Browse entries in the PDBbind-CN Database
HEADER 3D9N_COMPLEX COMPND 3D9N_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 GLU ALA VAL LYS THR PHE ASN SER GLU LEU TYR SER LEU SEQRES 2 A 138 ASN ASP TYR LYS PRO PRO ILE SER LYS ALA LYS MET THR SEQRES 3 A 138 GLN ILE THR LYS ALA ALA ILE LYS ALA ILE LYS PHE TYR SEQRES 4 A 138 LYS HIS VAL VAL GLN SER VAL GLU LYS PHE ILE GLN LYS SEQRES 5 A 138 CYS LYS PRO GLU TYR LYS VAL PRO GLY LEU TYR VAL ILE SEQRES 6 A 138 ASP SER ILE VAL ARG GLN SER ARG HIS GLN PHE GLY GLN SEQRES 7 A 138 GLU LYS ASP VAL PHE ALA PRO ARG PHE SER ASN ASN ILE SEQRES 8 A 138 ILE SER THR PHE GLN ASN LEU TYR ARG CYS PRO GLY ASP SEQRES 9 A 138 ASP LYS SER LYS ILE VAL ARG VAL LEU ASN LEU TRP GLN SEQRES 10 A 138 LYS ASN ASN VAL PHE LYS SER GLU ILE ILE GLN PRO LEU SEQRES 11 A 138 LEU ASP MET ALA ALA ALA LEU GLU HET TYR A 256 91 ATOM 1 N GLU A 2 56.195 6.778 -0.799 1.00 45.63 N ATOM 2 CA GLU A 2 54.882 6.824 -1.517 1.00 45.48 C ATOM 3 C GLU A 2 53.811 6.002 -0.800 1.00 44.39 C ATOM 4 O GLU A 2 52.632 6.374 -0.803 1.00 44.79 O ATOM 5 CB GLU A 2 55.032 6.369 -2.974 1.00 45.76 C ATOM 6 CG GLU A 2 53.772 6.543 -3.834 1.00 48.14 C ATOM 7 CD GLU A 2 53.298 7.993 -3.931 1.00 51.05 C ATOM 8 OE1 GLU A 2 54.091 8.863 -4.366 1.00 52.04 O ATOM 9 OE2 GLU A 2 52.125 8.257 -3.575 1.00 52.34 O ATOM 10 HA GLU A 2 54.553 7.863 -1.515 1.00 0.00 H ATOM 11 HB2 GLU A 2 55.836 6.947 -3.429 1.00 0.00 H ATOM 12 HB3 GLU A 2 55.300 5.312 -2.974 1.00 0.00 H ATOM 13 HG2 GLU A 2 53.987 6.182 -4.840 1.00 0.00 H ATOM 14 HG3 GLU A 2 52.971 5.946 -3.398 1.00 0.00 H ATOM 15 HN3 GLU A 2 56.523 5.793 -0.742 1.00 0.00 H ATOM 16 HN2 GLU A 2 56.078 7.161 0.161 1.00 0.00 H ATOM 17 HN1 GLU A 2 56.893 7.348 -1.318 1.00 0.00 H ATOM 18 N ALA A 3 54.219 4.882 -0.202 1.00 43.02 N ATOM 19 CA ALA A 3 53.324 4.091 0.651 1.00 41.17 C ATOM 20 C ALA A 3 52.893 4.926 1.851 1.00 40.00 C ATOM 21 O ALA A 3 51.705 4.951 2.202 1.00 39.21 O ATOM 22 CB ALA A 3 54.000 2.806 1.109 1.00 41.43 C ATOM 23 HA ALA A 3 52.443 3.814 0.072 1.00 0.00 H ATOM 24 HB1 ALA A 3 54.271 2.209 0.238 1.00 0.00 H ATOM 25 HB2 ALA A 3 54.898 3.052 1.677 1.00 0.00 H ATOM 26 HB3 ALA A 3 53.314 2.240 1.739 1.00 0.00 H ATOM 27 H ALA A 3 55.198 4.560 -0.344 1.00 0.00 H ATOM 28 N VAL A 4 53.871 5.611 2.451 1.00 38.20 N ATOM 29 CA VAL A 4 53.647 6.509 3.581 1.00 36.62 C ATOM 30 C VAL A 4 52.864 7.746 3.147 1.00 35.00 C ATOM 31 O VAL A 4 51.951 8.171 3.854 1.00 34.27 O ATOM 32 CB VAL A 4 54.972 6.879 4.295 1.00 37.39 C ATOM 33 CG1 VAL A 4 54.721 7.847 5.452 1.00 37.40 C ATOM 34 CG2 VAL A 4 55.617 5.607 4.850 1.00 38.15 C ATOM 35 HA VAL A 4 53.040 5.977 4.313 1.00 0.00 H ATOM 36 HB VAL A 4 55.629 7.360 3.570 1.00 0.00 H ATOM 37 HG11 VAL A 4 54.264 8.759 5.068 1.00 0.00 H ATOM 38 HG12 VAL A 4 54.052 7.381 6.176 1.00 0.00 H ATOM 39 HG13 VAL A 4 55.668 8.089 5.934 1.00 0.00 H ATOM 40 HG21 VAL A 4 54.937 5.137 5.560 1.00 0.00 H ATOM 41 HG22 VAL A 4 55.822 4.918 4.031 1.00 0.00 H ATOM 42 HG23 VAL A 4 56.549 5.864 5.353 1.00 0.00 H ATOM 43 H VAL A 4 54.842 5.499 2.095 1.00 0.00 H ATOM 44 N LYS A 5 53.197 8.297 1.976 1.00 33.32 N ATOM 45 CA LYS A 5 52.459 9.434 1.418 1.00 31.89 C ATOM 46 C LYS A 5 50.967 9.114 1.214 1.00 30.68 C ATOM 47 O LYS A 5 50.113 9.907 1.599 1.00 30.07 O ATOM 48 CB LYS A 5 53.105 9.930 0.112 1.00 32.04 C ATOM 49 CG LYS A 5 52.366 11.120 -0.525 1.00 32.94 C ATOM 50 CD LYS A 5 53.186 11.846 -1.584 1.00 33.11 C ATOM 51 CE LYS A 5 52.387 13.008 -2.161 1.00 35.38 C ATOM 52 NZ LYS A 5 53.254 14.121 -2.641 1.00 36.47 N ATOM 53 HA LYS A 5 52.515 10.240 2.150 1.00 0.00 H ATOM 54 HB2 LYS A 5 54.129 10.235 0.327 1.00 0.00 H ATOM 55 HB3 LYS A 5 53.115 9.107 -0.603 1.00 0.00 H ATOM 56 HG2 LYS A 5 51.452 10.751 -0.989 1.00 0.00 H ATOM 57 HG3 LYS A 5 52.111 11.830 0.262 1.00 0.00 H ATOM 58 HD2 LYS A 5 54.102 12.227 -1.132 1.00 0.00 H ATOM 59 HD3 LYS A 5 53.439 11.150 -2.384 1.00 0.00 H ATOM 60 HE2 LYS A 5 51.722 13.392 -1.387 1.00 0.00 H ATOM 61 HE3 LYS A 5 51.794 12.642 -2.999 1.00 0.00 H ATOM 62 HZ1 LYS A 5 53.819 14.485 -1.848 1.00 0.00 H ATOM 63 HZ2 LYS A 5 53.888 13.768 -3.386 1.00 0.00 H ATOM 64 HZ3 LYS A 5 52.658 14.883 -3.023 1.00 0.00 H ATOM 65 H LYS A 5 54.003 7.908 1.446 1.00 0.00 H ATOM 66 N THR A 6 50.666 7.957 0.631 1.00 29.41 N ATOM 67 CA THR A 6 49.283 7.524 0.390 1.00 28.86 C ATOM 68 C THR A 6 48.529 7.333 1.714 1.00 28.10 C ATOM 69 O THR A 6 47.392 7.779 1.868 1.00 27.44 O ATOM 70 CB THR A 6 49.245 6.195 -0.392 1.00 29.46 C ATOM 71 OG1 THR A 6 49.896 6.381 -1.652 1.00 31.61 O ATOM 72 CG2 THR A 6 47.808 5.716 -0.623 1.00 30.73 C ATOM 73 HA THR A 6 48.801 8.306 -0.197 1.00 0.00 H ATOM 74 HB THR A 6 49.758 5.434 0.196 1.00 0.00 H ATOM 75 HG1 THR A 6 50.835 6.654 -1.500 1.00 0.00 H ATOM 76 HG23 THR A 6 47.314 5.575 0.339 1.00 0.00 H ATOM 77 HG21 THR A 6 47.267 6.462 -1.205 1.00 0.00 H ATOM 78 HG22 THR A 6 47.824 4.771 -1.166 1.00 0.00 H ATOM 79 H THR A 6 51.442 7.333 0.333 1.00 0.00 H ATOM 80 N PHE A 7 49.183 6.669 2.662 1.00 26.85 N ATOM 81 CA PHE A 7 48.606 6.524 3.993 1.00 24.66 C ATOM 82 C PHE A 7 48.344 7.882 4.653 1.00 24.69 C ATOM 83 O PHE A 7 47.255 8.108 5.171 1.00 23.41 O ATOM 84 CB PHE A 7 49.475 5.656 4.913 1.00 25.73 C ATOM 85 CG PHE A 7 48.953 5.614 6.309 1.00 23.31 C ATOM 86 CD1 PHE A 7 47.832 4.828 6.624 1.00 23.42 C ATOM 87 CD2 PHE A 7 49.493 6.456 7.291 1.00 23.89 C ATOM 88 CE1 PHE A 7 47.296 4.831 7.943 1.00 22.62 C ATOM 89 CE2 PHE A 7 48.968 6.456 8.578 1.00 23.98 C ATOM 90 CZ PHE A 7 47.877 5.648 8.911 1.00 23.19 C ATOM 91 HA PHE A 7 47.651 6.017 3.852 1.00 0.00 H ATOM 92 HB2 PHE A 7 49.500 4.641 4.517 1.00 0.00 H ATOM 93 HB3 PHE A 7 50.486 6.064 4.928 1.00 0.00 H ATOM 94 HD2 PHE A 7 50.327 7.113 7.045 1.00 0.00 H ATOM 95 HE2 PHE A 7 49.414 7.096 9.339 1.00 0.00 H ATOM 96 HZ PHE A 7 47.481 5.657 9.927 1.00 0.00 H ATOM 97 HE1 PHE A 7 46.442 4.202 8.193 1.00 0.00 H ATOM 98 HD1 PHE A 7 47.369 4.212 5.853 1.00 0.00 H ATOM 99 H PHE A 7 50.112 6.250 2.453 1.00 0.00 H ATOM 100 N ASN A 8 49.349 8.763 4.656 1.00 24.32 N ATOM 101 CA ASN A 8 49.204 10.076 5.270 1.00 24.38 C ATOM 102 C ASN A 8 48.066 10.832 4.630 1.00 24.28 C ATOM 103 O ASN A 8 47.333 11.508 5.331 1.00 24.45 O ATOM 104 CB ASN A 8 50.467 10.907 5.120 1.00 25.19 C ATOM 105 CG ASN A 8 51.577 10.454 6.033 1.00 25.60 C ATOM 106 OD1 ASN A 8 51.354 9.704 6.970 1.00 28.48 O ATOM 107 ND2 ASN A 8 52.794 10.915 5.756 1.00 28.46 N ATOM 108 HA ASN A 8 49.006 9.911 6.329 1.00 0.00 H ATOM 109 HB2 ASN A 8 50.812 10.833 4.089 1.00 0.00 H ATOM 110 HB3 ASN A 8 50.230 11.946 5.349 1.00 0.00 H ATOM 111 HD22 ASN A 8 52.937 11.552 4.947 1.00 0.00 H ATOM 112 HD21 ASN A 8 53.602 10.638 6.349 1.00 0.00 H ATOM 113 H ASN A 8 50.253 8.506 4.211 1.00 0.00 H ATOM 114 N SER A 9 47.954 10.721 3.306 1.00 24.48 N ATOM 115 CA SER A 9 46.910 11.399 2.547 1.00 24.78 C ATOM 116 C SER A 9 45.535 10.937 3.008 1.00 24.77 C ATOM 117 O SER A 9 44.632 11.747 3.255 1.00 25.58 O ATOM 118 CB SER A 9 47.062 11.098 1.052 1.00 24.46 C ATOM 119 OG SER A 9 46.043 11.747 0.317 1.00 25.33 O ATOM 120 HA SER A 9 47.008 12.471 2.716 1.00 0.00 H ATOM 121 HB2 SER A 9 46.992 10.022 0.892 1.00 0.00 H ATOM 122 HB3 SER A 9 48.034 11.452 0.710 1.00 0.00 H ATOM 123 HG SER A 9 46.152 11.545 -0.646 1.00 0.00 H ATOM 124 H SER A 9 48.638 10.128 2.795 1.00 0.00 H ATOM 125 N GLU A 10 45.388 9.631 3.111 1.00 25.24 N ATOM 126 CA GLU A 10 44.107 9.085 3.528 1.00 24.93 C ATOM 127 C GLU A 10 43.811 9.369 4.993 1.00 24.68 C ATOM 128 O GLU A 10 42.678 9.725 5.330 1.00 24.41 O ATOM 129 CB GLU A 10 43.996 7.613 3.175 1.00 25.14 C ATOM 130 CG GLU A 10 44.001 7.446 1.670 1.00 25.42 C ATOM 131 CD GLU A 10 44.158 6.029 1.205 1.00 26.76 C ATOM 132 OE1 GLU A 10 44.353 5.134 2.044 1.00 27.63 O ATOM 133 OE2 GLU A 10 44.072 5.818 -0.025 1.00 29.17 O ATOM 134 HA GLU A 10 43.329 9.602 2.966 1.00 0.00 H ATOM 135 HB2 GLU A 10 44.841 7.073 3.602 1.00 0.00 H ATOM 136 HB3 GLU A 10 43.067 7.212 3.581 1.00 0.00 H ATOM 137 HG2 GLU A 10 43.058 7.830 1.281 1.00 0.00 H ATOM 138 HG3 GLU A 10 44.826 8.032 1.264 1.00 0.00 H ATOM 139 H GLU A 10 46.183 8.996 2.895 1.00 0.00 H ATOM 140 N LEU A 11 44.812 9.269 5.857 1.00 24.09 N ATOM 141 CA LEU A 11 44.608 9.619 7.256 1.00 23.91 C ATOM 142 C LEU A 11 44.149 11.078 7.415 1.00 23.44 C ATOM 143 O LEU A 11 43.161 11.365 8.108 1.00 23.32 O ATOM 144 CB LEU A 11 45.903 9.354 8.033 1.00 23.37 C ATOM 145 CG LEU A 11 45.888 9.806 9.486 1.00 24.36 C ATOM 146 CD1 LEU A 11 44.877 8.960 10.305 1.00 25.88 C ATOM 147 CD2 LEU A 11 47.284 9.704 10.109 1.00 24.59 C ATOM 148 HA LEU A 11 43.811 8.997 7.663 1.00 0.00 H ATOM 149 HB2 LEU A 11 46.095 8.281 8.015 1.00 0.00 H ATOM 150 HB3 LEU A 11 46.714 9.875 7.525 1.00 0.00 H ATOM 151 HG LEU A 11 45.578 10.851 9.510 1.00 0.00 H ATOM 152 HD21 LEU A 11 47.624 8.669 10.068 1.00 0.00 H ATOM 153 HD22 LEU A 11 47.976 10.337 9.553 1.00 0.00 H ATOM 154 HD23 LEU A 11 47.242 10.034 11.147 1.00 0.00 H ATOM 155 HD11 LEU A 11 43.879 9.081 9.884 1.00 0.00 H ATOM 156 HD12 LEU A 11 45.165 7.910 10.262 1.00 0.00 H ATOM 157 HD13 LEU A 11 44.879 9.297 11.342 1.00 0.00 H ATOM 158 H LEU A 11 45.745 8.940 5.535 1.00 0.00 H ATOM 159 N TYR A 12 44.860 12.024 6.795 1.00 23.44 N ATOM 160 CA TYR A 12 44.509 13.433 6.954 1.00 24.30 C ATOM 161 C TYR A 12 43.234 13.827 6.223 1.00 23.07 C ATOM 162 O TYR A 12 42.667 14.876 6.522 1.00 24.44 O ATOM 163 CB TYR A 12 45.694 14.342 6.621 1.00 25.37 C ATOM 164 CG TYR A 12 46.674 14.380 7.783 1.00 26.71 C ATOM 165 CD1 TYR A 12 46.664 15.448 8.669 1.00 29.85 C ATOM 166 CD2 TYR A 12 47.579 13.335 8.004 1.00 29.57 C ATOM 167 CE1 TYR A 12 47.546 15.488 9.741 1.00 28.88 C ATOM 168 CE2 TYR A 12 48.455 13.354 9.090 1.00 29.25 C ATOM 169 CZ TYR A 12 48.431 14.446 9.943 1.00 29.70 C ATOM 170 OH TYR A 12 49.289 14.520 11.012 1.00 30.74 O ATOM 171 HA TYR A 12 44.278 13.579 8.009 1.00 0.00 H ATOM 172 HB3 TYR A 12 45.330 15.350 6.424 1.00 0.00 H ATOM 173 HB2 TYR A 12 46.202 13.961 5.735 1.00 0.00 H ATOM 174 HD2 TYR A 12 47.600 12.491 7.315 1.00 0.00 H ATOM 175 HE2 TYR A 12 49.144 12.527 9.264 1.00 0.00 H ATOM 176 HE1 TYR A 12 47.540 16.339 10.422 1.00 0.00 H ATOM 177 HD1 TYR A 12 45.956 16.264 8.522 1.00 0.00 H ATOM 178 HH TYR A 12 49.129 15.364 11.504 1.00 0.00 H ATOM 179 H TYR A 12 45.667 11.756 6.196 1.00 0.00 H ATOM 180 N SER A 13 42.762 12.953 5.323 1.00 22.80 N ATOM 181 CA SER A 13 41.483 13.199 4.629 1.00 22.59 C ATOM 182 C SER A 13 40.309 13.178 5.613 1.00 21.85 C ATOM 183 O SER A 13 39.233 13.689 5.292 1.00 23.05 O ATOM 184 CB SER A 13 41.250 12.217 3.460 1.00 22.34 C ATOM 185 OG SER A 13 40.823 10.931 3.889 1.00 22.89 O ATOM 186 HA SER A 13 41.545 14.197 4.194 1.00 0.00 H ATOM 187 HB2 SER A 13 42.183 12.107 2.908 1.00 0.00 H ATOM 188 HB3 SER A 13 40.488 12.635 2.802 1.00 0.00 H ATOM 189 HG SER A 13 41.512 10.536 4.480 1.00 0.00 H ATOM 190 H SER A 13 43.304 12.091 5.111 1.00 0.00 H ATOM 191 N LEU A 14 40.529 12.604 6.801 1.00 22.78 N ATOM 192 CA LEU A 14 39.537 12.650 7.859 1.00 22.83 C ATOM 193 C LEU A 14 39.048 14.069 8.104 1.00 23.09 C ATOM 194 O LEU A 14 37.881 14.269 8.446 1.00 22.41 O ATOM 195 CB LEU A 14 40.064 12.044 9.153 1.00 22.45 C ATOM 196 CG LEU A 14 40.298 10.523 9.160 1.00 23.19 C ATOM 197 CD1 LEU A 14 40.825 10.148 10.547 1.00 25.50 C ATOM 198 CD2 LEU A 14 39.020 9.753 8.843 1.00 25.76 C ATOM 199 HA LEU A 14 38.692 12.049 7.523 1.00 0.00 H ATOM 200 HB2 LEU A 14 41.015 12.526 9.380 1.00 0.00 H ATOM 201 HB3 LEU A 14 39.346 12.271 9.941 1.00 0.00 H ATOM 202 HG LEU A 14 41.018 10.257 8.386 1.00 0.00 H ATOM 203 HD21 LEU A 14 38.262 9.987 9.590 1.00 0.00 H ATOM 204 HD22 LEU A 14 38.660 10.040 7.855 1.00 0.00 H ATOM 205 HD23 LEU A 14 39.229 8.683 8.858 1.00 0.00 H ATOM 206 HD11 LEU A 14 41.758 10.679 10.736 1.00 0.00 H ATOM 207 HD12 LEU A 14 40.089 10.425 11.301 1.00 0.00 H ATOM 208 HD13 LEU A 14 41.003 9.073 10.588 1.00 0.00 H ATOM 209 H LEU A 14 41.431 12.114 6.970 1.00 0.00 H ATOM 210 N ASN A 15 39.927 15.053 7.877 1.00 24.00 N ATOM 211 CA ASN A 15 39.600 16.484 8.073 1.00 25.00 C ATOM 212 C ASN A 15 38.532 17.054 7.139 1.00 24.90 C ATOM 213 O ASN A 15 38.045 18.176 7.341 1.00 24.21 O ATOM 214 CB ASN A 15 40.868 17.338 7.957 1.00 26.03 C ATOM 215 CG ASN A 15 41.737 17.253 9.197 1.00 28.35 C ATOM 216 OD1 ASN A 15 41.395 17.803 10.242 1.00 32.91 O ATOM 217 ND2 ASN A 15 42.869 16.575 9.083 1.00 30.35 N ATOM 218 HA ASN A 15 39.173 16.529 9.075 1.00 0.00 H ATOM 219 HB2 ASN A 15 41.446 16.993 7.100 1.00 0.00 H ATOM 220 HB3 ASN A 15 40.578 18.377 7.803 1.00 0.00 H ATOM 221 HD22 ASN A 15 43.117 16.126 8.178 1.00 0.00 H ATOM 222 HD21 ASN A 15 43.510 16.492 9.898 1.00 0.00 H ATOM 223 H ASN A 15 40.881 14.801 7.549 1.00 0.00 H ATOM 224 N ASP A 16 38.207 16.285 6.098 1.00 24.65 N ATOM 225 CA ASP A 16 37.200 16.667 5.126 1.00 24.77 C ATOM 226 C ASP A 16 35.789 16.254 5.550 1.00 23.25 C ATOM 227 O ASP A 16 34.791 16.622 4.896 1.00 22.20 O ATOM 228 CB ASP A 16 37.534 16.037 3.767 1.00 26.16 C ATOM 229 CG ASP A 16 38.724 16.761 3.088 1.00 30.70 C ATOM 230 OD1 ASP A 16 39.043 17.947 3.436 1.00 34.72 O ATOM 231 OD2 ASP A 16 39.336 16.136 2.191 1.00 36.63 O ATOM 232 HA ASP A 16 37.212 17.755 5.055 1.00 0.00 H ATOM 233 HB2 ASP A 16 37.794 14.989 3.915 1.00 0.00 H ATOM 234 HB3 ASP A 16 36.660 16.105 3.119 1.00 0.00 H ATOM 235 H ASP A 16 38.696 15.375 5.979 1.00 0.00 H ATOM 236 N TYR A 17 35.697 15.492 6.642 1.00 22.57 N ATOM 237 CA TYR A 17 34.456 14.839 7.026 1.00 23.15 C ATOM 238 C TYR A 17 34.012 15.140 8.440 1.00 23.99 C ATOM 239 O TYR A 17 34.846 15.290 9.344 1.00 24.77 O ATOM 240 CB TYR A 17 34.596 13.311 6.841 1.00 22.41 C ATOM 241 CG TYR A 17 34.975 12.965 5.418 1.00 21.98 C ATOM 242 CD1 TYR A 17 36.300 12.607 5.079 1.00 21.74 C ATOM 243 CD2 TYR A 17 34.019 12.996 4.419 1.00 22.69 C ATOM 244 CE1 TYR A 17 36.635 12.334 3.752 1.00 22.11 C ATOM 245 CE2 TYR A 17 34.340 12.737 3.104 1.00 21.75 C ATOM 246 CZ TYR A 17 35.638 12.377 2.779 1.00 20.34 C ATOM 247 OH TYR A 17 35.880 12.130 1.433 1.00 23.09 O ATOM 248 HA TYR A 17 33.684 15.243 6.372 1.00 0.00 H ATOM 249 HB3 TYR A 17 33.646 12.835 7.082 1.00 0.00 H ATOM 250 HB2 TYR A 17 35.368 12.940 7.515 1.00 0.00 H ATOM 251 HD2 TYR A 17 32.987 13.231 4.678 1.00 0.00 H ATOM 252 HE2 TYR A 17 33.580 12.815 2.327 1.00 0.00 H ATOM 253 HE1 TYR A 17 37.662 12.091 3.480 1.00 0.00 H ATOM 254 HD1 TYR A 17 37.062 12.544 5.856 1.00 0.00 H ATOM 255 HH TYR A 17 36.831 11.882 1.310 1.00 0.00 H ATOM 256 H TYR A 17 36.540 15.361 7.237 1.00 0.00 H ATOM 257 N LYS A 18 32.674 15.153 8.640 1.00 25.63 N ATOM 258 CA LYS A 18 32.103 15.273 9.984 1.00 27.91 C ATOM 259 C LYS A 18 31.966 13.873 10.595 1.00 27.54 C ATOM 260 O LYS A 18 31.202 13.049 10.039 1.00 28.73 O ATOM 261 CB LYS A 18 30.724 15.924 9.885 1.00 28.30 C ATOM 262 CG LYS A 18 30.172 16.437 11.213 1.00 32.19 C ATOM 263 CD LYS A 18 30.879 17.750 11.637 1.00 34.64 C ATOM 264 CE LYS A 18 30.717 18.060 13.128 1.00 35.17 C ATOM 265 NZ LYS A 18 31.436 19.398 13.387 1.00 