.298 2.357 10.069 1.00 46.13 C ATOM 600 CZ TYR A 40 25.932 2.425 9.860 1.00 47.26 C ATOM 601 OH TYR A 40 25.114 1.393 10.254 1.00 49.38 O ATOM 602 HA TYR A 40 29.061 6.502 10.470 1.00 0.00 H ATOM 603 HB3 TYR A 40 29.420 5.292 8.417 1.00 0.00 H ATOM 604 HB2 TYR A 40 28.007 6.065 7.662 1.00 0.00 H ATOM 605 HD2 TYR A 40 29.177 3.361 9.821 1.00 0.00 H ATOM 606 HE2 TYR A 40 27.739 1.483 10.549 1.00 0.00 H ATOM 607 HE1 TYR A 40 24.293 3.576 9.089 1.00 0.00 H ATOM 608 HD1 TYR A 40 25.727 5.439 8.369 1.00 0.00 H ATOM 609 HH TYR A 40 24.176 1.612 10.027 1.00 0.00 H ATOM 610 H TYR A 40 26.646 7.880 9.372 1.00 0.00 H ATOM 611 N ARG A 41 30.592 7.890 9.000 1.00 35.59 N ATOM 612 CA ARG A 41 31.468 8.845 8.355 1.00 38.46 C ATOM 613 C ARG A 41 32.303 8.108 7.319 1.00 40.01 C ATOM 614 O ARG A 41 32.742 6.972 7.548 1.00 41.90 O ATOM 615 CB ARG A 41 32.404 9.490 9.379 1.00 40.09 C ATOM 616 CG ARG A 41 31.962 10.848 9.937 1.00 42.72 C ATOM 617 CD ARG A 41 30.699 10.762 10.781 1.00 43.12 C ATOM 618 NE ARG A 41 30.737 9.689 11.772 1.00 42.26 N ATOM 619 CZ ARG A 41 29.670 9.269 12.443 1.00 43.57 C ATOM 620 NH1 ARG A 41 28.486 9.833 12.225 1.00 44.70 N ATOM 621 NH2 ARG A 41 29.780 8.282 13.322 1.00 43.00 N ATOM 622 HA ARG A 41 30.868 9.625 7.887 1.00 0.00 H ATOM 623 HB2 ARG A 41 32.505 8.802 10.218 1.00 0.00 H ATOM 624 HB3 ARG A 41 33.375 9.625 8.903 1.00 0.00 H ATOM 625 HG2 ARG A 41 32.766 11.248 10.555 1.00 0.00 H ATOM 626 HG3 ARG A 41 31.776 11.523 9.102 1.00 0.00 H ATOM 627 HD2 ARG A 41 29.851 10.591 10.118 1.00 0.00 H ATOM 628 HD3 ARG A 41 30.566 11.710 11.302 1.00 0.00 H ATOM 629 HE ARG A 41 31.650 9.229 11.963 1.00 0.00 H ATOM 630 HH12 ARG A 41 27.650 9.506 12.749 1.00 0.00 H ATOM 631 HH11 ARG A 41 28.396 10.602 11.530 1.00 0.00 H ATOM 632 HH22 ARG A 41 28.942 7.956 13.845 1.00 0.00 H ATOM 633 HH21 ARG A 41 30.704 7.834 13.488 1.00 0.00 H ATOM 634 H ARG A 41 31.015 7.108 9.540 1.00 0.00 H ATOM 635 N LYS A 42 32.537 8.757 6.187 1.00 38.74 N ATOM 636 CA LYS A 42 33.391 8.182 5.158 1.00 39.94 C ATOM 637 C LYS A 42 34.151 9.263 4.395 1.00 41.39 C ATOM 638 O LYS A 42 33.568 10.258 3.955 1.00 39.68 O ATOM 639 CB LYS A 42 32.559 7.342 4.187 1.00 42.14 C ATOM 640 CG LYS A 42 33.395 6.602 3.162 1.00 43.99 C ATOM 641 CD LYS A 42 32.519 5.879 2.163 1.00 46.20 C ATOM 642 CE LYS A 42 33.354 5.037 1.222 1.00 49.17 C ATOM 643 NZ LYS A 42 34.017 3.939 1.962 1.00 50.40 N ATOM 644 HA LYS A 42 34.122 7.542 5.652 1.00 0.00 H ATOM 645 HB2 LYS A 42 31.990 6.611 4.762 1.00 0.00 H ATOM 646 HB3 LYS A 42 31.871 8.003 3.660 1.00 0.00 H ATOM 647 HG2 LYS A 42 34.024 7.317 2.632 1.00 0.00 H ATOM 648 HG3 LYS A 42 34.026 5.875 3.674 1.00 0.00 H ATOM 649 HD2 LYS A 42 31.824 5.233 2.699 1.00 0.00 H ATOM 650 HD3 LYS A 42 31.958 6.612 1.584 1.00 0.00 H ATOM 651 HE2 LYS A 42 34.113 5.665 0.755 1.00 0.00 H ATOM 652 HE3 LYS A 42 32.710 4.613 0.451 1.00 0.00 H ATOM 653 HZ1 LYS A 42 34.634 4.341 2.696 1.00 0.00 H ATOM 654 HZ2 LYS A 42 33.295 3.336 2.406 1.00 0.00 H ATOM 655 HZ3 LYS A 42 34.586 3.371 1.302 1.00 0.00 H ATOM 656 H LYS A 42 32.104 9.690 6.032 1.00 0.00 H ATOM 657 N GLN A 43 35.458 9.066 4.253 1.00 43.16 N ATOM 658 CA GLN A 43 36.279 9.942 3.429 1.00 46.56 C ATOM 659 C GLN A 43 36.315 9.404 2.008 1.00 46.90 C ATOM 660 O GLN A 43 36.714 8.258 1.785 1.00 48.10 O ATOM 661 CB GLN A 43 37.714 9.993 3.950 1.00 50.35 C ATOM 662 CG GLN A 43 37.888 10.522 5.355 1.00 55.60 C ATOM 663 CD GLN A 43 39.359 10.665 5.718 1.00 60.18 C ATOM 664 OE1 GLN A 43 40.159 11.173 4.931 1.00 60.26 O ATOM 665 NE2 GLN A 43 39.724 10.199 6.904 1.00 62.95 N ATOM 666 HA GLN A 43 35.846 10.942 3.459 1.00 0.00 H ATOM 667 HB2 GLN A 43 38.116 8.980 3.922 1.00 0.00 H ATOM 668 HB3 GLN A 43 38.291 10.630 3.279 1.00 0.00 H ATOM 669 HG2 GLN A 43 37.408 11.498 5.428 1.00 0.00 H ATOM 670 HG3 GLN A 43 37.415 9.833 6.055 1.00 0.00 H ATOM 671 HE22 GLN A 43 39.015 9.778 7.538 1.00 0.00 H ATOM 672 HE21 GLN A 43 40.719 10.255 7.201 1.00 0.00 H ATOM 673 H GLN A 43 35.906 8.265 4.743 1.00 0.00 H ATOM 674 N VAL A 44 35.916 10.231 1.050 1.00 46.82 N ATOM 675 CA VAL A 44 35.931 9.837 -0.352 1.00 48.81 C ATOM 676 C VAL A 44 36.354 11.005 -1.226 1.00 49.96 C ATOM 677 O VAL A 44 36.182 12.166 -0.852 1.00 50.48 O ATOM 678 CB VAL A 44 34.545 9.351 -0.836 1.00 50.39 C ATOM 679 CG1 VAL A 44 34.039 8.218 0.033 1.00 52.09 C ATOM 680 CG2 VAL A 44 33.552 10.506 -0.849 1.00 50.50 C ATOM 681 HA VAL A 44 36.642 9.015 -0.436 1.00 0.00 H ATOM 682 HB VAL A 44 34.649 8.975 -1.854 1.00 0.00 H ATOM 683 HG11 VAL A 44 34.740 7.385 -0.014 1.00 0.00 H ATOM 684 HG12 VAL A 44 33.951 8.563 1.063 1.00 0.00 H ATOM 685 HG13 VAL A 44 33.063 7.893 -0.327 1.00 0.00 H ATOM 686 HG21 VAL A 44 33.455 10.911 0.158 1.00 0.00 H ATOM 687 HG22 VAL A 44 33.911 11.284 -1.522 1.00 0.00 H ATOM 688 HG23 VAL A 44 32.582 10.146 -1.192 1.00 0.00 H ATOM 689 H VAL A 44 35.585 11.183 1.306 1.00 0.00 H ATOM 690 N VAL A 45 36.915 10.687 -2.388 1.00 49.44 N ATOM 691 CA VAL A 45 37.265 11.697 -3.374 1.00 50.11 C ATOM 692 C VAL A 45 36.240 11.663 -4.495 1.00 50.35 C ATOM 693 O VAL A 45 36.026 10.627 -5.126 1.00 51.46 O ATOM 694 CB VAL A 45 38.667 11.465 -3.964 1.00 50.89 C ATOM 695 CG1 VAL A 45 38.962 12.497 -5.038 1.00 51.71 C ATOM 696 CG2 VAL A 45 39.714 11.513 -2.870 1.00 50.42 C ATOM 697 HA VAL A 45 37.270 12.668 -2.878 1.00 0.00 H ATOM 698 HB VAL A 45 38.697 10.476 -4.421 1.00 0.00 H ATOM 699 HG11 VAL A 45 38.221 12.414 -5.833 1.00 0.00 H ATOM 700 HG12 VAL A 45 38.918 13.495 -4.603 1.00 0.00 H ATOM 701 HG13 VAL A 45 39.957 12.320 -5.446 1.00 0.00 H ATOM 702 HG21 VAL A 45 39.688 12.490 -2.387 1.00 0.00 H ATOM 703 HG22 VAL A 45 39.505 10.737 -2.134 1.00 0.00 H ATOM 704 HG23 VAL A 45 40.700 11.347 -3.305 1.00 0.00 H ATOM 705 H VAL A 45 37.109 9.687 -2.598 1.00 0.00 H ATOM 706 N ILE A 46 35.600 12.802 -4.727 1.00 49.19 N ATOM 707 CA ILE A 46 34.556 12.910 -5.733 1.00 49.46 C ATOM 708 C ILE A 46 34.911 14.056 -6.666 1.00 50.45 C ATOM 709 O ILE A 46 35.045 15.197 -6.227 1.00 49.62 O ATOM 710 CB ILE A 46 33.183 13.178 -5.076 1.00 47.81 C ATOM 711 CG1 ILE A 46 32.901 12.134 -3.991 1.00 47.22 C ATOM 712 CG2 ILE A 46 32.076 13.193 -6.123 1.00 47.58 C ATOM 713 CD1 ILE A 46 31.566 12.317 -3.270 1.00 44.18 C ATOM 714 HA ILE A 46 34.486 11.973 -6.286 1.00 0.00 H ATOM 715 HB ILE A 46 33.209 14.161 -4.606 1.00 0.00 H ATOM 716 HG12 ILE A 46 32.905 11.148 -4.457 1.00 0.00 H ATOM 717 HG13 ILE A 46 33.699 12.188 -3.250 1.00 0.00 H ATOM 718 HD11 ILE A 46 31.547 13.293 -2.785 1.00 0.00 H ATOM 719 HD12 ILE A 46 30.752 12.253 -3.993 1.00 0.00 H ATOM 720 HD13 ILE A 46 31.450 11.535 -2.520 1.00 0.00 H ATOM 721 HG21 ILE A 46 32.277 13.979 -6.851 1.00 0.00 H ATOM 722 HG22 ILE A 46 32.042 12.228 -6.628 1.00 0.00 H ATOM 723 HG23 ILE A 46 31.120 13.383 -5.636 1.00 0.00 H ATOM 724 H ILE A 46 35.853 13.644 -4.172 1.00 0.00 H ATOM 725 N ASP A 47 35.078 13.747 -7.949 1.00 53.26 N ATOM 726 CA ASP A 47 35.453 14.752 -8.943 1.00 56.12 C ATOM 727 C ASP A 47 36.737 15.484 -8.565 1.00 57.15 C ATOM 728 O ASP A 47 36.853 16.696 -8.758 1.00 58.00 O ATOM 729 CB ASP A 47 34.322 15.760 -9.144 1.00 57.46 C ATOM 730 CG ASP A 47 33.064 15.120 -9.677 1.00 59.38 C ATOM 731 OD1 ASP A 47 33.172 14.074 -10.355 1.00 61.35 O ATOM 732 OD2 ASP A 47 31.970 15.661 -9.419 1.00 57.96 O ATOM 733 HA ASP A 47 35.635 14.221 -9.877 1.00 0.00 H ATOM 734 HB2 ASP A 47 34.097 16.229 -8.186 1.00 0.00 H ATOM 735 HB3 ASP A 47 34.653 16.521 -9.850 1.00 0.00 H ATOM 736 H ASP A 47 34.938 12.763 -8.254 1.00 0.00 H ATOM 737 N GLY A 48 37.695 14.744 -8.020 1.00 56.68 N ATOM 738 CA GLY A 48 38.983 15.316 -7.673 1.00 57.10 C ATOM 739 C GLY A 48 38.963 16.136 -6.397 1.00 57.51 C ATOM 740 O GLY A 48 39.943 16.804 -6.068 1.00 59.16 O ATOM 741 HA3 GLY A 48 39.305 15.960 -8.491 1.00 0.00 H ATOM 742 HA2 GLY A 48 39.698 14.503 -7.549 1.00 0.00 H ATOM 743 H GLY A 48 37.519 13.735 -7.838 1.00 0.00 H ATOM 744 N GLU A 49 37.846 16.094 -5.677 1.00 56.83 N ATOM 745 CA GLU A 49 37.740 16.792 -4.398 1.00 56.26 C ATOM 746 C GLU A 49 37.592 15.820 -3.231 1.00 53.98 C ATOM 747 O GLU A 49 36.897 14.807 -3.336 1.00 54.48 O ATOM 748 CB GLU A 49 36.566 17.776 -4.409 1.00 60.73 C ATOM 749 CG GLU A 49 36.150 18.243 -3.019 1.00 63.21 C ATOM 750 CD GLU A 49 35.007 19.237 -3.043 1.00 66.72 C ATOM 751 OE1 GLU A 49 35.187 20.346 -3.594 1.00 69.47 O ATOM 752 OE2 GLU A 49 33.926 18.910 -2.510 1.00 66.37 O ATOM 753 HA GLU A 49 38.668 17.346 -4.260 1.00 0.00 H ATOM 754 HB2 GLU A 49 36.853 18.649 -4.995 1.00 0.00 H ATOM 755 HB3 GLU A 49 35.712 17.289 -4.879 1.00 0.00 H ATOM 756 HG2 GLU A 49 35.842 17.373 -2.438 1.00 0.00 H ATOM 757 HG3 GLU A 49 37.009 18.713 -2.539 1.00 0.00 H ATOM 758 H GLU A 49 37.031 15.553 -6.031 1.00 0.00 H ATOM 759 N THR A 50 38.236 16.141 -2.113 1.00 52.42 N ATOM 760 CA THR A 50 38.173 15.295 -0.922 1.00 52.12 C ATOM 761 C THR A 50 36.965 15.623 -0.047 1.00 50.85 C ATOM 762 O THR A 50 36.837 16.731 0.479 1.00 52.71 O ATOM 763 CB THR A 50 39.463 15.392 -0.090 1.00 54.92 C ATOM 764 OG1 THR A 50 40.559 14.866 -0.849 1.00 55.45 O ATOM 765 CG2 THR A 50 39.323 14.598 1.204 1.00 55.95 C ATOM 766 HA THR A 50 38.064 14.271 -1.280 1.00 0.00 H ATOM 767 HB THR A 50 39.645 16.439 0.154 1.00 0.00 H ATOM 768 HG1 THR A 50 41.390 14.928 -0.314 1.00 0.00 H ATOM 769 HG23 THR A 50 38.490 14.995 1.784 1.00 0.00 H ATOM 770 HG21 THR A 50 39.136 13.551 0.968 1.00 0.00 H ATOM 771 HG22 THR A 50 40.243 14.683 1.782 1.00 0.00 H ATOM 772 H THR A 50 38.798 17.015 -2.085 1.00 0.00 H ATOM 773 N CYS A 51 36.088 14.638 0.115 1.00 48.60 N ATOM 774 CA CYS A 51 34.825 14.830 0.815 1.00 47.11 C ATOM 775 C CYS A 51 34.761 13.982 2.066 1.00 47.40 C ATOM 776 O CYS A 51 35.144 12.809 2.062 1.00 50.91 O ATOM 777 CB CYS A 51 33.652 14.445 -0.086 1.00 46.35 C ATOM 778 SG CYS A 51 33.658 15.243 -1.685 1.00 50.41 S ATOM 779 HA CYS A 51 34.761 15.884 1.086 1.00 0.00 H ATOM 780 HB2 CYS A 51 32.727 14.712 0.425 1.00 0.00 H ATOM 781 HB3 CYS A 51 33.681 13.367 -0.242 1.00 0.00 H ATOM 782 HG CYS A 51 34.813 14.907 -2.361 1.00 0.00 H ATOM 783 H CYS A 51 36.311 13.698 -0.271 1.00 0.00 H ATOM 784 N LEU A 52 34.278 14.589 3.139 1.00 42.59 N ATOM 785 CA LEU A 52 33.961 13.856 4.346 1.00 41.36 C ATOM 786 C LEU A 52 32.453 13.705 4.379 1.00 39.79 C ATOM 787 O LEU A 52 31.733 14.683 4.585 1.00 40.70 O ATOM 788 CB LEU A 52 34.438 14.623 5.576 1.00 46.07 C ATOM 789 CG LEU A 52 34.089 13.973 6.915 1.00 50.51 C ATOM 790 CD1 LEU A 52 34.399 12.478 6.883 1.00 51.25 C ATOM 791 CD2 LEU A 52 34.831 14.659 8.056 1.00 52.03 C ATOM 792 HA LEU A 52 34.456 12.885 4.353 1.00 0.00 H ATOM 793 HB2 LEU A 52 35.522 14.717 5.517 1.00 0.00 H ATOM 794 HB3 LEU A 52 33.987 15.615 5.553 1.00 0.00 H ATOM 795 HG LEU A 52 33.020 14.094 7.088 1.00 0.00 H ATOM 796 HD21 LEU A 52 35.905 14.574 7.892 1.00 0.00 H ATOM 797 HD22 LEU A 52 34.549 15.711 8.090 1.00 0.00 H ATOM 798 HD23 LEU A 52 34.567 14.180 8.999 1.00 0.00 H ATOM 799 HD11 LEU A 52 33.813 12.004 6.096 1.00 0.00 H ATOM 800 HD12 LEU A 52 35.461 12.333 6.685 1.00 0.00 H ATOM 801 HD13 LEU A 52 34.143 12.035 7.845 1.00 0.00 H ATOM 802 H LEU A 52 34.123 15.617 3.114 1.00 0.00 H ATOM 803 N LEU A 53 31.973 12.487 4.157 1.00 37.64 N ATOM 804 CA LEU A 53 30.537 12.242 4.194 1.00 37.83 C ATOM 805 C LEU A 53 30.122 11.883 5.610 1.00 37.54 C ATOM 806 O LEU A 53 30.739 11.040 6.265 1.00 39.21 O ATOM 807 CB LEU A 53 30.138 11.130 3.224 1.00 36.95 C ATOM 808 CG LEU A 53 30.632 11.285 1.786 1.00 40.56 C ATOM 809 CD1 LEU A 53 30.041 10.202 0.897 1.00 41.70 C ATOM 810 CD2 LEU A 53 30.311 12.674 1.241 1.00 38.65 C ATOM 811 HA LEU A 53 30.022 13.151 3.883 1.00 0.00 H ATOM 812 HB2 LEU A 53 30.532 10.191 3.613 1.00 0.00 H ATOM 813 HB3 LEU A 53 29.049 11.083 3.200 1.00 0.00 H ATOM 814 HG LEU A 53 31.716 11.172 1.787 1.00 0.00 H ATOM 815 HD21 LEU A 53 29.232 12.829 1.258 1.00 0.00 H ATOM 816 HD22 LEU A 53 30.798 13.427 1.860 1.00 0.00 H ATOM 817 HD23 LEU A 53 30.675 12.754 0.217 1.00 0.00 H ATOM 818 HD11 LEU A 53 30.341 9.223 1.271 1.00 0.00 H ATOM 819 HD12 LEU A 53 28.954 10.278 0.908 1.00 0.00 H ATOM 820 HD13 LEU A 53 30.406 10.331 -0.122 1.00 0.00 H ATOM 821 H LEU A 53 32.626 11.703 3.955 1.00 0.00 H ATOM 822 N ASP A 54 29.095 12.559 6.095 1.00 35.87 N ATOM 823 CA ASP A 54 28.537 12.251 7.399 1.00 35.95 C ATOM 824 C ASP A 54 27.091 11.888 7.142 1.00 32.09 C ATOM 825 O ASP A 54 26.290 12.751 6.803 1.00 32.41 O ATOM 826 CB ASP A 54 28.633 13.460 8.327 1.00 41.63 C ATOM 827 CG ASP A 54 28.405 13.095 9.779 1.00 46.48 C ATOM 828 OD1 ASP A 54 27.723 12.080 10.042 1.00 46.29 O ATOM 829 OD2 ASP A 54 28.911 13.823 10.660 1.00 50.50 O ATOM 830 HA ASP A 54 29.077 11.440 7.888 1.00 0.00 H ATOM 831 HB2 ASP A 54 29.626 13.899 8.228 1.00 0.00 H ATOM 832 HB3 ASP A 54 27.882 14.191 8.028 1.00 0.00 H ATOM 833 H ASP A 54 28.678 13.327 5.531 1.00 0.00 H ATOM 834 N ILE A 55 26.769 10.604 7.288 1.00 31.66 N ATOM 835 CA ILE A 55 25.503 10.067 6.807 1.00 31.43 C ATOM 836 C ILE A 55 24.626 9.565 7.944 1.00 32.06 C ATOM 837 O ILE A 55 25.044 8.734 8.751 1.00 34.42 O ATOM 838 CB ILE A 55 25.745 8.915 5.801 1.00 28.37 C ATOM 839 CG1 ILE A 55 26.622 9.411 4.650 1.00 30.14 C ATOM 840 CG2 ILE A 55 24.416 8.365 5.269 1.00 26.60 C ATOM 841 CD1 ILE A 55 27.303 8.311 3.859 1.00 32.39 C ATOM 842 HA ILE A 55 24.982 10.886 6.310 1.00 0.00 H ATOM 843 HB ILE A 55 26.259 8.103 6.315 1.00 0.00 H ATOM 844 HG12 ILE A 55 25.995 9.984 3.967 1.00 0.00 H ATOM 845 HG13 ILE A 55 27.393 10.060 5.065 1.00 0.00 H ATOM 846 HD11 ILE A 55 27.947 7.733 4.522 1.00 0.00 H ATOM 847 HD12 ILE A 55 26.547 7.657 3.424 1.00 0.00 H ATOM 848 HD13 ILE A 55 27.903 8.755 3.064 1.00 0.00 H ATOM 849 HG21 ILE A 55 23.822 7.986 6.101 1.00 0.00 H ATOM 850 HG22 ILE A 55 23.870 9.162 4.765 1.00 0.00 H ATOM 851 HG23 ILE A 55 24.614 7.557 4.565 1.00 0.00 H ATOM 852 H ILE A 55 27.441 9.966 7.759 1.00 0.00 H ATOM 853 N LEU A 56 23.406 10.077 8.005 1.00 29.95 N ATOM 854 CA LEU A 56 22.427 9.586 8.965 1.00 31.65 C ATOM 855 C LEU A 56 21.461 8.615 8.298 1.00 30.92 C ATOM 856 O LEU A 56 20.784 8.968 7.332 1.00 30.35 O ATOM 857 CB LEU A 56 21.635 10.742 9.567 1.00 31.98 C ATOM 858 CG LEU A 56 20.597 10.311 10.602 1.00 34.88 C ATOM 859 CD1 LEU A 56 21.269 9.732 11.840 1.00 37.61 C ATOM 860 CD2 LEU A 56 19.700 11.475 10.963 1.00 35.16 C ATOM 861 HA LEU A 56 22.970 9.070 9.757 1.00 0.00 H ATOM 862 HB2 LEU A 56 22.336 11.425 10.048 1.00 0.00 H ATOM 863 HB3 LEU A 56 21.119 11.262 8.760 1.00 0.00 H ATOM 864 HG LEU A 56 19.980 9.526 10.165 1.00 0.00 H ATOM 865 HD21 LEU A 56 20.304 12.282 11.378 1.00 0.00 H ATOM 866 HD22 LEU A 56 19.186 11.827 10.068 1.00 0.00 H ATOM 867 HD23 LEU A 56 18.966 11.151 11.701 1.00 0.00 H ATOM 868 HD11 LEU A 56 21.863 8.863 11.557 1.00 0.00 H ATOM 869 HD12 LEU A 56 21.917 10.486 12.287 1.00 0.00 H ATOM 870 HD13 LEU A 56 20.507 9.434 12.560 1.00 0.00 H ATOM 871 H LEU A 56 23.142 10.845 7.355 1.00 0.00 H ATOM 872 N ASP A 57 21.413 7.395 8.822 1.00 31.80 N ATOM 873 CA ASP A 57 20.525 6.346 8.331 1.00 33.78 C ATOM 874 C ASP A 57 19.281 6.288 9.219 1.00 35.66 C ATOM 875 O ASP A 57 19.318 5.705 10.300 1.00 38.78 O ATOM 876 CB ASP A 57 21.277 5.011 8.347 1.00 34.16 C ATOM 877 CG ASP A 57 20.390 3.822 8.060 1.00 38.03 C ATOM 878 OD1 ASP A 57 19.391 3.978 7.330 1.00 37.99 O ATOM 879 OD2 ASP A 57 20.706 2.721 8.567 1.00 39.36 O ATOM 880 HA ASP A 57 20.210 6.556 7.309 1.00 0.00 H ATOM 881 HB2 ASP A 57 22.063 5.047 7.592 1.00 0.00 H ATOM 882 HB3 ASP A 57 21.726 4.878 9.331 1.00 0.00 H ATOM 883 H ASP A 57 22.040 7.176 9.623 1.00 0.00 H ATOM 884 N THR A 58 18.188 6.905 8.774 1.00 32.11 N ATOM 885 CA THR A 58 17.016 7.090 9.638 1.00 34.94 C ATOM 886 C THR A 58 16.173 5.831 9.831 1.00 37.63 C ATOM 887 O THR A 58 16.162 4.945 8.981 1.00 37.47 O ATOM 888 CB THR A 58 16.098 8.238 9.148 1.00 35.33 C ATOM 889 OG1 THR A 58 15.484 7.884 7.896 1.00 33.39 O ATOM 890 CG2 THR A 58 16.891 9.528 8.994 1.00 36.18 C ATOM 891 HA THR A 58 17.446 7.350 10.605 1.00 0.00 H ATOM 892 HB THR A 58 15.318 8.396 9.892 1.00 0.00 H ATOM 