35.68 N ATOM 266 HA LYS A 18 32.751 15.885 10.612 1.00 0.00 H ATOM 267 HB2 LYS A 18 30.793 16.766 9.196 1.00 0.00 H ATOM 268 HB3 LYS A 18 30.026 15.187 9.487 1.00 0.00 H ATOM 269 HG2 LYS A 18 29.104 16.625 11.107 1.00 0.00 H ATOM 270 HG3 LYS A 18 30.332 15.681 11.982 1.00 0.00 H ATOM 271 HD2 LYS A 18 31.942 17.661 11.414 1.00 0.00 H ATOM 272 HD3 LYS A 18 30.456 18.574 11.062 1.00 0.00 H ATOM 273 HE2 LYS A 18 31.169 17.269 13.727 1.00 0.00 H ATOM 274 HE3 LYS A 18 29.660 18.147 13.381 1.00 0.00 H ATOM 275 HZ1 LYS A 18 32.441 19.304 13.136 1.00 0.00 H ATOM 276 HZ2 LYS A 18 31.001 20.142 12.806 1.00 0.00 H ATOM 277 HZ3 LYS A 18 31.350 19.647 14.393 1.00 0.00 H ATOM 278 H LYS A 18 32.037 15.076 7.822 1.00 0.00 H ATOM 279 N PRO A 19 32.651 13.596 11.728 1.00 27.81 N ATOM 280 CA PRO A 19 32.440 12.287 12.378 1.00 27.22 C ATOM 281 C PRO A 19 30.960 12.083 12.809 1.00 26.37 C ATOM 282 O PRO A 19 30.250 13.063 13.038 1.00 25.98 O ATOM 283 CB PRO A 19 33.355 12.354 13.612 1.00 27.60 C ATOM 284 CG PRO A 19 34.441 13.335 13.216 1.00 28.80 C ATOM 285 CD PRO A 19 33.673 14.379 12.434 1.00 27.75 C ATOM 286 HA PRO A 19 32.663 11.454 11.711 1.00 0.00 H ATOM 287 HD3 PRO A 19 33.214 15.107 13.103 1.00 0.00 H ATOM 288 HD2 PRO A 19 34.324 14.895 11.729 1.00 0.00 H ATOM 289 HG3 PRO A 19 35.198 12.855 12.595 1.00 0.00 H ATOM 290 HG2 PRO A 19 34.917 13.772 14.094 1.00 0.00 H ATOM 291 HB2 PRO A 19 32.806 12.715 14.482 1.00 0.00 H ATOM 292 HB3 PRO A 19 33.780 11.375 13.833 1.00 0.00 H ATOM 293 N PRO A 20 30.501 10.823 12.964 1.00 25.71 N ATOM 294 CA PRO A 20 31.285 9.584 12.817 1.00 25.77 C ATOM 295 C PRO A 20 31.741 9.298 11.389 1.00 24.93 C ATOM 296 O PRO A 20 30.997 9.580 10.412 1.00 24.69 O ATOM 297 CB PRO A 20 30.316 8.490 13.281 1.00 26.37 C ATOM 298 CG PRO A 20 29.004 9.048 13.117 1.00 27.97 C ATOM 299 CD PRO A 20 29.113 10.530 13.374 1.00 26.69 C ATOM 300 HA PRO A 20 32.211 9.648 13.388 1.00 0.00 H ATOM 301 HD3 PRO A 20 28.397 11.089 12.771 1.00 0.00 H ATOM 302 HD2 PRO A 20 28.956 10.760 14.428 1.00 0.00 H ATOM 303 HG3 PRO A 20 28.314 8.595 13.829 1.00 0.00 H ATOM 304 HG2 PRO A 20 28.646 8.870 12.103 1.00 0.00 H ATOM 305 HB2 PRO A 20 30.429 7.595 12.669 1.00 0.00 H ATOM 306 HB3 PRO A 20 30.496 8.239 14.326 1.00 0.00 H ATOM 307 N ILE A 21 32.956 8.744 11.303 1.00 25.02 N ATOM 308 CA ILE A 21 33.581 8.368 10.041 1.00 24.48 C ATOM 309 C ILE A 21 33.009 7.051 9.495 1.00 24.40 C ATOM 310 O ILE A 21 32.783 6.110 10.256 1.00 25.52 O ATOM 311 CB ILE A 21 35.116 8.311 10.202 1.00 24.80 C ATOM 312 CG1 ILE A 21 35.661 9.681 10.678 1.00 24.45 C ATOM 313 CG2 ILE A 21 35.810 7.877 8.909 1.00 25.41 C ATOM 314 CD1 ILE A 21 35.394 10.833 9.701 1.00 26.97 C ATOM 315 HA ILE A 21 33.349 9.134 9.301 1.00 0.00 H ATOM 316 HB ILE A 21 35.338 7.559 10.959 1.00 0.00 H ATOM 317 HG12 ILE A 21 35.192 9.924 11.631 1.00 0.00 H ATOM 318 HG13 ILE A 21 36.738 9.592 10.817 1.00 0.00 H ATOM 319 HD11 ILE A 21 35.867 10.613 8.744 1.00 0.00 H ATOM 320 HD12 ILE A 21 34.319 10.946 9.559 1.00 0.00 H ATOM 321 HD13 ILE A 21 35.807 11.756 10.108 1.00 0.00 H ATOM 322 HG21 ILE A 21 35.459 6.885 8.625 1.00 0.00 H ATOM 323 HG22 ILE A 21 35.576 8.587 8.116 1.00 0.00 H ATOM 324 HG23 ILE A 21 36.888 7.851 9.068 1.00 0.00 H ATOM 325 H ILE A 21 33.482 8.573 12.183 1.00 0.00 H ATOM 326 N SER A 22 32.824 7.034 8.178 1.00 22.97 N ATOM 327 CA SER A 22 32.350 5.893 7.392 1.00 23.47 C ATOM 328 C SER A 22 33.237 4.650 7.580 1.00 23.58 C ATOM 329 O SER A 22 34.446 4.777 7.658 1.00 23.56 O ATOM 330 CB SER A 22 32.385 6.322 5.928 1.00 23.46 C ATOM 331 OG SER A 22 32.413 5.241 5.032 1.00 23.13 O ATOM 332 HA SER A 22 31.347 5.619 7.718 1.00 0.00 H ATOM 333 HB2 SER A 22 33.276 6.929 5.766 1.00 0.00 H ATOM 334 HB3 SER A 22 31.497 6.920 5.721 1.00 0.00 H ATOM 335 HG SER A 22 32.435 5.584 4.104 1.00 0.00 H ATOM 336 H SER A 22 33.035 7.910 7.659 1.00 0.00 H ATOM 337 N LYS A 23 32.619 3.470 7.614 1.00 24.64 N ATOM 338 CA LYS A 23 33.351 2.208 7.574 1.00 24.82 C ATOM 339 C LYS A 23 34.267 2.145 6.354 1.00 24.08 C ATOM 340 O LYS A 23 35.426 1.720 6.471 1.00 24.70 O ATOM 341 CB LYS A 23 32.387 1.020 7.562 1.00 25.80 C ATOM 342 CG LYS A 23 33.063 -0.338 7.769 1.00 27.48 C ATOM 343 CD LYS A 23 33.075 -0.734 9.244 1.00 31.13 C ATOM 344 CE LYS A 23 33.945 -1.966 9.482 1.00 31.13 C ATOM 345 NZ LYS A 23 33.986 -2.362 10.914 1.00 34.06 N ATOM 346 HA LYS A 23 33.965 2.154 8.473 1.00 0.00 H ATOM 347 HB2 LYS A 23 31.657 1.164 8.358 1.00 0.00 H ATOM 348 HB3 LYS A 23 31.875 1.004 6.600 1.00 0.00 H ATOM 349 HG2 LYS A 23 32.520 -1.095 7.202 1.00 0.00 H ATOM 350 HG3 LYS A 23 34.090 -0.282 7.408 1.00 0.00 H ATOM 351 HD2 LYS A 23 33.467 0.096 9.831 1.00 0.00 H ATOM 352 HD3 LYS A 23 32.055 -0.953 9.561 1.00 0.00 H ATOM 353 HE2 LYS A 23 34.960 -1.748 9.150 1.00 0.00 H ATOM 354 HE3 LYS A 23 33.544 -2.796 8.900 1.00 0.00 H ATOM 355 HZ1 LYS A 23 34.375 -1.579 11.478 1.00 0.00 H ATOM 356 HZ2 LYS A 23 33.023 -2.580 11.240 1.00 0.00 H ATOM 357 HZ3 LYS A 23 34.589 -3.202 11.023 1.00 0.00 H ATOM 358 H LYS A 23 31.581 3.448 7.671 1.00 0.00 H ATOM 359 N ALA A 24 33.762 2.588 5.193 1.00 23.61 N ATOM 360 CA ALA A 24 34.561 2.573 3.968 1.00 22.44 C ATOM 361 C ALA A 24 35.818 3.417 4.104 1.00 22.49 C ATOM 362 O ALA A 24 36.893 3.011 3.667 1.00 21.87 O ATOM 363 CB ALA A 24 33.718 3.014 2.763 1.00 22.39 C ATOM 364 HA ALA A 24 34.884 1.546 3.797 1.00 0.00 H ATOM 365 HB1 ALA A 24 32.875 2.333 2.642 1.00 0.00 H ATOM 366 HB2 ALA A 24 33.349 4.026 2.930 1.00 0.00 H ATOM 367 HB3 ALA A 24 34.334 2.995 1.864 1.00 0.00 H ATOM 368 H ALA A 24 32.787 2.948 5.163 1.00 0.00 H ATOM 369 N LYS A 25 35.706 4.588 4.723 1.00 22.06 N ATOM 370 CA LYS A 25 36.893 5.428 4.907 1.00 22.68 C ATOM 371 C LYS A 25 37.903 4.771 5.858 1.00 22.70 C ATOM 372 O LYS A 25 39.129 4.785 5.625 1.00 22.89 O ATOM 373 CB LYS A 25 36.504 6.838 5.390 1.00 22.57 C ATOM 374 CG LYS A 25 37.683 7.771 5.771 1.00 24.91 C ATOM 375 CD LYS A 25 38.718 7.977 4.672 1.00 24.55 C ATOM 376 CE LYS A 25 38.197 8.763 3.482 1.00 24.66 C ATOM 377 NZ LYS A 25 39.263 9.086 2.449 1.00 25.21 N ATOM 378 HA LYS A 25 37.379 5.531 3.937 1.00 0.00 H ATOM 379 HB2 LYS A 25 35.939 7.321 4.592 1.00 0.00 H ATOM 380 HB3 LYS A 25 35.868 6.727 6.268 1.00 0.00 H ATOM 381 HG2 LYS A 25 37.272 8.745 6.037 1.00 0.00 H ATOM 382 HG3 LYS A 25 38.188 7.343 6.637 1.00 0.00 H ATOM 383 HD2 LYS A 25 39.567 8.514 5.095 1.00 0.00 H ATOM 384 HD3 LYS A 25 39.047 6.999 4.321 1.00 0.00 H ATOM 385 HE2 LYS A 25 37.775 9.700 3.846 1.00 0.00 H ATOM 386 HE3 LYS A 25 37.415 8.178 2.998 1.00 0.00 H ATOM 387 HZ1 LYS A 25 40.012 9.655 2.892 1.00 0.00 H ATOM 388 HZ2 LYS A 25 39.668 8.201 2.083 1.00 0.00 H ATOM 389 HZ3 LYS A 25 38.835 9.622 1.667 1.00 0.00 H ATOM 390 H LYS A 25 34.781 4.907 5.075 1.00 0.00 H ATOM 391 N MET A 26 37.411 4.230 6.965 1.00 23.01 N ATOM 392 CA MET A 26 38.275 3.538 7.920 1.00 23.37 C ATOM 393 C MET A 26 38.956 2.356 7.239 1.00 23.48 C ATOM 394 O MET A 26 40.141 2.133 7.448 1.00 23.43 O ATOM 395 CB MET A 26 37.467 3.063 9.125 1.00 23.96 C ATOM 396 CG MET A 26 38.300 2.772 10.355 1.00 26.31 C ATOM 397 SD MET A 26 39.280 4.176 10.954 1.00 28.44 S ATOM 398 CE MET A 26 38.015 5.341 11.463 1.00 32.82 C ATOM 399 HA MET A 26 39.038 4.232 8.272 1.00 0.00 H ATOM 400 HB2 MET A 26 36.742 3.837 9.378 1.00 0.00 H ATOM 401 HB3 MET A 26 36.940 2.151 8.845 1.00 0.00 H ATOM 402 HG2 MET A 26 38.983 1.957 10.118 1.00 0.00 H ATOM 403 HG3 MET A 26 37.628 2.460 11.155 1.00 0.00 H ATOM 404 HE1 MET A 26 37.391 5.595 10.606 1.00 0.00 H ATOM 405 HE2 MET A 26 37.400 4.890 12.242 1.00 0.00 H ATOM 406 HE3 MET A 26 38.488 6.244 11.849 1.00 0.00 H ATOM 407 H MET A 26 36.391 4.300 7.157 1.00 0.00 H ATOM 408 N THR A 27 38.212 1.631 6.411 1.00 22.25 N ATOM 409 CA THR A 27 38.793 0.501 5.649 1.00 22.92 C ATOM 410 C THR A 27 39.919 0.962 4.732 1.00 22.67 C ATOM 411 O THR A 27 40.984 0.334 4.683 1.00 23.29 O ATOM 412 CB THR A 27 37.722 -0.227 4.861 1.00 23.77 C ATOM 413 OG1 THR A 27 36.776 -0.778 5.779 1.00 26.16 O ATOM 414 CG2 THR A 27 38.323 -1.363 4.002 1.00 24.17 C ATOM 415 HA THR A 27 39.221 -0.195 6.371 1.00 0.00 H ATOM 416 HB THR A 27 37.242 0.483 4.188 1.00 0.00 H ATOM 417 HG1 THR A 27 36.368 -0.048 6.309 1.00 0.00 H ATOM 418 HG23 THR A 27 39.045 -0.944 3.301 1.00 0.00 H ATOM 419 HG21 THR A 27 38.821 -2.083 4.651 1.00 0.00 H ATOM 420 HG22 THR A 27 37.525 -1.860 3.450 1.00 0.00 H ATOM 421 H THR A 27 37.204 1.861 6.296 1.00 0.00 H ATOM 422 N GLN A 28 39.717 2.075 4.022 1.00 22.33 N ATOM 423 CA GLN A 28 40.749 2.638 3.137 1.00 22.51 C ATOM 424 C GLN A 28 42.034 2.977 3.907 1.00 22.71 C ATOM 425 O GLN A 28 43.146 2.643 3.498 1.00 23.37 O ATOM 426 CB GLN A 28 40.208 3.909 2.485 1.00 21.80 C ATOM 427 CG GLN A 28 41.133 4.548 1.461 1.00 22.65 C ATOM 428 CD GLN A 28 40.651 5.922 1.043 1.00 23.35 C ATOM 429 OE1 GLN A 28 40.373 6.769 1.889 1.00 24.88 O ATOM 430 NE2 GLN A 28 40.538 6.144 -0.259 1.00 25.38 N ATOM 431 HA GLN A 28 40.993 1.890 2.383 1.00 0.00 H ATOM 432 HB2 GLN A 28 39.271 3.662 1.987 1.00 0.00 H ATOM 433 HB3 GLN A 28 40.018 4.639 3.272 1.00 0.00 H ATOM 434 HG2 GLN A 28 42.129 4.641 1.895 1.00 0.00 H ATOM 435 HG3 GLN A 28 41.180 3.908 0.580 1.00 0.00 H ATOM 436 HE22 GLN A 28 40.785 5.396 -0.938 1.00 0.00 H ATOM 437 HE21 GLN A 28 40.202 7.067 -0.602 1.00 0.00 H ATOM 438 H GLN A 28 38.800 2.560 4.097 1.00 0.00 H ATOM 439 N ILE A 29 41.870 3.681 5.020 1.00 21.75 N ATOM 440 CA ILE A 29 43.026 4.052 5.850 1.00 21.94 C ATOM 441 C ILE A 29 43.750 2.788 6.331 1.00 22.26 C ATOM 442 O ILE A 29 44.975 2.737 6.319 1.00 23.49 O ATOM 443 CB ILE A 29 42.580 4.920 7.047 1.00 21.75 C ATOM 444 CG1 ILE A 29 42.003 6.262 6.534 1.00 22.17 C ATOM 445 CG2 ILE A 29 43.722 5.126 8.065 1.00 22.25 C ATOM 446 CD1 ILE A 29 41.202 7.034 7.582 1.00 22.53 C ATOM 447 HA ILE A 29 43.718 4.642 5.249 1.00 0.00 H ATOM 448 HB ILE A 29 41.791 4.393 7.584 1.00 0.00 H ATOM 449 HG12 ILE A 29 42.832 6.889 6.205 1.00 0.00 H ATOM 450 HG13 ILE A 29 41.349 6.053 5.687 1.00 0.00 H ATOM 451 HD11 ILE A 29 40.360 6.427 7.914 1.00 0.00 H ATOM 452 HD12 ILE A 29 41.844 7.263 8.432 1.00 0.00 H ATOM 453 HD13 ILE A 29 40.832 7.961 7.144 1.00 0.00 H ATOM 454 HG21 ILE A 29 44.046 4.158 8.446 1.00 0.00 H ATOM 455 HG22 ILE A 29 44.559 5.623 7.575 1.00 0.00 H ATOM 456 HG23 ILE A 29 43.365 5.742 8.890 1.00 0.00 H ATOM 457 H ILE A 29 40.914 3.973 5.308 1.00 0.00 H ATOM 458 N THR A 30 42.977 1.805 6.799 1.00 21.84 N ATOM 459 CA THR A 30 43.528 0.573 7.387 1.00 21.78 C ATOM 460 C THR A 30 44.281 -0.181 6.309 1.00 22.12 C ATOM 461 O THR A 30 45.411 -0.657 6.534 1.00 22.72 O ATOM 462 CB THR A 30 42.406 -0.296 7.956 1.00 21.90 C ATOM 463 OG1 THR A 30 41.803 0.436 9.031 1.00 23.20 O ATOM 464 CG2 THR A 30 42.965 -1.616 8.482 1.00 23.48 C ATOM 465 HA THR A 30 44.204 0.826 8.204 1.00 0.00 H ATOM 466 HB THR A 30 41.676 -0.526 7.180 1.00 0.00 H ATOM 467 HG1 THR A 30 41.440 1.290 8.685 1.00 0.00 H ATOM 468 HG23 THR A 30 43.422 -2.168 7.661 1.00 0.00 H ATOM 469 HG21 THR A 30 43.715 -1.413 9.247 1.00 0.00 H ATOM 470 HG22 THR A 30 42.156 -2.206 8.912 1.00 0.00 H ATOM 471 H THR A 30 41.944 1.914 6.746 1.00 0.00 H ATOM 472 N LYS A 31 43.668 -0.306 5.145 1.00 22.55 N ATOM 473 CA LYS A 31 44.315 -1.041 4.049 1.00 23.05 C ATOM 474 C LYS A 31 45.648 -0.383 3.677 1.00 22.57 C ATOM 475 O LYS A 31 46.624 -1.088 3.378 1.00 22.99 O ATOM 476 CB LYS A 31 43.396 -1.131 2.831 1.00 23.13 C ATOM 477 CG LYS A 31 42.389 -2.247 2.982 1.00 25.92 C ATOM 478 CD LYS A 31 41.534 -2.435 1.743 1.00 28.51 C ATOM 479 CE LYS A 31 40.815 -3.806 1.787 1.00 32.11 C ATOM 480 NZ LYS A 31 41.752 -5.005 1.604 1.00 32.32 N ATOM 481 HA LYS A 31 44.515 -2.056 4.392 1.00 0.00 H ATOM 482 HB2 LYS A 31 42.864 -0.186 2.717 1.00 0.00 H ATOM 483 HB3 LYS A 31 44.001 -1.316 1.943 1.00 0.00 H ATOM 484 HG2 LYS A 31 42.924 -3.176 3.181 1.00 0.00 H ATOM 485 HG3 LYS A 31 41.737 -2.017 3.825 1.00 0.00 H ATOM 486 HD2 LYS A 31 40.790 -1.640 1.696 1.00 0.00 H ATOM 487 HD3 LYS A 31 42.169 -2.390 0.858 1.00 0.00 H ATOM 488 HE2 LYS A 31 40.069 -3.828 0.992 1.00 0.00 H ATOM 489 HE3 LYS A 31 40.318 -3.902 2.752 1.00 0.00 H ATOM 490 HZ1 LYS A 31 42.226 -4.935 0.681 1.00 0.00 H ATOM 491 HZ2 LYS A 31 42.464 -5.006 2.362 1.00 0.00 H ATOM 492 HZ3 LYS A 31 41.199 -5.885 1.645 1.00 0.00 H ATOM 493 H LYS A 31 42.728 0.116 5.004 1.00 0.00 H ATOM 494 N ALA A 32 45.695 0.952 3.663 1.00 22.45 N ATOM 495 CA ALA A 32 46.930 1.662 3.324 1.00 21.99 C ATOM 496 C ALA A 32 47.995 1.449 4.393 1.00 22.70 C ATOM 497 O ALA A 32 49.161 1.261 4.064 1.00 23.35 O ATOM 498 CB ALA A 32 46.668 3.149 3.117 1.00 22.40 C ATOM 499 HA ALA A 32 47.302 1.249 2.386 1.00 0.00 H ATOM 500 HB1 ALA A 32 45.954 3.281 2.304 1.00 0.00 H ATOM 501 HB2 ALA A 32 46.260 3.576 4.033 1.00 0.00 H ATOM 502 HB3 ALA A 32 47.603 3.650 2.867 1.00 0.00 H ATOM 503 H ALA A 32 44.840 1.496 3.897 1.00 0.00 H ATOM 504 N ALA A 33 47.588 1.442 5.661 1.00 22.45 N ATOM 505 CA ALA A 33 48.539 1.174 6.746 1.00 21.59 C ATOM 506 C ALA A 33 49.162 -0.210 6.586 1.00 22.00 C ATOM 507 O ALA A 33 50.378 -0.370 6.692 1.00 23.31 O ATOM 508 CB ALA A 33 47.831 1.262 8.092 1.00 22.39 C ATOM 509 HA ALA A 33 49.330 1.922 6.702 1.00 0.00 H ATOM 510 HB1 ALA A 33 47.415 2.262 8.217 1.00 0.00 H ATOM 511 HB2 ALA A 33 47.028 0.526 8.128 1.00 0.00 H ATOM 512 HB3 ALA A 33 48.545 1.062 8.891 1.00 0.00 H ATOM 513 H ALA A 33 46.589 1.628 5.884 1.00 0.00 H ATOM 514 N ILE A 34 48.302 -1.204 6.377 1.00 22.35 N ATOM 515 CA ILE A 34 48.724 -2.605 6.291 1.00 21.34 C ATOM 516 C ILE A 34 49.644 -2.826 5.071 1.00 20.90 C ATOM 517 O ILE A 34 50.660 -3.543 5.160 1.00 20.97 O ATOM 518 CB ILE A 34 47.475 -3.569 6.281 1.00 22.57 C ATOM 519 CG1 ILE A 34 46.677 -3.480 7.592 1.00 26.34 C ATOM 520 CG2 ILE A 34 47.893 -5.034 5.995 1.00 22.00 C ATOM 521 CD1 ILE A 34 47.404 -3.935 8.753 1.00 29.07 C ATOM 522 HA ILE A 34 49.306 -2.848 7.180 1.00 0.00 H ATOM 523 HB ILE A 34 46.824 -3.238 5.472 1.00 0.00 H ATOM 524 HG12 ILE A 34 46.393 -2.440 7.751 1.00 0.00 H ATOM 525 HG13 ILE A 34 45.779 -4.089 7.489 1.00 0.00 H ATOM 526 HD11 ILE A 34 47.686 -4.979 8.617 1.00 0.00 H ATOM 527 HD12 ILE A 34 48.301 -3.328 8.879 1.00 0.00 H ATOM 528 HD13 ILE A 34 46.772 -3.840 9.636 1.00 0.00 H ATOM 529 HG21 ILE A 34 48.380 -5.088 5.021 1.00 0.00 H ATOM 530 HG22 ILE A 34 48.584 -5.371 6.768 1.00 0.00 H ATOM 531 HG23 ILE A 34 47.008 -5.670 5.996 1.00 0.00 H ATOM 532 H ILE A 34 47.292 -0.978 6.271 1.00 0.00 H ATOM 533 N LYS A 35 49.275 -2.234 3.935 1.00 20.53 N ATOM 534 CA LYS A 35 50.115 -2.316 2.735 1.00 20.69 C ATOM 535 C LYS A 35 51.516 -1.764 2.993 1.00 20.60 C ATOM 536 O LYS A 35 52.500 -2.244 2.408 1.00 20.97 O ATOM 537 CB LYS A 35 49.451 -1.570 1.593 1.00 21.65 C ATOM 538 CG LYS A 35 48.448 -2.438 0.879 1.00 25.24 C ATOM 539 CD LYS A 35 47.757 -1.710 -0.255 1.00 26.22 C ATOM 540 CE LYS A 35 48.734 -1.327 -1.355 1.00 25.89 C ATOM 541 NZ LYS A 35 48.044 -0.563 -2.472 1.00 25.56 N ATOM 542 HA LYS A 35 50.223 -3.366 2.464 1.00 0.00 H ATOM 543 HB2 LYS A 35 48.941 -0.693 1.991 1.00 0.00 H ATOM 544 HB3 LYS A 35 50.216 -1.254 0.883 1.00 0.00 H ATOM 545 HG2 LYS A 35 48.964 -3.308 0.474 1.00 0.00 H ATOM 546 HG3 LYS A 35 47.695 -2.765 1.596 1.00 0.00 H ATOM 547 HD2 LYS A 35 46.988 -2.358 -0.675 1.00 0.00 H ATOM 548 HD3 LYS A 35 47.293 -0.805 0.137 1.00 0.00 H ATOM 549 HE2 LYS A 35 49.177 -2.234 -1.767 1.00 0.00 H ATOM 550 HE3 LYS A 35 49.519 -0.701 -0.930 1.00 0.00 H ATOM 551 HZ1 LYS A 35 47.297 -1.156 -2.886 1.00 0.00 H ATOM 552 HZ2 LYS A 35 47.624 0.307 -2.087 1.00 0.00 H ATOM 553 HZ3 LYS A 35 48.740 -0.318 -3.205 1.00 0.00 H ATOM 554 H LYS A 35 48.379 -1.707 3.899 1.00 0.00 H ATOM 555 N ALA A 36 51.571 -0.750 3.857 1.00 21.77 N ATOM 556 CA ALA A 36 52.817 -0.077 4.249 1.00 22.51 C ATOM 557 C ALA A 36 53.504 -0.680 5.463 1.00 22.39 C ATOM 558 O ALA A 36 54.249 0.007 6.163 1.00 22.47 O ATOM 559 CB ALA A 36 52.532 1.422 4.519 1.00 22.46 C ATOM 560 HA ALA A 36 53.503 -0.210 3.413 1.00 0.00 H ATOM 561 HB1 ALA A 36 52.138 1.884 3.614 1.00 0.00 H ATOM 562 HB2 ALA A 36 51.801 1.513 5.323 1.00 0.00 H ATOM 563 HB3 ALA A 36 53.457 1.920 4.810 1.00 0.00 H ATOM 564 H ALA A 36 50.680 -0.416 4.278 1.00 0.00 H ATOM 565 N ILE A 37 53.284 -1.964 5.720 1.00 21.66 N ATOM 566 CA ILE A 37 53.861 -2.599 6.913 1.00 22.47 C ATOM 567 C ILE A 37 55.397 -2.477 7.004 1.00 22.24 C ATOM 568 O ILE A 37 55.943 -2.410 8.119 1.00 22.58 O ATOM 569 CB ILE A 37 53.420 -4.085 7.049 1.00 22.39 C ATOM 570 CG1 ILE A 37 53.852 -4.640 8.412 1.00 24.16 C ATOM 571 CG2 ILE A 37 53.979 -4.949 5.914 1.00 22.31 C ATOM 572 CD1 ILE A 37 53.486 -6.104 8.617 1.00 24.55 C ATOM 573 HA ILE A 37 53.457 -2.037 7.755 1.00 0.00 H ATOM 574 HB ILE A 37 52.333 -4.119 6.978 1.00 0.00 H ATOM 575 HG12 ILE A 37 54.934 -4.539 8.498 1.00 0.00 H ATOM 576 HG13 ILE A 37 53.370 -4.051 9.193 1.00 0.00 H ATOM 577 HD11 ILE A 37 52.405 -6.220 8.545 1.00 0.00 H ATOM 578 HD12 ILE A 37 53.970 -6.709 7.850 1.00 0.00 H ATOM 579 HD13 ILE A 37 53.823 -6.427 9.602 1.00 0.00 H ATOM 580 HG21 ILE A 37 53.617 -4.570 4.958 1.00 0.00 H ATOM 581 HG22 ILE A 37 55.068 -4.911 5.933 1.00 0.00 H ATOM 582 HG23 ILE A 37 53.648 -5.979 6.046 1.00 0.00 H ATOM 583 H ILE A 37 52.697 -2.526 5.070 1.00 0.00 H ATOM 584 N LYS A 38 56.092 -2.437 5.870 1.00 21.21 N ATOM 585 CA LYS A 38 57.557 -2.247 5.907 1.00 21.81 C ATOM 586 C LYS A 38 57.904 -0.939 6.647 1.00 21.67 C ATOM 587 O LYS A 38 58.978 -0.813 7.276 1.00 23.07 O ATOM 588 CB LYS A 38 58.160 -2.252 4.497 1.00 21.04 C ATOM 589 CG LYS A 38 59.647 -2.009 4.438 1.00 25.25 C ATOM 590 CD LYS A 38 60.087 -1.875 2.996 1.00 26.93 C ATOM 591 CE LYS A 38 61.387 -1.070 2.942 1.00 29.90 C ATOM 592 NZ LYS A 38 62.072 -1.180 1.632 1.00 32.05 N ATOM 593 HA LYS A 38 57.994 -3.085 6.451 1.00 0.00 H ATOM 594 HB2 LYS A 38 57.958 -3.224 4.046 1.00 0.00 H ATOM 595 HB3 LYS A 38 57.667 -1.473 3.915 1.00 0.00 H ATOM 596 HG2 LYS A 38 59.886 -1.092 4.976 1.00 0.00 H ATOM 597 HG3 LYS A 38 60.170 -2.847 4.900 1.00 0.00 H ATOM 598 HD2 LYS A 38 60.252 -2.865 2.571 1.00 0.00 H ATOM 599 HD3 LYS A 38 59.315 -1.360 2.425 1.00 0.00 H ATOM 600 HE2 LYS A 38 62.058 -1.437 3.719 1.00 0.00 H ATOM 601 HE3 LYS A 38 61.156 -0.021 3.129 1.00 0.00 H ATOM 602 HZ1 LYS A 38 62.305 -2.176 1.447 1.00 0.00 H ATOM 603 HZ2 LYS A 38 61.444 -0.824 0.883 1.00 0.00 H ATOM 604 HZ3 LYS A 38 62.946 -0.616 1.651 1.00 0.00 H ATOM 605 H LYS A 38 55.604 -2.539 4.957 1.00 0.00 H ATOM 606 N PHE A 39 57.006 0.032 6.534 1.00 22.12 N ATOM 607 CA PHE A 39 57.183 1.356 7.124 1.00 23.13 C ATOM 608 C PHE A 39 56.268 1.514 8.332 1.00 22.88 C ATOM 609 O PHE A 39 55.735 2.605 8.575 1.00 23.36 O ATOM 610 CB PHE A 39 56.842 2.445 6.091 1.00 22.99 C ATOM 611 CG PHE A 39 57.574 2.295 4.796 1.00 25.46 C ATOM 612 CD1 PHE A 39 58.922 2.614 4.715 1.00 26.88 C ATOM 613 CD2 PHE A 39 56.913 1.829 3.664 1.00 27.35 C ATOM 614 CE1 PHE A 39 59.607 2.465 3.515 1.00 28.60 C ATOM 615 CE2 PHE A 39 57.594 1.671 2.455 1.00 30.24 C ATOM 616 CZ PHE A 39 58.933 1.995 2.385 1.00 28.03 C ATOM 617 HA PHE A 39 58.222 1.461 7.435 1.00 0.00 H ATOM 618 HB2 PHE A 39 55.772 2.405 5.888 1.00 0.00 H ATOM 619 HB3 PHE A 39 57.093 3.416 6.518 1.00 0.00 H ATOM 620 HD2 PHE A 39 55.852 1.585 3.721 1.00 0.00 H ATOM 621 HE2 PHE A 39 57.072 1.295 1.575 1.00 0.00 H ATOM 622 HZ PHE A 39 59.469 1.884 1.442 1.00 0.00 H ATOM 623 HE1 PHE A 39 60.667 2.714 3.456 1.00 0.00 H ATOM 624 HD1 PHE A 39 59.446 2.983 5.597 1.00 0.00 H ATOM 625 H PHE A 39 56.135 -0.159 6.000 1.00 0.00 H ATOM 626 N TYR A 40 56.041 0.435 9.084 1.00 22.56 N ATOM 627 CA TYR A 40 55.112 0.513 10.226 1.00 22.76 C ATOM 628 C TYR A 40 55.473 1.608 11.233 1.00 22.86 C ATOM 629 O TYR A 40 54.569 2.176 11.836 1.00 23.39 O ATOM 630 CB TYR A 40 54.964 -0.834 10.943 1.00 23.15 C ATOM 631 CG TYR A 40 56.169 -1.251 11.764 1.00 23.05 C ATOM 632 CD1 TYR A 40 57.299 -1.815 11.166 1.00 22.99 C ATOM 633 CD2 TYR A 40 56.163 -1.101 13.144 1.00 22.78 C ATOM 634 CE1 TYR A 40 58.393 -2.196 11.937 1.00 23.91 C ATOM 635 CE2 TYR A 40 57.239 -1.476 13.906 1.00 23.95 C ATOM 636 CZ TYR A 40 58.350 -2.023 13.311 1.00 23.44 C ATOM 637 OH TYR A 40 59.426 -2.397 14.085 1.00 25.08 O ATOM 638 HA TYR A 40 54.151 0.783 9.788 1.00 0.00 H ATOM 639 HB3 TYR A 40 54.784 -1.602 10.190 1.00 0.00 H ATOM 640 HB2 TYR A 40 54.104 -0.771 11.610 1.00 0.00 H ATOM 641 HD2 TYR A 40 55.285 -0.677 13.631 1.00 0.00 H ATOM 642 HE2 TYR A 40 57.213 -1.340 14.987 1.00 0.00 H ATOM 643 HE1 TYR A 40 59.276 -2.627 11.464 1.00 0.00 H ATOM 644 HD1 TYR A 40 57.324 -1.958 10.086 1.00 0.00 H ATOM 645 HH TYR A 40 59.139 -3.083 14.738 1.00 0.00 H ATOM 646 H TYR A 40 56.520 -0.462 8.864 1.00 0.00 H ATOM 647 N LYS A 41 56.760 1.908 11.393 1.00 23.23 N ATOM 648 CA LYS A 41 57.153 2.969 12.335 1.00 22.79 C ATOM 649 C LYS A 41 56.659 4.338 11.861 1.00 23.59 C ATOM 650 O LYS A 41 56.173 5.141 12.660 1.00 23.67 O ATOM 651 CB LYS A 41 58.665 2.974 12.587 1.00 22.70 C ATOM 652 CG LYS A 41 59.209 1.655 13.158 1.00 22.68 C ATOM 653 CD LYS A 41 60.711 1.762 13.442 1.00 23.55 C ATOM 654 CE LYS A 41 61.269 0.444 13.991 1.00 24.48 C ATOM 655 NZ LYS A 41 62.767 0.440 14.152 1.00 28.29 N ATOM 656 HA LYS A 41 56.671 2.754 13.289 1.00 0.00 H ATOM 657 HB2 LYS A 41 59.170 3.172 11.641 1.00 0.00 H ATOM 658 HB3 LYS A 41 58.892 3.773 13.293 1.00 0.00 H ATOM 659 HG2 LYS A 41 58.685 1.424 14.086 1.00 0.00 H ATOM 660 HG3 LYS A 41 59.038 0.856 12.437 1.00 0.00 H ATOM 661 HD2 LYS A 41 61.231 2.010 12.517 1.00 0.00 H ATOM 662 HD3 LYS A 41 60.879 2.552 14.174 1.00 0.00 H ATOM 663 HE2 LYS A 41 60.994 -0.358 13.306 1.00 0.00 H ATOM 664 HE3 LYS A 41 60.817 0.258 14.966 1.00 0.00 H ATOM 665 HZ1 LYS A 41 63.214 0.605 13.228 1.00 0.00 H ATOM 666 HZ2 LYS A 41 63.045 1.194 14.812 1.00 0.00 H ATOM 667 HZ3 LYS A 41 63.072 -0.481 14.527 1.00 0.00 H ATOM 668 H LYS A 41 57.486 1.394 10.854 1.00 0.00 H ATOM 669 N HIS A 42 56.739 4.590 10.550 1.00 23.51 N ATOM 670 CA HIS A 42 56.210 5.837 9.993 1.00 24.26 C ATOM 671 C HIS A 42 54.697 5.905 10.143 1.00 23.96 C ATOM 672 O HIS A 42 54.126 6.958 10.453 1.00 23.56 O ATOM 673 CB HIS A 42 56.573 5.963 8.514 1.00 25.10 C ATOM 674 CG HIS A 42 57.979 6.400 8.268 1.00 29.81 C ATOM 675 ND1 HIS A 42 59.040 5.522 8.280 1.00 33.82 N ATOM 676 CD2 HIS A 42 58.497 7.614 7.961 1.00 32.05 C ATOM 677 CE1 HIS A 42 60.157 6.179 8.018 1.00 33.85 C ATOM 678 NE2 HIS A 42 59.854 7.450 7.820 1.00 34.62 N ATOM 679 HA HIS A 42 56.659 6.660 10.549 1.00 0.00 H ATOM 680 HB2 HIS A 42 56.428 4.991 8.041 1.00 0.00 H ATOM 681 HB3 HIS A 42 55.903 6.691 8.057 1.00 0.00 H ATOM 682 HD2 HIS A 42 57.942 8.545 7.847 1.00 0.00 H ATOM 683 HE1 HIS A 42 61.156 5.746 7.973 1.00 0.00 H ATOM 684 H HIS A 42 57.182 3.892 9.919 1.00 0.00 H ATOM 685 N VAL A 43 54.039 4.766 9.914 1.00 23.14 N ATOM 686 CA VAL A 43 52.587 4.713 10.010 1.00 23.44 C ATOM 687 C VAL A 43 52.160 5.083 11.439 1.00 23.08 C ATOM 688 O VAL A 43 51.300 5.941 11.631 1.00 23.95 O ATOM 689 CB VAL A 43 52.062 3.296 9.622 1.00 23.92 C ATOM 690 CG1 VAL A 43 50.602 3.167 9.968 1.00 24.96 C ATOM 691 CG2 VAL A 43 52.231 3.100 8.101 1.00 24.43 C ATOM 692 HA VAL A 43 52.153 5.429 9.312 1.00 0.00 H ATOM 693 HB VAL A 43 52.628 2.544 10.171 1.00 0.00 H ATOM 694 HG11 VAL A 43 50.469 3.315 11.040 1.00 0.00 H ATOM 695 HG12 VAL A 43 50.033 3.920 9.423 1.00 0.00 H ATOM 696 HG13 VAL A 43 50.251 2.173 9.691 1.00 0.00 H ATOM 697 HG21 VAL A 43 51.660 3.863 7.572 1.00 0.00 H ATOM 698 HG22 VAL A 43 53.286 3.187 7.840 1.00 0.00 H ATOM 699 HG23 VAL A 43 51.866 2.112 7.821 1.00 0.00 H ATOM 700 H VAL A 43 54.569 3.907 9.664 1.00 0.00 H ATOM 701 N VAL A 44 52.807 4.479 12.430 1.00 23.38 N ATOM 702 CA VAL A 44 52.471 4.734 13.823 1.00 23.39 C ATOM 703 C VAL A 44 52.738 6.191 14.148 1.00 22.91 C ATOM 704 O VAL A 44 51.926 6.850 14.795 1.00 22.91 O ATOM 705 CB VAL A 44 53.233 3.789 14.750 1.00 22.58 C ATOM 706 CG1 VAL A 44 53.179 4.281 16.206 1.00 24.30 C ATOM 707 CG2 VAL A 44 52.677 2.362 14.619 1.00 24.08 C ATOM 708 HA VAL A 44 51.411 4.539 13.982 1.00 0.00 H ATOM 709 HB VAL A 44 54.281 3.777 14.452 1.00 0.00 H ATOM 710 HG11 VAL A 44 53.629 5.272 16.270 1.00 0.00 H ATOM 711 HG12 VAL A 44 52.140 4.330 16.533 1.00 0.00 H ATOM 712 HG13 VAL A 44 53.730 3.589 16.843 1.00 0.00 H ATOM 713 HG21 VAL A 44 51.622 2.358 14.891 1.00 0.00 H ATOM 714 HG22 VAL A 44 52.789 2.023 13.589 1.00 0.00 H ATOM 715 HG23 VAL A 44 53.227 1.697 15.284 1.00 0.00 H ATOM 716 H VAL A 44 53.570 3.809 12.205 1.00 0.00 H ATOM 717 N GLN A 45 53.879 6.701 13.692 1.00 22.98 N ATOM 718 CA GLN A 45 54.248 8.097 13.957 1.00 23.89 C ATOM 719 C GLN A 45 53.189 9.041 13.385 1.00 23.67 C ATOM 720 O GLN A 45 52.784 10.013 14.044 1.00 23.69 O ATOM 721 CB GLN A 45 55.632 8.380 13.378 1.00 24.01 C ATOM 722 CG GLN A 45 56.072 9.852 13.389 1.00 24.66 C ATOM 723 CD GLN A 45 57.351 10.070 12.607 1.00 25.70 C ATOM 724 OE1 GLN A 45 57.399 9.884 11.380 1.00 27.54 O ATOM 725 NE2 GLN A 45 58.392 10.479 13.308 1.00 28.20 N ATOM 726 HA GLN A 45 54.291 8.268 15.033 1.00 0.00 H ATOM 727 HB2 GLN A 45 56.359 7.809 13.955 1.00 0.00 H ATOM 728 HB3 GLN A 45 55.639 8.036 12.344 1.00 0.00 H ATOM 729 HG2 GLN A 45 55.282 10.459 12.947 1.00 0.00 H ATOM 730 HG3 GLN A 45 56.233 10.163 14.421 1.00 0.00 H ATOM 731 HE22 GLN A 45 58.304 10.621 14.335 1.00 0.00 H ATOM 732 HE21 GLN A 45 59.300 10.659 12.834 1.00 0.00 H ATOM 733 H GLN A 45 54.521 6.100 13.138 1.00 0.00 H ATOM 734 N SER A 46 52.724 8.747 12.169 1.00 23.29 N ATOM 735 CA SER A 46 51.726 9.596 11.514 1.00 24.34 C ATOM 736 C SER A 46 50.406 9.599 12.267 1.00 23.33 C ATOM 737 O SER A 46 49.779 10.653 12.441 1.00 24.08 O ATOM 738 CB SER A 46 51.479 9.102 10.090 1.00 24.02 C ATOM 739 OG SER A 46 52.541 9.526 9.266 1.00 27.12 O ATOM 740 HA SER A 46 52.120 10.612 11.502 1.00 0.00 H ATOM 741 HB2 SER A 46 50.541 9.513 9.718 1.00 0.00 H ATOM 742 HB3 SER A 46 51.424 8.013 10.085 1.00 0.00 H ATOM 743 HG SER A 46 52.386 9.209 8.341 1.00 0.00 H ATOM 744 H SER A 46 53.076 7.901 11.678 1.00 0.00 H ATOM 745 N VAL A 47 49.975 8.414 12.695 1.00 23.23 N ATOM 746 CA VAL A 47 48.740 8.307 13.471 1.00 23.77 C ATOM 747 C VAL A 47 48.875 9.095 14.782 1.00 23.77 C ATOM 748 O VAL A 47 47.981 9.848 15.164 1.00 23.53 O ATOM 749 CB VAL A 47 48.368 6.844 13.740 1.00 22.78 C ATOM 750 CG1 VAL A 47 47.151 6.751 14.678 1.00 24.90 C ATOM 751 CG2 VAL A 47 48.083 6.134 12.410 1.00 23.05 C ATOM 752 HA VAL A 47 47.929 8.739 12.885 1.00 0.00 H ATOM 753 HB VAL A 47 49.206 6.352 14.234 1.00 0.00 H ATOM 754 HG11 VAL A 47 47.387 7.234 15.626 1.00 0.00 H ATOM 755 HG12 VAL A 47 46.299 7.251 14.217 1.00 0.00 H ATOM 756 HG13 VAL A 47 46.908 5.703 14.853 1.00 0.00 H ATOM 757 HG21 VAL A 47 47.256 6.632 11.904 1.00 0.00 H ATOM 758 HG22 VAL A 47 48.972 6.173 11.781 1.00 0.00 H ATOM 759 HG23 VAL A 47 47.819 5.094 12.604 1.00 0.00 H ATOM 760 H VAL A 47 50.522 7.557 12.475 1.00 0.00 H ATOM 761 N GLU A 48 50.010 8.934 15.453 1.00 23.56 N ATOM 762 CA GLU A 48 50.203 9.626 16.728 1.00 23.14 C ATOM 763 C GLU A 48 50.224 11.152 16.539 1.00 23.31 C ATOM 764 O GLU A 48 49.637 11.881 17.338 1.00 23.45 O ATOM 765 CB GLU A 48 51.469 9.135 17.393 1.00 23.25 C ATOM 766 CG GLU A 48 51.296 7.739 17.949 1.00 24.98 C ATOM 767 CD GLU A 48 52.605 7.141 18.484 1.00 25.72 C ATOM 768 OE1 GLU A 48 53.651 7.770 18.364 1.00 25.09 O ATOM 769 OE2 GLU A 48 52.543 6.024 19.022 1.00 25.17 O ATOM 770 HA GLU A 48 49.359 9.397 17.379 1.00 0.00 H ATOM 771 HB2 GLU A 48 52.275 9.127 16.659 1.00 0.00 H ATOM 772 HB3 GLU A 48 51.727 9.812 18.207 1.00 0.00 H ATOM 773 HG2 GLU A 48 50.572 7.776 18.763 1.00 0.00 H ATOM 774 HG3 GLU A 48 50.917 7.094 17.157 1.00 0.00 H ATOM 775 H GLU A 48 50.758 8.319 15.074 1.00 0.00 H ATOM 776 N LYS A 49 50.853 11.619 15.457 1.00 22.77 N ATOM 777 CA LYS A 49 50.919 13.048 15.145 1.00 23.08 C ATOM 778 C LYS A 49 49.513 13.590 14.864 1.00 23.00 C ATOM 779 O LYS A 49 49.145 14.690 15.311 1.00 24.17 O ATOM 780 CB LYS A 49 51.825 13.271 13.937 1.00 23.39 C ATOM 781 CG LYS A 49 52.103 14.730 13.600 1.00 22.92 C ATOM 782 CD LYS A 49 53.348 15.241 14.332 1.00 24.44 C ATOM 783 CE LYS A 49 53.013 15.832 15.676 1.00 25.41 C ATOM 784 NZ LYS A 49 54.224 16.370 16.365 1.00 24.11 N ATOM 785 HA LYS A 49 51.333 13.583 16.000 1.00 0.00 H ATOM 786 HB2 LYS A 49 52.779 12.782 14.135 1.00 0.00 H ATOM 787 HB3 LYS A 49 51.353 12.808 13.070 1.00 0.00 H ATOM 788 HG2 LYS A 49 52.259 14.823 12.525 1.00 0.00 H ATOM 789 HG3 LYS A 49 51.244 15.333 13.895 1.00 0.00 H ATOM 790 HD2 LYS A 49 54.038 14.409 14.476 1.00 0.00 H ATOM 791 HD3 LYS A 49 53.826 16.006 13.721 1.00 0.00 H ATOM 792 HE2 LYS A 49 52.567 15.058 16.300 1.00 0.00 H ATOM 793 HE3 LYS A 49 52.297 16.642 15.537 1.00 0.00 H ATOM 794 HZ1 LYS A 49 54.910 15.602 16.508 1.00 0.00 H ATOM 795 HZ2 LYS A 49 54.653 17.114 15.779 1.00 0.00 H ATOM 796 HZ3 LYS A 49 53.949 16.767 17.286 1.00 0.00 H ATOM 797 H LYS A 49 51.312 10.943 14.813 1.00 0.00 H ATOM 798 N PHE A 50 48.731 12.818 14.103 1.00 22.54 N ATOM 799 CA PHE A 50 47.370 13.216 13.817 1.00 22.23 C ATOM 800 C PHE A 50 46.609 13.405 15.130 1.00 22.71 C ATOM 801 O PHE A 50 45.970 14.436 15.343 1.00 22.57 O ATOM 802 CB PHE A 50 46.667 12.183 12.926 1.00 22.69 C ATOM 803 CG PHE A 50 45.237 12.516 12.647 1.00 22.68 C ATOM 804 CD1 PHE A 50 44.892 13.297 11.550 1.00 23.71 C ATOM 805 CD2 PHE A 50 44.230 12.022 13.472 1.00 22.37 C ATOM 806 CE1 PHE A 50 43.570 13.585 11.297 1.00 24.95 C ATOM 807 CE2 PHE A 50 42.897 12.331 13.234 1.00 23.46 C ATOM 808 CZ PHE A 50 42.568 13.095 12.141 1.00 24.16 C ATOM 809 HA PHE A 50 47.387 14.160 13.272 1.00 0.00 H ATOM 810 HB2 PHE A 50 47.200 12.125 11.977 1.00 0.00 H ATOM 811 HB3 PHE A 50 46.706 11.214 13.423 1.00 0.00 H ATOM 812 HD2 PHE A 50 44.491 11.384 14.316 1.00 0.00 H ATOM 813 HE2 PHE A 50 42.120 11.971 13.908 1.00 0.00 H ATOM 814 HZ PHE A 50 41.522 13.320 11.931 1.00 0.00 H ATOM 815 HE1 PHE A 50 43.303 14.197 10.436 1.00 0.00 H ATOM 816 HD1 PHE A 50 45.669 13.682 10.890 1.00 0.00 H ATOM 817 H PHE A 50 49.103 