893 HG1 THR A 58 16.188 7.720 7.219 1.00 0.00 H ATOM 894 HG23 THR A 58 17.351 9.786 9.948 1.00 0.00 H ATOM 895 HG21 THR A 58 17.667 9.389 8.241 1.00 0.00 H ATOM 896 HG22 THR A 58 16.221 10.330 8.683 1.00 0.00 H ATOM 897 H THR A 58 18.164 7.262 7.797 1.00 0.00 H ATOM 898 N ALA A 59 15.460 5.767 10.953 1.00 44.08 N ATOM 899 CA ALA A 59 14.541 4.659 11.223 1.00 52.08 C ATOM 900 C ALA A 59 13.176 5.169 11.684 1.00 59.67 C ATOM 901 O ALA A 59 13.044 5.674 12.799 1.00 61.84 O ATOM 902 CB ALA A 59 15.136 3.716 12.260 1.00 53.35 C ATOM 903 HA ALA A 59 14.395 4.110 10.293 1.00 0.00 H ATOM 904 HB1 ALA A 59 16.077 3.314 11.886 1.00 0.00 H ATOM 905 HB2 ALA A 59 15.315 4.263 13.186 1.00 0.00 H ATOM 906 HB3 ALA A 59 14.440 2.899 12.448 1.00 0.00 H ATOM 907 H ALA A 59 15.558 6.525 11.658 1.00 0.00 H ATOM 908 N GLY A 60 12.166 5.030 10.825 1.00 64.61 N ATOM 909 CA GLY A 60 10.830 5.537 11.106 1.00 67.60 C ATOM 910 C GLY A 60 10.243 6.314 9.935 1.00 71.00 C ATOM 911 O GLY A 60 10.603 6.071 8.779 1.00 71.45 O ATOM 912 HA3 GLY A 60 10.881 6.196 11.973 1.00 0.00 H ATOM 913 HA2 GLY A 60 10.176 4.694 11.330 1.00 0.00 H ATOM 914 H GLY A 60 12.338 4.542 9.923 1.00 0.00 H ATOM 915 N GLN A 61 9.338 7.248 10.234 1.00 72.74 N ATOM 916 CA GLN A 61 8.711 8.086 9.209 1.00 74.51 C ATOM 917 C GLN A 61 9.129 9.546 9.365 1.00 74.80 C ATOM 918 O GLN A 61 8.344 10.385 9.814 1.00 74.78 O ATOM 919 CB GLN A 61 7.180 7.976 9.272 1.00 75.33 C ATOM 920 CG GLN A 61 6.480 7.817 7.909 1.00 75.94 C ATOM 921 CD GLN A 61 6.173 9.140 7.206 1.00 75.88 C ATOM 922 OE1 GLN A 61 6.472 10.251 7.869 1.00 75.80 O ATOM 923 NE2 GLN A 61 5.664 9.154 6.081 1.00 75.52 N ATOM 924 HA GLN A 61 9.051 7.726 8.238 1.00 0.00 H ATOM 925 HB2 GLN A 61 6.928 7.110 9.884 1.00 0.00 H ATOM 926 HB3 GLN A 61 6.795 8.879 9.746 1.00 0.00 H ATOM 927 HG2 GLN A 61 7.125 7.226 7.259 1.00 0.00 H ATOM 928 HG3 GLN A 61 5.541 7.287 8.066 1.00 0.00 H ATOM 929 HE22 GLN A 61 5.446 8.259 5.598 1.00 0.00 H ATOM 930 HE21 GLN A 61 5.453 10.061 5.617 1.00 0.00 H ATOM 931 H GLN A 61 9.069 7.386 11.229 1.00 0.00 H TER 932 GLN A 61 ATOM 933 N SER A 65 8.701 14.763 15.060 1.00 89.66 N ATOM 934 CA SER A 65 9.124 14.704 16.456 1.00 89.74 C ATOM 935 C SER A 65 10.263 15.681 16.734 1.00 90.06 C ATOM 936 O SER A 65 10.651 16.465 15.865 1.00 89.92 O ATOM 937 CB SER A 65 9.554 13.283 16.834 1.00 89.44 C ATOM 938 OG SER A 65 10.949 13.100 16.650 1.00 89.01 O ATOM 939 HA SER A 65 8.269 14.991 17.068 1.00 0.00 H ATOM 940 HB2 SER A 65 9.017 12.571 16.208 1.00 0.00 H ATOM 941 HB3 SER A 65 9.307 13.104 17.880 1.00 0.00 H ATOM 942 HG SER A 65 11.195 12.175 16.902 1.00 0.00 H ATOM 943 HN3 SER A 65 9.504 14.519 14.445 1.00 0.00 H ATOM 944 HN2 SER A 65 8.373 15.725 14.839 1.00 0.00 H ATOM 945 HN1 SER A 65 7.926 14.087 14.905 1.00 0.00 H ATOM 946 N ALA A 66 10.796 15.623 17.951 1.00 89.84 N ATOM 947 CA ALA A 66 11.883 16.502 18.364 1.00 88.80 C ATOM 948 C ALA A 66 13.242 15.835 18.174 1.00 87.26 C ATOM 949 O ALA A 66 14.240 16.254 18.759 1.00 88.76 O ATOM 950 CB ALA A 66 11.697 16.929 19.807 1.00 88.90 C ATOM 951 HA ALA A 66 11.857 17.388 17.729 1.00 0.00 H ATOM 952 HB1 ALA A 66 10.751 17.461 19.908 1.00 0.00 H ATOM 953 HB2 ALA A 66 11.690 16.047 20.447 1.00 0.00 H ATOM 954 HB3 ALA A 66 12.517 17.585 20.099 1.00 0.00 H ATOM 955 H ALA A 66 10.425 14.928 18.630 1.00 0.00 H ATOM 956 N MET A 67 13.266 14.784 17.364 1.00 84.51 N ATOM 957 CA MET A 67 14.514 14.166 16.939 1.00 82.07 C ATOM 958 C MET A 67 14.583 14.328 15.430 1.00 75.85 C ATOM 959 O MET A 67 15.636 14.631 14.867 1.00 75.04 O ATOM 960 CB MET A 67 14.531 12.678 17.297 1.00 85.57 C ATOM 961 CG MET A 67 14.306 11.759 16.097 1.00 88.74 C ATOM 962 SD MET A 67 13.653 10.124 16.493 1.00 91.35 S ATOM 963 CE MET A 67 15.127 9.290 17.080 1.00 91.99 C ATOM 964 HA MET A 67 15.364 14.634 17.435 1.00 0.00 H ATOM 965 HB2 MET A 67 15.499 12.440 17.737 1.00 0.00 H ATOM 966 HB3 MET A 67 13.745 12.490 18.028 1.00 0.00 H ATOM 967 HG2 MET A 67 15.261 11.627 15.589 1.00 0.00 H ATOM 968 HG3 MET A 67 13.603 12.249 15.424 1.00 0.00 H ATOM 969 HE1 MET A 67 15.876 9.277 16.288 1.00 0.00 H ATOM 970 HE2 MET A 67 15.522 9.820 17.947 1.00 0.00 H ATOM 971 HE3 MET A 67 14.876 8.267 17.361 1.00 0.00 H ATOM 972 H MET A 67 12.366 14.390 17.022 1.00 0.00 H ATOM 973 N ARG A 68 13.432 14.139 14.790 1.00 69.61 N ATOM 974 CA ARG A 68 13.319 14.193 13.342 1.00 64.83 C ATOM 975 C ARG A 68 13.624 15.592 12.838 1.00 57.21 C ATOM 976 O ARG A 68 14.389 15.769 11.892 1.00 56.85 O ATOM 977 CB ARG A 68 11.909 13.792 12.902 1.00 67.42 C ATOM 978 CG ARG A 68 11.369 12.533 13.560 1.00 70.92 C ATOM 979 CD ARG A 68 9.881 12.359 13.262 1.00 73.16 C ATOM 980 NE ARG A 68 9.314 11.177 13.909 1.00 74.85 N ATOM 981 CZ ARG A 68 8.041 10.803 13.803 1.00 75.94 C ATOM 982 NH1 ARG A 68 7.195 11.519 13.073 1.00 76.20 N ATOM 983 NH2 ARG A 68 7.613 9.712 14.426 1.00 76.12 N ATOM 984 HA ARG A 68 14.041 13.494 12.919 1.00 0.00 H ATOM 985 HB2 ARG A 68 11.233 14.614 13.138 1.00 0.00 H ATOM 986 HB3 ARG A 68 11.923 13.632 11.824 1.00 0.00 H ATOM 987 HG2 ARG A 68 11.913 11.669 13.179 1.00 0.00 H ATOM 988 HG3 ARG A 68 11.512 12.604 14.638 1.00 0.00 H ATOM 989 HD2 ARG A 68 9.749 12.265 12.184 1.00 0.00 H ATOM 990 HD3 ARG A 68 9.348 13.241 13.616 1.00 0.00 H ATOM 991 HE ARG A 68 9.946 10.590 14.490 1.00 0.00 H ATOM 992 HH12 ARG A 68 6.201 11.225 12.992 1.00 0.00 H ATOM 993 HH11 ARG A 68 7.526 12.374 12.582 1.00 0.00 H ATOM 994 HH22 ARG A 68 6.618 9.422 14.342 1.00 0.00 H ATOM 995 HH21 ARG A 68 8.273 9.147 14.998 1.00 0.00 H ATOM 996 H ARG A 68 12.577 13.944 15.349 1.00 0.00 H ATOM 997 N ASP A 69 13.016 16.585 13.477 1.00 50.87 N ATOM 998 CA ASP A 69 13.173 17.962 13.047 1.00 47.56 C ATOM 999 C ASP A 69 14.642 18.379 13.078 1.00 45.20 C ATOM 1000 O ASP A 69 15.137 18.968 12.117 1.00 43.68 O ATOM 1001 CB ASP A 69 12.309 18.898 13.903 1.00 49.59 C ATOM 1002 CG ASP A 69 10.822 18.810 13.558 1.00 52.70 C ATOM 1003 OD1 ASP A 69 10.434 17.922 12.760 1.00 53.61 O ATOM 1004 OD2 ASP A 69 10.038 19.629 14.089 1.00 53.81 O ATOM 1005 HA ASP A 69 12.830 18.040 12.015 1.00 0.00 H ATOM 1006 HB2 ASP A 69 12.440 18.632 14.952 1.00 0.00 H ATOM 1007 HB3 ASP A 69 12.644 19.923 13.745 1.00 0.00 H ATOM 1008 H ASP A 69 12.417 16.372 14.300 1.00 0.00 H ATOM 1009 N GLN A 70 15.339 18.067 14.171 1.00 43.86 N ATOM 1010 CA GLN A 70 16.753 18.431 14.299 1.00 41.65 C ATOM 1011 C GLN A 70 17.615 17.829 13.187 1.00 42.06 C ATOM 1012 O GLN A 70 18.422 18.525 12.567 1.00 40.17 O ATOM 1013 CB GLN A 70 17.322 18.057 15.680 1.00 43.17 C ATOM 1014 CG GLN A 70 18.821 18.370 15.833 1.00 44.32 C ATOM 1015 CD GLN A 70 19.321 18.353 17.284 1.00 47.01 C ATOM 1016 OE1 GLN A 70 18.630 18.796 18.203 1.00 50.44 O ATOM 1017 NE2 GLN A 70 20.535 17.850 17.484 1.00 46.06 N ATOM 1018 HA GLN A 70 16.792 19.516 14.197 1.00 0.00 H ATOM 1019 HB2 GLN A 70 16.774 18.613 16.441 1.00 0.00 H ATOM 1020 HB3 GLN A 70 17.175 16.988 15.836 1.00 0.00 H ATOM 1021 HG2 GLN A 70 19.385 17.628 15.268 1.00 0.00 H ATOM 1022 HG3 GLN A 70 19.008 19.360 15.418 1.00 0.00 H ATOM 1023 HE22 GLN A 70 21.086 17.486 16.680 1.00 0.00 H ATOM 1024 HE21 GLN A 70 20.934 17.820 18.444 1.00 0.00 H ATOM 1025 H GLN A 70 14.871 17.556 14.947 1.00 0.00 H ATOM 1026 N TYR A 71 17.459 16.537 12.923 1.00 43.13 N ATOM 1027 CA TYR A 71 18.296 15.936 11.886 1.00 43.92 C ATOM 1028 C TYR A 71 17.961 16.455 10.484 1.00 40.92 C ATOM 1029 O TYR A 71 18.843 16.564 9.631 1.00 41.62 O ATOM 1030 CB TYR A 71 18.341 14.399 11.967 1.00 46.83 C ATOM 1031 CG TYR A 71 17.129 13.635 11.473 1.00 49.64 C ATOM 1032 CD1 TYR A 71 16.396 12.833 12.341 1.00 51.29 C ATOM 1033 CD2 TYR A 71 16.750 13.666 10.133 1.00 50.25 C ATOM 1034 CE1 TYR A 71 15.302 12.108 11.897 1.00 52.26 C ATOM 1035 CE2 TYR A 71 15.651 12.948 9.682 1.00 51.53 C ATOM 1036 CZ TYR A 71 14.933 12.171 10.570 1.00 52.91 C ATOM 1037 OH TYR A 71 13.842 11.452 10.132 1.00 55.53 O ATOM 1038 HA TYR A 71 19.314 16.268 12.091 1.00 0.00 H ATOM 1039 HB3 TYR A 71 18.492 14.131 13.013 1.00 0.00 H ATOM 1040 HB2 TYR A 71 19.198 14.066 11.381 1.00 0.00 H ATOM 1041 HD2 TYR A 71 17.326 14.264 9.427 1.00 0.00 H ATOM 1042 HE2 TYR A 71 15.356 12.997 8.634 1.00 0.00 H ATOM 1043 HE1 TYR A 71 14.735 11.490 12.594 1.00 0.00 H ATOM 1044 HD1 TYR A 71 16.687 12.774 13.390 1.00 0.00 H ATOM 1045 HH TYR A 71 13.168 12.073 9.758 1.00 0.00 H ATOM 1046 H TYR A 71 16.759 15.967 13.441 1.00 0.00 H ATOM 1047 N MET A 72 16.699 16.801 10.255 1.00 39.70 N ATOM 1048 CA MET A 72 16.312 17.403 8.981 1.00 37.55 C ATOM 1049 C MET A 72 16.900 18.814 8.836 1.00 37.12 C ATOM 1050 O MET A 72 17.304 19.222 7.746 1.00 38.17 O ATOM 1051 CB MET A 72 14.787 17.409 8.813 1.00 37.97 C ATOM 1052 CG MET A 72 14.202 16.055 8.391 1.00 41.37 C ATOM 1053 SD MET A 72 12.418 16.127 8.104 1.00 48.17 S ATOM 1054 CE MET A 72 12.330 17.551 7.059 1.00 51.04 C ATOM 1055 HA MET A 72 16.727 16.791 8.180 1.00 0.00 H ATOM 1056 HB2 MET A 72 14.338 17.696 9.764 1.00 0.00 H ATOM 1057 HB3 MET A 72 14.528 18.147 8.053 1.00 0.00 H ATOM 1058 HG2 MET A 72 14.400 15.328 9.179 1.00 0.00 H ATOM 1059 HG3 MET A 72 14.691 15.734 7.471 1.00 0.00 H ATOM 1060 HE1 MET A 72 12.728 18.415 7.591 1.00 0.00 H ATOM 1061 HE2 MET A 72 12.917 17.375 6.157 1.00 0.00 H ATOM 1062 HE3 MET A 72 11.291 17.737 6.787 1.00 0.00 H ATOM 1063 H MET A 72 15.980 16.642 10.989 1.00 0.00 H ATOM 1064 N ARG A 73 16.963 19.557 9.936 1.00 32.38 N ATOM 1065 CA ARG A 73 17.599 20.868 9.889 1.00 31.42 C ATOM 1066 C ARG A 73 19.102 20.721 9.642 1.00 33.73 C ATOM 1067 O ARG A 73 19.699 21.507 8.918 1.00 36.20 O ATOM 1068 CB ARG A 73 17.335 21.662 11.171 1.00 31.35 C ATOM 1069 CG ARG A 73 15.897 22.147 11.295 1.00 32.16 C ATOM 1070 CD ARG A 73 15.772 23.154 12.435 1.00 34.56 C ATOM 1071 NE ARG A 73 16.110 22.558 13.720 1.00 35.69 N ATOM 1072 CZ ARG A 73 15.219 22.055 14.564 1.00 38.94 C ATOM 1073 NH1 ARG A 73 15.621 21.528 15.713 1.00 38.82 N ATOM 1074 NH2 ARG A 73 13.922 22.084 14.258 1.00 41.27 N ATOM 1075 HA ARG A 73 17.162 21.426 9.061 1.00 0.00 H ATOM 1076 HB2 ARG A 73 17.560 21.024 12.026 1.00 0.00 H ATOM 1077 HB3 ARG A 73 17.995 22.529 11.183 1.00 0.00 H ATOM 1078 HG2 ARG A 73 15.596 22.622 10.361 1.00 0.00 H ATOM 1079 HG3 ARG A 73 15.246 21.296 11.494 1.00 0.00 H ATOM 1080 HD2 ARG A 73 14.746 23.519 12.474 1.00 0.00 H ATOM 1081 HD3 ARG A 73 16.446 23.989 12.244 1.00 0.00 H ATOM 1082 HE ARG A 73 17.113 22.525 13.993 1.00 0.00 H ATOM 1083 HH12 ARG A 73 14.924 21.133 16.376 1.00 0.00 H ATOM 1084 HH11 ARG A 73 16.633 21.510 15.951 1.00 0.00 H ATOM 1085 HH22 ARG A 73 13.223 21.690 14.919 1.00 0.00 H ATOM 1086 HH21 ARG A 73 13.609 22.501 13.358 1.00 0.00 H ATOM 1087 H ARG A 73 16.560 19.204 10.828 1.00 0.00 H ATOM 1088 N THR A 74 19.693 19.696 10.243 1.00 34.96 N ATOM 1089 CA THR A 74 21.132 19.433 10.119 1.00 37.79 C ATOM 1090 C THR A 74 21.537 19.022 8.695 1.00 38.29 C ATOM 1091 O THR A 74 22.570 19.459 8.172 1.00 38.39 O ATOM 1092 CB THR A 74 21.571 18.340 11.116 1.00 39.12 C ATOM 1093 OG1 THR A 74 21.176 18.716 12.447 1.00 41.03 O ATOM 1094 CG2 THR A 74 23.080 18.140 11.071 1.00 39.46 C ATOM 1095 HA THR A 74 21.640 20.369 10.350 1.00 0.00 H ATOM 1096 HB THR A 74 21.089 17.403 10.837 1.00 0.00 H ATOM 1097 HG1 THR A 74 20.192 18.818 12.481 1.00 0.00 H ATOM 1098 HG23 THR A 74 23.378 17.855 10.062 1.00 0.00 H ATOM 1099 HG21 THR A 74 23.577 19.069 11.349 1.00 0.00 H ATOM 1100 HG22 THR A 74 23.362 17.353 11.770 1.00 0.00 H ATOM 1101 H THR A 74 19.115 19.055 10.824 1.00 0.00 H ATOM 1102 N GLY A 75 20.720 18.186 8.066 1.00 37.56 N ATOM 1103 CA GLY A 75 21.059 17.642 6.760 1.00 36.54 C ATOM 1104 C GLY A 75 21.171 18.682 5.658 1.00 36.28 C ATOM 1105 O GLY A 75 20.357 19.609 5.583 1.00 38.12 O ATOM 1106 HA3 GLY A 75 20.287 16.927 6.477 1.00 0.00 H ATOM 1107 HA2 GLY A 75 22.016 17.127 6.842 1.00 0.00 H ATOM 1108 H GLY A 75 19.822 17.915 8.515 1.00 0.00 H ATOM 1109 N GLU A 76 22.180 18.525 4.801 1.00 35.27 N ATOM 1110 CA GLU A 76 22.371 19.408 3.653 1.00 35.97 C ATOM 1111 C GLU A 76 21.753 18.836 2.381 1.00 34.66 C ATOM 1112 O GLU A 76 21.392 19.574 1.472 1.00 37.72 O ATOM 1113 CB GLU A 76 23.857 19.652 3.404 1.00 39.07 C ATOM 1114 CG GLU A 76 24.575 20.397 4.501 1.00 43.70 C ATOM 1115 CD GLU A 76 26.071 20.448 4.247 1.00 47.99 C ATOM 1116 OE1 GLU A 76 26.789 19.554 4.741 1.00 48.56 O ATOM 1117 OE2 GLU A 76 26.526 21.372 3.539 1.00 51.52 O ATOM 1118 HA GLU A 76 21.870 20.346 3.895 1.00 0.00 H ATOM 1119 HB2 GLU A 76 24.342 18.684 3.279 1.00 0.00 H ATOM 1120 HB3 GLU A 76 23.955 20.228 2.484 1.00 0.00 H ATOM 1121 HG2 GLU A 76 24.188 21.415 4.551 1.00 0.00 H ATOM 1122 HG3 GLU A 76 24.393 19.893 5.450 1.00 0.00 H ATOM 1123 H GLU A 76 22.854 17.748 4.955 1.00 0.00 H ATOM 1124 N GLY A 77 21.666 17.515 2.309 1.00 30.83 N ATOM 1125 CA GLY A 77 21.065 16.852 1.166 1.00 27.77 C ATOM 1126 C GLY A 77 20.388 15.579 1.618 1.00 24.41 C ATOM 1127 O GLY A 77 20.768 14.990 2.635 1.00 25.75 O ATOM 1128 HA3 GLY A 77 21.839 16.613 0.437 1.00 0.00 H ATOM 1129 HA2 GLY A 77 20.328 17.513 0.709 1.00 0.00 H ATOM 1130 H GLY A 77 22.038 16.939 3.091 1.00 0.00 H ATOM 1131 N PHE A 78 19.394 15.140 0.851 1.00 22.25 N ATOM 1132 CA PHE A 78 18.570 14.011 1.253 1.00 22.35 C ATOM 1133 C PHE A 78 18.493 12.962 0.174 1.00 22.39 C ATOM 1134 O PHE A 78 18.184 13.260 -0.978 1.00 24.42 O ATOM 1135 CB PHE A 78 17.168 14.498 1.640 1.00 23.98 C ATOM 1136 CG PHE A 78 17.191 15.431 2.813 1.00 26.94 C ATOM 1137 CD1 PHE A 78 16.925 14.965 4.089 1.00 31.02 C ATOM 1138 CD2 PHE A 78 17.563 16.752 2.646 1.00 28.13 C ATOM 1139 CE1 PHE A 78 16.989 15.819 5.179 1.00 30.54 C ATOM 1140 CE2 PHE A 78 17.633 17.613 3.735 1.00 30.05 C ATOM 1141 CZ PHE A 78 17.342 17.146 4.999 1.00 30.95 C ATOM 1142 HA PHE A 78 19.037 13.545 2.121 1.00 0.00 H ATOM 1143 HB2 PHE A 78 16.730 15.017 0.788 1.00 0.00 H ATOM 1144 HB3 PHE A 78 16.554 13.633 1.892 1.00 0.00 H ATOM 1145 HD2 PHE A 78 17.804 17.122 1.650 1.00 0.00 H ATOM 1146 HE2 PHE A 78 17.917 18.655 3.590 1.00 0.00 H ATOM 1147 HZ PHE A 78 17.390 17.820 5.855 1.00 0.00 H ATOM 1148 HE1 PHE A 78 16.762 15.446 6.178 1.00 0.00 H ATOM 1149 HD1 PHE A 78 16.663 13.918 4.238 1.00 0.00 H ATOM 1150 H PHE A 78 19.202 15.614 -0.055 1.00 0.00 H ATOM 1151 N LEU A 79 18.800 11.732 0.560 1.00 21.18 N ATOM 1152 CA LEU A 79 18.633 10.590 -0.321 1.00 21.81 C ATOM 1153 C LEU A 79 17.257 10.031 -0.011 1.00 22.17 C ATOM 1154 O LEU A 79 17.034 9.501 1.080 1.00 22.78 O ATOM 1155 CB LEU A 79 19.699 9.540 -0.011 1.00 25.85 C ATOM 1156 CG LEU A 79 20.215 8.715 -1.181 1.00 28.19 C ATOM 1157 CD1 LEU A 79 20.934 9.610 -2.204 1.00 27.86 C ATOM 1158 CD2 LEU A 79 21.126 7.599 -0.669 1.00 29.83 C ATOM 1159 HA LEU A 79 18.731 10.868 -1.370 1.00 0.00 H ATOM 1160 HB2 LEU A 79 20.552 10.057 0.429 1.00 0.00 H ATOM 1161 HB3 LEU A 79 19.278 8.849 0.719 1.00 0.00 H ATOM 1162 HG LEU A 79 19.370 8.255 -1.693 1.00 0.00 H ATOM 1163 HD21 LEU A 79 21.971 8.037 -0.137 1.00 0.00 H ATOM 1164 HD22 LEU A 79 20.564 6.954 0.006 1.00 0.00 H ATOM 1165 HD23 LEU A 79 21.491 7.014 -1.513 1.00 0.00 H ATOM 1166 HD11 LEU A 79 20.238 10.360 -2.581 1.00 0.00 H ATOM 1167 HD12 LEU A 79 21.778 10.105 -1.723 1.00 0.00 H ATOM 1168 HD13 LEU A 79 21.294 8.998 -3.031 1.00 0.00 H ATOM 1169 H LEU A 79 19.171 11.581 1.520 1.00 0.00 H ATOM 1170 N CYS A 80 16.334 10.169 -0.961 1.00 21.94 N ATOM 1171 CA CYS A 80 14.944 9.765 -0.768 1.00 22.91 C ATOM 1172 C CYS A 80 14.737 8.402 -1.407 1.00 20.80 C ATOM 1173 O CYS A 80 14.623 8.286 -2.626 1.00 21.01 O ATOM 1174 CB CYS A 80 14.010 10.793 -1.401 1.00 24.82 C ATOM 1175 SG CYS A 80 14.169 12.426 -0.640 1.00 30.13 S ATOM 1176 HA CYS A 80 14.720 9.706 0.297 1.00 0.00 H ATOM 1177 HB2 CYS A 80 12.982 10.451 -1.285 1.00 0.00 H ATOM 1178 HB3 CYS A 80 14.247 10.876 -2.462 1.00 0.00 H ATOM 1179 HG CYS A 80 13.301 13.305 -1.256 1.00 0.00 H ATOM 1180 H CYS A 80 16.614 10.580 -1.875 1.00 0.00 H ATOM 1181 N VAL A 81 14.712 7.374 -0.568 1.00 19.81 N ATOM 1182 CA VAL A 81 14.762 6.000 -1.039 1.00 20.73 C ATOM 1183 C VAL A 81 