11.928 13.715 1.00 0.00 H ATOM 818 N ILE A 51 46.709 12.413 16.020 1.00 22.86 N ATOM 819 CA ILE A 51 45.974 12.461 17.288 1.00 23.16 C ATOM 820 C ILE A 51 46.438 13.620 18.174 1.00 22.87 C ATOM 821 O ILE A 51 45.642 14.249 18.856 1.00 23.13 O ATOM 822 CB ILE A 51 46.122 11.115 18.011 1.00 22.40 C ATOM 823 CG1 ILE A 51 45.229 10.086 17.307 1.00 23.29 C ATOM 824 CG2 ILE A 51 45.754 11.256 19.485 1.00 24.26 C ATOM 825 CD1 ILE A 51 45.550 8.644 17.712 1.00 23.28 C ATOM 826 HA ILE A 51 44.921 12.639 17.072 1.00 0.00 H ATOM 827 HB ILE A 51 47.158 10.779 17.970 1.00 0.00 H ATOM 828 HG12 ILE A 51 44.190 10.296 17.560 1.00 0.00 H ATOM 829 HG13 ILE A 51 45.366 10.184 16.230 1.00 0.00 H ATOM 830 HD11 ILE A 51 46.585 8.418 17.456 1.00 0.00 H ATOM 831 HD12 ILE A 51 45.407 8.529 18.787 1.00 0.00 H ATOM 832 HD13 ILE A 51 44.885 7.962 17.181 1.00 0.00 H ATOM 833 HG21 ILE A 51 46.414 11.985 19.955 1.00 0.00 H ATOM 834 HG22 ILE A 51 44.721 11.592 19.570 1.00 0.00 H ATOM 835 HG23 ILE A 51 45.865 10.291 19.980 1.00 0.00 H ATOM 836 H ILE A 51 47.317 11.595 15.810 1.00 0.00 H ATOM 837 N GLN A 52 47.725 13.927 18.121 1.00 22.92 N ATOM 838 CA GLN A 52 48.270 15.020 18.927 1.00 23.23 C ATOM 839 C GLN A 52 47.672 16.375 18.512 1.00 23.14 C ATOM 840 O GLN A 52 47.348 17.232 19.355 1.00 25.01 O ATOM 841 CB GLN A 52 49.772 15.067 18.728 1.00 23.88 C ATOM 842 CG GLN A 52 50.471 16.095 19.616 1.00 25.80 C ATOM 843 CD GLN A 52 51.931 16.266 19.248 1.00 31.63 C ATOM 844 OE1 GLN A 52 52.532 15.391 18.617 1.00 34.60 O ATOM 845 NE2 GLN A 52 52.518 17.380 19.658 1.00 34.15 N ATOM 846 HA GLN A 52 48.018 14.839 19.972 1.00 0.00 H ATOM 847 HB2 GLN A 52 50.181 14.082 18.952 1.00 0.00 H ATOM 848 HB3 GLN A 52 49.975 15.315 17.686 1.00 0.00 H ATOM 849 HG2 GLN A 52 49.966 17.055 19.508 1.00 0.00 H ATOM 850 HG3 GLN A 52 50.406 15.766 20.653 1.00 0.00 H ATOM 851 HE22 GLN A 52 51.973 18.091 20.187 1.00 0.00 H ATOM 852 HE21 GLN A 52 53.524 17.544 19.451 1.00 0.00 H ATOM 853 H GLN A 52 48.357 13.384 17.498 1.00 0.00 H ATOM 854 N LYS A 53 47.556 16.550 17.199 1.00 23.42 N ATOM 855 CA LYS A 53 47.324 17.856 16.594 1.00 24.77 C ATOM 856 C LYS A 53 45.905 18.110 16.100 1.00 23.64 C ATOM 857 O LYS A 53 45.541 19.267 15.818 1.00 24.15 O ATOM 858 CB LYS A 53 48.369 18.101 15.497 1.00 25.69 C ATOM 859 CG LYS A 53 49.796 18.050 16.072 1.00 29.36 C ATOM 860 CD LYS A 53 50.774 18.953 15.371 1.00 33.41 C ATOM 861 CE LYS A 53 51.840 19.456 16.335 1.00 34.99 C ATOM 862 NZ LYS A 53 52.394 20.759 15.863 1.00 38.51 N ATOM 863 HA LYS A 53 47.441 18.587 17.394 1.00 0.00 H ATOM 864 HB2 LYS A 53 48.266 17.334 14.729 1.00 0.00 H ATOM 865 HB3 LYS A 53 48.198 19.082 15.054 1.00 0.00 H ATOM 866 HG2 LYS A 53 49.753 18.341 17.122 1.00 0.00 H ATOM 867 HG3 LYS A 53 50.160 17.025 15.995 1.00 0.00 H ATOM 868 HD2 LYS A 53 51.255 18.400 14.564 1.00 0.00 H ATOM 869 HD3 LYS A 53 50.237 19.806 14.956 1.00 0.00 H ATOM 870 HE2 LYS A 53 52.645 18.724 16.395 1.00 0.00 H ATOM 871 HE3 LYS A 53 51.398 19.590 17.322 1.00 0.00 H ATOM 872 HZ1 LYS A 53 52.819 20.633 14.922 1.00 0.00 H ATOM 873 HZ2 LYS A 53 51.628 21.460 15.808 1.00 0.00 H ATOM 874 HZ3 LYS A 53 53.120 21.088 16.531 1.00 0.00 H ATOM 875 H LYS A 53 47.634 15.720 16.577 1.00 0.00 H ATOM 876 N CYS A 54 45.097 17.058 15.987 1.00 23.48 N ATOM 877 CA CYS A 54 43.774 17.214 15.383 1.00 23.46 C ATOM 878 C CYS A 54 42.789 17.897 16.301 1.00 23.56 C ATOM 879 O CYS A 54 43.028 18.026 17.508 1.00 23.88 O ATOM 880 CB CYS A 54 43.207 15.860 14.963 1.00 22.88 C ATOM 881 SG CYS A 54 42.854 14.730 16.351 1.00 23.82 S ATOM 882 HA CYS A 54 43.914 17.849 14.508 1.00 0.00 H ATOM 883 HB2 CYS A 54 43.929 15.377 14.304 1.00 0.00 H ATOM 884 HB3 CYS A 54 42.279 16.033 14.418 1.00 0.00 H ATOM 885 HG CYS A 54 41.928 15.313 17.192 1.00 0.00 H ATOM 886 H CYS A 54 45.406 16.126 16.328 1.00 0.00 H ATOM 887 N LYS A 55 41.685 18.360 15.714 1.00 23.76 N ATOM 888 CA LYS A 55 40.591 18.977 16.469 1.00 25.03 C ATOM 889 C LYS A 55 39.978 17.935 17.402 1.00 24.11 C ATOM 890 O LYS A 55 40.063 16.727 17.126 1.00 24.20 O ATOM 891 CB LYS A 55 39.508 19.481 15.509 1.00 24.85 C ATOM 892 CG LYS A 55 39.888 20.709 14.708 1.00 27.40 C ATOM 893 CD LYS A 55 38.754 21.135 13.768 1.00 27.28 C ATOM 894 CE LYS A 55 39.103 22.458 13.131 1.00 30.59 C ATOM 895 NZ LYS A 55 37.866 23.231 12.835 1.00 32.25 N ATOM 896 HA LYS A 55 40.983 19.816 17.044 1.00 0.00 H ATOM 897 HB2 LYS A 55 39.275 18.678 14.809 1.00 0.00 H ATOM 898 HB3 LYS A 55 38.620 19.720 16.095 1.00 0.00 H ATOM 899 HG2 LYS A 55 40.107 21.527 15.394 1.00 0.00 H ATOM 900 HG3 LYS A 55 40.776 20.486 14.116 1.00 0.00 H ATOM 901 HD2 LYS A 55 38.621 20.381 12.992 1.00 0.00 H ATOM 902 HD3 LYS A 55 37.829 21.237 14.336 1.00 0.00 H ATOM 903 HE2 LYS A 55 39.646 22.279 12.203 1.00 0.00 H ATOM 904 HE3 LYS A 55 39.731 23.031 13.813 1.00 0.00 H ATOM 905 HZ1 LYS A 55 37.266 22.687 12.182 1.00 0.00 H ATOM 906 HZ2 LYS A 55 37.348 23.406 13.720 1.00 0.00 H ATOM 907 HZ3 LYS A 55 38.122 24.139 12.397 1.00 0.00 H ATOM 908 H LYS A 55 41.597 18.280 14.681 1.00 0.00 H ATOM 909 N PRO A 56 39.359 18.386 18.514 1.00 24.75 N ATOM 910 CA PRO A 56 38.768 17.430 19.460 1.00 24.66 C ATOM 911 C PRO A 56 37.804 16.420 18.820 1.00 23.99 C ATOM 912 O PRO A 56 37.785 15.271 19.243 1.00 24.12 O ATOM 913 CB PRO A 56 38.021 18.328 20.451 1.00 25.37 C ATOM 914 CG PRO A 56 38.738 19.648 20.391 1.00 25.32 C ATOM 915 CD PRO A 56 39.222 19.787 18.977 1.00 24.94 C ATOM 916 HA PRO A 56 39.539 16.803 19.908 1.00 0.00 H ATOM 917 HD3 PRO A 56 38.497 20.329 18.369 1.00 0.00 H ATOM 918 HD2 PRO A 56 40.181 20.304 18.943 1.00 0.00 H ATOM 919 HG3 PRO A 56 39.580 19.655 21.083 1.00 0.00 H ATOM 920 HG2 PRO A 56 38.057 20.462 20.641 1.00 0.00 H ATOM 921 HB2 PRO A 56 36.979 18.443 20.154 1.00 0.00 H ATOM 922 HB3 PRO A 56 38.067 17.911 21.457 1.00 0.00 H ATOM 923 N GLU A 57 37.014 16.844 17.828 1.00 22.83 N ATOM 924 CA GLU A 57 36.064 15.927 17.182 1.00 23.67 C ATOM 925 C GLU A 57 36.746 14.741 16.479 1.00 22.72 C ATOM 926 O GLU A 57 36.080 13.748 16.148 1.00 21.99 O ATOM 927 CB GLU A 57 35.150 16.685 16.192 1.00 23.40 C ATOM 928 CG GLU A 57 35.863 17.102 14.887 1.00 26.72 C ATOM 929 CD GLU A 57 34.984 17.867 13.890 1.00 27.36 C ATOM 930 OE1 GLU A 57 33.752 17.623 13.819 1.00 32.97 O ATOM 931 OE2 GLU A 57 35.515 18.758 13.181 1.00 33.02 O ATOM 932 HA GLU A 57 35.456 15.509 17.984 1.00 0.00 H ATOM 933 HB2 GLU A 57 34.310 16.040 15.935 1.00 0.00 H ATOM 934 HB3 GLU A 57 34.779 17.584 16.684 1.00 0.00 H ATOM 935 HG2 GLU A 57 36.709 17.737 15.150 1.00 0.00 H ATOM 936 HG3 GLU A 57 36.227 16.200 14.396 1.00 0.00 H ATOM 937 H GLU A 57 37.072 17.833 17.510 1.00 0.00 H ATOM 938 N TYR A 58 38.052 14.843 16.238 1.00 22.50 N ATOM 939 CA TYR A 58 38.773 13.784 15.527 1.00 22.25 C ATOM 940 C TYR A 58 39.568 12.841 16.446 1.00 22.36 C ATOM 941 O TYR A 58 40.218 11.918 15.968 1.00 22.24 O ATOM 942 CB TYR A 58 39.678 14.358 14.422 1.00 22.31 C ATOM 943 CG TYR A 58 38.909 15.027 13.317 1.00 21.77 C ATOM 944 CD1 TYR A 58 38.096 14.285 12.469 1.00 24.17 C ATOM 945 CD2 TYR A 58 38.994 16.393 13.133 1.00 21.49 C ATOM 946 CE1 TYR A 58 37.386 14.896 11.468 1.00 22.40 C ATOM 947 CE2 TYR A 58 38.267 17.035 12.133 1.00 21.92 C ATOM 948 CZ TYR A 58 37.485 16.257 11.285 1.00 23.26 C ATOM 949 OH TYR A 58 36.759 16.880 10.287 1.00 23.69 O ATOM 950 HA TYR A 58 37.997 13.173 15.065 1.00 0.00 H ATOM 951 HB3 TYR A 58 40.263 13.544 13.994 1.00 0.00 H ATOM 952 HB2 TYR A 58 40.350 15.090 14.869 1.00 0.00 H ATOM 953 HD2 TYR A 58 39.643 16.980 13.783 1.00 0.00 H ATOM 954 HE2 TYR A 58 38.310 18.118 12.018 1.00 0.00 H ATOM 955 HE1 TYR A 58 36.743 14.304 10.817 1.00 0.00 H ATOM 956 HD1 TYR A 58 38.022 13.206 12.601 1.00 0.00 H ATOM 957 HH TYR A 58 36.257 16.200 9.772 1.00 0.00 H ATOM 958 H TYR A 58 38.568 15.687 16.559 1.00 0.00 H ATOM 959 N LYS A 59 39.513 13.059 17.761 1.00 22.61 N ATOM 960 CA LYS A 59 40.279 12.154 18.660 1.00 23.31 C ATOM 961 C LYS A 59 39.752 10.723 18.581 1.00 23.66 C ATOM 962 O LYS A 59 40.514 9.781 18.347 1.00 24.04 O ATOM 963 CB LYS A 59 40.232 12.644 20.123 1.00 23.39 C ATOM 964 CG LYS A 59 40.722 14.078 20.377 1.00 25.03 C ATOM 965 CD LYS A 59 42.152 14.310 19.919 1.00 24.63 C ATOM 966 CE LYS A 59 42.510 15.787 20.103 1.00 27.19 C ATOM 967 NZ LYS A 59 43.874 16.140 19.614 1.00 25.98 N ATOM 968 HA LYS A 59 41.315 12.167 18.320 1.00 0.00 H ATOM 969 HB2 LYS A 59 39.198 12.581 20.461 1.00 0.00 H ATOM 970 HB3 LYS A 59 40.849 11.971 20.719 1.00 0.00 H ATOM 971 HG2 LYS A 59 40.070 14.768 19.841 1.00 0.00 H ATOM 972 HG3 LYS A 59 40.663 14.281 21.446 1.00 0.00 H ATOM 973 HD2 LYS A 59 42.829 13.695 20.512 1.00 0.00 H ATOM 974 HD3 LYS A 59 42.246 14.041 18.867 1.00 0.00 H ATOM 975 HE2 LYS A 59 42.453 16.025 21.165 1.00 0.00 H ATOM 976 HE3 LYS A 59 41.783 16.388 19.557 1.00 0.00 H ATOM 977 HZ1 LYS A 59 44.582 15.583 20.133 1.00 0.00 H ATOM 978 HZ2 LYS A 59 43.942 15.929 18.598 1.00 0.00 H ATOM 979 HZ3 LYS A 59 44.046 17.154 19.771 1.00 0.00 H ATOM 980 H LYS A 59 38.949 13.842 18.148 1.00 0.00 H ATOM 981 N VAL A 60 38.449 10.557 18.779 1.00 24.23 N ATOM 982 CA VAL A 60 37.844 9.223 18.637 1.00 24.22 C ATOM 983 C VAL A 60 38.115 8.593 17.252 1.00 24.18 C ATOM 984 O VAL A 60 38.586 7.459 17.219 1.00 24.02 O ATOM 985 CB VAL A 60 36.353 9.174 19.115 1.00 25.21 C ATOM 986 CG1 VAL A 60 35.671 7.883 18.685 1.00 26.94 C ATOM 987 CG2 VAL A 60 36.293 9.326 20.637 1.00 26.41 C ATOM 988 HA VAL A 60 38.360 8.563 19.335 1.00 0.00 H ATOM 989 HB VAL A 60 35.818 10.000 18.647 1.00 0.00 H ATOM 990 HG11 VAL A 60 35.688 7.809 17.598 1.00 0.00 H ATOM 991 HG12 VAL A 60 36.200 7.033 19.116 1.00 0.00 H ATOM 992 HG13 VAL A 60 34.639 7.885 19.034 1.00 0.00 H ATOM 993 HG21 VAL A 60 36.849 8.513 21.104 1.00 0.00 H ATOM 994 HG22 VAL A 60 36.733 10.281 20.923 1.00 0.00 H ATOM 995 HG23 VAL A 60 35.254 9.291 20.964 1.00 0.00 H ATOM 996 H VAL A 60 37.855 11.372 19.035 1.00 0.00 H ATOM 997 N PRO A 61 37.842 9.307 16.127 1.00 23.35 N ATOM 998 CA PRO A 61 38.271 8.798 14.817 1.00 23.43 C ATOM 999 C PRO A 61 39.749 8.335 14.800 1.00 23.51 C ATOM 1000 O PRO A 61 40.068 7.265 14.280 1.00 23.81 O ATOM 1001 CB PRO A 61 38.052 10.005 13.897 1.00 22.97 C ATOM 1002 CG PRO A 61 36.838 10.649 14.467 1.00 22.64 C ATOM 1003 CD PRO A 61 37.073 10.569 15.980 1.00 24.25 C ATOM 1004 HA PRO A 61 37.717 7.908 14.518 1.00 0.00 H ATOM 1005 HD3 PRO A 61 37.649 11.424 16.334 1.00 0.00 H ATOM 1006 HD2 PRO A 61 36.129 10.519 16.522 1.00 0.00 H ATOM 1007 HG3 PRO A 61 35.937 10.105 14.182 1.00 0.00 H ATOM 1008 HG2 PRO A 61 36.755 11.685 14.139 1.00 0.00 H ATOM 1009 HB2 PRO A 61 38.906 10.682 13.929 1.00 0.00 H ATOM 1010 HB3 PRO A 61 37.880 9.687 12.869 1.00 0.00 H ATOM 1011 N GLY A 62 40.651 9.100 15.417 1.00 23.05 N ATOM 1012 CA GLY A 62 42.047 8.697 15.476 1.00 23.31 C ATOM 1013 C GLY A 62 42.244 7.391 16.253 1.00 22.50 C ATOM 1014 O GLY A 62 43.000 6.502 15.833 1.00 23.63 O ATOM 1015 HA3 GLY A 62 42.619 9.486 15.965 1.00 0.00 H ATOM 1016 HA2 GLY A 62 42.415 8.559 14.459 1.00 0.00 H ATOM 1017 H GLY A 62 40.353 9.993 15.860 1.00 0.00 H ATOM 1018 N LEU A 63 41.551 7.270 17.388 1.00 23.24 N ATOM 1019 CA LEU A 63 41.600 6.018 18.149 1.00 23.62 C ATOM 1020 C LEU A 63 41.065 4.879 17.285 1.00 23.55 C ATOM 1021 O LEU A 63 41.613 3.772 17.299 1.00 23.33 O ATOM 1022 CB LEU A 63 40.830 6.120 19.465 1.00 24.33 C ATOM 1023 CG LEU A 63 40.714 4.810 20.253 1.00 25.57 C ATOM 1024 CD1 LEU A 63 42.092 4.182 20.589 1.00 25.18 C ATOM 1025 CD2 LEU A 63 39.933 5.103 21.499 1.00 25.35 C ATOM 1026 HA LEU A 63 42.638 5.814 18.411 1.00 0.00 H ATOM 1027 HB2 LEU A 63 41.335 6.851 20.097 1.00 0.00 H ATOM 1028 HB3 LEU A 63 39.822 6.470 19.241 1.00 0.00 H ATOM 1029 HG LEU A 63 40.204 4.068 19.639 1.00 0.00 H ATOM 1030 HD21 LEU A 63 40.457 5.857 22.086 1.00 0.00 H ATOM 1031 HD22 LEU A 63 38.945 5.475 21.228 1.00 0.00 H ATOM 1032 HD23 LEU A 63 39.831 4.190 22.085 1.00 0.00 H ATOM 1033 HD11 LEU A 63 42.627 3.967 19.664 1.00 0.00 H ATOM 1034 HD12 LEU A 63 42.672 4.882 21.191 1.00 0.00 H ATOM 1035 HD13 LEU A 63 41.942 3.258 21.147 1.00 0.00 H ATOM 1036 H LEU A 63 40.976 8.065 17.733 1.00 0.00 H ATOM 1037 N TYR A 64 39.983 5.140 16.535 1.00 21.84 N ATOM 1038 CA TYR A 64 39.415 4.108 15.673 1.00 22.13 C ATOM 1039 C TYR A 64 40.374 3.670 14.588 1.00 23.13 C ATOM 1040 O TYR A 64 40.374 2.498 14.195 1.00 22.97 O ATOM 1041 CB TYR A 64 38.106 4.598 15.062 1.00 21.96 C ATOM 1042 CG TYR A 64 36.955 4.636 16.042 1.00 22.69 C ATOM 1043 CD1 TYR A 64 37.003 3.981 17.282 1.00 23.38 C ATOM 1044 CD2 TYR A 64 35.770 5.294 15.710 1.00 22.36 C ATOM 1045 CE1 TYR A 64 35.890 4.041 18.181 1.00 26.25 C ATOM 1046 CE2 TYR A 64 34.691 5.350 16.576 1.00 24.24 C ATOM 1047 CZ TYR A 64 34.746 4.725 17.802 1.00 24.39 C ATOM 1048 OH TYR A 64 33.641 4.797 18.619 1.00 25.05 O ATOM 1049 HA TYR A 64 39.220 3.235 16.296 1.00 0.00 H ATOM 1050 HB3 TYR A 64 37.838 3.932 14.242 1.00 0.00 H ATOM 1051 HB2 TYR A 64 38.262 5.605 14.675 1.00 0.00 H ATOM 1052 HD2 TYR A 64 35.691 5.780 14.737 1.00 0.00 H ATOM 1053 HE2 TYR A 64 33.792 5.893 16.285 1.00 0.00 H ATOM 1054 HE1 TYR A 64 35.942 3.553 19.154 1.00 0.00 H ATOM 1055 HD1 TYR A 64 37.895 3.422 17.563 1.00 0.00 H ATOM 1056 HH TYR A 64 33.821 4.307 19.460 1.00 0.00 H ATOM 1057 H TYR A 64 39.547 6.083 16.568 1.00 0.00 H ATOM 1058 N VAL A 65 41.217 4.594 14.124 1.00 22.16 N ATOM 1059 CA VAL A 65 42.278 4.224 13.180 1.00 22.75 C ATOM 1060 C VAL A 65 43.236 3.251 13.857 1.00 22.97 C ATOM 1061 O VAL A 65 43.563 2.220 13.285 1.00 23.77 O ATOM 1062 CB VAL A 65 43.057 5.470 12.634 1.00 23.55 C ATOM 1063 CG1 VAL A 65 44.250 5.014 11.840 1.00 24.69 C ATOM 1064 CG2 VAL A 65 42.144 6.338 11.758 1.00 24.93 C ATOM 1065 HA VAL A 65 41.809 3.748 12.319 1.00 0.00 H ATOM 1066 HB VAL A 65 43.393 6.070 13.480 1.00 0.00 H ATOM 1067 HG11 VAL A 65 44.909 4.428 12.481 1.00 0.00 H ATOM 1068 HG12 VAL A 65 43.915 4.401 11.003 1.00 0.00 H ATOM 1069 HG13 VAL A 65 44.788 5.884 11.463 1.00 0.00 H ATOM 1070 HG21 VAL A 65 41.785 5.749 10.914 1.00 0.00 H ATOM 1071 HG22 VAL A 65 41.296 6.683 12.350 1.00 0.00 H ATOM 1072 HG23 VAL A 65 42.705 7.197 11.390 1.00 0.00 H ATOM 1073 H VAL A 65 41.122 5.582 14.433 1.00 0.00 H ATOM 1074 N ILE A 66 43.661 3.559 15.078 1.00 22.46 N ATOM 1075 CA ILE A 66 44.562 2.601 15.783 1.00 22.13 C ATOM 1076 C ILE A 66 43.859 1.242 15.931 1.00 22.67 C ATOM 1077 O ILE A 66 44.440 0.205 15.610 1.00 22.56 O ATOM 1078 CB ILE A 66 44.939 3.113 17.189 1.00 21.36 C ATOM 1079 CG1 ILE A 66 45.647 4.454 17.065 1.00 23.06 C ATOM 1080 CG2 ILE A 66 45.813 2.037 17.944 1.00 22.65 C ATOM 1081 CD1 ILE A 66 46.043 5.052 18.432 1.00 24.05 C ATOM 1082 HA ILE A 66 45.470 2.501 15.188 1.00 0.00 H ATOM 1083 HB ILE A 66 44.040 3.266 17.786 1.00 0.00 H ATOM 1084 HG12 ILE A 66 46.550 4.317 16.470 1.00 0.00 H ATOM 1085 HG13 ILE A 66 44.982 5.153 16.558 1.00 0.00 H ATOM 1086 HD11 ILE A 66 45.147 5.203 19.034 1.00 0.00 H ATOM 1087 HD12 ILE A 66 46.717 4.366 18.946 1.00 0.00 H ATOM 1088 HD13 ILE A 66 46.544 6.008 18.278 1.00 0.00 H ATOM 1089 HG21 ILE A 66 45.245 1.112 18.041 1.00 0.00 H ATOM 1090 HG22 ILE A 66 46.724 1.847 17.376 1.00 0.00 H ATOM 1091 HG23 ILE A 66 46.072 2.411 18.934 1.00 0.00 H ATOM 1092 H ILE A 66 43.372 4.449 15.532 1.00 0.00 H ATOM 1093 N ASP A 67 42.630 1.247 16.450 1.00 22.70 N ATOM 1094 CA ASP A 67 41.895 0.009 16.672 1.00 23.34 C ATOM 1095 C ASP A 67 41.767 -0.789 15.372 1.00 23.22 C ATOM 1096 O ASP A 67 41.958 -2.003 15.359 1.00 23.12 O ATOM 1097 CB ASP A 67 40.511 0.368 17.231 1.00 23.56 C ATOM 1098 CG ASP A 67 39.643 -0.846 17.460 1.00 25.89 C ATOM 1099 OD1 ASP A 67 40.027 -1.659 18.325 1.00 27.92 O ATOM 1100 OD2 ASP A 67 38.603 -0.983 16.788 1.00 28.50 O ATOM 1101 HA ASP A 67 42.431 -0.619 17.384 1.00 0.00 H ATOM 1102 HB2 ASP A 67 40.642 0.888 18.180 1.00 0.00 H ATOM 1103 HB3 ASP A 67 40.009 1.028 16.523 1.00 0.00 H ATOM 1104 H ASP A 67 42.187 2.154 16.701 1.00 0.00 H ATOM 1105 N SER A 68 41.438 -0.099 14.272 1.00 22.54 N ATOM 1106 CA SER A 68 41.190 -0.770 12.995 1.00 23.37 C ATOM 1107 C SER A 68 42.478 -1.409 12.480 1.00 22.88 C ATOM 1108 O SER A 68 42.475 -2.562 11.989 1.00 24.01 O ATOM 1109 CB SER A 68 40.668 0.241 11.976 1.00 23.17 C ATOM 1110 OG SER A 68 39.367 0.686 12.309 1.00 26.33 O ATOM 1111 HA SER A 68 40.444 -1.551 13.142 1.00 0.00 H ATOM 1112 HB2 SER A 68 40.642 -0.228 10.992 1.00 0.00 H ATOM 1113 HB3 SER A 68 41.341 1.098 11.950 1.00 0.00 H ATOM 1114 HG SER A 68 39.385 1.118 13.200 1.00 0.00 H ATOM 1115 H SER A 68 41.357 0.936 14.327 1.00 0.00 H ATOM 1116 N ILE A 69 43.580 -0.647 12.566 1.00 22.49 N ATOM 1117 CA ILE A 69 44.867 -1.157 12.110 1.00 23.10 C ATOM 1118 C ILE A 69 45.290 -2.364 12.938 1.00 22.88 C ATOM 1119 O ILE A 69 45.659 -3.407 12.393 1.00 23.03 O ATOM 1120 CB ILE A 69 45.929 -0.063 12.214 1.00 21.89 C ATOM 1121 CG1 ILE A 69 45.653 0.988 11.126 1.00 25.11 C ATOM 1122 CG2 ILE A 69 47.336 -0.682 11.984 1.00 24.44 C ATOM 1123 CD1 ILE A 69 46.519 2.233 11.266 1.00 24.31 C ATOM 1124 HA ILE A 69 44.766 -1.465 11.069 1.00 0.00 H ATOM 1125 HB ILE A 69 45.896 0.397 13.201 1.00 0.00 H ATOM 1126 HG12 ILE A 69 45.846 0.538 10.152 1.00 0.00 H ATOM 1127 HG13 ILE A 69 44.606 1.285 11.187 1.00 0.00 H ATOM 1128 HD11 ILE A 69 46.329 2.699 12.233 1.00 0.00 H ATOM 1129 HD12 ILE A 69 47.570 1.953 11.197 1.00 0.00 H ATOM 1130 HD13 ILE A 69 46.276 2.935 10.468 1.00 0.00 H ATOM 1131 HG21 ILE A 69 47.524 -1.444 12.740 1.00 0.00 H ATOM 1132 HG22 ILE A 69 47.375 -1.134 10.993 1.00 0.00 H ATOM 1133 HG23 ILE A 69 48.092 0.100 12.059 1.00 0.00 H ATOM 1134 H ILE A 69 43.515 0.313 12.960 1.00 0.00 H ATOM 1135 N VAL A 70 45.182 -2.240 14.258 1.00 23.68 N ATOM 1136 CA VAL A 70 45.648 -3.319 15.120 1.00 24.21 C ATOM 1137 C VAL A 70 44.791 -4.571 14.941 1.00 24.67 C ATOM 1138 O VAL A 70 45.302 -5.692 14.839 1.00 25.39 O ATOM 1139 CB VAL A 70 45.662 -2.849 16.578 1.00 24.70 C ATOM 1140 CG1 VAL A 70 45.859 -4.026 17.488 1.00 27.39 C ATOM 1141 CG2 VAL A 70 46.766 -1.825 16.778 1.00 25.20 C ATOM 1142 HA VAL A 70 46.666 -3.585 14.836 1.00 0.00 H ATOM 1143 HB VAL A 70 44.708 -2.380 16.818 1.00 0.00 H ATOM 1144 HG11 VAL A 70 45.044 -4.735 17.344 1.00 0.00 H ATOM 1145 HG12 VAL A 70 46.808 -4.509 17.255 1.00 0.00 H ATOM 1146 HG13 VAL A 70 45.868 -3.686 18.523 1.00 0.00 H ATOM 1147 HG21 VAL A 70 47.728 -2.277 16.535 1.00 0.00 H ATOM 1148 HG22 VAL A 70 46.590 -0.970 16.125 1.00 0.00 H ATOM 1149 HG23 VAL A 70 46.770 -1.495 17.817 1.00 0.00 H ATOM 1150 H VAL A 70 44.768 -1.380 14.672 1.00 0.00 H ATOM 1151 N ARG A 71 43.477 -4.389 14.867 1.00 24.11 N ATOM 1152 CA ARG A 71 42.562 -5.508 14.595 1.00 24.30 C ATOM 1153 C ARG A 71 42.817 -6.199 13.241 1.00 23.45 C ATOM 1154 O ARG A 71 42.855 -7.439 13.158 1.00 23.46 O ATOM 1155 CB ARG A 71 41.101 -5.052 14.688 1.00 26.50 C ATOM 1156 CG ARG A 71 40.652 -4.767 16.126 1.00 26.91 C ATOM 1157 CD ARG A 71 39.182 -4.293 16.105 1.00 29.50 C ATOM 1158 NE ARG A 71 38.640 -4.114 17.455 1.00 32.35 N ATOM 1159 CZ ARG A 71 37.866 -5.012 18.071 1.00 33.27 C ATOM 1160 NH1 ARG A 71 37.555 -6.155 17.468 1.00 32.56 N ATOM 1161 NH2 ARG A 71 37.403 -4.770 19.290 1.00 33.31 N ATOM 1162 HA ARG A 71 42.763 -6.251 15.366 1.00 0.00 H ATOM 1163 HB2 ARG A 71 40.983 -4.142 14.100 1.00 0.00 H ATOM 1164 HB3 ARG A 71 40.466 -5.835 14.274 1.00 0.00 H ATOM 1165 HG2 ARG A 71 40.736 -5.675 16.723 1.00 0.00 H ATOM 1166 HG3 ARG A 71 41.282 -3.990 16.559 1.00 0.00 H ATOM 1167 HD2 ARG A 71 38.581 -5.035 15.580 1.00 0.00 H ATOM 1168 HD3 ARG A 71 39.127 -3.342 15.575 1.00 0.00 H ATOM 1169 HE ARG A 71 38.871 -3.237 17.963 1.00 0.00 H ATOM 1170 HH12 ARG A 71 36.952 -6.851 17.952 1.00 0.00 H ATOM 1171 HH11 ARG A 71 37.915 -6.353 16.513 1.00 0.00 H ATOM 1172 HH22 ARG A 71 36.801 -5.471 19.766 1.00 0.00 H ATOM 1173 HH21 ARG A 71 37.642 -3.879 19.770 1.00 0.00 H ATOM 1174 H ARG A 71 43.087 -3.435 15.004 1.00 0.00 H ATOM 1175 N GLN A 72 42.951 -5.416 12.177 1.00 22.94 N ATOM 1176 CA GLN A 72 43.244 -6.035 10.887 1.00 22.39 C ATOM 1177 C GLN A 72 44.604 -6.718 10.882 1.00 22.38 C ATOM 1178 O GLN A 72 44.725 -7.813 10.330 1.00 21.34 O ATOM 1179 CB GLN A 72 43.182 -5.002 9.764 1.00 23.43 C ATOM 1180 CG GLN A 72 43.460 -5.590 8.393 1.00 21.49 C ATOM 1181 CD GLN A 72 42.435 -6.618 7.980 1.00 26.48 C ATOM 1182 OE1 GLN A 72 41.244 -6.518 8.342 1.00 28.30 O ATOM 1183 NE2 GLN A 72 42.864 -7.600 7.187 1.00 25.02 N ATOM 1184 HA GLN A 72 42.482 -6.796 10.718 1.00 0.00 H ATOM 1185 HB2 GLN A 72 42.186 -4.559 9.755 1.00 0.00 H ATOM 1186 HB3 GLN A 72 43.922 -4.227 9.965 1.00 0.00 H ATOM 1187 HG2 GLN A 72 43.459 -4.783 7.661 1.00 0.00 H ATOM 1188 HG3 GLN A 72 44.442 -6.063 8.409 1.00 0.00 H ATOM 1189 HE22 GLN A 72 43.865 -7.645 6.910 1.00 0.00 H ATOM 1190 HE21 GLN A 72 42.197 -8.321 6.845 1.00 0.00 H ATOM 1191 H GLN A 72 42.850 -4.384 12.260 1.00 0.00 H ATOM 1192 N SER A 73 45.617 -6.095 11.488 1.00 22.82 N ATOM 1193 CA SER A 73 46.958 -6.684 11.504 1.00 22.83 C ATOM 1194 C SER A 73 46.991 -8.003 12.267 1.00 22.42 C ATOM 1195 O SER A 73 47.574 -8.977 11.819 1.00 21.42 O ATOM 1196 CB SER A 73 47.957 -5.696 12.102 1.00 23.01 C ATOM 1197 OG SER A 73 47.786 -4.435 11.501 1.00 26.97 O ATOM 1198 HA SER A 73 47.238 -6.899 10.473 1.00 0.00 H ATOM 1199 HB2 SER A 73 48.972 -6.050 11.921 1.00 0.00 H ATOM 1200 HB3 SER A 73 47.788 -5.613 13.176 1.00 0.00 H ATOM 1201 HG SER A 73 46.864 -4.114 11.666 1.00 0.00 H ATOM 1202 H SER A 73 45.452 -5.180 11.955 1.00 0.00 H ATOM 1203 N ARG A 74 46.362 -8.028 13.433 1.00 22.42 N ATOM 1204 CA ARG A 74 46.283 -9.264 14.204 1.00 23.05 C ATOM 1205 C ARG A 74 45.542 -10.356 13.431 1.00 23.11 C ATOM 1206 O ARG A 74 45.957 -11.518 13.438 1.00 23.47 O ATOM 1207 CB ARG A 74 45.648 -8.968 15.565 1.00 23.02 C ATOM 1208 CG ARG A 74 46.598 -8.175 16.475 1.00 24.02 C ATOM 1209 CD ARG A 74 45.907 -7.575 17.705 1.00 25.74 C ATOM 1210 NE ARG A 74 45.218 -8.558 18.548 1.00 29.26 N ATOM 1211 CZ ARG A 74 45.788 -9.238 19.539 1.00 28.53 C ATOM 1212 NH1 ARG A 74 47.079 -9.082 19.830 1.00 28.79 N ATOM 1213 NH2 ARG A 74 45.051 -10.076 20.263 1.00 30.20 N ATOM 1214 HA ARG A 74 47.287 -9.652 14.376 1.00 0.00 H ATOM 1215 HB2 ARG A 74 44.738 -8.387 15.412 1.00 0.00 H ATOM 1216 HB3 ARG A 74 45.398 -9.911 16.051 1.00 0.00 H ATOM 1217 HG2 ARG A 74 47.389 -8.844 16.815 1.00 0.00 H ATOM 1218 HG3 ARG A 74 47.035 -7.363 15.894 1.00 0.00 H ATOM 1219 HD2 ARG A 74 45.174 -6.844 17.363 1.00 0.00 H ATOM 1220 HD3 ARG A 74 46.662 -7.074 18.311 1.00 0.00 H ATOM 1221 HE ARG A 74 44.211 -8.736 18.357 1.00 0.00 H ATOM 1222 HH12 ARG A 74 47.506 -9.623 20.609 1.00 0.00 H ATOM 1223 HH11 ARG A 74 47.660 -8.419 19.278 1.00 0.00 H ATOM 1224 HH22 ARG A 74 45.486 -10.613 21.040 1.00 0.00 H ATOM 1225 HH21 ARG A 74 44.040 -10.194 20.052 1.00 0.00 H ATOM 1226 H ARG A 74 45.922 -7.161 13.801 1.00 0.00 H ATOM 1227 N HIS A 75 44.482 -9.970 12.726 1.00 23.53 N ATOM 1228 CA HIS A 75 43.737 -10.932 11.939 1.00 22.81 C ATOM 1229 C HIS A 75 44.585 -11.463 10.762 1.00 22.29 C ATOM 1230 O HIS A 75 44.604 -12.631 10.484 1.00 22.73 O ATOM 1231 CB HIS A 75 42.426 -10.331 11.456 1.00 23.65 C ATOM 1232 CG HIS A 75 41.740 -11.150 10.410 1.00 26.43 C ATOM 1233 ND1 HIS A 75 40.994 -12.271 10.709 1.00 30.96 N ATOM 1234 CD2 HIS A 75 41.698 -11.018 9.063 1.00 29.37 C ATOM 1235 CE1 HIS A 75 40.512 -12.786 9.592 1.00 31.00 C ATOM 1236 NE2 HIS A 75 40.924 -12.044 8.579 1.00 31.67 N ATOM 1237 HA HIS A 75 43.498 -11.783 12.577 1.00 0.00 H ATOM 1238 HB2 HIS A 75 41.757 -10.232 12.311 1.00 0.00 H ATOM 1239 HB3 HIS A 75 42.631 -9.344 11.041 1.00 0.00 H ATOM 1240 HD2 HIS A 75 42.187 -10.243 8.473 1.00 0.00 H ATOM 1241 HE1 HIS A 75 39.882 -13.672 9.518 1.00 0.00 H ATOM 1242 H HIS A 75 44.187 -8.973 12.740 1.00 0.00 H ATOM 1243 N GLN A 76 45.263 -10.542 10.084 1.00 21.80 N ATOM 1244 CA GLN A 76 45.936 -10.858 8.822 1.00 20.54 C ATOM 1245 C GLN A 76 47.292 -11.539 9.028 1.00 20.00 C ATOM 1246 O GLN A 76 47.655 -12.421 8.248 1.00 19.45 O ATOM 1247 CB GLN A 76 46.092 -9.547 8.028 1.00 20.99 C ATOM 1248 CG GLN A 76 46.666 -9.703 6.626 1.00 21.65 C ATOM 1249 CD GLN A 76 46.437 -8.477 5.781 1.00 21.38 C ATOM 1250 OE1 GLN A 76 45.551 -7.665 6.060 1.00 21.82 O ATOM 1251 NE2 GLN A 76 47.230 -8.337 4.721 1.00 20.94 N ATOM 1252 HA GLN A 76 45.329 -11.574 8.268 1.00 0.00 H ATOM 1253 HB2 GLN A 76 45.108 -9.086 7.941 1.00 0.00 H ATOM 1254 HB3 GLN A 76 46.752 -8.887 8.592 1.00 0.00 H ATOM 1255 HG2 GLN A 76 47.738 -9.882 6.703 1.00 0.00 H ATOM 1256 HG3 GLN A 76 46.190 -10.557 6.144 1.00 0.00 H ATOM 1257 HE22 GLN A 76 47.964 -9.046 4.524 1.00 0.00 H ATOM 1258 HE21 GLN A 76 47.115 -7.518 4.090 1.00 0.00 H ATOM 1259 H GLN A 76 45.317 -9.573 10.459 1.00 0.00 H ATOM 1260 N PHE A 77 48.052 -11.082 10.029 1.00 20.28 N ATOM 1261 CA PHE A 77 49.413 -11.614 10.304 1.00 19.95 C ATOM 1262 C PHE A 77 49.564 -12.548 11.522 1.00 21.04 C ATOM 1263 O PHE A 77 50.576 -13.242 11.667 1.00 21.59 O ATOM 1264 CB PHE A 77 50.389 -10.451 10.451 1.00 20.24 C ATOM 1265 CG PHE A 77 50.397 -9.531 9.258 1.00 19.71 C ATOM 1266 CD1 PHE A 77 49.734 -8.314 9.298 1.00 20.26 C ATOM 1267 CD2 PHE A 77 51.027 -9.922 8.084 1.00 19.50 C ATOM 1268 CE1 PHE A 77 49.722 -7.470 8.203 1.00 21.16 C ATOM 1269 CE2 PHE A 77 51.015 -9.095 6.969 1.00 20.95 C ATOM 1270 CZ PHE A 77 50.358 -7.863 7.016 1.00 20.93 C ATOM 1271 HA PHE A 77 49.631 -12.246 9.443 1.00 0.00 H ATOM 1272 HB2 PHE A 77 50.111 -9.874 11.333 1.00 0.00 H ATOM 1273 HB3 PHE A 77 51.393 -10.855 10.585 1.00 0.00 H ATOM 1274 HD2 PHE A 77 51.535 -10.885 8.038 1.00 0.00 H ATOM 1275 HE2 PHE A 77 51.519 -9.408 6.055 1.00 0.00 H ATOM 1276 HZ PHE A 77 50.340 -7.214 6.140 1.00 0.00 H ATOM 1277 HE1 PHE A 77 49.221 -6.504 8.262 1.00 0.00 H ATOM 1278 HD1 PHE A 77 49.213 -8.017 10.208 1.00 0.00 H ATOM 1279 H PHE A 77 47.677 -10.327 10.638 1.00 0.00 H ATOM 1280 N GLY A 78 48.538 -12.533 12.376 1.00 22.63 N ATOM 1281 CA GLY A 78 48.527 -13.337 13.595 1.00 23.06 C ATOM 1282 C GLY A 78 48.759 -12.440 14.791 1.00 24.28 C ATOM 1283 O GLY A 78 49.493 -11.480 14.706 1.00 24.47 O ATOM 1284 HA3 GLY A 78 49.317 -14.087 13.544 1.00 0.00 H ATOM 1285 HA2 GLY A 78 47.562 -13.834 13.695 1.00 0.00 H ATOM 1286 H GLY A 78 47.719 -11.928 12.166 1.00 0.00 H ATOM 1287 N GLN A 79 48.142 -12.767 15.923 1.00 25.55 N ATOM 1288 CA GLN A 79 48.283 -11.938 17.127 1.00 27.96 C ATOM 1289 C GLN A 79 49.734 -11.809 17.596 1.00 27.40 C ATOM 1290 O GLN A 79 50.170 -10.711 17.974 1.00 27.78 O ATOM 1291 CB GLN A 79 47.421 -12.477 18.264 1.00 28.17 C ATOM 1292 CG GLN A 79 45.946 -12.648 17.931 1.00 31.16 C ATOM 1293 CD GLN A 79 45.203 -13.364 19.061 1.00 32.23 C ATOM 1294 OE1 GLN A 79 45.787 -14.178 19.782 1.00 35.90 O ATOM 1295 NE2 GLN A 79 43.912 -13.062 19.217 1.00 36.56 N ATOM 1296 HA GLN A 79 47.940 -10.941 16.850 1.00 0.00 H ATOM 1297 HB2 GLN A 79 47.817 -13.450 18.556 1.00 0.00 H ATOM 1298 HB3 GLN A 79 47.500 -11.787 19.104 1.00 0.00 H ATOM 1299 HG2 GLN A 79 45.499 -11.665 17.778 1.00 0.00 H ATOM 1300 HG3 GLN A 79 45.853 -13.234 17.017 1.00 0.00 H ATOM 1301 HE22 GLN A 79 43.460 -12.370 18.586 1.00 0.00 H ATOM 1302 HE21 GLN A 79 43.358 -13.519 19.969 1.00 0.00 H ATOM 1303 H GLN A 79 47.551 -13.622 15.956 1.00 0.00 H ATOM 1304 N GLU A 80 50.478 -12.916 17.547 1.00 27.76 N ATOM 1305 CA GLU A 80 51.873 -12.931 17.967 1.00 28.07 C ATOM 1306 C GLU A 80 52.829 -12.243 16.996 1.00 27.30 C ATOM 1307 O GLU A 80 53.908 -11.815 17.396 1.00 27.76 O ATOM 1308 CB GLU A 80 52.330 -14.358 18.326 1.00 28.79 C ATOM 1309 CG GLU A 80 51.708 -14.868 19.626 1.00 33.40 C ATOM 1310 CD GLU A 80 52.159 -14.069 20.849 1.00 37.46 C ATOM 1311 OE1 GLU A 80 53.205 -14.417 21.438 1.00 41.01 O ATOM 1312 OE2 GLU A 80 51.464 -13.099 21.231 1.00 40.49 O ATOM 1313 HA GLU A 80 51.918 -12.323 18.871 1.00 0.00 H ATOM 1314 HB2 GLU A 80 52.045 -15.030 17.516 1.00 0.00 H ATOM 1315 HB3 GLU A 80 53.415 -14.360 18.434 1.00 0.00 H ATOM 1316 HG2 GLU A 80 50.623 -14.799 19.545 1.00 0.00 H ATOM 1317 HG3 GLU A 80 51.995 -15.910 19.765 1.00 0.00 H ATOM 1318 H GLU A 80 50.048 -13.796 17.198 1.00 0.00 H ATOM 1319 N LYS A 81 52.424 -12.099 15.731 1.00 25.30 N ATOM 1320 CA LYS A 81 53.320 -11.534 14.733 1.00 24.82 C ATOM 1321 C LYS A 81 53.033 -10.091 14.398 1.00 23.96 C ATOM 1322 O LYS A 81 53.890 -9.408 13.830 1.00 24.14 O ATOM 1323 CB LYS A 81 53.324 -12.393 13.443 1.00 24.83 C ATOM 1324 CG LYS A 81 53.844 -13.805 13.657 1.00 26.44 C ATOM 1325 CD LYS A 81 55.337 -13.794 14.055 1.00 27.69 C ATOM 1326 CE LYS A 81 55.936 -15.196 14.016 1.00 29.78 C ATOM 1327 NZ LYS A 81 57.363 -15.177 14.466 1.00 32.48 N ATOM 1328 HA LYS A 81 54.311 -11.551 15.188 1.00 0.00 H ATOM 1329 HB2 LYS A 81 52.303 -12.454 13.066 1.00 0.00 H ATOM 1330 HB3 LYS A 81 53.955 -11.901 12.702 1.00 0.00 H ATOM 1331 HG2 LYS A 81 53.267 -14.281 14.450 1.00 0.00 H ATOM 1332 HG3 LYS A 81 53.726 -14.372 12.734 1.00 0.00 H ATOM 1333 HD2 LYS A 81 55.884 -13.155 13.362 1.00 0.00 H ATOM 1334 HD3 LYS A 81 55.432 -13.396 15.065 1.00 0.00 H ATOM 1335 HE2 LYS A 81 55.888 -15.577 12.996 1.00 0.00 H ATOM 1336 HE3 LYS A 81 55.362 -15.849 14.674 1.00 0.00 H ATOM 1337 HZ1 LYS A 81 57.915 -14.558 13.838 1.00 0.00 H ATOM 1338 HZ2 LYS A 81 57.413 -14.817 15.441 1.00 0.00 H ATOM 1339 HZ3 LYS A 81 57.749 -16.142 14.431 1.00 0.00 H ATOM 1340 H LYS A 81 51.464 -12.392 15.458 1.00 0.00 H ATOM 1341 N ASP A 82 51.845 -9.620 14.778 1.00 23.49 N ATOM 1342 CA ASP A 82 51.466 -8.215 14.576 1.00 23.75 C ATOM 1343 C ASP A 82 52.548 -7.275 15.101 1.00 22.83 C ATOM 1344 O ASP A 82 52.977 -7.398 16.257 1.00 25.00 O ATOM 1345 CB ASP A 82 50.133 -7.911 15.276 1.00 23.97 C ATOM 1346 CG ASP A 82 49.902 -6.440 15.474 1.00 25.12 C ATOM 1347 OD1 ASP A 82 49.938 -5.666 14.480 1.00 24.78 O ATOM 1348 OD2 ASP A 82 49.654 -6.032 16.652 1.00 24.95 O ATOM 1349 HA ASP A 82 51.353 -8.052 13.504 1.00 0.00 H ATOM 1350 HB2 ASP A 82 49.321 -8.313 14.670 1.00 0.00 H ATOM 1351 HB3 ASP A 82 50.132 -8.398 16.251 1.00 0.00 H ATOM 1352 H ASP A 82 51.167 -10.266 15.230 1.00 0.00 H ATOM 1353 N VAL A 83 52.984 -6.354 14.240 1.00 22.33 N ATOM 1354 CA VAL A 83 53.968 -5.347 14.641 1.00 23.00 C ATOM 1355 C VAL A 83 53.329 -4.024 15.093 1.00 22.71 C ATOM 1356 O VAL A 83 54.007 -3.186 15.721 1.00 23.89 O ATOM 1357 CB VAL A 83 54.957 -5.021 13.509 1.00 23.28 C ATOM 1358 CG1 VAL A 83 55.709 -6.271 13.075 1.00 22.64 C ATOM 1359 CG2 VAL A 83 54.247 -4.390 12.315 1.00 24.10 C ATOM 1360 HA VAL A 83 54.491 -5.800 15.483 1.00 0.00 H ATOM 1361 HB VAL A 83 55.674 -4.297 13.896 1.00 0.00 H ATOM 1362 HG11 VAL A 83 56.263 -6.673 13.923 1.00 0.00 H ATOM 1363 HG12 VAL A 83 54.998 -7.016 12.718 1.00 0.00 H ATOM 1364 HG13 VAL A 83 56.403 -6.016 12.274 1.00 0.00 H ATOM 1365 HG21 VAL A 83 53.498 -5.083 11.932 1.00 0.00 H ATOM 1366 HG22 VAL A 83 53.762 -3.466 12.629 1.00 0.00 H ATOM 1367 HG23 VAL A 83 54.976 -4.173 11.534 1.00 0.00 H ATOM 1368 H VAL A 83 52.618 -6.351 13.266 1.00 0.00 H ATOM 1369 N PHE A 84 52.056 -3.821 14.777 1.00 23.15 N ATOM 1370 CA PHE A 84 51.433 -2.524 15.086 1.00 22.98 C ATOM 1371 C PHE A 84 51.097 -2.310 16.558 1.00 23.72 C ATOM 1372 O PHE A 84 51.436 -1.257 17.097 1.00 24.00 O ATOM 1373 CB PHE A 84 50.203 -2.292 14.204 1.00 22.83 C ATOM 1374 CG PHE A 84 50.549 -1.966 12.789 1.00 22.59 C ATOM 1375 CD1 PHE A 84 50.971 -0.686 12.447 1.00 25.03 C ATOM 1376 CD2 PHE A 84 50.485 -2.941 11.795 1.00 24.25 C ATOM 1377 CE1 PHE A 84 51.270 -0.361 11.113 1.00 24.14 C ATOM 1378 CE2 PHE A 84 50.790 -2.619 10.454 1.00 25.01 C ATOM 1379 CZ PHE A 84 51.200 -1.330 10.124 1.00 24.53 C ATOM 1380 HA PHE A 84 52.194 -1.777 14.859 1.00 0.00 H ATOM 1381 HB2 PHE A 84 49.594 -3.196 14.213 1.00 0.00 H ATOM 1382 HB3 PHE A 84 49.629 -1.464 14.620 1.00 0.00 H ATOM 1383 HD2 PHE A 84 50.197 -3.960 12.055 1.00 0.00 H ATOM 1384 HE2 PHE A 84 50.704 -3.379 9.678 1.00 0.00 H ATOM 1385 HZ PHE A 84 51.464 -1.084 9.095 1.00 0.00 H ATOM 1386 HE1 PHE A 84 51.558 0.658 10.855 1.00 0.00 H ATOM 1387 HD1 PHE A 84 51.071 0.074 13.222 1.00 0.00 H ATOM 1388 H PHE A 84 51.504 -4.572 14.315 1.00 0.00 H ATOM 1389 N ALA A 85 50.444 -3.268 17.224 1.00 23.22 N ATOM 1390 CA ALA A 85 50.141 -3.039 18.658 1.00 23.41 C ATOM 1391 C ALA A 85 51.410 -2.833 19.470 1.00 23.90 C ATOM 1392 O ALA A 85 51.472 -1.884 20.253 1.00 24.32 O ATOM 1393 CB ALA A 85 49.339 -4.186 19.228 1.00 25.44 C ATOM 1394 HA ALA A 85 49.546 -2.128 18.723 1.00 0.00 H ATOM 1395 HB1 ALA A 85 48.401 -4.279 18.681 1.00 0.00 H ATOM 1396 HB2 ALA A 85 49.910 -5.110 19.132 1.00 0.00 H ATOM 1397 HB3 ALA A 85 49.130 -3.994 20.280 1.00 0.00 H ATOM 1398 H ALA A 85 50.157 -4.148 16.750 1.00 0.00 H ATOM 1399 N PRO A 86 52.434 -3.691 19.292 1.00 23.30 N ATOM 1400 CA PRO A 86 53.678 -3.430 20.046 1.00 23.12 C ATOM 1401 C PRO A 86 54.271 -2.045 19.774 1.00 23.23 C ATOM 1402 O PRO A 86 54.735 -1.374 20.708 1.00 23.19 O ATOM 1403 CB PRO A 86 54.611 -4.547 19.577 1.00 23.38 C ATOM 1404 CG PRO A 86 53.642 -5.686 19.216 1.00 23.84 C ATOM 1405 CD PRO A 86 52.503 -4.984 18.559 1.00 23.00 C ATOM 1406 HA PRO A 86 53.509 -3.427 21.123 1.00 0.00 H ATOM 1407 HD3 PRO A 86 52.701 -4.823 17.499 1.00 0.00 H ATOM 1408 HD2 PRO A 86 51.577 -5.548 18.673 1.00 0.00 H ATOM 1409 HG3 PRO A 86 53.310 -6.213 20.111 1.00 0.00 H ATOM 1410 HG2 PRO A 86 54.110 -6.393 18.532 1.00 0.00 H ATOM 1411 HB2 PRO A 86 55.189 -4.235 18.707 1.00 0.00 H ATOM 1412 HB3 PRO A 86 55.291 -4.849 20.374 1.00 0.00 H ATOM 1413 N ARG A 87 54.222 -1.578 18.527 1.00 23.00 N ATOM 1414 CA ARG A 87 54.800 -0.281 18.222 1.00 22.38 C ATOM 1415 C ARG A 87 53.946 0.837 18.810 1.00 22.66 C ATOM 1416 O ARG A 87 54.485 1.796 19.381 1.00 23.62 O ATOM 1417 CB ARG A 87 54.976 -0.090 16.708 1.00 23.33 C ATOM 1418 CG ARG A 87 55.722 1.210 16.299 1.00 22.42 C ATOM 1419 CD ARG A 87 57.105 1.301 16.883 1.00 23.42 C ATOM 1420 NE ARG A 87 57.743 2.551 16.496 1.00 23.90 N ATOM 1421 CZ ARG A 87 59.043 2.793 16.606 1.00 25.28 C ATOM 1422 NH1 ARG A 87 59.880 1.861 17.058 1.00 25.99 N ATOM 1423 NH2 ARG A 87 59.523 3.969 16.221 1.00 26.24 N ATOM 1424 HA ARG A 87 55.789 -0.239 18.679 1.00 0.00 H ATOM 1425 HB2 ARG A 87 55.538 -0.940 16.322 1.00 0.00 H ATOM 1426 HB3 ARG A 87 53.987 -0.072 16.251 1.00 0.00 H ATOM 1427 HG2 ARG A 87 55.801 1.239 15.212 1.00 0.00 H ATOM 1428 HG3 ARG A 87 55.142 2.067 16.643 1.00 0.00 H ATOM 1429 HD2 ARG A 87 57.703 0.465 16.520 1.00 0.00 H ATOM 1430 HD3 ARG A 87 57.039 1.254 17.970 1.00 0.00 H ATOM 1431 HE ARG A 87 57.140 3.304 16.108 1.00 0.00 H ATOM 1432 HH12 ARG A 87 60.896 2.069 17.137 1.00 0.00 H ATOM 1433 HH11 ARG A 87 59.518 0.925 17.332 1.00 0.00 H ATOM 1434 HH22 ARG A 87 60.541 4.168 16.304 1.00 0.00 H ATOM 1435 HH21 ARG A 87 58.882 4.692 15.837 1.00 0.00 H ATOM 1436 H ARG A 87 53.772 -2.139 17.776 1.00 0.00 H ATOM 1437 N PHE A 88 52.624 0.721 18.662 1.00 22.27 N ATOM 1438 CA PHE A 88 51.736 1.729 19.286 1.00 23.14 C ATOM 1439 C PHE A 88 51.921 1.777 20.816 1.00 22.99 C ATOM 1440 O PHE A 88 51.687 2.822 21.434 1.00 23.74 O ATOM 1441 CB PHE A 88 50.274 1.456 18.989 1.00 23.29 C ATOM 1442 CG PHE A 88 49.792 2.006 17.660 1.00 22.44 C ATOM 1443 CD1 PHE A 88 49.766 3.384 17.424 1.00 23.16 C ATOM 1444 CD2 PHE A 88 49.369 1.131 16.640 1.00 24.16 C ATOM 1445 CE1 PHE A 88 49.309 3.894 16.207 1.00 24.35 C ATOM 1446 CE2 PHE A 88 48.906 1.620 15.426 1.00 23.56 C ATOM 1447 CZ PHE A 88 48.873 2.999 15.201 1.00 24.44 C ATOM 1448 HA PHE A 88 52.019 2.688 18.852 1.00 0.00 H ATOM 1449 HB2 PHE A 88 50.122 0.377 18.987 1.00 0.00 H ATOM 1450 HB3 PHE A 88 49.675 1.905 19.782 1.00 0.00 H ATOM 1451 HD2 PHE A 88 49.406 0.054 16.806 1.00 0.00 H ATOM 1452 HE2 PHE A 88 48.569 0.931 14.651 1.00 0.00 H ATOM 1453 HZ PHE A 88 48.511 3.386 14.249 1.00 0.00 H ATOM 1454 HE1 PHE A 88 49.288 4.970 16.034 1.00 0.00 H ATOM 1455 HD1 PHE A 88 50.107 4.069 18.200 1.00 0.00 H ATOM 1456 H PHE A 88 52.223 -0.067 18.115 1.00 0.00 H ATOM 1457 N SER A 89 52.317 0.665 21.436 1.00 22.26 N ATOM 1458 CA SER A 89 52.416 0.640 22.891 1.00 22.01 C ATOM 1459 C SER A 89 53.485 1.581 23.442 1.00 22.80 C ATOM 1460 O SER A 89 53.364 2.038 24.585 1.00 23.44 O ATOM 1461 CB SER A 89 52.635 -0.785 23.414 1.00 21.37 C ATOM 1462 OG SER A 89 53.988 -1.194 23.274 1.00 17.35 O ATOM 1463 HA SER A 89 51.457 1.006 23.257 1.00 0.00 H ATOM 1464 HB2 SER A 89 51.999 -1.469 22.853 1.00 0.00 H ATOM 1465 HB3 SER A 89 52.362 -0.820 24.469 1.00 0.00 H ATOM 1466 HG SER A 89 54.241 -1.170 22.317 1.00 0.00 H ATOM 1467 H SER A 89 52.555 -0.183 20.883 1.00 0.00 H ATOM 1468 N ASN A 90 54.521 1.880 22.648 1.00 23.22 N ATOM 1469 CA ASN A 90 55.654 2.685 23.139 1.00 23.01 C ATOM 1470 C ASN A 90 55.176 4.030 23.674 1.00 22.90 C ATOM 1471 O ASN A 90 55.522 4.432 24.794 1.00 23.47 O ATOM 1472 CB ASN A 90 56.694 2.911 22.026 1.00 24.15 C ATOM 1473 CG ASN A 90 57.345 1.618 21.563 1.00 25.87 C ATOM 1474 OD1 ASN A 90 57.193 0.576 22.194 1.00 27.39 O ATOM 1475 ND2 ASN A 90 58.119 1.699 20.475 1.00 27.15 N ATOM 1476 HA ASN A 90 56.123 2.129 23.951 1.00 0.00 H ATOM 1477 HB2 ASN A 90 56.199 3.377 21.174 1.00 0.00 H ATOM 1478 HB3 ASN A 90 57.470 3.577 22.403 1.00 0.00 H ATOM 1479 HD22 ASN A 90 58.217 2.604 19.973 1.00 0.00 H ATOM 1480 HD21 ASN A 90 58.623 0.857 20.131 1.00 0.00 H ATOM 1481 H ASN A 90 54.526 1.538 21.666 1.00 0.00 H ATOM 1482 N ASN A 91 54.378 4.717 22.869 1.00 21.98 N ATOM 1483 CA ASN A 91 53.935 6.060 23.263 1.00 21.83 C ATOM 1484 C ASN A 91 52.516 6.141 23.779 1.00 21.78 C ATOM 1485 O ASN A 91 51.988 7.240 23.951 1.00 22.15 O ATOM 1486 CB ASN A 91 54.073 7.022 22.077 1.00 21.61 C ATOM 1487 CG ASN A 91 55.522 7.249 21.695 1.00 22.44 C ATOM 1488 OD1 ASN A 91 56.435 7.199 22.538 1.00 24.48 O ATOM 1489 ND2 ASN A 91 55.745 7.463 20.404 1.00 24.28 N ATOM 1490 HA ASN A 91 54.583 6.337 24.094 1.00 0.00 H ATOM 1491 HB2 ASN A 91 53.545 6.603 21.221 1.00 0.00 H ATOM 1492 HB3 ASN A 91 53.626 7.979 22.346 1.00 0.00 H ATOM 1493 HD22 ASN A 91 54.948 7.496 19.737 1.00 0.00 H ATOM 1494 HD21 ASN A 91 56.717 7.597 20.059 1.00 0.00 H ATOM 1495 H ASN A 91 54.068 4.308 21.965 1.00 0.00 H ATOM 1496 N ILE A 92 51.880 4.984 23.983 1.00 21.85 N ATOM 1497 CA ILE A 92 50.440 4.889 24.162 1.00 22.09 C ATOM 1498 C ILE A 92 49.882 5.697 25.335 1.00 21.46 C ATOM 1499 O ILE A 92 48.762 6.195 25.266 1.00 21.42 O ATOM 1500 CB ILE A 92 50.010 3.406 24.216 1.00 22.58 C ATOM 1501 CG1 ILE A 92 48.526 3.275 23.929 1.00 23.53 C ATOM 1502 CG2 ILE A 92 50.354 2.764 25.547 1.00 23.65 C ATOM 1503 CD1 ILE A 92 48.111 1.858 23.565 1.00 27.51 C ATOM 1504 HA ILE A 92 49.993 5.361 23.287 1.00 0.00 H ATOM 1505 HB ILE A 92 50.568 2.875 23.445 1.00 0.00 H ATOM 1506 HG12 ILE A 92 47.972 3.582 24.816 1.00 0.00 H ATOM 1507 HG13 ILE A 92 48.273 3.935 23.099 1.00 0.00 H ATOM 1508 HD11 ILE A 92 48.650 1.541 22.672 1.00 0.00 H ATOM 1509 HD12 ILE A 92 48.348 1.188 24.391 1.00 0.00 H ATOM 1510 HD13 ILE A 92 47.039 1.833 23.372 1.00 0.00 H ATOM 1511 HG21 ILE A 92 51.431 2.813 25.705 1.00 0.00 H ATOM 1512 HG22 ILE A 92 49.843 3.297 26.349 1.00 0.00 H ATOM 1513 HG23 ILE A 92 50.034 1.722 25.540 1.00 0.00 H ATOM 1514 H ILE A 92 52.442 4.109 24.015 1.00 0.00 H ATOM 1515 N ILE A 93 50.673 5.855 26.392 1.00 20.51 N ATOM 1516 CA ILE A 93 50.183 6.652 27.523 1.00 20.48 C ATOM 1517 C ILE A 93 49.983 8.107 27.085 1.00 21.41 C ATOM 1518 O ILE A 93 48.948 8.732 27.416 1.00 21.97 O ATOM 1519 CB ILE A 93 51.176 6.593 28.698 1.00 19.95 C ATOM 1520 CG1 ILE A 93 51.366 5.153 29.206 1.00 22.68 C ATOM 1521 CG2 ILE A 93 50.721 7.498 29.850 1.00 20.51 C ATOM 1522 CD1 ILE A 93 50.155 4.499 29.843 1.00 24.62 C ATOM 1523 HA ILE A 93 49.230 6.238 27.852 1.00 0.00 H ATOM 1524 HB ILE A 93 52.135 6.953 28.325 1.00 0.00 H ATOM 1525 HG12 ILE A 93 51.668 4.539 28.358 1.00 0.00 H ATOM 1526 HG13 ILE A 93 52.165 5.165 29.947 1.00 0.00 H ATOM 1527 HD11 ILE A 93 49.841 5.083 30.708 1.00 0.00 H ATOM 1528 HD12 ILE A 93 49.343 4.456 29.117 1.00 0.00 H ATOM 1529 HD13 ILE A 93 50.414 3.489 30.160 1.00 0.00 H ATOM 1530 HG21 ILE A 93 50.657 8.528 29.498 1.00 0.00 H ATOM 1531 HG22 ILE A 93 49.743 7.171 30.202 1.00 0.00 H ATOM 1532 HG23 ILE A 93 51.442 7.436 30.665 1.00 0.00 H ATOM 1533 H ILE A 93 51.619 5.423 26.417 1.00 0.00 H ATOM 1534 N SER A 94 50.947 8.614 26.327 1.00 21.60 N ATOM 1535 CA SER A 94 50.863 9.998 25.827 1.00 21.92 C ATOM 1536 C SER A 94 49.781 10.115 24.747 1.00 22.17 C ATOM 1537 O SER A 94 49.036 11.096 24.686 1.00 21.44 O ATOM 1538 CB SER A 94 52.206 10.453 25.294 1.00 23.11 C ATOM 1539 OG SER A 94 52.105 11.805 24.875 1.00 24.65 O ATOM 1540 HA SER A 94 50.588 10.649 26.657 1.00 0.00 H ATOM 1541 HB2 SER A 94 52.494 9.829 24.448 1.00 0.00 H ATOM 1542 HB3 SER A 94 52.958 10.369 26.079 1.00 0.00 H ATOM 1543 HG SER A 94 51.843 12.369 25.645 1.00 0.00 H ATOM 1544 H SER A 94 51.771 8.028 26.083 1.00 0.00 H ATOM 1545 N THR A 95 49.671 9.095 23.897 1.00 20.94 N ATOM 1546 CA THR A 95 48.622 9.090 22.872 1.00 21.76 C ATOM 1547 C THR A 95 47.262 9.238 23.541 1.00 21.94 C ATOM 1548 O THR A 95 46.421 10.056 23.129 1.00 21.86 O ATOM 1549 CB THR A 95 48.682 7.793 22.100 1.00 22.28 C ATOM 1550 OG1 THR A 95 49.997 7.663 21.558 1.00 22.16 O ATOM 1551 CG2 THR A 95 47.634 7.812 20.940 1.00 23.99 C ATOM 1552 HA THR A 95 48.774 9.922 22.184 1.00 0.00 H ATOM 1553 HB THR A 95 48.455 6.953 22.757 1.00 0.00 H ATOM 1554 HG1 THR A 95 50.060 6.818 21.046 1.00 0.00 H ATOM 1555 HG23 THR A 95 46.632 7.911 21.358 1.00 0.00 H ATOM 1556 HG21 THR A 95 47.839 8.655 20.281 1.00 0.00 H ATOM 1557 HG22 THR A 95 47.703 6.882 20.375 1.00 0.00 H ATOM 1558 H THR A 95 50.334 8.296 23.961 1.00 0.00 H ATOM 1559 N PHE A 96 47.044 8.464 24.604 1.00 20.93 N ATOM 1560 CA PHE A 96 45.769 8.543 25.286 1.00 20.86 C ATOM 1561 C PHE A 96 45.566 9.841 26.039 1.00 21.02 C ATOM 1562 O PHE A 96 44.429 10.337 26.119 1.00 21.68 O ATOM 1563 CB PHE A 96 45.506 7.320 26.156 1.00 20.35 C ATOM 1564 CG PHE A 96 44.879 6.219 25.389 1.00 21.07 C ATOM 1565 CD1 PHE A 96 45.623 5.527 24.441 1.00 21.30 C ATOM 1566 CD2 PHE A 96 43.543 5.918 25.556 1.00 22.20 C ATOM 1567 CE1 PHE A 96 45.032 4.517 23.675 1.00 22.02 C ATOM 1568 CE2 PHE A 96 42.934 4.889 24.809 1.00 22.69 C ATOM 1569 CZ PHE A 96 43.686 4.196 23.866 1.00 22.42 C ATOM 1570 HA PHE A 96 45.014 8.543 24.500 1.00 0.00 H ATOM 1571 HB2 PHE A 96 46.453 6.969 26.566 1.00 0.00 H ATOM 1572 HB3 PHE A 96 44.841 7.604 26.972 1.00 0.00 H ATOM 1573 HD2 PHE A 96 42.950 6.483 26.275 1.00 0.00 H ATOM 1574 HE2 PHE A 96 41.885 4.639 24.969 1.00 0.00 H ATOM 1575 HZ PHE A 96 43.225 3.403 23.277 1.00 0.00 H ATOM 1576 HE1 PHE A 96 45.621 3.981 22.930 1.00 0.00 H ATOM 1577 HD1 PHE A 96 46.675 5.773 24.293 1.00 0.00 H ATOM 1578 H PHE A 96 47.781 7.811 24.940 1.00 0.00 H ATOM 1579 N GLN A 97 46.636 10.407 26.593 1.00 20.89 N ATOM 1580 CA GLN A 97 46.498 11.729 27.193 1.00 21.30 C ATOM 1581 C GLN A 97 45.935 12.725 26.149 1.00 21.39 C ATOM 1582 O GLN A 97 45.064 13.539 26.465 1.00 22.22 O ATOM 1583 CB GLN A 97 47.826 12.189 27.744 1.00 21.54 C ATOM 1584 CG GLN A 97 47.726 13.491 28.475 1.00 22.30 C ATOM 1585 CD GLN A 97 49.065 13.894 28.990 1.00 21.00 C ATOM 1586 OE1 GLN A 97 50.072 13.728 28.303 1.00 23.46 O ATOM 1587 NE2 GLN A 97 49.101 14.426 30.201 1.00 22.29 N ATOM 1588 HA GLN A 97 45.794 11.681 28.024 1.00 0.00 H ATOM 1589 HB2 GLN A 97 48.201 11.430 28.431 1.00 0.00 H ATOM 1590 HB3 GLN A 97 48.526 12.306 26.917 1.00 0.00 H ATOM 1591 HG2 GLN A 97 47.355 14.258 27.796 1.00 0.00 H ATOM 1592 HG3 GLN A 97 47.035 13.383 29.311 1.00 0.00 H ATOM 1593 HE22 GLN A 97 48.221 14.546 30.743 1.00 0.00 H ATOM 1594 HE21 GLN A 97 50.009 14.725 30.611 1.00 0.00 H ATOM 1595 H GLN A 97 47.553 9.916 26.598 1.00 0.00 H ATOM 1596 N ASN A 98 46.411 12.603 24.906 1.00 21.77 N ATOM 1597 CA ASN A 98 45.887 13.412 23.808 1.00 22.50 C ATOM 1598 C ASN A 98 44.446 13.063 23.448 1.00 22.75 C ATOM 1599 O ASN A 98 43.610 13.957 23.252 1.00 21.55 O ATOM 1600 CB ASN A 98 46.786 13.262 22.581 1.00 22.95 C ATOM 1601 CG ASN A 98 48.159 13.866 22.808 1.00 22.33 C ATOM 1602 OD1 ASN A 98 48.339 14.719 23.694 1.00 23.32 O ATOM 1603 ND2 ASN A 98 49.141 13.423 22.028 1.00 22.59 N ATOM 1604 HA ASN A 98 45.884 14.448 24.146 1.00 0.00 H ATOM 1605 HB2 ASN A 98 46.900 12.202 22.355 1.00 0.00 H ATOM 1606 HB3 ASN A 98 46.315 13.764 21.736 1.00 0.00 H ATOM 1607 HD22 ASN A 98 48.944 12.708 21.299 1.00 0.00 H ATOM 1608 HD21 ASN A 98 50.106 13.792 22.147 1.00 0.00 H ATOM 1609 H ASN A 98 47.170 11.918 24.716 1.00 0.00 H ATOM 1610 N LEU A 99 44.137 11.785 23.401 1.00 22.16 N ATOM 1611 CA LEU A 99 42.783 11.346 23.055 1.00 22.35 C ATOM 1612 C LEU A 99 41.736 11.820 24.033 1.00 23.19 C ATOM 1613 O LEU A 99 40.623 12.144 23.629 1.00 24.28 O ATOM 1614 CB LEU A 99 42.718 9.833 23.007 1.00 22.57 C ATOM 1615 CG LEU A 99 43.498 9.216 21.845 1.00 21.14 C ATOM 1616 CD1 LEU A 99 43.552 7.722 22.038 1.00 23.70 C ATOM 1617 CD2 LEU A 99 42.736 9.506 20.529 1.00 21.24 C ATOM 1618 HA LEU A 99 42.569 11.786 22.081 1.00 0.00 H ATOM 1619 HB2 LEU A 99 43.124 9.442 23.940 1.00 0.00 H ATOM 1620 HB3 LEU