13.394 5.347 -0.992 1.00 20.59 C ATOM 1184 O VAL A 81 12.702 5.429 0.018 1.00 21.68 O ATOM 1185 CB VAL A 81 15.712 5.157 -0.152 1.00 20.91 C ATOM 1186 CG1 VAL A 81 15.877 3.760 -0.719 1.00 20.41 C ATOM 1187 CG2 VAL A 81 17.063 5.858 0.007 1.00 21.87 C ATOM 1188 HA VAL A 81 15.120 6.033 -2.068 1.00 0.00 H ATOM 1189 HB VAL A 81 15.267 5.062 0.839 1.00 0.00 H ATOM 1190 HG11 VAL A 81 14.905 3.269 -0.760 1.00 0.00 H ATOM 1191 HG12 VAL A 81 16.296 3.824 -1.723 1.00 0.00 H ATOM 1192 HG13 VAL A 81 16.548 3.187 -0.080 1.00 0.00 H ATOM 1193 HG21 VAL A 81 17.520 5.991 -0.974 1.00 0.00 H ATOM 1194 HG22 VAL A 81 16.913 6.831 0.474 1.00 0.00 H ATOM 1195 HG23 VAL A 81 17.715 5.249 0.633 1.00 0.00 H ATOM 1196 H VAL A 81 14.655 7.557 0.454 1.00 0.00 H ATOM 1197 N PHE A 82 13.016 4.694 -2.087 1.00 18.97 N ATOM 1198 CA PHE A 82 11.873 3.777 -2.090 1.00 19.71 C ATOM 1199 C PHE A 82 12.336 2.434 -2.636 1.00 19.88 C ATOM 1200 O PHE A 82 13.419 2.337 -3.220 1.00 19.79 O ATOM 1201 CB PHE A 82 10.700 4.329 -2.928 1.00 19.56 C ATOM 1202 CG PHE A 82 10.978 4.390 -4.415 1.00 18.62 C ATOM 1203 CD1 PHE A 82 10.552 3.372 -5.255 1.00 18.02 C ATOM 1204 CD2 PHE A 82 11.660 5.476 -4.973 1.00 19.79 C ATOM 1205 CE1 PHE A 82 10.800 3.423 -6.630 1.00 19.31 C ATOM 1206 CE2 PHE A 82 11.912 5.533 -6.339 1.00 19.65 C ATOM 1207 CZ PHE A 82 11.482 4.504 -7.175 1.00 19.46 C ATOM 1208 HA PHE A 82 11.505 3.663 -1.070 1.00 0.00 H ATOM 1209 HB2 PHE A 82 9.833 3.688 -2.768 1.00 0.00 H ATOM 1210 HB3 PHE A 82 10.475 5.337 -2.580 1.00 0.00 H ATOM 1211 HD2 PHE A 82 11.998 6.288 -4.329 1.00 0.00 H ATOM 1212 HE2 PHE A 82 12.448 6.385 -6.758 1.00 0.00 H ATOM 1213 HZ PHE A 82 11.679 4.547 -8.246 1.00 0.00 H ATOM 1214 HE1 PHE A 82 10.458 2.614 -7.275 1.00 0.00 H ATOM 1215 HD1 PHE A 82 10.016 2.520 -4.837 1.00 0.00 H ATOM 1216 H PHE A 82 13.548 4.839 -2.969 1.00 0.00 H ATOM 1217 N ALA A 83 11.536 1.393 -2.427 1.00 18.96 N ATOM 1218 CA ALA A 83 11.844 0.086 -3.004 1.00 20.28 C ATOM 1219 C ALA A 83 10.944 -0.136 -4.210 1.00 20.17 C ATOM 1220 O ALA A 83 9.760 0.186 -4.160 1.00 18.57 O ATOM 1221 CB ALA A 83 11.652 -1.020 -1.978 1.00 21.95 C ATOM 1222 HA ALA A 83 12.888 0.062 -3.315 1.00 0.00 H ATOM 1223 HB1 ALA A 83 12.314 -0.846 -1.130 1.00 0.00 H ATOM 1224 HB2 ALA A 83 10.617 -1.022 -1.637 1.00 0.00 H ATOM 1225 HB3 ALA A 83 11.888 -1.982 -2.434 1.00 0.00 H ATOM 1226 H ALA A 83 10.681 1.510 -1.846 1.00 0.00 H ATOM 1227 N ILE A 84 11.511 -0.671 -5.291 1.00 20.29 N ATOM 1228 CA ILE A 84 10.768 -0.836 -6.544 1.00 19.32 C ATOM 1229 C ILE A 84 9.612 -1.834 -6.474 1.00 20.47 C ATOM 1230 O ILE A 84 8.793 -1.894 -7.390 1.00 20.94 O ATOM 1231 CB ILE A 84 11.713 -1.106 -7.758 1.00 21.94 C ATOM 1232 CG1 ILE A 84 12.594 -2.342 -7.556 1.00 26.34 C ATOM 1233 CG2 ILE A 84 12.638 0.081 -7.946 1.00 22.30 C ATOM 1234 CD1 ILE A 84 11.856 -3.630 -7.320 1.00 31.99 C ATOM 1235 HA ILE A 84 10.287 0.128 -6.711 1.00 0.00 H ATOM 1236 HB ILE A 84 11.073 -1.270 -8.625 1.00 0.00 H ATOM 1237 HG12 ILE A 84 13.210 -2.466 -8.447 1.00 0.00 H ATOM 1238 HG13 ILE A 84 13.236 -2.160 -6.695 1.00 0.00 H ATOM 1239 HD11 ILE A 84 11.244 -3.537 -6.423 1.00 0.00 H ATOM 1240 HD12 ILE A 84 11.217 -3.843 -8.177 1.00 0.00 H ATOM 1241 HD13 ILE A 84 12.574 -4.440 -7.190 1.00 0.00 H ATOM 1242 HG21 ILE A 84 12.045 0.976 -8.136 1.00 0.00 H ATOM 1243 HG22 ILE A 84 13.233 0.223 -7.044 1.00 0.00 H ATOM 1244 HG23 ILE A 84 13.299 -0.105 -8.793 1.00 0.00 H ATOM 1245 H ILE A 84 12.503 -0.979 -5.245 1.00 0.00 H ATOM 1246 N ASN A 85 9.545 -2.598 -5.385 1.00 22.22 N ATOM 1247 CA ASN A 85 8.431 -3.523 -5.158 1.00 22.55 C ATOM 1248 C ASN A 85 7.602 -3.098 -3.949 1.00 23.00 C ATOM 1249 O ASN A 85 6.976 -3.926 -3.281 1.00 24.01 O ATOM 1250 CB ASN A 85 8.945 -4.952 -4.968 1.00 24.90 C ATOM 1251 CG ASN A 85 9.703 -5.134 -3.666 1.00 25.66 C ATOM 1252 OD1 ASN A 85 10.256 -4.181 -3.116 1.00 25.79 O ATOM 1253 ND2 ASN A 85 9.736 -6.372 -3.165 1.00 26.78 N ATOM 1254 HA ASN A 85 7.791 -3.495 -6.040 1.00 0.00 H ATOM 1255 HB2 ASN A 85 8.094 -5.633 -4.974 1.00 0.00 H ATOM 1256 HB3 ASN A 85 9.610 -5.197 -5.796 1.00 0.00 H ATOM 1257 HD22 ASN A 85 9.255 -7.148 -3.663 1.00 0.00 H ATOM 1258 HD21 ASN A 85 10.243 -6.560 -2.277 1.00 0.00 H ATOM 1259 H ASN A 85 10.304 -2.537 -4.676 1.00 0.00 H ATOM 1260 N ASN A 86 7.617 -1.803 -3.662 1.00 21.03 N ATOM 1261 CA ASN A 86 6.891 -1.264 -2.514 1.00 20.52 C ATOM 1262 C ASN A 86 6.195 0.048 -2.892 1.00 19.26 C ATOM 1263 O ASN A 86 6.766 1.138 -2.794 1.00 20.00 O ATOM 1264 CB ASN A 86 7.848 -1.093 -1.331 1.00 21.39 C ATOM 1265 CG ASN A 86 7.145 -0.657 -0.054 1.00 25.43 C ATOM 1266 OD1 ASN A 86 6.073 -0.059 -0.087 1.00 24.87 O ATOM 1267 ND2 ASN A 86 7.775 -0.934 1.083 1.00 28.13 N ATOM 1268 HA ASN A 86 6.112 -1.963 -2.211 1.00 0.00 H ATOM 1269 HB2 ASN A 86 8.345 -2.045 -1.146 1.00 0.00 H ATOM 1270 HB3 ASN A 86 8.592 -0.341 -1.592 1.00 0.00 H ATOM 1271 HD22 ASN A 86 8.682 -1.443 1.064 1.00 0.00 H ATOM 1272 HD21 ASN A 86 7.361 -0.642 1.991 1.00 0.00 H ATOM 1273 H ASN A 86 8.159 -1.155 -4.269 1.00 0.00 H ATOM 1274 N THR A 87 4.961 -0.077 -3.363 1.00 20.17 N ATOM 1275 CA THR A 87 4.224 1.063 -3.897 1.00 22.32 C ATOM 1276 C THR A 87 4.066 2.178 -2.870 1.00 21.81 C ATOM 1277 O THR A 87 4.300 3.357 -3.167 1.00 21.41 O ATOM 1278 CB THR A 87 2.851 0.614 -4.433 1.00 20.74 C ATOM 1279 OG1 THR A 87 3.057 -0.257 -5.550 1.00 23.27 O ATOM 1280 CG2 THR A 87 2.019 1.824 -4.879 1.00 23.42 C ATOM 1281 HA THR A 87 4.808 1.470 -4.722 1.00 0.00 H ATOM 1282 HB THR A 87 2.310 0.097 -3.640 1.00 0.00 H ATOM 1283 HG1 THR A 87 2.180 -0.552 -5.903 1.00 0.00 H ATOM 1284 HG23 THR A 87 1.861 2.488 -4.029 1.00 0.00 H ATOM 1285 HG21 THR A 87 2.551 2.359 -5.666 1.00 0.00 H ATOM 1286 HG22 THR A 87 1.056 1.481 -5.258 1.00 0.00 H ATOM 1287 H THR A 87 4.507 -1.013 -3.351 1.00 0.00 H ATOM 1288 N LYS A 88 3.687 1.809 -1.656 1.00 21.45 N ATOM 1289 CA LYS A 88 3.515 2.793 -0.598 1.00 22.92 C ATOM 1290 C LYS A 88 4.805 3.580 -0.372 1.00 22.53 C ATOM 1291 O LYS A 88 4.768 4.793 -0.145 1.00 22.83 O ATOM 1292 CB LYS A 88 3.092 2.106 0.700 1.00 25.70 C ATOM 1293 CG LYS A 88 3.245 2.964 1.950 1.00 34.65 C ATOM 1294 CD LYS A 88 2.115 3.931 2.122 1.00 40.52 C ATOM 1295 CE LYS A 88 1.794 4.141 3.611 1.00 42.90 C ATOM 1296 NZ LYS A 88 2.925 4.736 4.399 1.00 43.30 N ATOM 1297 HA LYS A 88 2.734 3.488 -0.906 1.00 0.00 H ATOM 1298 HB2 LYS A 88 2.044 1.821 0.609 1.00 0.00 H ATOM 1299 HB3 LYS A 88 3.701 1.210 0.825 1.00 0.00 H ATOM 1300 HG2 LYS A 88 3.282 2.310 2.821 1.00 0.00 H ATOM 1301 HG3 LYS A 88 4.177 3.524 1.878 1.00 0.00 H ATOM 1302 HD2 LYS A 88 2.392 4.887 1.678 1.00 0.00 H ATOM 1303 HD3 LYS A 88 1.231 3.541 1.618 1.00 0.00 H ATOM 1304 HE2 LYS A 88 1.542 3.175 4.048 1.00 0.00 H ATOM 1305 HE3 LYS A 88 0.935 4.807 3.687 1.00 0.00 H ATOM 1306 HZ1 LYS A 88 3.751 4.106 4.347 1.00 0.00 H ATOM 1307 HZ2 LYS A 88 3.171 5.665 4.002 1.00 0.00 H ATOM 1308 HZ3 LYS A 88 2.634 4.847 5.391 1.00 0.00 H ATOM 1309 H LYS A 88 3.510 0.804 -1.456 1.00 0.00 H ATOM 1310 N SER A 89 5.949 2.897 -0.425 1.00 21.27 N ATOM 1311 CA SER A 89 7.218 3.577 -0.179 1.00 20.10 C ATOM 1312 C SER A 89 7.496 4.631 -1.262 1.00 20.80 C ATOM 1313 O SER A 89 8.084 5.682 -0.986 1.00 21.07 O ATOM 1314 CB SER A 89 8.392 2.583 -0.049 1.00 20.06 C ATOM 1315 OG SER A 89 8.814 2.061 -1.294 1.00 19.64 O ATOM 1316 HA SER A 89 7.130 4.091 0.778 1.00 0.00 H ATOM 1317 HB2 SER A 89 8.078 1.755 0.587 1.00 0.00 H ATOM 1318 HB3 SER A 89 9.233 3.097 0.416 1.00 0.00 H ATOM 1319 HG SER A 89 8.060 1.583 -1.723 1.00 0.00 H ATOM 1320 H SER A 89 5.938 1.880 -0.642 1.00 0.00 H ATOM 1321 N PHE A 90 7.060 4.358 -2.487 1.00 17.81 N ATOM 1322 CA PHE A 90 7.214 5.327 -3.580 1.00 19.62 C ATOM 1323 C PHE A 90 6.277 6.514 -3.332 1.00 22.19 C ATOM 1324 O PHE A 90 6.654 7.689 -3.477 1.00 23.31 O ATOM 1325 CB PHE A 90 6.904 4.662 -4.933 1.00 20.57 C ATOM 1326 CG PHE A 90 6.936 5.610 -6.108 1.00 20.35 C ATOM 1327 CD1 PHE A 90 8.129 6.195 -6.514 1.00 19.72 C ATOM 1328 CD2 PHE A 90 5.768 5.894 -6.823 1.00 20.39 C ATOM 1329 CE1 PHE A 90 8.162 7.070 -7.610 1.00 21.35 C ATOM 1330 CE2 PHE A 90 5.783 6.761 -7.915 1.00 21.62 C ATOM 1331 CZ PHE A 90 6.984 7.354 -8.313 1.00 21.31 C ATOM 1332 HA PHE A 90 8.244 5.683 -3.610 1.00 0.00 H ATOM 1333 HB2 PHE A 90 7.641 3.877 -5.106 1.00 0.00 H ATOM 1334 HB3 PHE A 90 5.910 4.219 -4.877 1.00 0.00 H ATOM 1335 HD2 PHE A 90 4.829 5.429 -6.521 1.00 0.00 H ATOM 1336 HE2 PHE A 90 4.861 6.975 -8.456 1.00 0.00 H ATOM 1337 HZ PHE A 90 7.004 8.033 -9.165 1.00 0.00 H ATOM 1338 HE1 PHE A 90 9.103 7.528 -7.914 1.00 0.00 H ATOM 1339 HD1 PHE A 90 9.050 5.972 -5.975 1.00 0.00 H ATOM 1340 H PHE A 90 6.602 3.443 -2.675 1.00 0.00 H ATOM 1341 N GLU A 91 5.047 6.206 -2.952 1.00 21.94 N ATOM 1342 CA GLU A 91 4.088 7.261 -2.651 1.00 21.33 C ATOM 1343 C GLU A 91 4.553 8.121 -1.482 1.00 23.91 C ATOM 1344 O GLU A 91 4.339 9.341 -1.477 1.00 25.85 O ATOM 1345 CB GLU A 91 2.719 6.646 -2.382 1.00 21.06 C ATOM 1346 CG GLU A 91 2.210 5.879 -3.584 1.00 22.76 C ATOM 1347 CD GLU A 91 0.976 5.065 -3.272 1.00 25.70 C ATOM 1348 OE1 GLU A 91 0.761 4.727 -2.085 1.00 28.55 O ATOM 1349 OE2 GLU A 91 0.230 4.761 -4.217 1.00 25.87 O ATOM 1350 HA GLU A 91 4.011 7.921 -3.515 1.00 0.00 H ATOM 1351 HB2 GLU A 91 2.796 5.966 -1.534 1.00 0.00 H ATOM 1352 HB3 GLU A 91 2.013 7.442 -2.144 1.00 0.00 H ATOM 1353 HG2 GLU A 91 1.970 6.589 -4.376 1.00 0.00 H ATOM 1354 HG3 GLU A 91 2.995 5.206 -3.927 1.00 0.00 H ATOM 1355 H GLU A 91 4.764 5.209 -2.868 1.00 0.00 H ATOM 1356 N ASP A 92 5.190 7.485 -0.503 1.00 24.33 N ATOM 1357 CA ASP A 92 5.713 8.181 0.683 1.00 25.63 C ATOM 1358 C ASP A 92 6.688 9.299 0.335 1.00 23.03 C ATOM 1359 O ASP A 92 6.853 10.242 1.107 1.00 25.14 O ATOM 1360 CB ASP A 92 6.421 7.201 1.634 1.00 28.82 C ATOM 1361 CG ASP A 92 5.458 6.367 2.458 1.00 35.49 C ATOM 1362 OD1 ASP A 92 4.251 6.686 2.503 1.00 38.46 O ATOM 1363 OD2 ASP A 92 5.927 5.390 3.084 1.00 37.10 O ATOM 1364 HA ASP A 92 4.843 8.621 1.170 1.00 0.00 H ATOM 1365 HB2 ASP A 92 7.041 6.529 1.041 1.00 0.00 H ATOM 1366 HB3 ASP A 92 7.053 7.773 2.313 1.00 0.00 H ATOM 1367 H ASP A 92 5.324 6.456 -0.579 1.00 0.00 H ATOM 1368 N ILE A 93 7.347 9.186 -0.816 1.00 22.65 N ATOM 1369 CA ILE A 93 8.340 10.190 -1.223 1.00 22.63 C ATOM 1370 C ILE A 93 7.750 11.610 -1.215 1.00 22.98 C ATOM 1371 O ILE A 93 8.393 12.563 -0.771 1.00 24.26 O ATOM 1372 CB ILE A 93 8.914 9.879 -2.619 1.00 24.01 C ATOM 1373 CG1 ILE A 93 9.669 8.543 -2.599 1.00 26.92 C ATOM 1374 CG2 ILE A 93 9.811 11.031 -3.099 1.00 25.68 C ATOM 1375 CD1 ILE A 93 10.819 8.500 -1.613 1.00 27.65 C ATOM 1376 HA ILE A 93 9.146 10.145 -0.491 1.00 0.00 H ATOM 1377 HB ILE A 93 8.092 9.784 -3.328 1.00 0.00 H ATOM 1378 HG12 ILE A 93 8.964 7.754 -2.338 1.00 0.00 H ATOM 1379 HG13 ILE A 93 10.066 8.358 -3.597 1.00 0.00 H ATOM 1380 HD11 ILE A 93 11.542 9.275 -1.866 1.00 0.00 H ATOM 1381 HD12 ILE A 93 10.439 8.671 -0.606 1.00 0.00 H ATOM 1382 HD13 ILE A 93 11.300 7.523 -1.660 1.00 0.00 H ATOM 1383 HG21 ILE A 93 9.225 11.948 -3.152 1.00 0.00 H ATOM 1384 HG22 ILE A 93 10.635 11.165 -2.398 1.00 0.00 H ATOM 1385 HG23 ILE A 93 10.207 10.794 -4.086 1.00 0.00 H ATOM 1386 H ILE A 93 7.156 8.374 -1.437 1.00 0.00 H ATOM 1387 N HIS A 94 6.515 11.741 -1.696 1.00 23.37 N ATOM 1388 CA HIS A 94 5.847 13.029 -1.689 1.00 25.43 C ATOM 1389 C HIS A 94 5.818 13.598 -0.275 1.00 26.07 C ATOM 1390 O HIS A 94 6.096 14.781 -0.053 1.00 27.75 O ATOM 1391 CB HIS A 94 4.417 12.874 -2.200 1.00 27.53 C ATOM 1392 CG HIS A 94 3.541 14.040 -1.891 1.00 29.75 C ATOM 1393 ND1 HIS A 94 3.695 15.270 -2.495 1.00 29.63 N ATOM 1394 CD2 HIS A 94 2.505 14.173 -1.026 1.00 28.19 C ATOM 1395 CE1 HIS A 94 2.788 16.106 -2.025 1.00 29.95 C ATOM 1396 NE2 HIS A 94 2.055 15.464 -1.129 1.00 30.45 N ATOM 1397 HA HIS A 94 6.395 13.711 -2.339 1.00 0.00 H ATOM 1398 HB2 HIS A 94 4.450 12.745 -3.282 1.00 0.00 H ATOM 1399 HB3 HIS A 94 3.982 11.985 -1.742 1.00 0.00 H ATOM 1400 HD2 HIS A 94 2.105 13.399 -0.371 1.00 0.00 H ATOM 1401 HE1 HIS A 94 2.664 17.147 -2.324 1.00 0.00 H ATOM 1402 H HIS A 94 6.023 10.910 -2.081 1.00 0.00 H ATOM 1403 N HIS A 95 5.473 12.752 0.685 1.00 25.71 N ATOM 1404 CA HIS A 95 5.295 13.204 2.062 1.00 27.53 C ATOM 1405 C HIS A 95 6.627 13.557 2.744 1.00 28.18 C ATOM 1406 O HIS A 95 6.705 14.517 3.528 1.00 28.36 O ATOM 1407 CB HIS A 95 4.518 12.147 2.852 1.00 28.67 C ATOM 1408 CG HIS A 95 3.227 11.744 2.201 1.00 34.58 C ATOM 1409 ND1 HIS A 95 2.048 12.433 2.391 1.00 37.36 N ATOM 1410 CD2 HIS A 95 2.939 10.736 1.343 1.00 35.66 C ATOM 1411 CE1 HIS A 95 1.087 11.858 1.688 1.00 37.91 C ATOM 1412 NE2 HIS A 95 1.600 10.825 1.042 1.00 36.74 N ATOM 1413 HA HIS A 95 4.718 14.128 2.042 1.00 0.00 H ATOM 1414 HB2 HIS A 95 5.145 11.261 2.954 1.00 0.00 H ATOM 1415 HB3 HIS A 95 4.296 12.549 3.841 1.00 0.00 H ATOM 1416 HD2 HIS A 95 3.639 9.992 0.962 1.00 0.00 H ATOM 1417 HE1 HIS A 95 0.047 12.181 1.648 1.00 0.00 H ATOM 1418 H HIS A 95 5.326 11.749 0.454 1.00 0.00 H ATOM 1419 N TYR A 96 7.667 12.779 2.459 1.00 27.25 N ATOM 1420 CA TYR A 96 9.003 13.109 2.962 1.00 28.82 C ATOM 1421 C TYR A 96 9.492 14.433 2.392 1.00 28.79 C ATOM 1422 O TYR A 96 10.037 15.276 3.118 1.00 31.19 O ATOM 1423 CB TYR A 96 10.013 11.995 2.653 1.00 31.15 C ATOM 1424 CG TYR A 96 9.813 10.769 3.504 1.00 32.33 C ATOM 1425 CD1 TYR A 96 10.111 10.792 4.863 1.00 35.96 C ATOM 1426 CD2 TYR A 96 9.318 9.589 2.956 1.00 34.58 C ATOM 1427 CE1 TYR A 96 9.917 9.681 5.652 1.00 38.34 C ATOM 1428 CE2 TYR A 96 9.128 8.471 3.739 1.00 37.85 C ATOM 1429 CZ TYR A 96 9.428 8.522 5.088 1.00 39.96 C ATOM 1430 OH TYR A 96 9.242 7.410 5.878 1.00 42.85 O ATOM 1431 HA TYR A 96 8.924 13.205 4.045 1.00 0.00 H ATOM 1432 HB3 TYR A 96 11.018 12.379 2.827 1.00 0.00 H ATOM 1433 HB2 TYR A 96 9.909 11.712 1.605 1.00 0.00 H ATOM 1434 HD2 TYR A 96 9.078 9.549 1.894 1.00 0.00 H ATOM 1435 HE2 TYR A 96 8.743 7.552 3.297 1.00 0.00 H ATOM 1436 HE1 TYR A 96 10.149 9.717 6.716 1.00 0.00 H ATOM 1437 HD1 TYR A 96 10.505 11.705 5.310 1.00 0.00 H ATOM 1438 HH TYR A 96 8.288 7.146 5.855 1.00 0.00 H ATOM 1439 H TYR A 96 7.531 11.930 1.874 1.00 0.00 H ATOM 1440 N ARG A 97 9.300 14.622 1.092 1.00 28.73 N ATOM 1441 CA ARG A 97 9.720 15.865 0.445 1.00 30.87 C ATOM 1442 C ARG A 97 9.007 17.070 1.045 1.00 31.85 C ATOM 1443 O ARG A 97 9.636 18.088 1.340 1.00 33.52 O ATOM 1444 CB ARG A 97 9.478 15.809 -1.067 1.00 32.90 C ATOM 1445 CG ARG A 97 9.946 17.064 -1.826 1.00 35.28 C ATOM 1446 CD ARG A 97 9.918 16.828 -3.334 1.00 39.95 C ATOM 1447 NE ARG A 97 10.229 18.025 -4.115 1.00 43.87 N ATOM 1448 CZ ARG A 97 9.316 18.860 -4.605 1.00 49.63 C ATOM 1449 NH1 ARG A 97 8.021 18.642 -4.393 1.00 50.73 N ATOM 1450 NH2 ARG A 97 9.696 19.920 -5.306 1.00 52.34 N ATOM 1451 HA ARG A 97 10.790 15.977 0.621 1.00 0.00 H ATOM 1452 HB2 ARG A 97 10.012 14.947 -1.468 1.00 0.00 H ATOM 1453 HB3 ARG A 97 8.409 15.684 -1.238 1.00 0.00 H ATOM 1454 HG2 ARG A 97 9.286 17.896 -1.582 1.00 0.00 H ATOM 1455 HG3 ARG A 97 10.964 17.308 -1.521 1.00 0.00 H ATOM 1456 HD2 ARG A 97 8.922 16.483 -3.612 1.00 0.00 H ATOM 1457 HD3 ARG A 97 10.649 16.057 -3.577 1.00 0.00 H ATOM 1458 HE ARG A 97 11.230 18.238 -4.300 1.00 0.00 H ATOM 1459 HH12 ARG A 97 7.313 19.299 -4.779 1.00 0.00 H ATOM 1460 HH11 ARG A 97 7.716 17.815 -3.841 1.00 0.00 H ATOM 1461 HH22 ARG A 97 8.983 20.573 -5.689 1.00 0.00 H ATOM 1462 HH21 ARG A 97 10.707 20.098 -5.472 1.00 0.00 H ATOM 1463 H ARG A 97 8.845 13.877 0.526 1.00 0.00 H ATOM 1464 N GLU A 98 7.695 16.958 1.231 1.00 30.79 N ATOM 1465 CA GLU A 98 6.935 18.053 1.832 1.00 33.28 C ATOM 1466 C GLU A 98 7.430 18.368 3.240 1.00 33.77 C ATOM 1467 O GLU A 98 7.568 19.536 3.617 1.00 34.74 O ATOM 1468 CB GLU A 98 5.443 17.726 1.857 1.00 36.05 C ATOM 1469 CG GLU A 98 4.804 17.704 0.478 1.00 42.00 C ATOM 1470 CD GLU A 98 4.918 19.042 -0.228 1.00 46.83 C ATOM 1471 OE1 GLU A 98 5.296 19.069 -1.419 1.00 47.80 O ATOM 1472 OE2 GLU A 98 4.631 20.071 0.413 1.00 49.68 O ATOM 1473 HA GLU A 98 7.090 18.938 1.214 1.00 0.00 H ATOM 1474 HB2 GLU A 98 5.312 16.745 2.314 1.00 0.00 H ATOM 1475 HB3 GLU A 98 4.935 18.478 2.461 1.00 0.00 H ATOM 1476 HG2 GLU A 98 5.299 16.944 -0.127 1.00 0.00 H ATOM 1477 HG3 GLU A 98 3.749 17.451 0.584 1.00 0.00 H ATOM 1478 H GLU A 98 7.206 16.085 0.947 1.00 0.00 H ATOM 1479 N GLN A 99 7.693 17.323 4.016 1.00 34.11 N ATOM 1480 CA GLN A 99 8.180 17.498 5.381 1.00 36.91 C ATOM 1481 C GLN A 99 9.537 18.195 5.402 1.00 37.23 C ATOM 1482 O GLN A 99 9.769 19.099 6.206 1.00 38.94 O ATOM 1483 CB GLN A 99 8.256 16.154 6.105 1.00 43.29 C ATOM 1484 CG GLN A 99 8.553 16.283 7.586 1.00 52.07 C ATOM 1485 CD GLN A 99 8.282 15.001 8.352 1.00 58.71 C ATOM 1486 OE1 GLN A 99 8.285 13.907 7.781 1.00 60.89 O ATOM 1487 NE2 GLN A 99 8.041 15.131 9.656 1.00 60.89 N ATOM 1488 HA GLN A 99 7.469 18.135 5.907 1.00 0.00 H ATOM 1489 HB2 GLN A 99 7.300 15.643 5.987 1.00 0.00 H ATOM 1490 HB3 GLN A 99 9.044 15.558 5.645 1.00 0.00 H ATOM 1491 HG2 GLN A 99 9.603 16.548 7.710 1.00 0.00 H ATOM 1492 HG3 GLN A 99 7.929 17.075 7.999 1.00 0.00 H ATOM 1493 HE22 GLN A 99 8.049 16.074 10.095 1.00 0.00 H ATOM 1494 HE21 GLN A 99 7.845 14.290 10.235 1.00 0.00 H ATOM 1495 H GLN A 99 7.549 16.362 3.644 1.00 0.00 H ATOM 1496 N ILE A 100 10.430 17.772 4.513 1.00 34.33 N ATOM 1497 CA ILE A 100 11.743 18.401 4.389 1.00 36.66 C ATOM 1498 C ILE A 100 11.661 19.886 4.036 1.00 39.32 C ATOM 1499 O ILE A 100 12.301 20.732 4.681 1.00 38.17 O ATOM 1500 CB ILE A 100 12.637 17.657 3.372 1.00 37.42 C ATOM 1501 CG1 ILE A 100 12.924 16.240 3.862 1.00 40.75 C ATOM 1502 CG2 ILE A 100 13.954 18.414 3.169 1.00 38.82 C ATOM 1503 CD1 ILE A 100 13.385 15.295 2.766 1.00 41.09 C ATOM 1504 HA ILE A 100 12.201 18.328 5.375 1.00 0.00 H ATOM 1505 HB ILE A 100 12.110 17.604 2.419 1.00 0.00 H ATOM 1506 HG12 ILE A 100 13.703 16.290 4.623 1.00 0.00 H ATOM 1507 HG13 ILE A 100 12.012 15.837 4.303 1.00 0.00 H ATOM 1508 HD11 ILE A 100 12.612 15.223 2.001 1.00 0.00 H ATOM 1509 HD12 ILE A 100 14.304 15.677 2.321 1.00 0.00 H ATOM 1510 HD13 ILE A 100 13.569 14.309 3.192 1.00 0.00 H ATOM 1511 HG21 ILE A 100 13.742 19.415 2.793 1.00 0.00 H ATOM 1512 HG22 ILE A 100 14.480 18.486 4.121 1.00 0.00 H ATOM 1513 HG23 ILE A 100 14.573 17.877 2.450 1.00 0.00 H ATOM 1514 H ILE A 100 10.188 16.974 3.891 1.00 0.00 H ATOM 1515 N LYS A 101 10.873 20.202 3.016 1.00 40.91 N ATOM 1516 CA LYS A 101 10.745 21.583 2.565 1.00 40.89 C ATOM 1517 C LYS A 101 10.197 22.473 3.677 1.00 42.74 C ATOM 1518 O LYS A 101 10.585 23.635 3.803 1.00 43.54 O ATOM 1519 CB LYS A 101 9.870 21.673 1.312 1.00 43.12 C ATOM 1520 CG LYS A 101 10.487 21.017 0.081 1.00 47.37 C ATOM 1521 CD LYS A 101 9.710 21.332 -1.195 1.00 51.11 C ATOM 1522 CE LYS A 101 8.238 20.958 -1.074 1.00 52.89 C ATOM 1523 NZ LYS A 101 7.475 21.228 -2.336 1.00 54.40 N ATOM 1524 HA LYS A 101 11.741 21.943 2.306 1.00 0.00 H ATOM 1525 HB2 LYS A 101 8.918 21.184 1.521 1.00 0.00 H ATOM 1526 HB3 LYS A 101 9.695 22.726 1.089 1.00 0.00 H ATOM 1527 HG2 LYS A 101 11.509 21.377 -0.033 1.00 0.00 H ATOM 1528 HG3 LYS A 101 10.498 19.937 0.227 1.00 0.00 H ATOM 1529 HD2 LYS A 101 9.786 22.400 -1.399 1.00 0.00 H ATOM 1530 HD3 LYS A 101 10.149 20.773 -2.022 1.00 0.00 H ATOM 1531 HE2 LYS A 101 7.794 21.538 -0.265 1.00 0.00 H ATOM 1532 HE3 LYS A 101 8.164 19.896 -0.840 1.00 0.00 H ATOM 1533 HZ1 LYS A 101 7.532 22.241 -2.564 1.00 0.00 H ATOM 1534 HZ2 LYS A 101 7.886 20.673 -3.113 1.00 0.00 H ATOM 1535 HZ3 LYS A 101 6.480 20.957 -2.203 1.00 0.00 H ATOM 1536 H LYS A 101 10.339 19.453 2.531 1.00 0.00 H ATOM 1537 N ARG A 102 9.305 21.912 4.488 1.00 41.70 N ATOM 1538 CA ARG A 102 8.699 22.638 5.596 1.00 44.40 C ATOM 1539 C ARG A 102 9.673 22.862 6.750 1.00 46.77 C ATOM 1540 O ARG A 102 9.805 23.984 7.262 1.00 48.03 O ATOM 1541 CB ARG A 102 7.476 21.874 6.102 1.00 45.90 C ATOM 1542 CG ARG A 102 6.706 22.587 7.191 1.00 52.07 C ATOM 1543 CD ARG A 102 5.654 21.672 7.787 1.00 57.65 C ATOM 1544 NE ARG A 102 6.254 20.537 8.479 1.00 62.38 N ATOM 1545 CZ ARG A 102 5.891 19.272 8.295 1.00 66.05 C ATOM 1546 NH1 ARG A 102 6.494 18.301 8.969 1.00 67.69 N ATOM 1547 NH2 ARG A 102 4.922 18.977 7.439 1.00 67.47 N ATOM 1548 HA ARG A 102 8.407 23.619 5.220 1.00 0.00 H ATOM 1549 HB2 ARG A 102 6.804 21.708 5.260 1.00 0.00 H ATOM 1550 HB3 ARG A 102 7.811 20.913 6.493 1.00 0.00 H ATOM 1551 HG2 ARG A 102 7.397 22.897 7.975 1.00 0.00 H ATOM 1552 HG3 ARG A 102 6.219 23.466 6.769 1.00 0.00 H ATOM 1553 HD2 ARG A 102 5.015 21.300 6.986 1.00 0.00 H ATOM 1554 HD3 ARG A 102 5.052 22.240 8.496 1.00 0.00 H ATOM 1555 HE ARG A 102 7.015 20.730 9.161 1.00 0.00 H ATOM 1556 HH12 ARG A 102 6.208 17.312 8.823 1.00 0.00 H ATOM 1557 HH11 ARG A 102 7.252 18.529 9.643 1.00 0.00 H ATOM 1558 HH22 ARG A 102 4.639 17.987 7.296 1.00 0.00 H ATOM 1559 HH21 ARG A 102 4.446 19.736 6.911 1.00 0.00 H ATOM 1560 H ARG A 102 9.031 20.922 4.326 1.00 0.00 H ATOM 1561 N VAL A 103 10.343 21.791 7.170 1.00 46.99 N ATOM 1562 CA VAL A 103 11.280 21.873 8.292 1.00 48.13 C ATOM 1563 C VAL A 103 12.423 22.820 7.974 1.00 48.37 C ATOM 1564 O VAL A 103 12.843 23.624 8.817 1.00 51.45 O ATOM 1565 CB VAL A 103 11.850 20.487 8.660 1.00 46.89 C ATOM 1566 CG1 VAL A 103 13.114 20.626 9.518 1.00 46.25 C ATOM 1567 CG2 VAL A 103 10.799 19.656 9.370 1.00 48.61 C ATOM 1568 HA VAL A 103 10.721 22.256 9.146 1.00 0.00 H ATOM 1569 HB VAL A 103 12.128 19.973 7.740 1.00 0.00 H ATOM 1570 HG11 VAL A 103 13.870 21.180 8.962 1.00 0.00 H ATOM 1571 HG12 VAL A 103 12.871 21.161 10.436 1.00 0.00 H ATOM 1572 HG13 VAL A 103 13.496 19.635 9.764 1.00 0.00 H ATOM 1573 HG21 VAL A 103 10.489 20.167 10.282 1.00 0.00 H ATOM 1574 HG22 VAL A 103 9.938 19.524 8.715 1.00 0.00 H ATOM 1575 HG23 VAL A 103 11.218 18.682 9.622 1.00 0.00 H ATOM 1576 H VAL A 103 10.198 20.879 6.692 1.00 0.00 H ATOM 1577 N LYS A 104 12.917 22.742 6.746 1.00 49.03 N ATOM 1578 CA LYS A 104 14.049 23.569 6.342 1.00 50.68 C ATOM 1579 C LYS A 104 13.576 24.896 5.739 1.00 54.10 C ATOM 1580 O LYS A 104 14.384 25.737 5.344 1.00 55.06 O ATOM 1581 CB LYS A 104 14.961 22.790 5.390 1.00 47.70 C ATOM 1582 CG LYS A 104 15.507 21.500 6.018 1.00 46.83 C ATOM 1583 CD LYS A 104 16.428 20.733 5.082 1.00 42.58 C ATOM 1584 CE LYS A 104 17.754 21.444 4.901 1.00 38.10 C ATOM 1585 NZ LYS A 104 18.499 21.526 6.184 1.00 35.95 N ATOM 1586 HA LYS A 104 14.635 23.820 7.226 1.00 0.00 H ATOM 1587 HB2 LYS A 104 14.393 22.530 4.497 1.00 0.00 H ATOM 1588 HB3 LYS A 104 15.801 23.426 5.113 1.00 0.00 H ATOM 1589 HG2 LYS A 104 16.063 21.759 6.919 1.00 0.00 H ATOM 1590 HG3 LYS A 104 14.667 20.858 6.283 1.00 0.00 H ATOM 1591 HD2 LYS A 104 16.611 19.742 5.498 1.00 0.00 H ATOM 1592 HD3 LYS A 104 15.943 20.634 4.111 1.00 0.00 H ATOM 1593 HE2 LYS A 104 17.569 22.453 4.532 1.00 0.00 H ATOM 1594 HE3 LYS A 104 18.355 20.897 4.175 1.00 0.00 H ATOM 1595 HZ1 LYS A 104 17.932 22.052 6.880 1.00 0.00 H ATOM 1596 HZ2 LYS A 104 18.682 20.566 6.539 1.00 0.00 H ATOM 1597 HZ3 LYS A 104 19.402 22.018 6.028 1.00 0.00 H ATOM 1598 H LYS A 104 12.492 22.083 6.062 1.00 0.00 H ATOM 1599 N ASP A 105 12.257 25.075 5.696 1.00 56.03 N ATOM 1600 CA ASP A 105 11.642 26.302 5.193 1.00 57.56 C ATOM 1601 C ASP A 105 12.238 26.727 3.850 1.00 57.47 C ATOM 1602 O ASP A 105 12.661 27.873 3.680 1.00 56.80 O ATOM 1603 CB ASP A 105 11.768 27.428 6.230 1.00 62.58 C ATOM 1604 CG ASP A 105 10.789 28.570 5.987 1.00 66.74 C ATOM 1605 OD1 ASP A 105 11.022 29.677 6.521 1.00 68.84 O ATOM 1606 OD2 ASP A 105 9.785 28.364 5.272 1.00 68.15 O ATOM 1607 HA ASP A 105 10.584 26.099 5.026 1.00 0.00 H ATOM 1608 HB2 ASP A 105 11.579 27.012 7.220 1.00 0.00 H ATOM 1609 HB3 ASP A 105 12.782 27.825 6.191 1.00 0.00 H ATOM 1610 H ASP A 105 11.639 24.310 6.034 1.00 0.00 H ATOM 1611 N SER A 106 12.266 25.800 2.896 1.00 57.66 N ATOM 1612 CA SER A 106 12.796 26.090 1.566 1.00 59.01 C ATOM 1613 C SER A 106 12.151 25.242 0.472 1.00 58.74 C ATOM 1614 O SER A 106 11.788 24.087 0.694 1.00 55.71 O ATOM 1615 CB SER A 106 14.316 25.900 1.535 1.00 60.20 C ATOM 1616 OG SER A 106 14.840 26.204 0.252 1.00 60.36 O ATOM 1617 HA SER A 106 12.550 27.132 1.360 1.00 0.00 H ATOM 1618 HB2 SER A 106 14.551 24.864 1.780 1.00 0.00 H ATOM 1619 HB3 SER A 106 14.773 26.560 2.273 1.00 0.00 H ATOM 1620 HG SER A 106 15.821 26.074 0.258 1.00 0.00 H ATOM 1621 H SER A 106 11.902 24.848 3.102 1.00 0.00 H ATOM 1622 N GLU A 107 12.021 25.824 -0.715 1.00 61.97 N ATOM 1623 CA GLU A 107 11.510 25.099 -1.870 1.00 65.61 C ATOM 1624 C GLU A 107 12.669 24.448 -2.612 1.00 65.33 C ATOM 1625 O GLU A 107 12.469 23.636 -3.514 1.00 66.47 O ATOM 1626 CB GLU A 107 10.766 26.048 -2.810 1.00 68.90 C ATOM 1627 CG GLU A 107 9.968 25.341 -3.892 1.00 71.74 C ATOM 1628 CD GLU A 107 8.648 24.798 -3.379 1.00 74.57 C ATOM 1629 OE1 GLU A 107 7.991 25.496 -2.579 1.00 75.75 O ATOM 1630 OE2 GLU A 107 8.269 23.671 -3.772 1.00 75.10 O ATOM 1631 HA GLU A 107 10.816 24.332 -1.527 1.00 0.00 H ATOM 1632 HB2 GLU A 107 10.080 26.652 -2.216 1.00 0.00 H ATOM 1633 HB3 GLU A 107 11.497 26.698 -3.291 1.00 0.00 H ATOM 1634 HG2 GLU A 107 9.766 26.048 -4.697 1.00 0.00 H ATOM 1635 HG3 GLU A 107 10.561 24.512 -4.279 1.00 0.00 H ATOM 1636 H GLU A 107 12.291 26.823 -0.822 1.00 0.00 H ATOM 1637 N ASP A 108 13.884 24.815 -2.219 1.00 63.96 N ATOM 1638 CA ASP A 108 15.088 24.349 -2.892 1.00 61.32 C ATOM 1639 C ASP A 108 15.994 23.578 -1.936 1.00 53.92 C ATOM 1640 O ASP A 108 16.830 24.168 -1.251 1.00 54.79 O ATOM 1641 CB ASP A 108 15.849 25.539 -3.480 1.00 66.73 C ATOM 1642 CG ASP A 108 16.873 25.120 -4.510 1.00 70.76 C ATOM 1643 OD1 ASP A 108 16.602 24.147 -5.246 1.00 71.70 O ATOM 1644 OD2 ASP A 108 17.945 25.761 -4.584 1.00 71.86 O ATOM 1645 HA ASP A 108 14.787 23.674 -3.694 1.00 0.00 H ATOM 1646 HB2 ASP A 108 15.134 26.213 -3.952 1.00 0.00 H ATOM 1647 HB3 ASP A 108 16.360 26.062 -2.671 1.00 0.00 H ATOM 1648 H ASP A 108 13.978 25.455 -1.405 1.00 0.00 H ATOM 1649 N VAL A 109 15.823 22.261 -1.886 1.00 45.27 N ATOM 1650 CA VAL A 109 16.655 21.417 -1.037 1.00 39.78 C ATOM 1651 C VAL A 109 17.284 20.298 -1.862 1.00 34.76 C ATOM 1652 O VAL A 109 16.572 19.572 -2.552 1.00 35.08 O ATOM 1653 CB VAL A 109 15.835 20.775 0.097 1.00 41.57 C ATOM 1654 CG1 VAL A 109 16.755 19.997 1.048 1.00 41.41 C ATOM 1655 CG2 VAL A 109 15.035 21.830 0.849 1.00 43.56 C ATOM 1656 HA VAL A 109 17.426 22.055 -0.606 1.00 0.00 H ATOM 1657 HB VAL A 109 15.128 20.072 -0.343 1.00 0.00 H ATOM 1658 HG11 VAL A 109 17.269 19.213 0.493 1.00 0.00 H ATOM 1659 HG12 VAL A 109 17.488 20.678 1.481 1.00 0.00 H ATOM 1660 HG13 VAL A 109 16.159 19.550 1.843 1.00 0.00 H ATOM 1661 HG21 VAL A 109 15.717 22.563 1.279 1.00 0.00 H ATOM 1662 HG22 VAL A 109 14.353 22.327 0.159 1.00 0.00 H ATOM 1663 HG23 VAL A 109 14.464 21.352 1.645 1.00 0.00 H ATOM 1664 H VAL A 109 15.079 21.823 -2.466 1.00 0.00 H ATOM 1665 N PRO A 110 18.620 20.148 -1.789 1.00 34.07 N ATOM 1666 CA PRO A 110 19.288 19.075 -2.540 1.00 33.32 C ATOM 1667 C PRO A 110 18.728 17.699 -2.198 1.00 31.48 C ATOM 1668 O PRO A 110 18.720 17.304 -1.031 1.00 31.41 O ATOM 1669 CB PRO A 110 20.746 19.171 -2.075 1.00 32.97 C ATOM 1670 CG PRO A 110 20.913 20.611 -1.684 1.00 33.34 C ATOM 1671 CD PRO A 110 19.586 21.011 -1.081 1.00 34.38 C ATOM 1672 HA PRO A 110 19.154 19.189 -3.616 1.00 0.00 H ATOM 1673 HD3 PRO A 110 19.570 20.818 -0.008 1.00 0.00 H ATOM 1674 HD2 PRO A 110 19.375 22.065 -1.263 1.00 0.00 H ATOM 1675 HG3 PRO A 110 21.136 21.222 -2.559 1.00 0.00 H ATOM 1676 HG2 PRO A 110 21.714 20.719 -0.953 1.00 0.00 H ATOM 1677 HB2 PRO A 110 20.924 18.515 -1.223 1.00 0.00 H ATOM 1678 HB3 PRO A 110 21.428 18.908 -2.883 1.00 0.00 H ATOM 1679 N MET A 111 18.271 16.985 -3.223 1.00 28.30 N ATOM 1680 CA MET A 111 17.694 15.657 -3.062 1.00 26.24 C ATOM 1681 C MET A 111 18.021 14.790 -4.256 1.00 24.43 C ATOM 1682 O MET A 111 18.218 15.289 -5.368 1.00 24.57 O ATOM 1683 CB MET A 111 16.171 15.733 -2.914 1.00 28.71 C ATOM 1684 CG MET A 111 15.713 16.355 -1.615 1.00 33.98 C ATOM 1685 SD MET A 111 13.923 16.300 -1.521 1.00 40.77 S ATOM 1686 CE MET A 111 13.532 17.737 -2.518 1.00 45.11 C ATOM 1687 HA MET A 111 18.123 15.222 -2.159 1.00 0.00 H ATOM 1688 HB2 MET A 111 15.775 16.327 -3.738 1.00 0.00 H ATOM 1689 HB3 MET A 111 15.769 14.721 -2.971 1.00 0.00 H ATOM 1690 HG2 MET A 111 16.047 17.392 -1.571 1.00 0.00 H ATOM 1691 HG3 MET A 111 16.138 15.802 -0.778 1.00 0.00 H ATOM 1692 HE1 MET A 111 13.977 18.623 -2.066 1.00 0.00 H ATOM 1693 HE2 MET A 111 13.932 17.600 -3.523 1.00 0.00 H ATOM 1694 HE3 MET A 111 12.450 17.858 -2.570 1.00 0.00 H ATOM 1695 H MET A 111 18.328 17.391 -4.179 1.00 0.00 H ATOM 1696 N VAL A 112 18.068 13.485 -4.015 1.00 22.46 N ATOM 1697 CA VAL A 112 18.173 12.495 -5.076 1.00 21.39 C ATOM 1698 C VAL A 112 17.129 11.428 -4.802 1.00 20.18 C ATOM 1699 O VAL A 112 16.983 10.983 -3.665 1.00 22.64 O ATOM 1700 CB VAL A 112 19.581 11.869 -5.117 1.00 22.45 C ATOM 1701 CG1 VAL A 112 19.628 10.704 -6.078 1.00 23.18 C ATOM 1702 CG2 VAL A 112 20.607 12.925 -5.526 1.00 24.58 C ATOM 1703 HA VAL A 112 18.005 12.965 -6.045 1.00 0.00 H ATOM 1704 HB VAL A 112 19.821 11.498 -4.120 1.00 0.00 H ATOM 1705 HG11 VAL A 112 18.916 9.943 -5.760 1.00 0.00 H ATOM 1706 HG12 VAL A 112 19.369 11.050 -7.079 1.00 0.00 H ATOM 1707 HG13 VAL A 112 20.633 10.282 -6.086 1.00 0.00 H ATOM 1708 HG21 VAL A 112 20.355 13.311 -6.514 1.00 0.00 H ATOM 1709 HG22 VAL A 112 20.596 13.740 -4.802 1.00 0.00 H ATOM 1710 HG23 VAL A 112 21.599 12.475 -5.553 1.00 0.00 H ATOM 1711 H VAL A 112 18.028 13.158 -3.029 1.00 0.00 H ATOM 1712 N LEU A 113 16.385 11.048 -5.835 1.00 17.77 N ATOM 1713 CA LEU A 113 15.409 9.970 -5.723 1.00 16.89 C ATOM 1714 C LEU A 113 16.111 8.654 -6.004 1.00 19.78 C ATOM 1715 O LEU A 113 16.766 8.516 -7.034 1.00 20.32 O ATOM 1716 CB LEU A 113 14.294 10.172 -6.746 1.00 19.79 C ATOM 1717 CG LEU A 113 13.182 9.124 -6.736 1.00 17.84 C ATOM 1718 CD1 LEU A 113 12.443 9.145 -5.405 1.00 20.30 C ATOM 1719 CD2 LEU A 113 12.219 9.369 -7.904 1.00 20.06 C ATOM 1720 HA LEU A 113 14.978 9.965 -4.722 1.00 0.00 H ATOM 1721 HB2 LEU A 113 13.839 11.144 -6.557 1.00 0.00 H ATOM 1722 HB3 LEU A 113 14.746 10.171 -7.738 1.00 0.00 H ATOM 1723 HG LEU A 113 13.625 8.136 -6.858 1.00 0.00 H ATOM 1724 HD21 LEU A 113 11.778 10.361 -7.808 1.00 0.00 H ATOM 1725 HD22 LEU A 113 12.766 9.303 -8.844 1.00 0.00 H ATOM 1726 HD23 LEU A 113 11.431 8.616 -7.887 1.00 0.00 H ATOM 1727 HD11 LEU A 113 13.143 8.927 -4.599 1.00 0.00 H ATOM 1728 HD12 LEU A 113 12.004 10.130 -5.250 1.00 0.00 H ATOM 1729 HD13 LEU A 113 11.655 8.392 -5.417 1.00 0.00 H ATOM 1730 H LEU A 113 16.502 11.532 -6.748 1.00 0.00 H ATOM 1731 N VAL A 114 15.982 7.696 -5.090 1.00 18.58 N ATOM 1732 CA VAL A 114 16.651 6.406 -5.235 1.00 18.87 C ATOM 1733 C VAL A 114 15.619 5.292 -5.259 1.00 21.05 C ATOM 1734 O VAL A 114 14.836 5.158 -4.320 1.00 19.64 O ATOM 1735 CB VAL A 114 17.631 6.151 -4.076 1.00 18.34 C ATOM 1736 CG1 VAL A 114 18.206 4.719 -4.147 1.00 21.55 C ATOM 1737 CG2 VAL A 114 18.743 7.197 -4.102 1.00 22.48 C ATOM 1738 HA VAL A 114 17.211 6.424 -6.170 1.00 0.00 H ATOM 1739 HB VAL A 114 17.094 6.239 -3.131 1.00 0.00 H ATOM 1740 HG11 VAL A 114 17.391 3.998 -4.083 1.00 0.00 H ATOM 1741 HG12 VAL A 114 18.736 4.588 -5.091 1.00 0.00 H ATOM 1742 HG13 VAL A 114 18.896 4.564 -3.317 1.00 0.00 H ATOM 1743 HG21 VAL A 114 19.278 7.133 -5.049 1.00 0.00 H ATOM 1744 HG22 VAL A 114 18.308 8.191 -3.996 1.00 0.00 H ATOM 1745 HG23 VAL A 114 19.434 7.012 -3.279 1.00 0.00 H ATOM 1746 H VAL A 114 15.391 7.870 -4.252 1.00 0.00 H ATOM 1747 N GLY A 115 15.613 4.517 -6.340 1.00 18.50 N ATOM 1748 CA GLY A 115 14.775 3.331 -6.426 1.00 19.79 C ATOM 1749 C GLY A 115 15.611 2.092 -6.142 1.00 21.01 C ATOM 1750 O GLY A 115 16.372 1.645 -6.994 1.00 23.69 O ATOM 1751 HA3 GLY A 115 14.349 3.260 -7.427 1.00 0.00 H ATOM 1752 HA2 GLY A 115 13.970 3.401 -5.694 1.00 0.00 H ATOM 1753 H GLY A 115 16.223 4.765 -7.145 1.00 0.00 H ATOM 1754 N ASN A 116 15.472 1.546 -4.939 1.00 19.78 N ATOM 1755 CA ASN A 116 16.285 0.412 -4.498 1.00 17.86 C ATOM 1756 C ASN A 116 15.630 -0.962 -4.732 1.00 19.27 C ATOM 1757 O ASN A 116 14.433 -1.054 -4.997 1.00 21.11 O ATOM 1758 CB ASN A 