A 99 41.673 9.537 22.915 1.00 0.00 H ATOM 1621 HG LEU A 99 44.504 9.633 21.806 1.00 0.00 H ATOM 1622 HD21 LEU A 99 41.740 9.066 20.583 1.00 0.00 H ATOM 1623 HD22 LEU A 99 42.652 10.584 20.389 1.00 0.00 H ATOM 1624 HD23 LEU A 99 43.282 9.071 19.691 1.00 0.00 H ATOM 1625 HD11 LEU A 99 44.051 7.496 22.981 1.00 0.00 H ATOM 1626 HD12 LEU A 99 42.538 7.323 22.057 1.00 0.00 H ATOM 1627 HD13 LEU A 99 44.106 7.270 21.215 1.00 0.00 H ATOM 1628 H LEU A 99 44.866 11.075 23.613 1.00 0.00 H ATOM 1629 N TYR A 100 42.067 11.830 25.325 1.00 23.49 N ATOM 1630 CA TYR A 100 41.084 12.187 26.339 1.00 24.65 C ATOM 1631 C TYR A 100 40.784 13.693 26.340 1.00 25.06 C ATOM 1632 O TYR A 100 39.953 14.165 27.127 1.00 26.42 O ATOM 1633 CB TYR A 100 41.544 11.732 27.726 1.00 23.94 C ATOM 1634 CG TYR A 100 41.373 10.254 27.994 1.00 24.86 C ATOM 1635 CD1 TYR A 100 40.109 9.642 27.908 1.00 24.71 C ATOM 1636 CD2 TYR A 100 42.452 9.476 28.398 1.00 23.57 C ATOM 1637 CE1 TYR A 100 39.959 8.271 28.157 1.00 25.73 C ATOM 1638 CE2 TYR A 100 42.313 8.115 28.658 1.00 24.75 C ATOM 1639 CZ TYR A 100 41.063 7.518 28.538 1.00 26.38 C ATOM 1640 OH TYR A 100 40.905 6.164 28.809 1.00 26.00 O ATOM 1641 HA TYR A 100 40.159 11.667 26.089 1.00 0.00 H ATOM 1642 HB3 TYR A 100 40.970 12.281 28.472 1.00 0.00 H ATOM 1643 HB2 TYR A 100 42.601 11.976 27.831 1.00 0.00 H ATOM 1644 HD2 TYR A 100 43.430 9.943 28.514 1.00 0.00 H ATOM 1645 HE2 TYR A 100 43.178 7.522 28.954 1.00 0.00 H ATOM 1646 HE1 TYR A 100 38.982 7.798 28.052 1.00 0.00 H ATOM 1647 HD1 TYR A 100 39.237 10.241 27.645 1.00 0.00 H ATOM 1648 HH TYR A 100 41.165 5.984 29.747 1.00 0.00 H ATOM 1649 H TYR A 100 43.035 11.581 25.611 1.00 0.00 H ATOM 1650 N ARG A 101 41.462 14.444 25.471 1.00 25.93 N ATOM 1651 CA ARG A 101 41.125 15.857 25.234 1.00 28.37 C ATOM 1652 C ARG A 101 40.062 15.973 24.147 1.00 29.46 C ATOM 1653 O ARG A 101 40.121 16.826 23.259 1.00 31.63 O ATOM 1654 CB ARG A 101 42.379 16.667 24.919 1.00 29.17 C ATOM 1655 CG ARG A 101 43.293 16.795 26.158 1.00 31.90 C ATOM 1656 CD ARG A 101 44.733 17.174 25.811 1.00 36.39 C ATOM 1657 NE ARG A 101 45.627 17.105 26.974 1.00 38.29 N ATOM 1658 CZ ARG A 101 46.956 17.134 26.898 1.00 39.86 C ATOM 1659 NH1 ARG A 101 47.556 17.227 25.717 1.00 41.30 N ATOM 1660 NH2 ARG A 101 47.690 17.068 27.998 1.00 39.88 N ATOM 1661 HA ARG A 101 40.700 16.281 26.144 1.00 0.00 H ATOM 1662 HB2 ARG A 101 42.931 16.171 24.121 1.00 0.00 H ATOM 1663 HB3 ARG A 101 42.085 17.664 24.591 1.00 0.00 H ATOM 1664 HG2 ARG A 101 42.882 17.562 26.814 1.00 0.00 H ATOM 1665 HG3 ARG A 101 43.303 15.839 26.681 1.00 0.00 H ATOM 1666 HD2 ARG A 101 44.743 18.192 25.422 1.00 0.00 H ATOM 1667 HD3 ARG A 101 45.100 16.490 25.046 1.00 0.00 H ATOM 1668 HE ARG A 101 45.195 17.029 27.917 1.00 0.00 H ATOM 1669 HH12 ARG A 101 48.594 17.249 25.662 1.00 0.00 H ATOM 1670 HH11 ARG A 101 46.988 17.277 24.848 1.00 0.00 H ATOM 1671 HH22 ARG A 101 48.728 17.091 27.933 1.00 0.00 H ATOM 1672 HH21 ARG A 101 47.229 16.993 28.927 1.00 0.00 H ATOM 1673 H ARG A 101 42.252 14.019 24.945 1.00 0.00 H ATOM 1674 N CYS A 102 39.093 15.073 24.235 1.00 30.12 N ATOM 1675 CA CYS A 102 38.010 14.950 23.278 1.00 29.41 C ATOM 1676 C CYS A 102 36.779 15.545 23.956 1.00 29.45 C ATOM 1677 O CYS A 102 36.789 15.788 25.172 1.00 29.72 O ATOM 1678 CB CYS A 102 37.784 13.467 22.975 1.00 29.02 C ATOM 1679 SG CYS A 102 37.344 12.500 24.453 1.00 28.08 S ATOM 1680 HA CYS A 102 38.225 15.462 22.340 1.00 0.00 H ATOM 1681 HB2 CYS A 102 38.699 13.055 22.550 1.00 0.00 H ATOM 1682 HB3 CYS A 102 36.976 13.379 22.249 1.00 0.00 H ATOM 1683 HG CYS A 102 36.179 13.000 24.998 1.00 0.00 H ATOM 1684 H CYS A 102 39.110 14.414 25.040 1.00 0.00 H ATOM 1685 N PRO A 103 35.703 15.784 23.187 1.00 29.16 N ATOM 1686 CA PRO A 103 34.495 16.270 23.847 1.00 29.59 C ATOM 1687 C PRO A 103 34.037 15.251 24.901 1.00 30.04 C ATOM 1688 O PRO A 103 34.183 14.049 24.696 1.00 28.90 O ATOM 1689 CB PRO A 103 33.484 16.373 22.703 1.00 29.30 C ATOM 1690 CG PRO A 103 34.300 16.451 21.455 1.00 29.49 C ATOM 1691 CD PRO A 103 35.524 15.617 21.734 1.00 28.65 C ATOM 1692 HA PRO A 103 34.629 17.217 24.370 1.00 0.00 H ATOM 1693 HD3 PRO A 103 35.355 14.572 21.476 1.00 0.00 H ATOM 1694 HD2 PRO A 103 36.389 15.991 21.185 1.00 0.00 H ATOM 1695 HG3 PRO A 103 34.580 17.483 21.244 1.00 0.00 H ATOM 1696 HG2 PRO A 103 33.745 16.046 20.609 1.00 0.00 H ATOM 1697 HB2 PRO A 103 32.840 15.494 22.683 1.00 0.00 H ATOM 1698 HB3 PRO A 103 32.872 17.268 22.815 1.00 0.00 H ATOM 1699 N GLY A 104 33.506 15.733 26.023 1.00 30.50 N ATOM 1700 CA GLY A 104 33.067 14.864 27.125 1.00 31.67 C ATOM 1701 C GLY A 104 32.181 13.701 26.689 1.00 32.36 C ATOM 1702 O GLY A 104 32.282 12.594 27.234 1.00 33.04 O ATOM 1703 HA3 GLY A 104 32.509 15.471 27.838 1.00 0.00 H ATOM 1704 HA2 GLY A 104 33.952 14.456 27.612 1.00 0.00 H ATOM 1705 H GLY A 104 33.398 16.762 26.124 1.00 0.00 H ATOM 1706 N ASP A 105 31.336 13.943 25.689 1.00 32.72 N ATOM 1707 CA ASP A 105 30.441 12.916 25.157 1.00 33.43 C ATOM 1708 C ASP A 105 31.124 11.864 24.276 1.00 32.86 C ATOM 1709 O ASP A 105 30.470 10.917 23.822 1.00 33.42 O ATOM 1710 CB ASP A 105 29.270 13.563 24.422 1.00 34.57 C ATOM 1711 CG ASP A 105 28.349 14.328 25.367 1.00 36.85 C ATOM 1712 OD1 ASP A 105 28.702 14.458 26.567 1.00 41.35 O ATOM 1713 OD2 ASP A 105 27.274 14.804 24.927 1.00 40.55 O ATOM 1714 HA ASP A 105 30.077 12.365 26.024 1.00 0.00 H ATOM 1715 HB2 ASP A 105 29.662 14.255 23.677 1.00 0.00 H ATOM 1716 HB3 ASP A 105 28.694 12.783 23.924 1.00 0.00 H ATOM 1717 H ASP A 105 31.312 14.895 25.272 1.00 0.00 H ATOM 1718 N ASP A 106 32.428 12.030 24.039 1.00 31.47 N ATOM 1719 CA ASP A 106 33.218 11.046 23.299 1.00 29.78 C ATOM 1720 C ASP A 106 34.029 10.133 24.226 1.00 28.61 C ATOM 1721 O ASP A 106 34.571 9.122 23.785 1.00 27.50 O ATOM 1722 CB ASP A 106 34.141 11.729 22.277 1.00 29.78 C ATOM 1723 CG ASP A 106 33.430 12.114 20.997 1.00 31.35 C ATOM 1724 OD1 ASP A 106 32.195 11.903 20.893 1.00 34.52 O ATOM 1725 OD2 ASP A 106 34.106 12.619 20.070 1.00 31.08 O ATOM 1726 HA ASP A 106 32.508 10.417 22.762 1.00 0.00 H ATOM 1727 HB2 ASP A 106 34.553 12.631 22.730 1.00 0.00 H ATOM 1728 HB3 ASP A 106 34.953 11.044 22.031 1.00 0.00 H ATOM 1729 H ASP A 106 32.898 12.888 24.393 1.00 0.00 H ATOM 1730 N LYS A 107 34.111 10.487 25.507 1.00 27.61 N ATOM 1731 CA LYS A 107 34.902 9.732 26.490 1.00 26.97 C ATOM 1732 C LYS A 107 34.475 8.268 26.638 1.00 26.86 C ATOM 1733 O LYS A 107 35.325 7.371 26.665 1.00 25.69 O ATOM 1734 CB LYS A 107 34.961 10.474 27.842 1.00 27.50 C ATOM 1735 CG LYS A 107 36.177 11.368 27.892 1.00 30.69 C ATOM 1736 CD LYS A 107 36.141 12.414 28.976 1.00 33.54 C ATOM 1737 CE LYS A 107 37.309 13.389 28.815 1.00 35.34 C ATOM 1738 NZ LYS A 107 37.236 14.256 27.592 1.00 32.94 N ATOM 1739 HA LYS A 107 35.916 9.682 26.094 1.00 0.00 H ATOM 1740 HB2 LYS A 107 34.063 11.080 27.960 1.00 0.00 H ATOM 1741 HB3 LYS A 107 35.015 9.746 28.651 1.00 0.00 H ATOM 1742 HG2 LYS A 107 37.054 10.741 28.053 1.00 0.00 H ATOM 1743 HG3 LYS A 107 36.266 11.876 26.932 1.00 0.00 H ATOM 1744 HD2 LYS A 107 35.202 12.964 28.914 1.00 0.00 H ATOM 1745 HD3 LYS A 107 36.211 11.927 29.948 1.00 0.00 H ATOM 1746 HE2 LYS A 107 38.231 12.810 28.767 1.00 0.00 H ATOM 1747 HE3 LYS A 107 37.334 14.038 29.691 1.00 0.00 H ATOM 1748 HZ1 LYS A 107 37.225 13.655 26.743 1.00 0.00 H ATOM 1749 HZ2 LYS A 107 36.368 14.828 27.625 1.00 0.00 H ATOM 1750 HZ3 LYS A 107 38.065 14.883 27.563 1.00 0.00 H ATOM 1751 H LYS A 107 33.595 11.332 25.825 1.00 0.00 H ATOM 1752 N SER A 108 33.161 8.029 26.681 1.00 26.48 N ATOM 1753 CA SER A 108 32.614 6.676 26.741 1.00 26.25 C ATOM 1754 C SER A 108 33.057 5.826 25.551 1.00 25.60 C ATOM 1755 O SER A 108 33.192 4.619 25.681 1.00 26.07 O ATOM 1756 CB SER A 108 31.078 6.715 26.825 1.00 26.23 C ATOM 1757 OG SER A 108 30.536 7.259 25.637 1.00 28.21 O ATOM 1758 HA SER A 108 33.008 6.209 27.644 1.00 0.00 H ATOM 1759 HB2 SER A 108 30.779 7.332 27.673 1.00 0.00 H ATOM 1760 HB3 SER A 108 30.699 5.702 26.963 1.00 0.00 H ATOM 1761 HG SER A 108 29.549 7.278 25.705 1.00 0.00 H ATOM 1762 H SER A 108 32.504 8.835 26.671 1.00 0.00 H ATOM 1763 N LYS A 109 33.283 6.461 24.401 1.00 24.79 N ATOM 1764 CA LYS A 109 33.729 5.740 23.193 1.00 24.63 C ATOM 1765 C LYS A 109 35.149 5.198 23.351 1.00 24.13 C ATOM 1766 O LYS A 109 35.458 4.110 22.867 1.00 24.99 O ATOM 1767 CB LYS A 109 33.644 6.623 21.940 1.00 24.88 C ATOM 1768 CG LYS A 109 32.196 7.093 21.636 1.00 26.86 C ATOM 1769 CD LYS A 109 32.125 7.894 20.350 1.00 28.29 C ATOM 1770 CE LYS A 109 30.699 8.476 20.167 1.00 28.94 C ATOM 1771 NZ LYS A 109 30.442 9.711 20.960 1.00 33.02 N ATOM 1772 HA LYS A 109 33.049 4.897 23.067 1.00 0.00 H ATOM 1773 HB2 LYS A 109 34.272 7.501 22.089 1.00 0.00 H ATOM 1774 HB3 LYS A 109 34.013 6.054 21.086 1.00 0.00 H ATOM 1775 HG2 LYS A 109 31.552 6.218 21.544 1.00 0.00 H ATOM 1776 HG3 LYS A 109 31.846 7.715 22.460 1.00 0.00 H ATOM 1777 HD2 LYS A 109 32.846 8.710 20.392 1.00 0.00 H ATOM 1778 HD3 LYS A 109 32.362 7.245 19.507 1.00 0.00 H ATOM 1779 HE2 LYS A 109 29.977 7.717 20.470 1.00 0.00 H ATOM 1780 HE3 LYS A 109 30.557 8.710 19.112 1.00 0.00 H ATOM 1781 HZ1 LYS A 109 30.562 9.503 21.972 1.00 0.00 H ATOM 1782 HZ2 LYS A 109 31.115 10.451 20.675 1.00 0.00 H ATOM 1783 HZ3 LYS A 109 29.471 10.038 20.785 1.00 0.00 H ATOM 1784 H LYS A 109 33.141 7.490 24.354 1.00 0.00 H ATOM 1785 N ILE A 110 35.994 5.957 24.049 1.00 23.01 N ATOM 1786 CA ILE A 110 37.376 5.536 24.285 1.00 23.16 C ATOM 1787 C ILE A 110 37.388 4.338 25.245 1.00 23.19 C ATOM 1788 O ILE A 110 38.109 3.352 25.048 1.00 23.21 O ATOM 1789 CB ILE A 110 38.219 6.715 24.837 1.00 23.46 C ATOM 1790 CG1 ILE A 110 38.302 7.847 23.798 1.00 24.09 C ATOM 1791 CG2 ILE A 110 39.622 6.230 25.244 1.00 22.99 C ATOM 1792 CD1 ILE A 110 38.938 9.123 24.276 1.00 23.37 C ATOM 1793 HA ILE A 110 37.828 5.228 23.342 1.00 0.00 H ATOM 1794 HB ILE A 110 37.729 7.109 25.727 1.00 0.00 H ATOM 1795 HG12 ILE A 110 38.880 7.482 22.949 1.00 0.00 H ATOM 1796 HG13 ILE A 110 37.288 8.079 23.473 1.00 0.00 H ATOM 1797 HD11 ILE A 110 38.368 9.519 25.116 1.00 0.00 H ATOM 1798 HD12 ILE A 110 39.961 8.921 24.592 1.00 0.00 H ATOM 1799 HD13 ILE A 110 38.944 9.851 23.464 1.00 0.00 H ATOM 1800 HG21 ILE A 110 39.531 5.466 26.017 1.00 0.00 H ATOM 1801 HG22 ILE A 110 40.126 5.810 24.374 1.00 0.00 H ATOM 1802 HG23 ILE A 110 40.198 7.071 25.629 1.00 0.00 H ATOM 1803 H ILE A 110 35.665 6.866 24.433 1.00 0.00 H ATOM 1804 N VAL A 111 36.597 4.438 26.299 1.00 22.61 N ATOM 1805 CA VAL A 111 36.531 3.396 27.312 1.00 22.45 C ATOM 1806 C VAL A 111 36.042 2.097 26.679 1.00 23.09 C ATOM 1807 O VAL A 111 36.530 1.023 27.032 1.00 22.29 O ATOM 1808 CB VAL A 111 35.673 3.835 28.511 1.00 23.07 C ATOM 1809 CG1 VAL A 111 35.525 2.710 29.538 1.00 25.24 C ATOM 1810 CG2 VAL A 111 36.346 5.022 29.154 1.00 22.06 C ATOM 1811 HA VAL A 111 37.530 3.216 27.710 1.00 0.00 H ATOM 1812 HB VAL A 111 34.673 4.092 28.161 1.00 0.00 H ATOM 1813 HG11 VAL A 111 35.047 1.851 29.068 1.00 0.00 H ATOM 1814 HG12 VAL A 111 36.510 2.423 29.905 1.00 0.00 H ATOM 1815 HG13 VAL A 111 34.913 3.058 30.370 1.00 0.00 H ATOM 1816 HG21 VAL A 111 37.343 4.736 29.488 1.00 0.00 H ATOM 1817 HG22 VAL A 111 36.423 5.832 28.428 1.00 0.00 H ATOM 1818 HG23 VAL A 111 35.756 5.353 30.009 1.00 0.00 H ATOM 1819 H VAL A 111 36.005 5.286 26.407 1.00 0.00 H ATOM 1820 N ARG A 112 35.073 2.209 25.760 1.00 22.64 N ATOM 1821 CA ARG A 112 34.577 1.053 25.036 1.00 23.48 C ATOM 1822 C ARG A 112 35.733 0.340 24.306 1.00 22.09 C ATOM 1823 O ARG A 112 35.895 -0.879 24.417 1.00 22.60 O ATOM 1824 CB ARG A 112 33.508 1.490 24.024 1.00 23.98 C ATOM 1825 CG ARG A 112 32.901 0.338 23.221 1.00 26.61 C ATOM 1826 CD ARG A 112 31.672 0.767 22.405 1.00 27.79 C ATOM 1827 NE ARG A 112 30.718 1.417 23.296 1.00 34.02 N ATOM 1828 CZ ARG A 112 30.361 2.698 23.220 1.00 37.74 C ATOM 1829 NH1 ARG A 112 30.840 3.474 22.250 1.00 38.85 N ATOM 1830 NH2 ARG A 112 29.503 3.194 24.101 1.00 39.02 N ATOM 1831 HA ARG A 112 34.133 0.358 25.748 1.00 0.00 H ATOM 1832 HB2 ARG A 112 32.706 1.989 24.567 1.00 0.00 H ATOM 1833 HB3 ARG A 112 33.964 2.192 23.326 1.00 0.00 H ATOM 1834 HG2 ARG A 112 33.657 -0.047 22.537 1.00 0.00 H ATOM 1835 HG3 ARG A 112 32.603 -0.450 23.912 1.00 0.00 H ATOM 1836 HD2 ARG A 112 31.210 -0.109 21.950 1.00 0.00 H ATOM 1837 HD3 ARG A 112 31.976 1.463 21.623 1.00 0.00 H ATOM 1838 HE ARG A 112 30.285 0.839 24.044 1.00 0.00 H ATOM 1839 HH12 ARG A 112 30.557 4.473 22.196 1.00 0.00 H ATOM 1840 HH11 ARG A 112 31.497 3.081 21.546 1.00 0.00 H ATOM 1841 HH22 ARG A 112 29.221 4.194 24.046 1.00 0.00 H ATOM 1842 HH21 ARG A 112 29.112 2.584 24.847 1.00 0.00 H ATOM 1843 H ARG A 112 34.667 3.146 25.561 1.00 0.00 H ATOM 1844 N VAL A 113 36.500 1.100 23.545 1.00 21.57 N ATOM 1845 CA VAL A 113 37.643 0.547 22.826 1.00 20.99 C ATOM 1846 C VAL A 113 38.590 -0.164 23.813 1.00 21.52 C ATOM 1847 O VAL A 113 39.025 -1.302 23.565 1.00 21.60 O ATOM 1848 CB VAL A 113 38.369 1.615 22.007 1.00 22.10 C ATOM 1849 CG1 VAL A 113 39.686 1.095 21.464 1.00 22.76 C ATOM 1850 CG2 VAL A 113 37.499 2.055 20.817 1.00 22.60 C ATOM 1851 HA VAL A 113 37.277 -0.190 22.111 1.00 0.00 H ATOM 1852 HB VAL A 113 38.561 2.457 22.672 1.00 0.00 H ATOM 1853 HG11 VAL A 113 40.328 0.798 22.294 1.00 0.00 H ATOM 1854 HG12 VAL A 113 39.498 0.234 20.822 1.00 0.00 H ATOM 1855 HG13 VAL A 113 40.175 1.880 20.887 1.00 0.00 H ATOM 1856 HG21 VAL A 113 37.294 1.194 20.180 1.00 0.00 H ATOM 1857 HG22 VAL A 113 36.560 2.466 21.187 1.00 0.00 H ATOM 1858 HG23 VAL A 113 38.028 2.815 20.243 1.00 0.00 H ATOM 1859 H VAL A 113 36.285 2.114 23.456 1.00 0.00 H ATOM 1860 N LEU A 114 38.867 0.484 24.943 1.00 20.64 N ATOM 1861 CA LEU A 114 39.803 -0.098 25.921 1.00 20.38 C ATOM 1862 C LEU A 114 39.249 -1.381 26.480 1.00 20.65 C ATOM 1863 O LEU A 114 39.993 -2.334 26.661 1.00 21.10 O ATOM 1864 CB LEU A 114 40.101 0.850 27.086 1.00 20.44 C ATOM 1865 CG LEU A 114 40.991 2.030 26.693 1.00 22.77 C ATOM 1866 CD1 LEU A 114 41.032 3.035 27.843 1.00 25.29 C ATOM 1867 CD2 LEU A 114 42.423 1.593 26.332 1.00 24.36 C ATOM 1868 HA LEU A 114 40.732 -0.284 25.383 1.00 0.00 H ATOM 1869 HB2 LEU A 114 39.157 1.240 27.465 1.00 0.00 H ATOM 1870 HB3 LEU A 114 40.602 0.285 27.873 1.00 0.00 H ATOM 1871 HG LEU A 114 40.560 2.487 25.802 1.00 0.00 H ATOM 1872 HD21 LEU A 114 42.878 1.099 27.191 1.00 0.00 H ATOM 1873 HD22 LEU A 114 42.389 0.902 25.490 1.00 0.00 H ATOM 1874 HD23 LEU A 114 43.012 2.469 26.061 1.00 0.00 H ATOM 1875 HD11 LEU A 114 40.023 3.391 28.049 1.00 0.00 H ATOM 1876 HD12 LEU A 114 41.437 2.552 28.732 1.00 0.00 H ATOM 1877 HD13 LEU A 114 41.666 3.877 27.565 1.00 0.00 H ATOM 1878 H LEU A 114 38.421 1.404 25.136 1.00 0.00 H ATOM 1879 N ASN A 115 37.946 -1.402 26.764 1.00 19.93 N ATOM 1880 CA ASN A 115 37.334 -2.583 27.342 1.00 20.83 C ATOM 1881 C ASN A 115 37.438 -3.739 26.341 1.00 19.81 C ATOM 1882 O ASN A 115 37.644 -4.900 26.712 1.00 21.24 O ATOM 1883 CB ASN A 115 