116 16.658 0.590 -3.014 1.00 20.15 C ATOM 1759 CG ASN A 116 17.720 -0.401 -2.546 1.00 21.95 C ATOM 1760 OD1 ASN A 116 18.733 -0.611 -3.220 1.00 21.93 O ATOM 1761 ND2 ASN A 116 17.486 -1.019 -1.393 1.00 21.49 N ATOM 1762 HA ASN A 116 17.182 0.414 -5.117 1.00 0.00 H ATOM 1763 HB2 ASN A 116 17.038 1.601 -2.869 1.00 0.00 H ATOM 1764 HB3 ASN A 116 15.761 0.450 -2.410 1.00 0.00 H ATOM 1765 HD22 ASN A 116 16.619 -0.811 -0.858 1.00 0.00 H ATOM 1766 HD21 ASN A 116 18.170 -1.711 -1.026 1.00 0.00 H ATOM 1767 H ASN A 116 14.761 1.938 -4.289 1.00 0.00 H ATOM 1768 N LYS A 117 16.448 -2.008 -4.633 1.00 20.41 N ATOM 1769 CA LYS A 117 16.063 -3.412 -4.855 1.00 21.36 C ATOM 1770 C LYS A 117 15.829 -3.755 -6.324 1.00 24.09 C ATOM 1771 O LYS A 117 14.978 -4.595 -6.643 1.00 24.28 O ATOM 1772 CB LYS A 117 14.844 -3.804 -4.011 1.00 23.19 C ATOM 1773 CG LYS A 117 14.975 -3.456 -2.547 1.00 22.36 C ATOM 1774 CD LYS A 117 14.056 -4.318 -1.691 1.00 24.30 C ATOM 1775 CE LYS A 117 14.101 -3.933 -0.206 1.00 24.76 C ATOM 1776 NZ LYS A 117 13.218 -4.837 0.610 1.00 24.74 N ATOM 1777 HA LYS A 117 16.920 -4.002 -4.529 1.00 0.00 H ATOM 1778 HB2 LYS A 117 13.970 -3.289 -4.410 1.00 0.00 H ATOM 1779 HB3 LYS A 117 14.699 -4.881 -4.096 1.00 0.00 H ATOM 1780 HG2 LYS A 117 16.007 -3.617 -2.234 1.00 0.00 H ATOM 1781 HG3 LYS A 117 14.713 -2.407 -2.406 1.00 0.00 H ATOM 1782 HD2 LYS A 117 13.034 -4.203 -2.051 1.00 0.00 H ATOM 1783 HD3 LYS A 117 14.360 -5.360 -1.791 1.00 0.00 H ATOM 1784 HE2 LYS A 117 13.760 -2.904 -0.093 1.00 0.00 H ATOM 1785 HE3 LYS A 117 15.127 -4.016 0.154 1.00 0.00 H ATOM 1786 HZ1 LYS A 117 12.237 -4.758 0.273 1.00 0.00 H ATOM 1787 HZ2 LYS A 117 13.542 -5.820 0.509 1.00 0.00 H ATOM 1788 HZ3 LYS A 117 13.266 -4.556 1.610 1.00 0.00 H ATOM 1789 H LYS A 117 17.438 -1.818 -4.378 1.00 0.00 H ATOM 1790 N CYS A 118 16.585 -3.127 -7.222 1.00 22.96 N ATOM 1791 CA CYS A 118 16.352 -3.348 -8.651 1.00 27.44 C ATOM 1792 C CYS A 118 16.810 -4.718 -9.130 1.00 29.47 C ATOM 1793 O CYS A 118 16.693 -5.041 -10.315 1.00 33.61 O ATOM 1794 CB CYS A 118 16.979 -2.252 -9.502 1.00 31.52 C ATOM 1795 SG CYS A 118 16.194 -0.665 -9.310 1.00 35.98 S ATOM 1796 HA CYS A 118 15.270 -3.311 -8.778 1.00 0.00 H ATOM 1797 HB2 CYS A 118 16.910 -2.546 -10.549 1.00 0.00 H ATOM 1798 HB3 CYS A 118 18.028 -2.154 -9.221 1.00 0.00 H ATOM 1799 HG CYS A 118 16.282 -0.266 -7.992 1.00 0.00 H ATOM 1800 H CYS A 118 17.338 -2.482 -6.910 1.00 0.00 H ATOM 1801 N ASP A 119 17.315 -5.523 -8.201 1.00 28.30 N ATOM 1802 CA ASP A 119 17.653 -6.914 -8.477 1.00 29.30 C ATOM 1803 C ASP A 119 16.418 -7.829 -8.485 1.00 31.06 C ATOM 1804 O ASP A 119 16.454 -8.935 -9.037 1.00 33.82 O ATOM 1805 CB ASP A 119 18.674 -7.407 -7.445 1.00 30.69 C ATOM 1806 CG ASP A 119 18.154 -7.306 -6.023 1.00 30.29 C ATOM 1807 OD1 ASP A 119 18.155 -6.186 -5.482 1.00 28.58 O ATOM 1808 OD2 ASP A 119 17.735 -8.342 -5.449 1.00 30.77 O ATOM 1809 HA ASP A 119 18.084 -6.958 -9.477 1.00 0.00 H ATOM 1810 HB2 ASP A 119 18.912 -8.449 -7.658 1.00 0.00 H ATOM 1811 HB3 ASP A 119 19.578 -6.804 -7.531 1.00 0.00 H ATOM 1812 H ASP A 119 17.475 -5.148 -7.244 1.00 0.00 H ATOM 1813 N LEU A 120 15.327 -7.357 -7.887 1.00 29.67 N ATOM 1814 CA LEU A 120 14.097 -8.147 -7.744 1.00 30.05 C ATOM 1815 C LEU A 120 13.214 -8.197 -8.997 1.00 34.65 C ATOM 1816 O LEU A 120 13.213 -7.272 -9.798 1.00 36.94 O ATOM 1817 CB LEU A 120 13.269 -7.618 -6.572 1.00 30.54 C ATOM 1818 CG LEU A 120 13.870 -7.829 -5.185 1.00 30.49 C ATOM 1819 CD1 LEU A 120 12.966 -7.246 -4.119 1.00 30.86 C ATOM 1820 CD2 LEU A 120 14.115 -9.322 -4.949 1.00 28.23 C ATOM 1821 HA LEU A 120 14.433 -9.169 -7.566 1.00 0.00 H ATOM 1822 HB2 LEU A 120 13.130 -6.547 -6.717 1.00 0.00 H ATOM 1823 HB3 LEU A 120 12.299 -8.115 -6.596 1.00 0.00 H ATOM 1824 HG LEU A 120 14.826 -7.309 -5.127 1.00 0.00 H ATOM 1825 HD21 LEU A 120 13.169 -9.860 -5.019 1.00 0.00 H ATOM 1826 HD22 LEU A 120 14.805 -9.699 -5.703 1.00 0.00 H ATOM 1827 HD23 LEU A 120 14.544 -9.466 -3.957 1.00 0.00 H ATOM 1828 HD11 LEU A 120 12.844 -6.177 -4.293 1.00 0.00 H ATOM 1829 HD12 LEU A 120 11.993 -7.736 -4.162 1.00 0.00 H ATOM 1830 HD13 LEU A 120 13.413 -7.407 -3.138 1.00 0.00 H ATOM 1831 H LEU A 120 15.346 -6.390 -7.505 1.00 0.00 H ATOM 1832 N PRO A 121 12.447 -9.288 -9.155 1.00 36.47 N ATOM 1833 CA PRO A 121 11.497 -9.461 -10.267 1.00 36.24 C ATOM 1834 C PRO A 121 10.125 -8.809 -10.033 1.00 36.49 C ATOM 1835 O PRO A 121 9.725 -8.606 -8.891 1.00 39.91 O ATOM 1836 CB PRO A 121 11.335 -10.983 -10.338 1.00 39.43 C ATOM 1837 CG PRO A 121 11.563 -11.445 -8.939 1.00 38.60 C ATOM 1838 CD PRO A 121 12.630 -10.531 -8.385 1.00 38.59 C ATOM 1839 HA PRO A 121 11.869 -8.985 -11.174 1.00 0.00 H ATOM 1840 HD3 PRO A 121 12.480 -10.356 -7.320 1.00 0.00 H ATOM 1841 HD2 PRO A 121 13.624 -10.948 -8.547 1.00 0.00 H ATOM 1842 HG3 PRO A 121 11.904 -12.480 -8.929 1.00 0.00 H ATOM 1843 HG2 PRO A 121 10.647 -11.360 -8.355 1.00 0.00 H ATOM 1844 HB2 PRO A 121 10.333 -11.249 -10.674 1.00 0.00 H ATOM 1845 HB3 PRO A 121 12.071 -11.419 -11.013 1.00 0.00 H ATOM 1846 N SER A 122 9.420 -8.489 -11.117 1.00 35.69 N ATOM 1847 CA SER A 122 8.023 -8.048 -11.050 1.00 36.20 C ATOM 1848 C SER A 122 7.832 -6.765 -10.248 1.00 34.36 C ATOM 1849 O SER A 122 6.910 -6.653 -9.443 1.00 35.70 O ATOM 1850 CB SER A 122 7.124 -9.149 -10.476 1.00 38.94 C ATOM 1851 OG SER A 122 6.869 -10.147 -11.448 1.00 43.80 O ATOM 1852 HA SER A 122 7.733 -7.834 -12.079 1.00 0.00 H ATOM 1853 HB2 SER A 122 6.179 -8.709 -10.158 1.00 0.00 H ATOM 1854 HB3 SER A 122 7.619 -9.604 -9.618 1.00 0.00 H ATOM 1855 HG SER A 122 7.725 -10.551 -11.737 1.00 0.00 H ATOM 1856 H SER A 122 9.879 -8.555 -12.048 1.00 0.00 H ATOM 1857 N ARG A 123 8.700 -5.796 -10.479 1.00 30.23 N ATOM 1858 CA ARG A 123 8.601 -4.531 -9.771 1.00 28.35 C ATOM 1859 C ARG A 123 7.183 -3.993 -9.921 1.00 28.01 C ATOM 1860 O ARG A 123 6.516 -4.244 -10.935 1.00 31.67 O ATOM 1861 CB ARG A 123 9.629 -3.535 -10.295 1.00 33.88 C ATOM 1862 CG ARG A 123 9.520 -3.226 -11.755 1.00 35.35 C ATOM 1863 CD ARG A 123 10.803 -2.556 -12.235 1.00 37.49 C ATOM 1864 NE ARG A 123 10.945 -1.203 -11.713 1.00 38.58 N ATOM 1865 CZ ARG A 123 12.081 -0.514 -11.719 1.00 36.99 C ATOM 1866 NH1 ARG A 123 12.099 0.721 -11.241 1.00 38.70 N ATOM 1867 NH2 ARG A 123 13.196 -1.056 -12.203 1.00 34.76 N ATOM 1868 HA ARG A 123 8.815 -4.686 -8.713 1.00 0.00 H ATOM 1869 HB2 ARG A 123 9.511 -2.603 -9.742 1.00 0.00 H ATOM 1870 HB3 ARG A 123 10.622 -3.943 -10.108 1.00 0.00 H ATOM 1871 HG2 ARG A 123 9.364 -4.151 -12.311 1.00 0.00 H ATOM 1872 HG3 ARG A 123 8.677 -2.556 -11.922 1.00 0.00 H ATOM 1873 HD2 ARG A 123 10.791 -2.513 -13.324 1.00 0.00 H ATOM 1874 HD3 ARG A 123 11.655 -3.151 -11.906 1.00 0.00 H ATOM 1875 HE ARG A 123 10.102 -0.747 -11.309 1.00 0.00 H ATOM 1876 HH12 ARG A 123 12.985 1.266 -11.242 1.00 0.00 H ATOM 1877 HH11 ARG A 123 11.228 1.145 -10.864 1.00 0.00 H ATOM 1878 HH22 ARG A 123 14.081 -0.510 -12.204 1.00 0.00 H ATOM 1879 HH21 ARG A 123 13.182 -2.025 -12.580 1.00 0.00 H ATOM 1880 H ARG A 123 9.461 -5.940 -11.174 1.00 0.00 H ATOM 1881 N THR A 124 6.719 -3.281 -8.901 1.00 26.10 N ATOM 1882 CA THR A 124 5.379 -2.708 -8.917 1.00 26.44 C ATOM 1883 C THR A 124 5.439 -1.202 -9.168 1.00 26.74 C ATOM 1884 O THR A 124 4.420 -0.563 -9.436 1.00 31.06 O ATOM 1885 CB THR A 124 4.641 -2.993 -7.601 1.00 28.36 C ATOM 1886 OG1 THR A 124 5.473 -2.615 -6.498 1.00 27.87 O ATOM 1887 CG2 THR A 124 4.311 -4.474 -7.486 1.00 29.96 C ATOM 1888 HA THR A 124 4.826 -3.178 -9.730 1.00 0.00 H ATOM 1889 HB THR A 124 3.715 -2.419 -7.588 1.00 0.00 H ATOM 1890 HG1 THR A 124 4.997 -2.799 -5.649 1.00 0.00 H ATOM 1891 HG23 THR A 124 3.678 -4.770 -8.322 1.00 0.00 H ATOM 1892 HG21 THR A 124 5.234 -5.053 -7.505 1.00 0.00 H ATOM 1893 HG22 THR A 124 3.786 -4.656 -6.548 1.00 0.00 H ATOM 1894 H THR A 124 7.326 -3.128 -8.071 1.00 0.00 H ATOM 1895 N VAL A 125 6.636 -0.638 -9.063 1.00 25.16 N ATOM 1896 CA VAL A 125 6.855 0.769 -9.394 1.00 23.21 C ATOM 1897 C VAL A 125 7.746 0.847 -10.625 1.00 26.17 C ATOM 1898 O VAL A 125 8.917 0.479 -10.569 1.00 28.89 O ATOM 1899 CB VAL A 125 7.545 1.514 -8.241 1.00 21.73 C ATOM 1900 CG1 VAL A 125 7.660 2.998 -8.577 1.00 24.45 C ATOM 1901 CG2 VAL A 125 6.775 1.310 -6.935 1.00 26.48 C ATOM 1902 HA VAL A 125 5.887 1.235 -9.578 1.00 0.00 H ATOM 1903 HB VAL A 125 8.548 1.109 -8.107 1.00 0.00 H ATOM 1904 HG11 VAL A 125 8.248 3.119 -9.487 1.00 0.00 H ATOM 1905 HG12 VAL A 125 6.664 3.413 -8.729 1.00 0.00 H ATOM 1906 HG13 VAL A 125 8.150 3.519 -7.754 1.00 0.00 H ATOM 1907 HG21 VAL A 125 5.761 1.693 -7.049 1.00 0.00 H ATOM 1908 HG22 VAL A 125 6.738 0.247 -6.699 1.00 0.00 H ATOM 1909 HG23 VAL A 125 7.279 1.845 -6.130 1.00 0.00 H ATOM 1910 H VAL A 125 7.439 -1.212 -8.737 1.00 0.00 H ATOM 1911 N ASP A 126 7.184 1.318 -11.734 1.00 29.58 N ATOM 1912 CA ASP A 126 7.891 1.370 -13.011 1.00 34.85 C ATOM 1913 C ASP A 126 8.994 2.420 -13.058 1.00 31.65 C ATOM 1914 O ASP A 126 8.911 3.451 -12.401 1.00 31.67 O ATOM 1915 CB ASP A 126 6.901 1.643 -14.141 1.00 44.87 C ATOM 1916 CG ASP A 126 6.006 0.465 -14.413 1.00 56.47 C ATOM 1917 OD1 ASP A 126 4.774 0.659 -14.521 1.00 60.70 O ATOM 1918 OD2 ASP A 126 6.543 -0.659 -14.513 1.00 60.98 O ATOM 1919 HA ASP A 126 8.368 0.398 -13.132 1.00 0.00 H ATOM 1920 HB2 ASP A 126 6.282 2.498 -13.867 1.00 0.00 H ATOM 1921 HB3 ASP A 126 7.459 1.876 -15.048 1.00 0.00 H ATOM 1922 H ASP A 126 6.204 1.663 -11.691 1.00 0.00 H ATOM 1923 N THR A 127 10.013 2.163 -13.872 1.00 32.70 N ATOM 1924 CA THR A 127 11.119 3.097 -13.991 1.00 33.48 C ATOM 1925 C THR A 127 10.585 4.428 -14.498 1.00 32.54 C ATOM 1926 O THR A 127 10.974 5.490 -14.005 1.00 32.98 O ATOM 1927 CB THR A 127 12.227 2.563 -14.929 1.00 37.50 C ATOM 1928 OG1 THR A 127 12.746 1.341 -14.396 1.00 41.05 O ATOM 1929 CG2 THR A 127 13.362 3.561 -15.046 1.00 38.91 C ATOM 1930 HA THR A 127 11.573 3.227 -13.008 1.00 0.00 H ATOM 1931 HB THR A 127 11.794 2.399 -15.916 1.00 0.00 H ATOM 1932 HG1 THR A 127 13.124 1.509 -13.496 1.00 0.00 H ATOM 1933 HG23 THR A 127 12.980 4.498 -15.451 1.00 0.00 H ATOM 1934 HG21 THR A 127 13.791 3.739 -14.060 1.00 0.00 H ATOM 1935 HG22 THR A 127 14.128 3.162 -15.711 1.00 0.00 H ATOM 1936 H THR A 127 10.018 1.285 -14.429 1.00 0.00 H ATOM 1937 N LYS A 128 9.668 4.363 -15.460 1.00 30.15 N ATOM 1938 CA LYS A 128 9.109 5.576 -16.049 1.00 33.96 C ATOM 1939 C LYS A 128 8.387 6.455 -15.029 1.00 31.78 C ATOM 1940 O LYS A 128 8.547 7.675 -15.033 1.00 32.03 O ATOM 1941 CB LYS A 128 8.168 5.257 -17.215 1.00 37.27 C ATOM 1942 CG LYS A 128 7.477 6.497 -17.761 1.00 43.21 C ATOM 1943 CD LYS A 128 6.610 6.203 -18.975 1.00 48.59 C ATOM 1944 CE LYS A 128 5.939 7.479 -19.474 1.00 51.37 C ATOM 1945 NZ LYS A 128 5.064 7.239 -20.664 1.00 56.80 N ATOM 1946 HA LYS A 128 9.963 6.139 -16.425 1.00 0.00 H ATOM 1947 HB2 LYS A 128 8.747 4.797 -18.016 1.00 0.00 H ATOM 1948 HB3 LYS A 128 7.408 4.556 -16.870 1.00 0.00 H ATOM 1949 HG2 LYS A 128 6.848 6.919 -16.977 1.00 0.00 H ATOM 1950 HG3 LYS A 128 8.238 7.224 -18.044 1.00 0.00 H ATOM 1951 HD2 LYS A 128 7.232 5.790 -19.769 1.00 0.00 H ATOM 1952 HD3 LYS A 128 5.844 5.478 -18.702 1.00 0.00 H ATOM 1953 HE2 LYS A 128 6.712 8.197 -19.747 1.00 0.00 H ATOM 1954 HE3 LYS A 128 5.330 7.892 -18.670 1.00 0.00 H ATOM 1955 HZ1 LYS A 128 5.637 6.853 -21.441 1.00 0.00 H ATOM 1956 HZ2 LYS A 128 4.317 6.561 -20.412 1.00 0.00 H ATOM 1957 HZ3 LYS A 128 4.633 8.137 -20.963 1.00 0.00 H ATOM 1958 H LYS A 128 9.345 3.434 -15.797 1.00 0.00 H ATOM 1959 N GLN A 129 7.584 5.857 -14.159 1.00 31.49 N ATOM 1960 CA GLN A 129 6.895 6.680 -13.172 1.00 32.93 C ATOM 1961 C GLN A 129 7.878 7.358 -12.204 1.00 27.24 C ATOM 1962 O GLN A 129 7.668 8.503 -11.819 1.00 26.29 O ATOM 1963 CB GLN A 129 5.762 5.927 -12.451 1.00 38.35 C ATOM 1964 CG GLN A 129 6.133 4.633 -11.771 1.00 41.23 C ATOM 1965 CD GLN A 129 4.902 3.843 -11.302 1.00 40.98 C ATOM 1966 OE1 GLN A 129 4.804 2.636 -11.521 1.00 38.77 O ATOM 1967 NE2 GLN A 129 3.970 4.526 -10.649 1.00 42.77 N ATOM 1968 HA GLN A 129 6.403 7.481 -13.723 1.00 0.00 H ATOM 1969 HB2 GLN A 129 5.353 6.594 -11.692 1.00 0.00 H ATOM 1970 HB3 GLN A 129 4.992 5.703 -13.189 1.00 0.00 H ATOM 1971 HG2 GLN A 129 6.697 4.018 -12.472 1.00 0.00 H ATOM 1972 HG3 GLN A 129 6.755 4.858 -10.905 1.00 0.00 H ATOM 1973 HE22 GLN A 129 4.092 5.546 -10.485 1.00 0.00 H ATOM 1974 HE21 GLN A 129 3.118 4.041 -10.301 1.00 0.00 H ATOM 1975 H GLN A 129 7.449 4.826 -14.180 1.00 0.00 H ATOM 1976 N ALA A 130 8.957 6.668 -11.833 1.00 23.76 N ATOM 1977 CA ALA A 130 9.968 7.275 -10.968 1.00 23.73 C ATOM 1978 C ALA A 130 10.771 8.368 -11.698 1.00 23.39 C ATOM 1979 O ALA A 130 11.037 9.441 -11.142 1.00 23.98 O ATOM 1980 CB ALA A 130 10.899 6.209 -10.381 1.00 25.12 C ATOM 1981 HA ALA A 130 9.441 7.758 -10.146 1.00 0.00 H ATOM 1982 HB1 ALA A 130 10.314 5.501 -9.793 1.00 0.00 H ATOM 1983 HB2 ALA A 130 11.402 5.682 -11.192 1.00 0.00 H ATOM 1984 HB3 ALA A 130 11.641 6.688 -9.742 1.00 0.00 H ATOM 1985 H ALA A 130 9.081 5.689 -12.162 1.00 0.00 H ATOM 1986 N GLN A 131 11.153 8.090 -12.942 1.00 22.69 N ATOM 1987 CA GLN A 131 11.826 9.081 -13.771 1.00 26.40 C ATOM 1988 C GLN A 131 10.974 10.341 -13.932 1.00 26.27 C ATOM 1989 O GLN A 131 11.487 11.458 -13.851 1.00 26.93 O ATOM 1990 CB GLN A 131 12.170 8.490 -15.146 1.00 31.33 C ATOM 1991 CG GLN A 131 13.279 7.437 -15.114 1.00 39.14 C ATOM 1992 CD GLN A 131 13.574 6.845 -16.487 1.00 47.77 C ATOM 1993 OE1 GLN A 131 12.780 6.981 -17.418 1.00 52.54 O ATOM 1994 NE2 GLN A 131 14.720 6.182 -16.616 1.00 50.20 N ATOM 1995 HA GLN A 131 12.752 9.362 -13.269 1.00 0.00 H ATOM 1996 HB2 GLN A 131 11.271 8.029 -15.555 1.00 0.00 H ATOM 1997 HB3 GLN A 131 12.488 9.303 -15.798 1.00 0.00 H ATOM 1998 HG2 GLN A 131 14.188 7.901 -14.732 1.00 0.00 H ATOM 1999 HG3 GLN A 131 12.975 6.631 -14.446 1.00 0.00 H ATOM 2000 HE22 GLN A 131 15.362 6.091 -15.803 1.00 0.00 H ATOM 2001 HE21 GLN A 131 14.974 5.755 -17.530 1.00 0.00 H ATOM 2002 H GLN A 131 10.967 7.144 -13.331 1.00 0.00 H ATOM 2003 N ASP A 132 9.677 10.160 -14.179 1.00 27.69 N ATOM 2004 CA ASP A 132 8.775 11.297 -14.358 1.00 30.73 C ATOM 2005 C ASP A 132 8.679 12.136 -13.085 1.00 28.23 C ATOM 2006 O ASP A 132 8.670 13.371 -13.143 1.00 26.68 O ATOM 2007 CB ASP A 132 7.375 10.839 -14.785 1.00 33.31 C ATOM 2008 CG ASP A 132 7.324 10.340 -16.224 1.00 39.02 C ATOM 2009 OD1 ASP A 132 8.284 10.572 -16.988 1.00 38.97 O ATOM 2010 OD2 ASP A 132 6.307 9.718 -16.592 1.00 41.89 O ATOM 2011 HA ASP A 132 9.196 11.914 -15.152 1.00 0.00 H ATOM 2012 HB2 ASP A 132 7.057 10.031 -14.126 1.00 0.00 H ATOM 2013 HB3 ASP A 132 6.689 11.680 -14.684 1.00 0.00 H ATOM 2014 H ASP A 132 9.300 9.193 -14.246 1.00 0.00 H ATOM 2015 N LEU A 133 8.596 11.462 -11.937 1.00 26.37 N ATOM 2016 CA LEU A 133 8.520 12.148 -10.656 1.00 23.50 C ATOM 2017 C LEU A 133 9.786 12.976 -10.427 1.00 23.62 C ATOM 2018 O LEU A 133 9.720 14.146 -10.052 1.00 23.43 O ATOM 2019 CB LEU A 133 8.355 11.148 -9.508 1.00 21.62 C ATOM 2020 CG LEU A 133 8.231 11.778 -8.114 1.00 24.20 C ATOM 2021 CD1 LEU A 133 6.956 12.620 -7.991 1.00 27.26 C ATOM 2022 CD2 LEU A 133 8.289 10.699 -7.017 1.00 27.34 C ATOM 2023 HA LEU A 133 7.650 12.805 -10.677 1.00 0.00 H ATOM 2024 HB2 LEU A 133 7.455 10.562 -9.696 1.00 0.00 H ATOM 2025 HB3 LEU A 133 9.223 10.489 -9.506 1.00 0.00 H ATOM 2026 HG LEU A 133 9.080 12.447 -7.976 1.00 0.00 H ATOM 2027 HD21 LEU A 133 7.469 9.995 -7.158 1.00 0.00 H ATOM 2028 HD22 LEU A 133 9.240 10.169 -7.080 1.00 0.00 H ATOM 2029 HD23 LEU A 133 8.199 11.172 -6.039 1.00 0.00 H ATOM 2030 HD11 LEU A 133 6.977 13.420 -8.732 1.00 0.00 H ATOM 2031 HD12 LEU A 133 6.086 11.987 -8.163 1.00 0.00 H ATOM 2032 HD13 LEU A 133 6.901 13.050 -6.991 1.00 0.00 H ATOM 2033 H LEU A 133 8.585 10.422 -11.958 1.00 0.00 H ATOM 2034 N ALA A 134 10.940 12.356 -10.647 1.00 23.24 N ATOM 2035 CA ALA A 134 12.213 13.050 -10.472 1.00 24.49 C ATOM 2036 C ALA A 134 12.272 14.267 -11.386 1.00 24.93 C ATOM 2037 O ALA A 134 12.747 15.326 -10.988 1.00 24.79 O ATOM 2038 CB ALA A 134 13.370 12.122 -10.768 1.00 24.49 C ATOM 2039 HA ALA A 134 12.290 13.378 -9.435 1.00 0.00 H ATOM 2040 HB1 ALA A 134 13.335 11.271 -10.088 1.00 0.00 H ATOM 2041 HB2 ALA A 134 13.298 11.770 -11.797 1.00 0.00 H ATOM 2042 HB3 ALA A 134 14.309 12.659 -10.632 1.00 0.00 H ATOM 2043 H ALA A 134 10.937 11.361 -10.949 1.00 0.00 H ATOM 2044 N ARG A 135 11.784 14.113 -12.612 1.00 25.80 N ATOM 2045 CA ARG A 135 11.770 15.228 -13.560 1.00 28.10 C ATOM 2046 C ARG A 135 10.911 16.373 -13.023 1.00 26.45 C ATOM 2047 O ARG A 135 11.312 17.538 -13.063 1.00 26.23 O ATOM 2048 CB ARG A 135 11.262 14.774 -14.936 1.00 30.51 C ATOM 2049 CG ARG A 135 11.362 15.867 -16.013 1.00 36.79 C ATOM 2050 CD ARG A 135 10.863 15.398 -17.380 1.00 42.07 C ATOM 2051 NE ARG A 135 9.402 15.394 -17.465 1.00 45.25 N ATOM 2052 CZ ARG A 135 8.652 14.295 -17.470 1.00 49.45 C ATOM 2053 NH1 ARG A 135 7.330 14.397 -17.543 1.00 52.04 N ATOM 2054 NH2 ARG A 135 9.221 13.095 -17.412 1.00 48.57 N ATOM 2055 HA ARG A 135 12.793 15.585 -13.679 1.00 0.00 H ATOM 2056 HB2 ARG A 135 11.853 13.916 -15.257 1.00 0.00 H ATOM 2057 HB3 ARG A 135 10.217 14.478 -14.839 1.00 0.00 H ATOM 2058 HG2 ARG A 135 10.764 16.722 -15.698 1.00 0.00 H ATOM 2059 HG3 ARG A 135 12.405 16.169 -16.107 1.00 0.00 H ATOM 2060 HD2 ARG A 135 11.228 14.387 -17.559 1.00 0.00 H ATOM 2061 HD3 ARG A 135 11.257 16.066 -18.146 1.00 0.00 H ATOM 2062 HE ARG A 135 8.917 16.312 -17.526 1.00 0.00 H ATOM 2063 HH12 ARG A 135 6.742 13.539 -17.547 1.00 0.00 H ATOM 2064 HH11 ARG A 135 6.883 15.334 -17.596 1.00 0.00 H ATOM 2065 HH22 ARG A 135 8.631 12.239 -17.416 1.00 0.00 H ATOM 2066 HH21 ARG A 135 10.257 13.012 -17.362 1.00 0.00 H ATOM 2067 H ARG A 135 11.407 13.188 -12.902 1.00 0.00 H ATOM 2068 N SER A 136 9.726 16.039 -12.520 1.00 27.69 N ATOM 2069 CA SER A 136 8.849 17.037 -11.915 1.00 25.33 C ATOM 2070 C SER A 136 9.569 17.786 -10.780 1.00 25.21 C ATOM 2071 O SER A 136 9.478 19.014 -10.664 1.00 27.02 O ATOM 2072 CB SER A 136 7.564 16.374 -11.407 1.00 31.68 C ATOM 2073 OG SER A 136 6.759 17.313 -10.721 1.00 43.55 O ATOM 2074 HA SER A 136 8.581 17.769 -12.677 1.00 0.00 H ATOM 2075 HB2 SER A 136 7.824 15.561 -10.729 1.00 0.00 H ATOM 2076 HB3 SER A 136 7.007 15.975 -12.255 1.00 0.00 H ATOM 2077 HG SER A 136 5.935 16.868 -10.401 1.00 0.00 H ATOM 2078 H SER A 136 9.418 15.046 -12.558 1.00 0.00 H ATOM 2079 N TYR A 137 10.284 17.048 -9.940 1.00 24.35 N ATOM 2080 CA TYR A 137 10.982 17.662 -8.811 1.00 26.24 C ATOM 2081 C TYR A 137 12.255 18.413 -9.209 1.00 27.58 C ATOM 2082 O TYR A 137 12.803 19.200 -8.414 1.00 29.65 O ATOM 2083 CB TYR A 137 11.347 16.598 -7.781 1.00 27.12 C ATOM 2084 CG TYR A 137 10.183 15.988 -7.038 1.00 27.20 C ATOM 2085 CD1 TYR A 137 8.918 16.569 -7.063 1.00 27.03 C ATOM 2086 CD2 TYR A 137 10.360 14.829 -6.291 1.00 27.03 C ATOM 2087 CE1 TYR A 137 7.858 15.997 -6.360 1.00 28.66 C ATOM 2088 CE2 TYR A 137 9.321 14.261 -5.586 1.00 29.16 C ATOM 2089 CZ TYR A 137 8.073 14.842 -5.627 1.00 29.76 C ATOM 2090 OH TYR A 137 7.050 14.266 -4.920 1.00 30.99 O ATOM 2091 HA TYR A 137 10.289 18.393 -8.395 1.00 0.00 H ATOM 2092 HB3 TYR A 137 12.012 17.054 -7.048 1.00 0.00 H ATOM 2093 HB2 TYR A 137 11.873 15.796 -8.298 1.00 0.00 H ATOM 2094 HD2 TYR A 137 11.343 14.359 -6.262 1.00 0.00 H ATOM 2095 HE2 TYR A 137 9.486 13.357 -4.999 1.00 0.00 H ATOM 2096 HE1 TYR A 137 6.869 16.455 -6.387 1.00 0.00 H ATOM 2097 HD1 TYR A 137 8.754 17.480 -7.638 1.00 0.00 H ATOM 2098 HH TYR A 137 6.223 14.795 -5.048 1.00 0.00 H ATOM 2099 H TYR A 137 10.349 16.020 -10.086 1.00 0.00 H ATOM 2100 N GLY A 138 12.738 18.155 -10.421 1.00 25.14 N ATOM 2101 CA GLY A 138 14.001 18.724 -10.869 1.00 27.07 C ATOM 2102 C GLY A 138 15.224 18.089 -10.219 1.00 26.77 C ATOM 2103 O GLY A 138 16.270 18.746 -10.044 1.00 28.93 O ATOM 2104 HA3 GLY A 138 14.001 19.789 -10.636 1.00 0.00 H ATOM 2105 HA2 GLY A 138 14.076 18.590 -11.948 1.00 0.00 H ATOM 2106 H GLY A 138 12.203 17.534 -11.061 1.00 0.00 H ATOM 2107 N ILE A 139 15.115 16.807 -9.869 1.00 25.89 N ATOM 2108 CA ILE A 139 16.205 16.104 -9.181 1.00 26.38 C ATOM 2109 C ILE A 139 16.611 14.828 -9.923 1.00 25.74 C ATOM 2110 O ILE A 139 15.842 14.297 -10.732 1.00 23.87 O ATOM 2111 CB ILE A 139 15.824 15.741 -7.727 1.00 24.72 C ATOM 2112 CG1 ILE A 139 14.707 14.682 -7.704 1.00 23.62 C ATOM 2113 CG2 ILE A 139 15.411 16.980 -6.944 1.00 25.29 C ATOM 2114 CD1 ILE A 139 14.311 14.258 -6.290 1.00 24.09 C ATOM 2115 HA ILE A 139 17.050 16.792 -9.166 1.00 0.00 H ATOM 2116 HB ILE A 139 16.705 15.318 -7.244 1.00 0.00 H ATOM 2117 HG12 ILE A 139 13.829 15.093 -8.202 1.00 0.00 H ATOM 2118 HG13 ILE A 139 15.052 13.802 -8.246 1.00 0.00 H ATOM 2119 HD11 ILE A 139 15.178 13.835 -5.783 1.00 0.00 H ATOM 2120 HD12 ILE A 139 13.954 15.127 -5.738 1.00 0.00 H ATOM 2121 HD13 ILE A 139 13.520 13.510 -6.344 1.00 0.00 H ATOM 2122 HG21 ILE A 139 16.240 17.687 -6.922 1.00 0.00 H ATOM 2123 HG22 ILE A 139 14.550 17.443 -7.426 1.00 0.00 H ATOM 2124 HG23 ILE A 139 15.149 16.694 -5.925 1.00 0.00 H ATOM 2125 H ILE A 139 14.238 16.293 -10.088 1.00 0.00 H ATOM 2126 N PRO A 140 17.823 14.326 -9.651 1.00 24.34 N ATOM 2127 CA PRO A 140 18.248 13.066 -10.273 1.00 24.78 C ATOM 2128 C PRO A 140 17.478 11.856 -9.744 1.00 24.56 C ATOM 2129 O PRO A 140 16.995 11.865 -8.607 1.00 22.53 O ATOM 2130 CB PRO A 140 19.722 12.952 -9.854 1.00 26.67 C ATOM 2131 CG PRO A 140 20.133 14.360 -9.556 1.00 27.01 C ATOM 2132 CD PRO A 140 18.923 14.964 -8.908 1.00 24.99 C ATOM 2133 HA PRO A 140 18.077 13.074 -11.349 1.00 0.00 H ATOM 2134 HD3 PRO A 140 18.878 14.719 -7.847 1.00 0.00 H ATOM 2135 HD2 PRO A 140 18.907 16.047 -9.030 1.00 0.00 H ATOM 2136 HG3 PRO A 140 20.387 14.892 -10.473 1.00 0.00 H ATOM 2137 HG2 PRO A 140 20.986 14.379 -8.878 1.00 0.00 H ATOM 2138 HB2 PRO A 140 19.825 12.324 -8.969 1.00 0.00 H ATOM 2139 HB3 PRO A 140 20.323 12.537 -10.664 1.00 0.00 H ATOM 2140 N PHE A 141 17.370 10.835 -10.589 1.00 23.04 N ATOM 2141 CA PHE A 141 16.825 9.542 -10.209 1.00 22.05 C ATOM 2142 C PHE A 141 17.881 8.475 -10.480 1.00 22.55 C ATOM 2143 O PHE A 141 18.413 8.371 -11.597 1.00 25.40 O ATOM 2144 CB PHE A 141 15.554 9.229 -11.002 1.00 23.79 C ATOM 2145 CG PHE A 141 15.068 7.814 -10.835 1.00 24.65 C ATOM 2146 CD1 PHE A 141 14.899 7.274 -9.566 1.00 23.33 C ATOM 2147 CD2 PHE A 141 14.748 7.033 -11.942 1.00 27.15 C ATOM 2148 CE1 PHE A 141 14.438 5.982 -9.392 1.00 22.01 C ATOM 2149 CE2 PHE A 141 14.280 5.729 -11.781 1.00 27.38 C ATOM 2150 CZ PHE A 141 14.136 5.196 -10.499 1.00 24.00 C ATOM 2151 HA PHE A 141 16.563 9.558 -9.151 1.00 0.00 H ATOM 2152 HB2 PHE A 141 14.766 9.905 -10.670 1.00 0.00 H ATOM 2153 HB3 PHE A 141 15.757 9.401 -12.059 1.00 0.00 H ATOM 2154 HD2 PHE A 141 14.864 7.445 -12.945 1.00 0.00 H ATOM 2155 HE2 PHE A 141 14.027 5.128 -12.654 1.00 0.00 H ATOM 2156 HZ PHE A 141 13.789 4.171 -10.366 1.00 0.00 H ATOM 2157 HE1 PHE A 141 14.311 5.579 -8.387 1.00 0.00 H ATOM 2158 HD1 PHE A 141 15.134 7.880 -8.691 1.00 0.00 H ATOM 2159 H PHE A 141 17.691 10.968 -11.569 1.00 0.00 H ATOM 2160 N ILE A 142 18.191 7.694 -9.452 1.00 22.09 N ATOM 2161 CA ILE A 142 19.162 6.613 -9.574 1.00 22.35 C ATOM 2162 C ILE A 142 18.567 5.301 -9.089 1.00 20.75 C ATOM 2163 O ILE A 142 17.963 5.241 -8.015 1.00 22.74 O ATOM 2164 CB ILE A 142 20.441 6.911 -8.762 1.00 27.10 C ATOM 2165 CG1 ILE A 142 21.065 8.242 -9.226 1.00 32.72 C ATOM 2166 CG2 ILE A 142 21.433 5.758 -8.888 1.00 31.23 C ATOM 2167 CD1 ILE A 142 22.388 8.549 -8.600 1.00 37.86 C ATOM 2168 HA ILE A 142 19.422 6.532 -10.629 1.00 0.00 H ATOM 2169 HB ILE A 142 20.179 7.009 -7.709 1.00 0.00 H ATOM 2170 HG12 ILE A 142 21.200 8.199 -10.307 1.00 0.00 H ATOM 2171 HG13 ILE A 142 20.374 9.048 -8.979 1.00 0.00 H ATOM 2172 HD11 ILE A 142 22.271 8.609 -7.518 1.00 0.00 H ATOM 2173 HD12 ILE A 142 23.097 7.759 -8.847 1.00 0.00 H ATOM 2174 HD13 ILE A 142 22.756 9.502 -8.981 1.00 0.00 H ATOM 2175 HG21 ILE A 142 20.976 4.844 -8.508 1.00 0.00 H ATOM 2176 HG22 ILE A 142 21.701 5.624 -9.936 1.00 0.00 H ATOM 2177 HG23 ILE A 142 22.328 5.986 -8.309 1.00 0.00 H ATOM 2178 H ILE A 142 17.729 7.858 -8.535 1.00 0.00 H ATOM 2179 N GLU A 143 18.730 4.251 -9.889 1.00 21.66 N ATOM 2180 CA GLU A 143 18.311 2.915 -9.476 1.00 23.79 C ATOM 2181 C GLU A 143 19.464 2.164 -8.822 1.00 24.30 C ATOM 2182 O GLU A 143 20.601 2.226 -9.294 1.00 25.75 O ATOM 2183 CB GLU A 143 17.741 2.131 -10.658 1.00 27.43 C ATOM 2184 CG GLU A 143 16.371 2.653 -11.078 1.00 31.03 C ATOM 2185 CD GLU A 143 15.752 1.871 -12.227 1.00 40.72 C ATOM 2186 OE1 GLU A 143 14.507 1.792 -12.289 1.00 43.88 O ATOM 2187 OE2 GLU A 143 16.507 1.347 -13.071 1.00 45.45 O ATOM 2188 HA GLU A 143 17.518 3.022 -8.735 1.00 0.00 H ATOM 2189 HB2 GLU A 143 18.425 2.218 -11.502 1.00 0.00 H ATOM 2190 HB3 GLU A 143 17.647 1.083 -10.374 1.00 0.00 H ATOM 2191 HG2 GLU A 143 15.701 2.595 -10.220 1.00 0.00 H ATOM 2192 HG3 GLU A 143 16.477 3.693 -11.385 1.00 0.00 H ATOM 2193 H GLU A 143 19.163 4.384 -10.825 1.00 0.00 H ATOM 2194 N THR A 144 19.163 1.455 -7.737 1.00 22.50 N ATOM 2195 CA THR A 144 20.193 0.775 -6.957 1.00 23.97 C ATOM 2196 C THR A 144 19.797 -0.637 -6.569 1.00 23.73 C ATOM 2197 O THR A 144 18.613 -0.992 -6.552 1.00 22.48 O ATOM 2198 CB THR A 144 20.519 1.544 -5.645 1.00 22.84 C ATOM 2199 OG1 THR A 144 19.354 1.596 -4.805 1.00 21.32 O ATOM 2200 CG2 THR A 144 20.995 2.965 -5.944 1.00 24.04 C ATOM 2201 HA THR A 144 21.066 0.741 -7.609 1.00 0.00 H ATOM 2202 HB THR A 144 21.319 1.011 -5.131 1.00 0.00 H ATOM 2203 HG1 THR A 144 19.068 0.675 -4.581 1.00 0.00 H ATOM 2204 HG23 THR A 144 21.879 2.924 -6.581 1.00 0.00 H ATOM 2205 HG21 THR A 144 20.202 3.512 -6.454 1.00 0.00 H ATOM 2206 HG22 THR A 144 21.242 3.468 -5.009 1.00 0.00 H ATOM 2207 H THR A 144 18.170 1.383 -7.437 1.00 0.00 H ATOM 2208 N SER A 145 20.812 -1.435 -6.263 1.00 22.94 N ATOM 2209 CA SER A 145 20.625 -2.674 -5.526 1.00 24.84 C ATOM 2210 C SER A 145 21.683 -2.726 -4.439 1.00 26.10 C ATOM 2211 O SER A 145 22.869 -2.838 -4.738 1.00 29.59 O ATOM 2212 CB SER A 145 20.770 -3.894 -6.434 1.00 24.62 C ATOM 2213 OG SER A 145 20.709 -5.078 -5.655 1.00 26.75 O ATOM 2214 HA SER A 145 19.620 -2.695 -5.105 1.00 0.00 H ATOM 2215 HB2 SER A 145 21.728 -3.849 -6.952 1.00 0.00 H ATOM 2216 HB3 SER A 145 19.963 -3.899 -7.166 1.00 0.00 H ATOM 2217 HG SER A 145 19.838 -5.118 -5.186 1.00 0.00 H ATOM 2218 H SER A 145 21.772 -1.166 -6.560 1.00 0.00 H ATOM 2219 N ALA A 146 21.261 -2.626 -3.182 1.00 25.40 N ATOM 2220 CA ALA A 146 22.184 -2.788 -2.071 1.00 29.20 C ATOM 2221 C ALA A 146 22.695 -4.233 -2.037 1.00 30.48 C ATOM 2222 O ALA A 146 23.777 -4.509 -1.518 1.00 31.25 O ATOM 2223 CB ALA A 146 21.506 -2.428 -0.766 1.00 30.02 C ATOM 2224 HA ALA A 146 23.032 -2.117 -2.206 1.00 0.00 H ATOM 2225 HB1 ALA A 146 21.174 -1.390 -0.805 1.00 0.00 H ATOM 2226 HB2 ALA A 146 20.646 -3.080 -0.613 1.00 0.00 H ATOM 2227 HB3 ALA A 146 22.211 -2.555 0.055 1.00 0.00 H ATOM 2228 H ALA A 146 20.258 -2.429 -2.991 1.00 0.00 H ATOM 2229 N LYS A 147 21.916 -5.154 -2.593 1.00 29.45 N ATOM 2230 CA LYS A 147 22.327 -6.560 -2.628 1.00 32.49 C ATOM 2231 C LYS A 147 23.549 -6.784 -3.522 1.00 34.01 C ATOM 2232 O LYS A 147 24.516 -7.447 -3.124 1.00 37.80 O ATOM 2233 CB LYS A 147 21.172 -7.463 -3.078 1.00 35.45 C ATOM 2234 CG LYS A 147 21.536 -8.946 -3.113 1.00 39.73 C ATOM 2235 CD LYS A 147 20.364 -9.798 -3.562 1.00 44.01 C ATOM 2236 CE LYS A 147 20.738 -11.275 -3.594 1.00 48.10 C ATOM 2237 NZ LYS A 147 19.632 -12.107 -4.142 1.00 52.59 N ATOM 2238 HA LYS A 147 22.608 -6.828 -1.609 1.00 0.00 H ATOM 2239 HB2 LYS A 147 20.339 -7.328 -2.388 1.00 0.00 H ATOM 2240 HB3 LYS A 147 20.866 -7.159 -4.079 1.00 0.00 H ATOM 2241 HG2 LYS A 147 22.365 -9.091 -3.806 1.00 0.00 H ATOM 2242 HG3 LYS A 147 21.840 -9.260 -2.114 1.00 0.00 H ATOM 2243 HD2 LYS A 147 19.534 -9.656 -2.869 1.00 0.00 H ATOM 2244 HD3 LYS A 147 20.059 -9.486 -4.561 1.00 0.00 H ATOM 2245 HE2 LYS A 147 20.961 -11.606 -2.580 1.00 0.00 H ATOM 2246 HE3 LYS A 147 21.621 -11.403 -4.220 1.00 0.00 H ATOM 2247 HZ1 LYS A 147 18.787 -11.994 -3.546 1.00 0.00 H ATOM 2248 HZ2 LYS A 147 19.417 -11.800 -5.112 1.00 0.00 H ATOM 2249 HZ3 LYS A 147 19.922 -13.106 -4.149 1.00 0.00 H ATOM 2250 H LYS A 147 21.004 -4.874 -3.008 1.00 0.00 H ATOM 2251 N THR A 148 23.511 -6.234 -4.732 1.00 33.36 N ATOM 2252 CA THR A 148 24.620 -6.399 -5.680 1.00 36.68 C ATOM 2253 C THR A 148 25.636 -5.261 -5.583 1.00 37.36 C ATOM 2254 O THR A 148 26.758 -5.356 -6.104 1.00 40.12 O ATOM 2255 CB THR A 148 24.111 -6.459 -7.129 1.00 36.26 C ATOM 2256 OG1 THR A 148 23.629 -5.168 -7.521 1.00 33.80 O ATOM 2257 CG2 THR A 148 22.994 -7.484 -7.261 1.00 37.44 C ATOM 2258 HA THR A 148 25.104 -7.338 -5.412 1.00 0.00 H ATOM 2259 HB THR A 148 24.935 -6.756 -7.778 1.00 0.00 H ATOM 2260 HG1 THR A 148 23.302 -5.209 -8.454 1.00 0.00 H ATOM 2261 HG23 THR A 148 23.365 -8.464 -6.962 1.00 0.00 H ATOM 2262 HG21 THR A 148 22.162 -7.197 -6.618 1.00 0.00 H ATOM 2263 HG22 THR A 148 22.658 -7.522 -8.297 1.00 0.00 H ATOM 2264 H THR A 148 22.679 -5.676 -5.012 1.00 0.00 H ATOM 2265 N ARG A 149 25.214 -4.193 -4.917 1.00 36.21 N ATOM 2266 CA ARG A 149 25.965 -2.947 -4.777 1.00 34.87 C ATOM 2267 C ARG A 149 25.818 -2.012 -5.980 1.00 31.69 C ATOM 2268 O ARG A 149 26.376 -0.915 -5.989 1.00 33.01 O ATOM 2269 CB ARG A 149 27.448 -3.181 -4.438 1.00 37.87 C ATOM 2270 CG ARG A 149 28.051 -2.022 -3.652 1.00 41.26 C ATOM 2271 CD ARG A 149 29.511 -2.248 -3.290 1.00 45.16 C ATOM 2272 NE ARG A 149 29.990 -1.200 -2.393 1.00 48.47 N ATOM 2273 CZ ARG A 149 30.347 0.018 -2.793 1.00 50.39 C ATOM 2274 NH1 ARG A 149 30.770 0.916 -1.909 1.00 49.86 N ATOM 2275 NH2 ARG A 149 30.284 0.335 -4.079 1.00 51.08 N ATOM 2276 HA ARG A 149 25.510 -2.440 -3.926 1.00 0.00 H ATOM 2277 HB2 ARG A 149 27.533 -4.090 -3.843 1.00 0.00 H ATOM 2278 HB3 ARG A 149 28.005 -3.303 -5.367 1.00 0.00 H ATOM 2279 HG2 ARG A 149 27.978 -1.117 -4.255 1.00 0.00 H ATOM 2280 HG3 ARG A 149 27.481 -1.891 -2.732 1.00 0.00 H ATOM 2281 HD2 ARG A 149 30.111 -2.242 -4.200 1.00 0.00 H ATOM 2282 HD3 ARG A 149 29.612 -3.215 -2.797 1.00 0.00 H ATOM 2283 HE ARG A 149 30.056 -1.419 -1.379 1.00 0.00 H ATOM 2284 HH12 ARG A 149 31.048 1.867 -2.226 1.00 0.00 H ATOM 2285 HH11 ARG A 149 30.823 0.668 -0.900 1.00 0.00 H ATOM 2286 HH22 ARG A 149 30.562 1.286 -4.394 1.00 0.00 H ATOM 2287 HH21 ARG A 149 29.956 -0.368 -4.772 1.00 0.00 H ATOM 2288 H ARG A 149 24.281 -4.247 -4.461 1.00 0.00 H ATOM 2289 N GLN A 150 25.050 -2.429 -6.982 1.00 31.25 N ATOM 2290 CA GLN A 150 24.853 -1.586 -8.157 1.00 30.44 C ATOM 2291 C GLN A 150 24.259 -0.226 -7.801 1.00 28.37 C ATOM 2292 O GLN A 150 23.246 -0.145 -7.106 1.00 28.02 O ATOM 2293 CB GLN A 150 23.954 -2.268 -9.177 1.00 34.00 C ATOM 2294 CG GLN A 150 23.665 -1.381 -10.371 1.00 38.72 C ATOM 2295 CD GLN A 150 23.058 -2.135 -11.524 1.00 40.55 C ATOM 2296 OE1 GLN A 150 22.496 -3.215 -11.347 1.00 39.45 O ATOM 2297 NE2 GLN A 150 23.177 -1.574 -12.724 1.00 44.90 N ATOM 2298 HA GLN A 150 25.842 -1.428 -8.587 1.00 0.00 H ATOM 2299 HB2 GLN A 150 24.445 -3.177 -9.525 1.00 0.00 H ATOM 2300 HB3 GLN A 150 23.011 -2.527 -8.696 1.00 0.00 H ATOM 2301 HG2 GLN A 150 22.972 -0.597 -10.064 1.00 0.00 H ATOM 2302 HG3 GLN A 150 24.599 -0.929 -10.703 1.00 0.00 H ATOM 2303 HE22 GLN A 150 23.661 -0.659 -12.825 1.00 0.00 H ATOM 2304 HE21 GLN A 150 22.786 -2.050 -13.562 1.00 0.00 H ATOM 2305 H GLN A 150 24.588 -3.359 -6.928 1.00 0.00 H ATOM 2306 N GLY A 151 24.898 0.837 -8.284 1.00 28.49 N ATOM 2307 CA GLY A 151 24.369 2.182 -8.153 1.00 26.71 C ATOM 2308 C GLY A 151 24.584 2.844 -6.802 1.00 26.33 C ATOM 2309 O GLY A 151 24.262 4.019 -6.635 1.00 27.23 O ATOM 2310 HA3 GLY A 151 23.296 2.140 -8.339 1.00 0.00 H ATOM 2311 HA2 GLY A 151 24.844 2.805 -8.911 1.00 0.00 H ATOM 2312 H GLY A 151 25.806 0.699 -8.771 1.00 0.00 H ATOM 2313 N VAL A 152 25.127 2.108 -5.835 1.00 25.70 N ATOM 2314 CA VAL A 152 25.262 2.645 -4.476 1.00 27.27 C ATOM 2315 C VAL A 152 26.168 3.880 -4.418 1.00 28.50 C ATOM 2316 O VAL A 152 25.755 4.945 -3.942 1.00 27.89 O ATOM 2317 CB VAL A 152 25.723 1.562 -3.460 1.00 28.87 C ATOM 2318 CG1 VAL A 152 26.053 2.190 -2.103 1.00 30.82 C ATOM 2319 CG2 VAL A 152 24.648 0.489 -3.310 1.00 30.82 C ATOM 2320 HA VAL A 152 24.263 2.967 -4.181 1.00 0.00 H ATOM 2321 HB VAL A 152 26.631 1.095 -3.843 1.00 0.00 H ATOM 2322 HG11 VAL A 152 26.854 2.919 -2.227 1.00 0.00 H ATOM 2323 HG12 VAL A 152 25.166 2.686 -1.708 1.00 0.00 H ATOM 2324 HG13 VAL A 152 26.373 1.410 -1.411 1.00 0.00 H ATOM 2325 HG21 VAL A 152 23.727 0.947 -2.951 1.00 0.00 H ATOM 2326 HG22 VAL A 152 24.468 0.019 -4.277 1.00 0.00 H ATOM 2327 HG23 VAL A 152 24.984 -0.263 -2.596 1.00 0.00 H ATOM 2328 H VAL A 152 25.458 1.145 -6.044 1.00 0.00 H ATOM 2329 N ASP A 153 27.397 3.750 -4.902 1.00 29.37 N ATOM 2330 CA ASP A 153 28.293 4.900 -4.916 1.00 32.00 C ATOM 2331 C ASP A 153 27.678 6.038 -5.726 1.00 31.49 C ATOM 2332 O ASP A 153 27.732 7.194 -5.319 1.00 31.18 O ATOM 2333 CB ASP A 153 29.656 4.539 -5.501 1.00 36.56 C ATOM 2334 CG ASP A 153 30.398 3.521 -4.667 1.00 43.98 C ATOM 2335 OD1 ASP A 153 30.272 3.550 -3.426 1.00 45.40 O ATOM 2336 OD2 ASP A 153 31.114 2.691 -5.258 1.00 49.67 O ATOM 2337 HA ASP A 153 28.435 5.219 -3.884 1.00 0.00 H ATOM 2338 HB2 ASP A 153 29.509 4.131 -6.501 1.00 0.00 H ATOM 2339 HB3 ASP A 153 30.259 5.445 -5.564 1.00 0.00 H ATOM 2340 H ASP A 153 27.719 2.832 -5.270 1.00 0.00 H ATOM 2341 N ASP A 154 27.087 5.701 -6.872 1.00 30.98 N ATOM 2342 CA ASP A 154 26.484 6.701 -7.744 1.00 30.83 C ATOM 2343 C ASP A 154 25.414 7.528 -7.025 1.00 28.54 C ATOM 2344 O ASP A 154 25.390 8.751 -7.150 1.00 27.56 O ATOM 2345 CB ASP A 154 25.904 6.034 -8.997 1.00 36.88 C ATOM 2346 CG ASP A 154 25.533 7.033 -10.077 1.00 45.33 C ATOM 2347 OD1 ASP A 154 26.024 8.183 -10.030 1.00 49.58 O ATOM 2348 OD2 ASP A 154 24.755 6.663 -10.983 1.00 49.60 O ATOM 2349 HA ASP A 154 27.272 7.392 -8.042 1.00 0.00 H ATOM 2350 HB2 ASP A 154 26.646 5.345 -9.400 1.00 0.00 H ATOM 2351 HB3 ASP A 154 25.010 5.479 -8.714 1.00 0.00 H ATOM 2352 H ASP A 154 27.055 4.700 -7.151 1.00 0.00 H ATOM 2353 N ALA A 155 24.535 6.861 -6.275 1.00 26.89 N ATOM 2354 CA ALA A 155 23.483 7.559 -5.535 1.00 25.25 C ATOM 2355 C ALA A 155 24.070 8.607 -4.593 1.00 25.78 C ATOM 2356 O ALA A 155 23.673 9.776 -4.616 1.00 25.77 O ATOM 2357 CB ALA A 155 22.625 6.575 -4.757 1.00 24.51 C ATOM 2358 HA ALA A 155 22.854 8.071 -6.263 1.00 0.00 H ATOM 2359 HB1 ALA A 155 22.161 5.873 -5.450 1.00 0.00 H ATOM 2360 HB2 ALA A 155 23.250 6.030 -4.050 1.00 0.00 H ATOM 2361 HB3 ALA A 155 21.851 7.119 -4.216 1.00 0.00 H ATOM 2362 H ALA A 155 24.599 5.825 -6.215 1.00 0.00 H ATOM 2363 N PHE A 156 25.017 8.186 -3.760 1.00 24.55 N ATOM 2364 CA PHE A 156 25.595 9.089 -2.771 1.00 25.07 C ATOM 2365 C PHE A 156 26.427 10.204 -3.407 1.00 29.08 C ATOM 2366 O PHE A 156 26.333 11.362 -2.998 1.00 30.61 O ATOM 2367 CB PHE A 156 26.414 8.310 -1.731 1.00 27.31 C ATOM 2368 CG PHE A 156 25.569 7.550 -0.741 1.00 30.72 C ATOM 2369 CD1 PHE A 156 25.060 8.184 0.382 1.00 31.09 C ATOM 2370 CD2 PHE A 156 25.292 6.201 -0.930 1.00 30.84 C ATOM 2371 CE1 PHE A 156 24.290 7.487 1.304 1.00 30.41 C ATOM 2372 CE2 PHE A 156 24.522 5.498 -0.013 1.00 30.47 C ATOM 2373 CZ PHE A 156 24.017 6.146 1.104 1.00 32.00 C ATOM 2374 HA PHE A 156 24.763 9.575 -2.262 1.00 0.00 H ATOM 2375 HB2 PHE A 156 27.052 7.599 -2.257 1.00 0.00 H ATOM 2376 HB3 PHE A 156 27.036 9.017 -1.182 1.00 0.00 H ATOM 2377 HD2 PHE A 156 25.684 5.689 -1.809 1.00 0.00 H ATOM 2378 HE2 PHE A 156 24.315 4.440 -0.171 1.00 0.00 H ATOM 2379 HZ PHE A 156 23.406 5.600 1.823 1.00 0.00 H ATOM 2380 HE1 PHE A 156 23.901 7.997 2.185 1.00 0.00 H ATOM 2381 HD1 PHE A 156 25.267 9.242 0.543 1.00 0.00 H ATOM 2382 H PHE A 156 25.349 7.202 -3.814 1.00 0.00 H ATOM 2383 N TYR A 157 27.235 9.859 -4.407 1.00 30.42 N ATOM 2384 CA TYR A 157 28.060 10.856 -5.088 1.00 30.93 C ATOM 2385 C TYR A 157 27.202 11.862 -5.846 1.00 31.40 C ATOM 2386 O TYR A 157 27.537 13.041 -5.932 1.00 29.89 O ATOM 2387 CB TYR A 157 29.009 10.200 -6.082 1.00 34.67 C ATOM 2388 CG TYR A 157 30.113 9.372 -5.469 1.00 40.85 C ATOM 2389 CD1 TYR A 157 30.078 8.985 -4.134 1.00 41.79 C ATOM 2390 CD2 TYR A 157 31.204 8.982 -6.235 1.00 47.01 C ATOM 2391 CE1 TYR A 157 31.105 8.218 -3.583 1.00 45.19 C ATOM 2392 CE2 TYR A 157 32.221 8.226 -5.699 1.00 49.90 C ATOM 2393 CZ TYR A 157 32.169 7.847 -4.375 1.00 49.67 C ATOM 2394 OH TYR A 157 33.199 7.093 -3.853 1.00 52.47 O ATOM 2395 HA TYR A 157 28.630 11.368 -4.313 1.00 0.00 H ATOM 2396 HB3 TYR A 157 29.470 10.987 -6.678 1.00 0.00 H ATOM 2397 HB2 TYR A 157 28.421 9.551 -6.731 1.00 0.00 H ATOM 2398 HD2 TYR A 157 31.256 9.281 -7.282 1.00 0.00 H ATOM 2399 HE2 TYR A 157 33.066 7.928 -6.320 1.00 0.00 H ATOM 2400 HE1 TYR A 157 31.066 7.916 -2.537 1.00 0.00 H ATOM 2401 HD1 TYR A 157 29.237 9.285 -3.509 1.00 0.00 H ATOM 2402 HH TYR A 157 33.017 6.903 -2.899 1.00 0.00 H ATOM 2403 H TYR A 157 27.280 8.865 -4.709 1.00 0.00 H ATOM 2404 N THR A 158 26.101 11.388 -6.415 1.00 29.01 N ATOM 2405 CA THR A 158 25.198 12.284 -7.124 1.00 28.09 C ATOM 2406 C THR A 158 24.597 13.307 -6.170 1.00 27.17 C ATOM 2407 O THR A 158 24.469 14.486 -6.511 1.00 26.65 O ATOM 2408 CB THR A 158 24.107 11.503 -7.876 1.00 29.22 C ATOM 2409 OG1 THR A 158 24.728 10.717 -8.901 1.00 31.37 O ATOM 2410 CG2 THR A 158 23.103 12.450 -8.519 1.00 29.82 C ATOM 2411 HA THR A 158 25.778 12.824 -7.872 1.00 0.00 H ATOM 2412 HB THR A 158 23.578 10.867 -7.166 1.00 0.00 H ATOM 2413 HG1 THR A 158 25.370 10.086 -8.488 1.00 0.00 H ATOM 2414 HG23 THR A 158 22.626 13.052 -7.745 1.00 0.00 H ATOM 2415 HG21 THR A 158 23.620 13.103 -9.222 1.00 0.00 H ATOM 2416 HG22 THR A 158 22.347 11.871 -9.048 1.00 0.00 H ATOM 2417 H THR A 158 25.882 10.373 -6.354 1.00 0.00 H ATOM 2418 N LEU A 159 24.272 12.870 -4.957 1.00 25.53 N ATOM 2419 CA LEU A 159 23.729 13.785 -3.960 1.00 24.48 C ATOM 2420 C LEU A 159 24.754 14.865 -3.582 1.00 27.86 C ATOM 2421 O LEU A 159 24.407 16.038 -3.435 1.00 27.54 O ATOM 2422 CB LEU A 159 23.249 13.020 -2.725 1.00 23.10 C ATOM 2423 CG LEU A 159 22.609 13.898 -1.646 1.00 24.82 C ATOM 2424 CD1 LEU A 159 21.443 14.729 -2.217 1.00 26.37 C ATOM 2425 CD2 LEU A 159 22.141 13.038 -0.481 1.00 26.71 C ATOM 2426 HA LEU A 159 22.868 14.289 -4.398 1.00 0.00 H ATOM 2427 HB2 LEU A 159 22.513 12.282 -3.045 1.00 0.00 H ATOM 2428 HB3 LEU A 159 24.106 12.510 -2.285 1.00 0.00 H ATOM 2429 HG LEU A 159 23.363 14.598 -1.285 1.00 0.00 H ATOM 2430 HD21 LEU A 159 21.407 12.315 -0.837 1.00 0.00 H ATOM 2431 HD22 LEU A 159 22.994 12.511 -0.054 1.00 0.00 H ATOM 2432 HD23 LEU A 159 21.688 13.674 0.279 1.00 0.00 H ATOM 2433 HD11 LEU A 159 21.814 15.374 -3.014 1.00 0.00 H ATOM 2434 HD12 LEU A 159 20.682 14.058 -2.615 1.00 0.00 H ATOM 2435 HD13 LEU A 159 21.012 15.340 -1.424 1.00 0.00 H ATOM 2436 H LEU A 159 24.406 11.867 -4.717 1.00 0.00 H ATOM 2437 N VAL A 160 26.015 14.470 -3.437 1.00 29.94 N ATOM 2438 CA VAL A 160 27.076 15.447 -3.189 1.00 31.52 C ATOM 2439 C VAL A 160 27.157 16.458 -4.334 1.00 33.16 C ATOM 2440 O VAL A 160 27.312 17.658 -4.106 1.00 32.89 O ATOM 2441 CB VAL A 160 28.436 14.769 -2.999 1.00 30.64 C ATOM 2442 CG1 VAL A 160 29.553 15.819 -2.896 1.00 31.78 C ATOM 2443 CG2 VAL A 160 28.404 13.892 -1.772 1.00 31.94 C ATOM 2444 HA VAL A 160 26.825 15.969 -2.266 1.00 0.00 H ATOM 2445 HB VAL A 160 28.645 14.144 -3.867 1.00 0.00 H ATOM 2446 HG11 VAL A 160 29.578 16.412 -3.810 1.00 0.00 H ATOM 2447 HG12 VAL A 160 29.360 16.471 -2.044 1.00 0.00 H ATOM 2448 HG13 VAL A 160 30.511 15.317 -2.761 1.00 0.00 H ATOM 2449 HG21 VAL A 160 28.180 14.502 -0.897 1.00 0.00 H ATOM 2450 HG22 VAL A 160 27.634 13.129 -1.892 1.00 0.00 H ATOM 2451 HG23 VAL A 160 29.375 13.413 -1.644 1.00 0.00 H ATOM 2452 H VAL A 160 26.249 13.459 -3.500 1.00 0.00 H ATOM 2453 N ARG A 161 27.044 15.980 -5.569 1.00 33.04 N ATOM 2454 CA ARG A 161 27.072 16.899 -6.702 1.00 35.40 C ATOM 2455 C ARG A 161 25.874 17.851 -6.670 1.00 35.91 C ATOM 2456 O ARG A 161 26.000 19.024 -7.028 1.00 37.06 O ATOM 2457 CB ARG A 161 27.166 16.144 -8.029 1.00 37.25 C ATOM 2458 CG ARG A 161 28.475 15.374 -8.179 1.00 39.64 C ATOM 2459 CD ARG A 161 28.565 14.616 -9.495 1.00 42.76 C ATOM 2460 NE ARG A 161 29.778 13.803 -9.550 1.00 45.74 N ATOM 2461 CZ ARG A 161 29.788 12.480 -9.674 1.00 49.52 C ATOM 2462 NH1 ARG A 161 30.940 11.825 -9.708 1.00 52.16 N ATOM 2463 NH2 ARG A 161 28.646 11.812 -9.773 1.00 50.35 N ATOM 2464 HA ARG A 161 27.972 17.508 -6.617 1.00 0.00 H ATOM 2465 HB2 ARG A 161 26.338 15.438 -8.088 1.00 0.00 H ATOM 2466 HB3 ARG A 161 27.089 16.862 -8.845 1.00 0.00 H ATOM 2467 HG2 ARG A 161 29.303 16.081 -8.126 1.00 0.00 H ATOM 2468 HG3 ARG A 161 28.555 14.660 -7.359 1.00 0.00 H ATOM 2469 HD2 ARG A 161 28.577 15.331 -10.318 1.00 0.00 H ATOM 2470 HD3 ARG A 161 27.695 13.966 -9.592 1.00 0.00 H ATOM 2471 HE ARG A 161 30.694 14.292 -9.488 1.00 0.00 H ATOM 2472 HH12 ARG A 161 30.947 10.790 -9.805 1.00 0.00 H ATOM 2473 HH11 ARG A 161 31.837 12.347 -9.638 1.00 0.00 H ATOM 2474 HH22 ARG A 161 28.656 10.777 -9.870 1.00 0.00 H ATOM 2475 HH21 ARG A 161 27.741 12.324 -9.754 1.00 0.00 H ATOM 2476 H ARG A 161 26.936 14.958 -5.727 1.00 0.00 H ATOM 2477 N GLU A 162 24.717 17.355 -6.232 1.00 35.00 N ATOM 2478 CA GLU A 162 23.532 18.206 -6.094 1.00 32.50 C ATOM 2479 C GLU A 162 23.730 19.291 -5.035 1.00 34.54 C ATOM 2480 O GLU A 162 23.310 20.441 -5.209 1.00 33.90 O ATOM 2481 CB GLU A 162 22.301 17.370 -5.741 1.00 31.81 C ATOM 2482 CG GLU A 162 21.743 16.553 -6.901 1.00 33.59 C ATOM 2483 CD GLU A 162 21.348 17.413 -8.091 1.00 37.41 C ATOM 2484 OE1 GLU A 162 20.444 18.259 -7.946 1.00 38.60 O ATOM 2485 OE2 GLU A 162 21.947 17.247 -9.172 1.00 38.57 O ATOM 2486 HA GLU A 162 23.377 18.691 -7.058 1.00 0.00 H ATOM 2487 HB2 GLU A 162 22.573 16.683 -4.939 1.00 0.00 H ATOM 2488 HB3 GLU A 162 21.519 18.044 -5.391 1.00 0.00 H ATOM 2489 HG2 GLU A 162 22.503 15.840 -7.223 1.00 0.00 H ATOM 2490 HG3 GLU A 162 20.863 16.012 -6.554 1.00 0.00 H ATOM 2491 H GLU A 162 24.654 16.347 -5.984 1.00 0.00 H ATOM 2492 N ILE A 163 24.351 18.914 -3.926 1.00 32.67 N ATOM 2493 CA ILE A 163 24.634 19.861 -2.859 1.00 34.91 C ATOM 2494 C ILE A 163 25.584 20.951 -3.353 1.00 38.81 C ATOM 2495 O ILE A 163 25.395 22.134 -3.061 1.00 39.75 O ATOM 2496 CB ILE A 163 25.208 19.156 -1.618 1.00 33.85 C ATOM 2497 CG1 ILE A 163 24.112 18.313 -0.949 1.00 32.47 C ATOM 2498 CG2 ILE A 163 25.807 20.177 -0.650 1.00 34.89 C ATOM 2499 CD1 ILE A 163 24.638 17.355 0.110 1.00 31.81 C ATOM 2500 HA ILE A 163 23.693 20.326 -2.565 1.00 0.00 H ATOM 2501 HB ILE A 163 26.013 18.487 -1.921 1.00 0.00 H ATOM 2502 HG12 ILE A 163 23.397 18.988 -0.478 1.00 0.00 H ATOM 2503 HG13 ILE A 163 23.607 17.731 -1.720 1.00 0.00 H ATOM 2504 HD11 ILE A 163 25.346 16.664 -0.347 1.00 0.00 H ATOM 2505 HD12 ILE A 163 25.137 17.922 0.896 1.00 0.00 H ATOM 2506 HD13 ILE A 163 23.806 16.795 0.537 1.00 0.00 H ATOM 2507 HG21 ILE A 163 26.607 20.723 -1.149 1.00 0.00 H ATOM 2508 HG22 ILE A 163 25.031 20.875 -0.334 1.00 0.00 H ATOM 2509 HG23 ILE A 163 26.208 19.658 0.221 1.00 0.00 H ATOM 2510 H ILE A 163 24.642 17.921 -3.817 1.00 0.00 H ATOM 2511 N ARG A 164 26.591 20.555 -4.125 1.00 40.44 N ATOM 2512 CA ARG A 164 27.517 21.528 -4.698 1.00 44.07 C ATOM 2513 C ARG A 164 26.798 22.521 -5.600 1.00 46.90 C ATOM 2514 O ARG A 164 27.046 23.726 -5.531 1.00 47.75 O ATOM 2515 CB ARG A 164 28.607 20.829 -5.498 1.00 44.83 C ATOM 2516 CG ARG A 164 29.570 20.034 -4.662 1.00 46.47 C ATOM 2517 CD ARG A 164 30.622 19.424 -5.554 1.00 48.56 C ATOM 2518 NE ARG A 164 31.584 18.627 -4.808 1.00 50.06 N ATOM 2519 CZ ARG A 164 32.279 17.632 -5.342 1.00 51.45 C ATOM 2520 NH1 ARG A 164 32.094 17.320 -6.616 1.00 51.67 N ATOM 2521 NH2 ARG A 164 33.146 16.947 -4.605 1.00 52.18 N ATOM 2522 HA ARG A 164 27.965 22.071 -3.865 1.00 0.00 H ATOM 2523 HB2 ARG A 164 28.130 20.153 -6.207 1.00 0.00 H ATOM 2524 HB3 ARG A 164 29.171 21.586 -6.043 1.00 0.00 H ATOM 2525 HG2 ARG A 164 30.046 20.690 -3.933 1.00 0.00 H ATOM 2526 HG3 ARG A 164 29.032 19.243 -4.140 1.00 0.00 H ATOM 2527 HD2 ARG A 164 31.153 20.225 -6.068 1.00 0.00 H ATOM 2528 HD3 ARG A 164 30.132 18.785 -6.289 1.00 0.00 H ATOM 2529 HE ARG A 164 31.734 18.849 -3.803 1.00 0.00 H ATOM 2530 HH12 ARG A 164 32.634 16.541 -7.044 1.00 0.00 H ATOM 2531 HH11 ARG A 164 31.409 17.854 -7.188 1.00 0.00 H ATOM 2532 HH22 ARG A 164 33.688 16.168 -5.030 1.00 0.00 H ATOM 2533 HH21 ARG A 164 33.283 17.190 -3.603 1.00 0.00 H ATOM 2534 H ARG A 164 26.721 19.542 -4.323 1.00 0.00 H ATOM 2535 N LYS A 165 25.916 22.017 -6.459 1.00 47.01 N ATOM 2536 CA LYS A 165 25.206 22.892 -7.383 1.00 48.58 C ATOM 2537 C LYS A 165 24.351 23.896 -6.620 1.00 47.31 C ATOM 2538 O LYS A 165 24.258 25.065 -6.998 1.00 48.72 O ATOM 2539 CB LYS A 165 24.357 22.081 -8.363 1.00 52.52 C ATOM 2540 CG LYS A 165 25.183 21.196 -9.281 1.00 55.23 C ATOM 2541 CD LYS A 165 24.384 20.749 -10.494 1.00 58.12 C ATOM 2542 CE LYS A 165 23.097 20.056 -10.088 1.00 58.75 C ATOM 2543 NZ LYS A 165 22.338 19.560 -11.272 1.00 59.92 N ATOM 2544 HA LYS A 165 25.944 23.446 -7.963 1.00 0.00 H ATOM 2545 HB2 LYS A 165 23.677 21.449 -7.792 1.00 0.00 H ATOM 2546 HB3 LYS A 165 23.779 22.773 -8.976 1.00 0.00 H ATOM 2547 HG2 LYS A 165 26.057 21.753 -9.618 1.00 0.00 H ATOM 2548 HG3 LYS A 165 25.507 20.315 -8.726 1.00 0.00 H ATOM 2549 HD2 LYS A 165 24.141 21.622 -11.099 1.00 0.00 H ATOM 2550 HD3 LYS A 165 24.988 20.058 -11.082 1.00 0.00 H ATOM 2551 HE2 LYS A 165 22.474 20.762 -9.539 1.00 0.00 H ATOM 2552 HE3 LYS A 165 23.339 19.210 -9.444 1.00 0.00 H ATOM 2553 HZ1 LYS A 165 22.097 20.362 -11.889 1.00 0.00 H ATOM 2554 HZ2 LYS A 165 22.924 18.880 -11.798 1.00 0.00 H ATOM 2555 HZ3 LYS A 165 21.466 19.093 -10.952 1.00 0.00 H ATOM 2556 H LYS A 165 25.732 20.993 -6.471 1.00 0.00 H ATOM 2557 N HIS A 166 23.741 23.431 -5.536 1.00 44.76 N ATOM 2558 CA HIS A 166 22.928 24.282 -4.675 1.00 45.42 C ATOM 2559 C HIS A 166 23.796 25.361 -4.025 1.00 45.67 C ATOM 2560 O HIS A 166 23.413 26.532 -3.962 1.00 45.40 O ATOM 2561 CB HIS A 166 22.241 23.426 -3.609 1.00 45.73 C ATOM 2562 CG HIS A 166 21.334 24.193 -2.698 1.00 49.13 C ATOM 2563 ND1 HIS A 166 20.170 24.840 -2.935 1.00 50.88 N ATOM 2564 CD2 HIS A 166 21.585 24.337 -1.349 1.00 51.44 C ATOM 2565 CE1 HIS A 166 19.746 25.365 -1.738 1.00 52.29 C ATOM 2566 NE2 HIS A 166 20.618 25.048 -0.798 1.00 53.56 N ATOM 2567 HA HIS A 166 22.164 24.777 -5.275 1.00 0.00 H ATOM 2568 HB2 HIS A 166 21.652 22.660 -4.113 1.00 0.00 H ATOM 2569 HB3 HIS A 166 23.012 22.950 -3.003 1.00 0.00 H ATOM 2570 HD2 HIS A 166 22.446 23.928 -0.821 1.00 0.00 H ATOM 2571 HE1 HIS A 166 18.837 25.948 -1.589 1.00 0.00 H ATOM 2572 H HIS A 166 23.847 22.425 -5.293 1.00 0.00 H ATOM 2573 N LYS A 167 24.971 24.967 -3.545 1.00 47.03 N ATOM 2574 CA LYS A 167 25.889 25.924 -2.929 1.00 53.07 C ATOM 2575 C LYS A 167 26.203 27.081 -3.866 1.00 59.39 C ATOM 2576 O LYS A 167 26.245 28.242 -3.448 1.00 61.62 O ATOM 2577 CB LYS A 167 27.193 25.244 -2.524 1.00 54.24 C ATOM 2578 CG LYS A 167 27.128 24.462 -1.232 1.00 55.86 C ATOM 2579 CD LYS A 167 28.504 23.913 -0.909 1.00 58.61 C ATOM 2580 CE LYS A 167 28.539 23.206 0.425 1.00 61.19 C ATOM 2581 NZ LYS A 167 29.937 22.797 0.753 1.00 62.22 N ATOM 2582 HA LYS A 167 25.391 26.315 -2.042 1.00 0.00 H ATOM 2583 HB2 LYS A 167 27.479 24.558 -3.321 1.00 0.00 H ATOM 2584 HB3 LYS A 167 27.957 26.014 -2.416 1.00 0.00 H ATOM 2585 HG2 LYS A 167 26.798 25.117 -0.426 1.00 0.00 H ATOM 2586 HG3 LYS A 167 26.423 23.638 -1.340 1.00 0.00 H ATOM 2587 HD2 LYS A 167 28.792 23.207 -1.688 1.00 0.00 H ATOM 2588 HD3 LYS A 167 29.215 24.739 -0.887 1.00 0.00 H ATOM 2589 HE2 LYS A 167 27.905 22.320 0.381 1.00 0.00 H ATOM 2590 HE3 LYS A 167 28.169 23.878 1.199 1.00 0.00 H ATOM 2591 HZ1 LYS A 167 30.291 22.154 0.016 1.00 0.00 H ATOM 2592 HZ2 LYS A 167 30.542 23.641 0.798 1.00 0.00 H ATOM 2593 HZ3 LYS A 167 29.948 22.312 1.673 1.00 0.00 H ATOM 2594 H LYS A 167 25.241 23.965 -3.608 1.00 0.00 H ATOM 2595 N GLU A 168 26.434 26.761 -5.133 1.00 62.45 N ATOM 2596 CA GLU A 168 26.792 27.775 -6.112 1.00 67.34 C ATOM 2597 C GLU A 168 25.569 28.587 -6.521 1.00 69.54 C ATOM 2598 O GLU A 168 25.663 29.788 -6.773 1.00 69.39 O ATOM 2599 CB GLU A 168 27.438 27.125 -7.332 1.00 70.47 C ATOM 2600 CG GLU A 168 28.207 28.091 -8.208 1.00 75.56 C ATOM 2601 CD GLU A 168 29.274 27.395 -9.024 1.00 79.20 C ATOM 2602 OE1 GLU A 168 29.322 26.146 -8.991 1.00 79.75 O ATOM 2603 OE2 GLU A 168 30.068 28.093 -9.693 1.00 80.62 O ATOM 2604 HA GLU A 168 27.512 28.455 -5.657 1.00 0.00 H ATOM 2605 HB2 GLU A 168 28.126 26.353 -6.986 1.00 0.00 H ATOM 2606 HB3 GLU A 168 26.653 26.667 -7.933 1.00 0.00 H ATOM 2607 HG2 GLU A 168 27.509 28.582 -8.887 1.00 0.00 H ATOM 2608 HG3 GLU A 168 28.682 28.839 -7.574 1.00 0.00 H ATOM 2609 H GLU A 168 26.358 25.768 -5.431 1.00 0.00 H ATOM 2610 N LYS A 169 24.422 27.921 -6.579 1.00 71.45 N ATOM 2611 CA LYS A 169 23.169 28.580 -6.916 1.00 73.57 C ATOM 2612 C LYS A 169 22.773 29.582 -5.835 1.00 75.36 C ATOM 2613 O LYS A 169 22.239 30.644 -6.137 1.00 75.76 O ATOM 2614 CB LYS A 169 22.057 27.547 -7.113 1.00 74.76 C ATOM 2615 CG LYS A 169 20.758 28.118 -7.659 1.00 76.15 C ATOM 2616 CD LYS A 169 19.693 27.038 -7.802 1.00 76.92 C ATOM 2617 CE LYS A 169 18.430 27.583 -8.457 1.00 77.57 C ATOM 2618 NZ LYS A 169 17.845 28.722 -7.690 1.00 77.59 N ATOM 2619 HA LYS A 169 23.313 29.123 -7.850 1.00 0.00 H ATOM 2620 HB2 LYS A 169 22.415 26.789 -7.809 1.00 0.00 H ATOM 2621 HB3 LYS A 169 21.847 27.084 -6.149 1.00 0.00 H ATOM 2622 HG2 LYS A 169 20.394 28.887 -6.978 1.00 0.00 H ATOM 2623 HG3 LYS A 169 20.948 28.561 -8.637 1.00 0.00 H ATOM 2624 HD2 LYS A 169 20.089 26.228 -8.415 1.00 0.00 H ATOM 2625 HD3 LYS A 169 19.442 26.654 -6.813 1.00 0.00 H ATOM 2626 HE2 LYS A 169 17.692 26.783 -8.517 1.00 0.00 H ATOM 2627 HE3 LYS A 169 18.675 27.925 -9.462 1.00 0.00 H ATOM 2628 HZ1 LYS A 169 17.601 28.403 -6.731 1.00 0.00 H ATOM 2629 HZ2 LYS A 169 18.540 29.494 -7.634 1.00 0.00 H ATOM 2630 HZ3 LYS A 169 16.988 29.060 -8.173 1.00 0.00 H ATOM 2631 H LYS A 169 24.419 26.901 -6.378 1.00 0.00 H ATOM 2632 N MET A 170 23.041 29.241 -4.578 1.00 77.11 N ATOM 2633 CA MET A 170 22.670 30.095 -3.451 1.00 79.84 C ATOM 2634 C MET A 170 23.468 31.394 -3.413 1.00 81.22 C ATOM 2635 O MET A 170 22.922 32.457 -3.115 1.00 80.79 O ATOM 2636 CB MET A 170 22.839 29.347 -2.126 1.00 81.93 C ATOM 2637 CG MET A 170 21.839 28.226 -1.915 1.00 83.96 C ATOM 2638 SD MET A 170 20.142 28.822 -1.955 1.00 86.25 S ATOM 2639 CE MET A 170 20.170 29.999 -0.605 1.00 86.56 C ATOM 2640 HA MET A 170 21.621 30.356 -3.592 1.00 0.00 H ATOM 2641 HB2 MET A 170 23.842 28.921 -2.099 1.00 0.00 H ATOM 2642 HB3 MET A 170 22.728 30.063 -1.312 1.00 0.00 H ATOM 2643 HG2 MET A 170 22.027 27.763 -0.946 1.00 0.00 H ATOM 2644 HG3 MET A 170 21.970 27.484 -2.702 1.00 0.00 H ATOM 2645 HE1 MET A 170 20.431 29.484 0.319 1.00 0.00 H ATOM 2646 HE2 MET A 170 20.910 30.771 -0.813 1.00 0.00 H ATOM 2647 HE3 MET A 170 19.186 30.456 -0.502 1.00 0.00 H ATOM 2648 H MET A 170 23.528 28.341 -4.391 1.00 0.00 H ATOM 2649 N SER A 171 24.761 31.301 -3.705 1.00 82.50 N ATOM 2650 CA SER A 171 25.625 32.477 -3.707 1.00 83.34 C ATOM 2651 C SER A 171 25.210 33.465 -4.792 1.00 86.44 C ATOM 2652 O SER A 171 25.216 34.676 -4.574 1.00 86.34 O ATOM 2653 CB SER A 171 27.090 32.074 -3.883 1.00 81.62 C ATOM 2654 OG SER A 171 27.584 31.444 -2.715 1.00 79.98 O ATOM 2655 HA SER A 171 25.515 32.970 -2.741 1.00 0.00 H ATOM 2656 HB2 SER A 171 27.684 32.965 -4.087 1.00 0.00 H ATOM 2657 HB3 SER A 171 27.172 31.384 -4.723 1.00 0.00 H ATOM 2658 HG SER A 171 28.532 31.193 -2.853 1.00 0.00 H ATOM 2659 H SER A 171 25.165 30.371 -3.937 1.00 0.00 H ATOM 2660 N LYS A 172 24.851 32.938 -5.959 1.00 89.42 N ATOM 2661 CA LYS A 172 24.358 33.760 -7.058 1.00 92.42 C ATOM 2662 C LYS A 172 22.863 34.023 -6.884 1.00 94.78 C ATOM 2663 O LYS A 172 22.313 34.954 -7.474 1.00 94.94 O ATOM 2664 CB LYS A 172 24.611 33.062 -8.397 1.00 93.14 C ATOM 2665 CG LYS A 172 26.057 32.633 -8.619 1.00 93.69 C ATOM 2666 CD LYS A 172 26.181 31.596 -9.736 1.00 94.29 C ATOM 2667 CE LYS A 172 25.999 32.207 -11.121 1.00 94.85 C ATOM 2668 NZ LYS A 172 24.619 32.714 -11.359 1.00 95.23 N ATOM 2669 HA LYS A 172 24.891 34.711 -7.050 1.00 0.00 H ATOM 2670 HB2 LYS A 172 23.980 32.174 -8.444 1.00 0.00 H ATOM 2671 HB3 LYS A 172 24.331 33.747 -9.197 1.00 0.00 H ATOM 2672 HG2 LYS A 172 26.648 33.510 -8.885 1.00 0.00 H ATOM 2673 HG3 LYS A 172 26.443 32.203 -7.695 1.00 0.00 H ATOM 2674 HD2 LYS A 172 27.169 31.140 -9.682 1.00 0.00 H ATOM 2675 HD3 LYS A 172 25.420 30.830 -9.589 1.00 0.00 H ATOM 2676 HE2 LYS A 172 26.223 31.446 -11.868 1.00 0.00 H ATOM 2677 HE3 LYS A 172 26.697 33.037 -11.229 1.00 0.00 H ATOM 2678 HZ1 LYS A 172 23.942 31.929 -11.269 1.00 0.00 H ATOM 2679 HZ2 LYS A 172 24.395 33.449 -10.658 1.00 0.00 H ATOM 2680 HZ3 LYS A 172 24.559 33.117 -12.316 1.00 0.00 H ATOM 2681 H LYS A 172 24.924 31.909 -6.092 1.00 0.00 H ATOM 2682 N ASP A 173 22.221 33.197 -6.058 1.00 96.70 N ATOM 2683 CA ASP A 173 20.769 33.228 -5.851 1.00 98.88 C ATOM 2684 C ASP A 173 19.971 33.440 -7.141 1.00100.31 C ATOM 2685 O ASP A 173 20.490 33.257 -8.244 1.00100.18 O ATOM 2686 CB ASP A 173 20.376 34.257 -4.780 1.00 99.48 C ATOM 2687 CG ASP A 173 21.425 35.338 -4.586 1.00100.11 C ATOM 2688 OD1 ASP A 173 21.401 36.335 -5.338 1.00100.41 O ATOM 2689 OD2 ASP A 173 22.269 35.194 -3.675 1.00100.04 O ATOM 2690 HA ASP A 173 20.500 32.235 -5.490 1.00 0.00 H ATOM 2691 HB2 ASP A 173 19.440 34.730 -5.078 1.00 0.00 H ATOM 2692 HB3 ASP A 173 20.233 33.737 -3.833 1.00 0.00 H ATOM 2693 H ASP A 173 22.779 32.494 -5.533 1.00 0.00 H ATOM 2694 N GLY A 174 18.700 33.803 -6.994 1.00101.83 N ATOM 2695 CA GLY A 174 17.861 34.123 -8.135 1.00103.20 C ATOM 2696 C GLY A 174 17.821 35.623 -8.355 1.00104.50 C ATOM 2697 O GLY A 174 17.826 36.103 -9.490 1.00104.40 O ATOM 2698 HA3 GLY A 174 16.850 33.759 -7.952 1.00 0.00 H ATOM 2699 HA2 GLY A 174 18.264 33.639 -9.025 1.00 0.00 H ATOM 2700 H GLY A 174 18.297 33.859 -6.037 1.00 0.00 H ATOM 2701 N LYS A 175 17.783 36.362 -7.250 1.00105.53 N ATOM 2702 CA LYS A 175 17.833 37.818 -7.276 1.00106.05 C ATOM 2703 C LYS A 175 18.404 38.326 -5.955 1.00106.95 C ATOM 2704 O LYS A 175 19.066 37.580 -5.233 1.00107.14 O ATOM 2705 CB LYS A 175 16.447 38.395 -7.517 1.00105.48 C ATOM 2706 HA LYS A 175 18.478 38.141 -8.093 1.00 0.00 H ATOM 2707 HB2 LYS A 175 16.067 38.036 -8.473 1.00 0.00 H ATOM 2708 HB3 LYS A 175 15.778 38.078 -6.717 1.00 0.00 H ATOM 2709 H LYS A 175 17.715 35.881 -6.330 1.00 0.00 H ATOM 2710 N LYS A 176 18.150 39.597 -5.652 1.00107.34 N ATOM 2711 CA LYS A 176 18.552 40.201 -4.379 1.00107.27 C ATOM 2712 C LYS A 176 20.030 40.596 -4.303 1.00107.48 C ATOM 2713 O LYS A 176 20.352 41.740 -3.974 1.00107.98 O ATOM 2714 CB LYS A 176 18.175 39.294 -3.203 1.00106.80 C ATOM 2715 HA LYS A 176 17.995 41.136 -4.314 1.00 0.00 H ATOM 2716 HB2 LYS A 176 17.096 39.142 -3.195 1.00 0.00 H ATOM 2717 HB3 LYS A 176 18.678 38.333 -3.311 1.00 0.00 H ATOM 2718 H LYS A 176 17.646 40.185 -6.346 1.00 0.00 H ATOM 2719 N LYS A 177 20.924 39.658 -4.603 1.00106.85 N ATOM 2720 CA LYS A 177 22.356 39.905 -4.436 1.00106.14 C ATOM 2721 C LYS A 177 23.201 39.567 -5.666 1.00105.71 C ATOM 2722 O LYS A 177 23.921 40.423 -6.181 1.00106.00 O ATOM 2723 CB LYS A 177 22.882 39.162 -3.209 1.00105.85 C ATOM 2724 HA LYS A 177 22.457 40.981 -4.295 1.00 0.00 H ATOM 2725 HB2 LYS A 177 22.354 39.510 -2.321 1.00 0.00 H ATOM 2726 HB3 LYS A 177 22.717 38.092 -3.335 1.00 0.00 H ATOM 2727 H LYS A 177 20.601 38.737 -4.961 1.00 0.00 H ATOM 2728 N LYS A 178 23.111 38.320 -6.124 1.00105.10 N ATOM 2729 CA LYS A 178 23.968 37.812 -7.196 1.00104.88 C ATOM 2730 C LYS A 178 25.401 37.621 -6.695 1.00104.96 C ATOM 2731 O LYS A 178 25.728 38.015 -5.575 1.00104.87 O ATOM 2732 CB LYS A 178 23.933 38.734 -8.412 1.00104.54 C ATOM 2733 HA LYS A 178 23.582 36.841 -7.506 1.00 0.00 H ATOM 2734 HB2 LYS A 178 22.911 38.803 -8.785 1.00 0.00 H ATOM 2735 HB3 LYS A 178 24.284 39.725 -8.125 1.00 0.00 H ATOM 2736 H LYS A 178 22.405 37.683 -5.704 1.00 0.00 H ATOM 2737 N LYS A 179 26.251 37.013 -7.519 1.00104.86 N ATOM 2738 CA LYS A 179 27.627 36.734 -7.113 1.00104.77 C ATOM 2739 C LYS A 179 28.583 36.568 -8.294 1.00105.20 C ATOM 2740 O LYS A 179 29.259 37.516 -8.697 1.00105.33 O ATOM 2741 CB LYS A 179 27.674 35.501 -6.220 1.00104.45 C ATOM 2742 HA LYS A 179 27.969 37.606 -6.556 1.00 0.00 H ATOM 2743 HB2 LYS A 179 27.068 35.675 -5.331 1.00 0.00 H ATOM 2744 HB3 LYS A 179 27.282 34.643 -6.766 1.00 0.00 H ATOM 2745 H LYS A 179 25.931 36.732 -8.468 1.00 0.00 H ATOM 2746 N LYS A 180 28.642 35.355 -8.835 1.00105.26 N ATOM 2747 CA LYS A 180 29.557 35.048 -9.930 1.00105.19 C ATOM 2748 C LYS A 180 28.853 35.097 -11.283 1.00104.91 C ATOM 2749 O LYS A 180 29.454 35.459 -12.294 1.00104.70 O ATOM 2750 CB LYS A 180 30.205 33.686 -9.713 1.00105.14 C ATOM 2751 HA LYS A 180 30.335 35.812 -9.937 1.00 0.00 H ATOM 2752 HB2 LYS A 180 30.762 33.695 -8.776 1.00 0.00 H ATOM 2753 HB3 LYS A 180 29.431 32.920 -9.670 1.00 0.00 H ATOM 2754 H LYS A 180 28.020 34.606 -8.469 1.00 0.00 H TER 2755 LYS A 180 HETATM 2756 MG MG A 1 17.234 0.577 8.623 1.00 38.12 MG HETATM 2757 O HOH 2 0.000 0.000 -1.522 1.00 27.10 O HETATM 2758 O HOH 3 -0.566 2.739 -0.965 1.00 23.59 O HETATM 2759 O HOH 4 10.092 5.652 0.922 1.00 24.75 O HETATM 2760 O HOH 5 17.395 2.828 8.318 1.00 31.39 O HETATM 2761 O HOH 6 17.288 -1.686 8.959 1.00 39.90 O HETATM 2762 O HOH 7 10.731 -4.595 -0.524 1.00 30.71 O HETATM 2763 O HOH 8 27.459 3.126 -8.243 1.00 39.22 O HETATM 2764 O HOH 9 -0.457 16.141 0.220 1.00 33.21 O HETATM 2765 O HOH 10 17.701 0.825 10.841 1.00 37.48 O HETATM 2766 O HOH 11 4.132 -1.217 1.490 1.00 33.88 O HETATM 2767 O HOH 12 0.196 8.796 -0.390 1.00 30.46 O HETATM 2768 O HOH 13 12.881 8.348 6.896 1.00 36.22 O HETATM 2769 O HOH 14 4.664 15.260 -5.191 1.00 33.91 O HETATM 2770 O HOH 15 24.376 -3.769 3.209 1.00 40.71 O HETATM 2771 O HOH 16 0.601 6.138 0.380 1.00 33.32 O HETATM 2772 O HOH 17 18.581 18.018 -6.071 1.00 37.80 O HETATM 2773 O HOH 18 7.565 3.209 7.206 1.00 52.40 O HETATM 2774 O HOH 19 9.845 -2.878 1.365 1.00 42.08 O HETATM 2775 O HOH 20 22.330 -5.237 -9.745 1.00 48.82 O HETATM 2776 O HOH 21 20.232 4.591 -12.370 1.00 46.05 O HETATM 2777 O HOH 22 28.260 1.153 -6.463 1.00 37.87 O HETATM 2778 O HOH 23 28.906 20.934 2.252 1.00 57.34 O HETATM 2779 O HOH 24 13.594 -2.922 7.842 1.00 46.40 O HETATM 2780 O HOH 25 3.404 7.114 -10.717 1.00 44.59 O HETATM 2781 O HOH 26 27.244 0.408 -9.940 1.00 52.39 O HETATM 2782 O HOH 27 10.125 -9.458 -6.564 1.00 38.30 O HETATM 2783 O HOH 28 14.345 -9.175 2.427 1.00 39.15 O HETATM 2784 O HOH 29 18.190 11.429 -13.321 1.00 44.92 O HETATM 2785 O HOH 30 1.684 -0.262 -7.866 1.00 58.76 O HETATM 2786 O HOH 31 7.139 5.960 5.555 1.00 50.89 O HETATM 2787 O HOH 32 12.259 23.215 12.069 1.00 55.21 O HETATM 2788 O HOH 33 15.870 -10.576 -1.442 1.00 46.81 O HETATM 2789 O HOH 34 22.229 3.114 -11.529 1.00 61.90 O HETATM 2790 O HOH 35 11.968 -5.241 3.522 1.00 38.09 O HETATM 2791 O HOH 36 31.392 1.280 10.300 1.00 62.78 O HETATM 2792 O HOH 37 7.205 -0.012 3.845 1.00 50.17 O HETATM 2793 O HOH 38 6.610 16.869 -2.659 1.00 41.76 O HETATM 2794 O HOH 39 22.652 1.334 9.663 1.00 56.25 O HETATM 2795 O HOH 40 3.142 0.452 -11.611 1.00 64.00 O HETATM 2796 O HOH 41 34.114 4.695 7.027 1.00 57.42 O HETATM 2797 O HOH 42 8.902 -11.568 -13.077 1.00 36.74 O HETATM 2798 O HOH 43 17.817 -10.957 -5.884 1.00 44.20 O HETATM 2799 O HOH 44 12.295 11.207 7.751 1.00 50.00 O HETATM 2800 O HOH 45 30.221 -1.308 -6.445 1.00 65.40 O HETATM 2801 O HOH 46 2.052 14.958 3.658 1.00 47.98 O HETATM 2802 O HOH 47 14.999 0.893 9.175 1.00 33.66 O HETATM 2803 O HOH 48 19.400 -2.170 -9.151 1.00 45.84 O HETATM 2804 O HOH 49 18.007 23.900 1.878 1.00 55.85 O HETATM 2805 O HOH 50 27.871 19.576 -9.233 1.00 58.68 O HETATM 2806 O HOH 51 4.581 17.944 -5.660 1.00 42.72 O HETATM 2807 O HOH 52 15.473 14.329 -13.410 1.00 46.52 O HETATM 2808 O HOH 53 19.107 1.174 -14.576 1.00 65.62 O HETATM 2809 O HOH 54 10.283 9.431 -18.284 1.00 50.55 O HETATM 2810 O HOH 55 11.326 -5.921 -11.740 1.00 58.36 O HETATM 2811 O HOH 56 17.453 23.945 7.871 1.00 47.86 O HETATM 2812 O HOH 57 13.233 2.684 8.715 1.00 47.92 O HETATM 2813 O HOH 58 11.673 12.013 -17.864 1.00 63.01 O HETATM 2814 O HOH 59 20.927 23.081 4.855 1.00 49.79 O HETATM 2815 O HOH 60 15.037 19.497 -4.681 1.00 62.17 O HETATM 2816 O HOH 61 12.445 18.936 -5.216 1.00 70.97 O HETATM 2817 O HOH 62 23.643 15.217 14.778 1.00 54.17 O HETATM 2818 O HOH 63 29.369 12.735 13.636 1.00 59.30 O HETATM 2819 O HOH 64 36.773 6.769 5.954 1.00 56.43 O HETATM 2820 N1 BZI A 65 25.358 12.533 11.401 1.00 -0.31 N HETATM 2821 C2 BZI A 65 25.126 12.510 12.681 1.00 0.10 C HETATM 2822 N3 BZI A 65 23.962 13.160 12.955 1.00 -0.25 N HETATM 2823 C3A BZI A 65 23.447 13.613 11.750 1.00 0.08 C HETATM 2824 C4 BZI A 65 22.312 14.325 11.389 1.00 -0.04 C HETATM 2825 C5 BZI A 65 22.087 14.623 10.061 1.00 -0.07 C HETATM 2826 C6 BZI A 65 22.986 14.213 9.086 1.00 -0.08 C HETATM 2827 C7 BZI A 65 24.113 13.513 9.422 1.00 -0.06 C HETATM 2828 C7A BZI A 65 24.358 13.200 10.762 1.00 0.03 C HETATM 2829 H6 BZI A 65 24.812 13.203 8.653 1.00 0.06 H HETATM 2830 H5 BZI A 65 22.793 14.450 8.046 1.00 0.05 H HETATM 2831 H4 BZI A 65 21.202 15.181 9.777 1.00 0.05 H HETATM 2832 H3 BZI A 65 21.606 14.645 12.146 1.00 0.06 H HETATM 2833 H2 BZI A 65 23.541 13.291 13.886 1.00 0.23 H HETATM 2834 H1 BZI A 65 25.769 12.040 13.424 1.00 0.14 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 239 238 243 2756 CONECT 933 934 943 944 945 CONECT 943 933 CONECT 944 933 CONECT 945 933 CONECT 2756 239 CONECT 2820 2821 2828 CONECT 2821 2820 2822 2834 CONECT 2822 2821 2823 2833 CONECT 2823 2822 2824 2828 CONECT 2824 2823 2825 2832 CONECT 2825 2824 2826 2831 CONECT 2826 2825 2827 2830 CONECT 2827 2826 2828 2829 CONECT 2828 2820 2823 2827 CONECT 2829 2827 CONECT 2830 2826 CONECT 2831 2825 CONECT 2832 2824 CONECT 2833 2822 CONECT 2834 2821 MASTER 0 0 0 0 0 0 0 0 2832 2 25 14 END
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Related entries of code: 4dsu
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PDBbind
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4epy
RCSB PDB
PDBbind
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166aa, >4NYJ_2|Chain... at 92%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
170aa, >6B0Y_1|Chains... at 97%
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RCSB PDB
PDBbind
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6d59
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
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6d5h
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
167aa, >6D5J_3|Chain... at 92%
6fa2
RCSB PDB
PDBbind
171aa, >6FA2_3|Chain... at 96%
6fa3
RCSB PDB
PDBbind
172aa, >6FA3_2|Chain... at 96%
6fa4
RCSB PDB
PDBbind
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6quw
RCSB PDB
PDBbind
170aa, >6QUW_1|Chains... at 99%
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PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
183aa, >6P8Z_1|Chains... at 90%
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
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RCSB PDB
PDBbind
187aa, >6CCX_2|Chain... at 97%
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4dsu
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
GTPase KRas, isoform 2B
Ligand Name
BZI
EC.Number
E.C.3.6
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Kd=1.5mM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Proc.Natl.Acad.Sci.USA Vol. 109: pp. 5299-5304
Ligand Properties
Formula
C
7
H
6
N
2
Molecular Weight
118.136
Exact Mass
118.053
No. of atoms
15
No. of bonds
16
Polar Surface Area
28.68
LOGP Value
1.49 (
Computed with XLOGP3
)
1.56 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 2
Canonical SMILES
c1ccc2c(c1)[nH]cn2
InChI String
InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P01112
Entrez Gene ID
NCBI Entrez Gene ID:
3265
ASD
Information of known allosteric effects of PDB entries
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