35.855 -2.325 27.723 1.00 21.44 C ATOM 1884 CG ASN A 115 35.681 -1.422 28.975 1.00 25.17 C ATOM 1885 OD1 ASN A 115 36.575 -1.275 29.800 1.00 33.86 O ATOM 1886 ND2 ASN A 115 34.507 -0.816 29.088 1.00 30.02 N ATOM 1887 HA ASN A 115 37.863 -2.841 28.259 1.00 0.00 H ATOM 1888 HB2 ASN A 115 35.361 -1.843 26.879 1.00 0.00 H ATOM 1889 HB3 ASN A 115 35.378 -3.285 27.922 1.00 0.00 H ATOM 1890 HD22 ASN A 115 33.773 -0.966 28.367 1.00 0.00 H ATOM 1891 HD21 ASN A 115 34.320 -0.191 29.898 1.00 0.00 H ATOM 1892 H ASN A 115 37.363 -0.563 26.569 1.00 0.00 H ATOM 1893 N LEU A 116 37.273 -3.432 25.058 1.00 19.46 N ATOM 1894 CA LEU A 116 37.353 -4.488 24.058 1.00 20.11 C ATOM 1895 C LEU A 116 38.802 -4.957 23.855 1.00 20.44 C ATOM 1896 O LEU A 116 39.060 -6.169 23.701 1.00 20.89 O ATOM 1897 CB LEU A 116 36.727 -4.034 22.737 1.00 19.91 C ATOM 1898 CG LEU A 116 35.200 -3.856 22.787 1.00 19.54 C ATOM 1899 CD1 LEU A 116 34.751 -3.061 21.551 1.00 21.55 C ATOM 1900 CD2 LEU A 116 34.422 -5.149 22.931 1.00 21.74 C ATOM 1901 HA LEU A 116 36.782 -5.341 24.425 1.00 0.00 H ATOM 1902 HB2 LEU A 116 37.173 -3.079 22.458 1.00 0.00 H ATOM 1903 HB3 LEU A 116 36.959 -4.778 21.975 1.00 0.00 H ATOM 1904 HG LEU A 116 34.970 -3.302 23.697 1.00 0.00 H ATOM 1905 HD21 LEU A 116 34.639 -5.798 22.083 1.00 0.00 H ATOM 1906 HD22 LEU A 116 34.715 -5.647 23.856 1.00 0.00 H ATOM 1907 HD23 LEU A 116 33.355 -4.928 22.958 1.00 0.00 H ATOM 1908 HD11 LEU A 116 35.237 -2.085 21.552 1.00 0.00 H ATOM 1909 HD12 LEU A 116 35.030 -3.606 20.649 1.00 0.00 H ATOM 1910 HD13 LEU A 116 33.669 -2.930 21.578 1.00 0.00 H ATOM 1911 H LEU A 116 37.089 -2.449 24.772 1.00 0.00 H ATOM 1912 N TRP A 117 39.745 -4.025 23.875 1.00 21.36 N ATOM 1913 CA TRP A 117 41.156 -4.415 23.827 1.00 21.05 C ATOM 1914 C TRP A 117 41.522 -5.332 24.994 1.00 21.78 C ATOM 1915 O TRP A 117 42.218 -6.339 24.817 1.00 22.49 O ATOM 1916 CB TRP A 117 42.049 -3.199 23.884 1.00 21.74 C ATOM 1917 CG TRP A 117 42.115 -2.412 22.600 1.00 22.96 C ATOM 1918 CD1 TRP A 117 41.583 -2.735 21.388 1.00 24.06 C ATOM 1919 CD2 TRP A 117 42.802 -1.178 22.431 1.00 22.51 C ATOM 1920 NE1 TRP A 117 41.890 -1.744 20.451 1.00 22.27 N ATOM 1921 CE2 TRP A 117 42.648 -0.785 21.078 1.00 22.19 C ATOM 1922 CE3 TRP A 117 43.548 -0.358 23.300 1.00 22.69 C ATOM 1923 CZ2 TRP A 117 43.206 0.404 20.584 1.00 23.23 C ATOM 1924 CZ3 TRP A 117 44.098 0.828 22.808 1.00 24.09 C ATOM 1925 CH2 TRP A 117 43.942 1.178 21.446 1.00 23.83 C ATOM 1926 HA TRP A 117 41.305 -4.947 22.887 1.00 0.00 H ATOM 1927 HB2 TRP A 117 41.678 -2.540 24.669 1.00 0.00 H ATOM 1928 HB3 TRP A 117 43.058 -3.528 24.134 1.00 0.00 H ATOM 1929 HE1 TRP A 117 41.596 -1.734 19.453 1.00 0.00 H ATOM 1930 HD1 TRP A 117 41.003 -3.634 21.180 1.00 0.00 H ATOM 1931 HZ2 TRP A 117 43.059 0.704 19.546 1.00 0.00 H ATOM 1932 HH2 TRP A 117 44.418 2.085 21.072 1.00 0.00 H ATOM 1933 HZ3 TRP A 117 44.651 1.488 23.477 1.00 0.00 H ATOM 1934 HE3 TRP A 117 43.694 -0.645 24.341 1.00 0.00 H ATOM 1935 H TRP A 117 39.483 -3.020 23.925 1.00 0.00 H ATOM 1936 N GLN A 118 41.001 -5.013 26.175 1.00 20.19 N ATOM 1937 CA GLN A 118 41.273 -5.865 27.342 1.00 20.10 C ATOM 1938 C GLN A 118 40.691 -7.247 27.175 1.00 20.52 C ATOM 1939 O GLN A 118 41.345 -8.264 27.427 1.00 20.88 O ATOM 1940 CB GLN A 118 40.781 -5.235 28.640 1.00 20.11 C ATOM 1941 CG GLN A 118 41.391 -5.998 29.809 1.00 19.43 C ATOM 1942 CD GLN A 118 40.869 -5.634 31.156 1.00 22.10 C ATOM 1943 OE1 GLN A 118 41.555 -5.864 32.154 1.00 23.12 O ATOM 1944 NE2 GLN A 118 39.633 -5.126 31.223 1.00 20.02 N ATOM 1945 HA GLN A 118 42.357 -5.958 27.406 1.00 0.00 H ATOM 1946 HB2 GLN A 118 41.089 -4.190 28.682 1.00 0.00 H ATOM 1947 HB3 GLN A 118 39.694 -5.294 28.689 1.00 0.00 H ATOM 1948 HG2 GLN A 118 41.203 -7.060 29.652 1.00 0.00 H ATOM 1949 HG3 GLN A 118 42.466 -5.816 29.805 1.00 0.00 H ATOM 1950 HE22 GLN A 118 39.095 -4.950 30.350 1.00 0.00 H ATOM 1951 HE21 GLN A 118 39.210 -4.907 32.148 1.00 0.00 H ATOM 1952 H GLN A 118 40.405 -4.166 26.273 1.00 0.00 H ATOM 1953 N LYS A 119 39.433 -7.303 26.738 1.00 19.18 N ATOM 1954 CA LYS A 119 38.767 -8.584 26.563 1.00 20.48 C ATOM 1955 C LYS A 119 39.510 -9.487 25.571 1.00 20.12 C ATOM 1956 O LYS A 119 39.566 -10.696 25.764 1.00 20.79 O ATOM 1957 CB LYS A 119 37.302 -8.384 26.142 1.00 20.34 C ATOM 1958 CG LYS A 119 36.541 -9.680 25.874 1.00 20.23 C ATOM 1959 CD LYS A 119 36.633 -10.133 24.403 1.00 20.60 C ATOM 1960 CE LYS A 119 35.929 -11.440 24.197 1.00 23.58 C ATOM 1961 NZ LYS A 119 36.197 -11.953 22.807 1.00 26.43 N ATOM 1962 HA LYS A 119 38.780 -9.092 27.527 1.00 0.00 H ATOM 1963 HB2 LYS A 119 36.789 -7.845 26.938 1.00 0.00 H ATOM 1964 HB3 LYS A 119 37.287 -7.785 25.231 1.00 0.00 H ATOM 1965 HG2 LYS A 119 36.955 -10.465 26.507 1.00 0.00 H ATOM 1966 HG3 LYS A 119 35.492 -9.527 26.127 1.00 0.00 H ATOM 1967 HD2 LYS A 119 36.173 -9.376 23.768 1.00 0.00 H ATOM 1968 HD3 LYS A 119 37.682 -10.246 24.130 1.00 0.00 H ATOM 1969 HE2 LYS A 119 34.856 -11.298 24.330 1.00 0.00 H ATOM 1970 HE3 LYS A 119 36.291 -12.165 24.926 1.00 0.00 H ATOM 1971 HZ1 LYS A 119 35.850 -11.262 22.111 1.00 0.00 H ATOM 1972 HZ2 LYS A 119 37.220 -12.090 22.681 1.00 0.00 H ATOM 1973 HZ3 LYS A 119 35.705 -12.859 22.673 1.00 0.00 H ATOM 1974 H LYS A 119 38.923 -6.423 26.520 1.00 0.00 H ATOM 1975 N ASN A 120 40.078 -8.870 24.529 1.00 21.32 N ATOM 1976 CA ASN A 120 40.789 -9.582 23.485 1.00 23.26 C ATOM 1977 C ASN A 120 42.314 -9.626 23.678 1.00 24.49 C ATOM 1978 O ASN A 120 43.035 -10.077 22.778 1.00 25.26 O ATOM 1979 CB ASN A 120 40.449 -8.957 22.134 1.00 24.15 C ATOM 1980 CG ASN A 120 39.025 -9.257 21.705 1.00 21.80 C ATOM 1981 OD1 ASN A 120 38.658 -10.410 21.460 1.00 24.40 O ATOM 1982 ND2 ASN A 120 38.210 -8.210 21.626 1.00 25.63 N ATOM 1983 HA ASN A 120 40.457 -10.619 23.532 1.00 0.00 H ATOM 1984 HB2 ASN A 120 40.574 -7.877 22.205 1.00 0.00 H ATOM 1985 HB3 ASN A 120 41.133 -9.352 21.382 1.00 0.00 H ATOM 1986 HD22 ASN A 120 38.565 -7.257 21.842 1.00 0.00 H ATOM 1987 HD21 ASN A 120 37.217 -8.344 21.348 1.00 0.00 H ATOM 1988 H ASN A 120 40.007 -7.834 24.465 1.00 0.00 H ATOM 1989 N ASN A 121 42.786 -9.193 24.850 1.00 25.37 N ATOM 1990 CA ASN A 121 44.233 -9.145 25.170 1.00 26.53 C ATOM 1991 C ASN A 121 45.106 -8.502 24.080 1.00 27.15 C ATOM 1992 O ASN A 121 46.191 -9.000 23.731 1.00 27.91 O ATOM 1993 CB ASN A 121 44.753 -10.533 25.562 1.00 27.83 C ATOM 1994 CG ASN A 121 44.242 -10.976 26.906 1.00 29.19 C ATOM 1995 OD1 ASN A 121 43.392 -11.860 26.989 1.00 35.84 O ATOM 1996 ND2 ASN A 121 44.749 -10.362 27.977 1.00 31.23 N ATOM 1997 HA ASN A 121 44.321 -8.479 26.028 1.00 0.00 H ATOM 1998 HB2 ASN A 121 44.432 -11.253 24.810 1.00 0.00 H ATOM 1999 HB3 ASN A 121 45.842 -10.504 25.593 1.00 0.00 H ATOM 2000 HD22 ASN A 121 45.467 -9.619 27.859 1.00 0.00 H ATOM 2001 HD21 ASN A 121 44.426 -10.627 28.930 1.00 0.00 H ATOM 2002 H ASN A 121 42.108 -8.875 25.571 1.00 0.00 H ATOM 2003 N VAL A 122 44.629 -7.387 23.546 1.00 26.01 N ATOM 2004 CA VAL A 122 45.343 -6.685 22.487 1.00 27.42 C ATOM 2005 C VAL A 122 46.620 -6.069 23.078 1.00 29.13 C ATOM 2006 O VAL A 122 47.672 -6.015 22.412 1.00 31.17 O ATOM 2007 CB VAL A 122 44.417 -5.670 21.803 1.00 25.94 C ATOM 2008 CG1 VAL A 122 45.178 -4.818 20.753 1.00 26.71 C ATOM 2009 CG2 VAL A 122 43.266 -6.385 21.163 1.00 26.37 C ATOM 2010 HA VAL A 122 45.653 -7.372 21.699 1.00 0.00 H ATOM 2011 HB VAL A 122 44.040 -4.988 22.565 1.00 0.00 H ATOM 2012 HG11 VAL A 122 45.984 -4.272 21.244 1.00 0.00 H ATOM 2013 HG12 VAL A 122 45.595 -5.473 19.988 1.00 0.00 H ATOM 2014 HG13 VAL A 122 44.488 -4.112 20.291 1.00 0.00 H ATOM 2015 HG21 VAL A 122 43.644 -7.087 20.420 1.00 0.00 H ATOM 2016 HG22 VAL A 122 42.707 -6.927 21.926 1.00 0.00 H ATOM 2017 HG23 VAL A 122 42.613 -5.659 20.679 1.00 0.00 H ATOM 2018 H VAL A 122 43.725 -7.004 23.890 1.00 0.00 H ATOM 2019 N PHE A 123 46.503 -5.573 24.306 1.00 29.85 N ATOM 2020 CA PHE A 123 47.640 -5.095 25.078 1.00 30.69 C ATOM 2021 C PHE A 123 47.662 -5.804 26.429 1.00 31.71 C ATOM 2022 O PHE A 123 46.622 -6.225 26.943 1.00 31.60 O ATOM 2023 CB PHE A 123 47.553 -3.565 25.262 1.00 30.61 C ATOM 2024 CG PHE A 123 47.620 -2.788 23.982 1.00 28.86 C ATOM 2025 CD1 PHE A 123 48.853 -2.449 23.414 1.00 29.68 C ATOM 2026 CD2 PHE A 123 46.460 -2.395 23.306 1.00 29.98 C ATOM 2027 CE1 PHE A 123 48.916 -1.737 22.235 1.00 26.41 C ATOM 2028 CE2 PHE A 123 46.520 -1.683 22.106 1.00 30.08 C ATOM 2029 CZ PHE A 123 47.774 -1.342 21.562 1.00 28.81 C ATOM 2030 HA PHE A 123 48.565 -5.318 24.546 1.00 0.00 H ATOM 2031 HB2 PHE A 123 46.609 -3.333 25.754 1.00 0.00 H ATOM 2032 HB3 PHE A 123 48.380 -3.249 25.898 1.00 0.00 H ATOM 2033 HD2 PHE A 123 45.487 -2.650 23.726 1.00 0.00 H ATOM 2034 HE2 PHE A 123 45.603 -1.393 21.594 1.00 0.00 H ATOM 2035 HZ PHE A 123 47.843 -0.779 20.631 1.00 0.00 H ATOM 2036 HE1 PHE A 123 49.891 -1.479 21.822 1.00 0.00 H ATOM 2037 HD1 PHE A 123 49.775 -2.752 23.910 1.00 0.00 H ATOM 2038 H PHE A 123 45.556 -5.524 24.734 1.00 0.00 H ATOM 2039 N LYS A 124 48.857 -5.915 27.007 1.00 32.83 N ATOM 2040 CA LYS A 124 49.051 -6.493 28.329 1.00 34.09 C ATOM 2041 C LYS A 124 48.389 -5.621 29.399 1.00 33.78 C ATOM 2042 O LYS A 124 48.216 -4.419 29.193 1.00 33.27 O ATOM 2043 CB LYS A 124 50.553 -6.642 28.616 1.00 35.37 C ATOM 2044 CG LYS A 124 51.332 -7.336 27.495 1.00 38.65 C ATOM 2045 CD LYS A 124 52.616 -7.981 28.005 1.00 42.98 C ATOM 2046 CE LYS A 124 53.153 -8.986 26.981 1.00 45.14 C ATOM 2047 NZ LYS A 124 54.490 -9.541 27.357 1.00 46.97 N ATOM 2048 HA LYS A 124 48.585 -7.478 28.354 1.00 0.00 H ATOM 2049 HB2 LYS A 124 50.975 -5.648 28.763 1.00 0.00 H ATOM 2050 HB3 LYS A 124 50.672 -7.225 29.529 1.00 0.00 H ATOM 2051 HG2 LYS A 124 50.701 -8.108 27.054 1.00 0.00 H ATOM 2052 HG3 LYS A 124 51.587 -6.598 26.734 1.00 0.00 H ATOM 2053 HD2 LYS A 124 53.364 -7.207 28.175 1.00 0.00 H ATOM 2054 HD3 LYS A 124 52.411 -8.498 28.942 1.00 0.00 H ATOM 2055 HE2 LYS A 124 53.242 -8.486 26.016 1.00 0.00 H ATOM 2056 HE3 LYS A 124 52.445 -9.810 26.898 1.00 0.00 H ATOM 2057 HZ1 LYS A 124 55.178 -8.765 27.431 1.00 0.00 H ATOM 2058 HZ2 LYS A 124 54.416 -10.029 28.272 1.00 0.00 H ATOM 2059 HZ3 LYS A 124 54.802 -10.214 26.628 1.00 0.00 H ATOM 2060 H LYS A 124 49.691 -5.572 26.489 1.00 0.00 H ATOM 2061 N SER A 125 48.030 -6.223 30.532 1.00 32.85 N ATOM 2062 CA SER A 125 47.290 -5.521 31.594 1.00 31.97 C ATOM 2063 C SER A 125 48.039 -4.279 32.093 1.00 31.26 C ATOM 2064 O SER A 125 47.431 -3.278 32.475 1.00 30.46 O ATOM 2065 CB SER A 125 47.013 -6.467 32.769 1.00 32.47 C ATOM 2066 OG SER A 125 46.339 -5.798 33.828 1.00 34.27 O ATOM 2067 HA SER A 125 46.345 -5.190 31.162 1.00 0.00 H ATOM 2068 HB2 SER A 125 47.960 -6.857 33.142 1.00 0.00 H ATOM 2069 HB3 SER A 125 46.394 -7.293 32.421 1.00 0.00 H ATOM 2070 HG SER A 125 46.899 -5.049 34.153 1.00 0.00 H ATOM 2071 H SER A 125 48.281 -7.223 30.671 1.00 0.00 H ATOM 2072 N GLU A 126 49.362 -4.366 32.096 1.00 30.66 N ATOM 2073 CA GLU A 126 50.183 -3.268 32.580 1.00 30.22 C ATOM 2074 C GLU A 126 50.096 -2.045 31.673 1.00 29.10 C ATOM 2075 O GLU A 126 50.480 -0.949 32.100 1.00 28.00 O ATOM 2076 CB GLU A 126 51.631 -3.707 32.728 1.00 31.36 C ATOM 2077 CG GLU A 126 52.299 -4.057 31.426 1.00 33.63 C ATOM 2078 CD GLU A 126 53.548 -4.871 31.644 1.00 38.20 C ATOM 2079 OE1 GLU A 126 54.153 -4.768 32.738 1.00 39.96 O ATOM 2080 OE2 GLU A 126 53.907 -5.622 30.718 1.00 41.40 O ATOM 2081 HA GLU A 126 49.794 -2.983 33.557 1.00 0.00 H ATOM 2082 HB2 GLU A 126 52.190 -2.895 33.193 1.00 0.00 H ATOM 2083 HB3 GLU A 126 51.660 -4.584 33.375 1.00 0.00 H ATOM 2084 HG2 GLU A 126 51.604 -4.632 30.815 1.00 0.00 H ATOM 2085 HG3 GLU A 126 52.563 -3.137 30.905 1.00 0.00 H ATOM 2086 H GLU A 126 49.819 -5.232 31.747 1.00 0.00 H ATOM 2087 N ILE A 127 49.616 -2.255 30.445 1.00 28.21 N ATOM 2088 CA ILE A 127 49.329 -1.156 29.508 1.00 27.91 C ATOM 2089 C ILE A 127 47.858 -0.757 29.621 1.00 27.35 C ATOM 2090 O ILE A 127 47.541 0.412 29.780 1.00 26.06 O ATOM 2091 CB ILE A 127 49.660 -1.522 28.022 1.00 28.54 C ATOM 2092 CG1 ILE A 127 51.159 -1.813 27.836 1.00 30.97 C ATOM 2093 CG2 ILE A 127 49.158 -0.425 27.057 1.00 29.02 C ATOM 2094 CD1 ILE A 127 52.113 -0.598 27.990 1.00 34.53 C ATOM 2095 HA ILE A 127 49.974 -0.322 29.785 1.00 0.00 H ATOM 2096 HB ILE A 127 49.127 -2.440 27.774 1.00 0.00 H ATOM 2097 HG12 ILE A 127 51.448 -2.560 28.575 1.00 0.00 H ATOM 2098 HG13 ILE A 127 51.298 -2.222 26.835 1.00 0.00 H ATOM 2099 HD11 ILE A 127 51.857 0.159 27.249 1.00 0.00 H ATOM 2100 HD12 ILE A 127 52.007 -0.179 28.991 1.00 0.00 H ATOM 2101 HD13 ILE A 127 53.142 -0.924 27.838 1.00 0.00 H ATOM 2102 HG21 ILE A 127 48.078 -0.319 27.159 1.00 0.00 H ATOM 2103 HG22 ILE A 127 49.642 0.521 27.301 1.00 0.00 H ATOM 2104 HG23 ILE A 127 49.401 -0.705 26.032 1.00 0.00 H ATOM 2105 H ILE A 127 49.438 -3.233 30.138 1.00 0.00 H ATOM 2106 N ILE A 128 46.948 -1.730 29.537 1.00 26.05 N ATOM 2107 CA ILE A 128 45.512 -1.423 29.599 1.00 26.69 C ATOM 2108 C ILE A 128 45.062 -0.740 30.888 1.00 25.10 C ATOM 2109 O ILE A 128 44.307 0.226 30.840 1.00 24.49 O ATOM 2110 CB ILE A 128 44.607 -2.671 29.304 1.00 27.86 C ATOM 2111 CG1 ILE A 128 44.615 -3.019 27.815 1.00 30.23 C ATOM 2112 CG2 ILE A 128 43.180 -2.439 29.804 1.00 28.79 C ATOM 2113 CD1 ILE A 128 43.929 -1.995 26.881 1.00 32.01 C ATOM 2114 HA ILE A 128 45.374 -0.697 28.798 1.00 0.00 H ATOM 2115 HB ILE A 128 45.022 -3.521 29.846 1.00 0.00 H ATOM 2116 HG12 ILE A 128 45.654 -3.116 27.500 1.00 0.00 H ATOM 2117 HG13 ILE A 128 44.108 -3.976 27.692 1.00 0.00 H ATOM 2118 HD11 ILE A 128 42.882 -1.891 27.165 1.00 0.00 H ATOM 2119 HD12 ILE A 128 44.429 -1.031 26.972 1.00 0.00 H ATOM 2120 HD13 ILE A 128 43.995 -2.344 25.851 1.00 0.00 H ATOM 2121 HG21 ILE A 128 43.197 -2.264 30.880 1.00 0.00 H ATOM 2122 HG22 ILE A 128 42.756 -1.570 29.300 1.00 0.00 H ATOM 2123 HG23 ILE A 128 42.573 -3.318 29.588 1.00 0.00 H ATOM 2124 H ILE A 128 47.259 -2.716 29.426 1.00 0.00 H ATOM 2125 N GLN A 129 45.514 -1.223 32.050 1.00 23.97 N ATOM 2126 CA GLN A 129 45.062 -0.652 33.313 1.00 23.70 C ATOM 2127 C GLN A 129 45.350 0.848 33.459 1.00 23.38 C ATOM 2128 O GLN A 129 44.460 1.614 33.813 1.00 22.64 O ATOM 2129 CB GLN A 129 45.603 -1.426 34.518 1.00 24.38 C ATOM 2130 CG GLN A 129 44.878 -1.070 35.793 1.00 24.62 C ATOM 2131 CD GLN A 129 43.378 -1.298 35.690 1.00 26.15 C ATOM 2132 OE1 GLN A 129 42.931 -2.393 35.317 1.00 25.45 O ATOM 2133 NE2 GLN A 129 42.596 -0.267 36.024 1.00 26.19 N ATOM 2134 HA GLN A 129 43.977 -0.754 33.293 1.00 0.00 H ATOM 2135 HB2 GLN A 129 45.485 -2.494 34.332 1.00 0.00 H ATOM 2136 HB3 GLN A 129 46.661 -1.194 34.639 1.00 0.00 H ATOM 2137 HG2 GLN A 129 45.271 -1.685 36.603 1.00 0.00 H ATOM 2138 HG3 GLN A 129 45.058 -0.018 36.016 1.00 0.00 H ATOM 2139 HE22 GLN A 129 43.022 0.631 36.331 1.00 0.00 H ATOM 2140 HE21 GLN A 129 41.561 -0.362 35.977 1.00 0.00 H ATOM 2141 H GLN A 129 46.192 -2.011 32.053 1.00 0.00 H ATOM 2142 N PRO A 130 46.614 1.286 33.189 1.00 23.50 N ATOM 2143 CA PRO A 130 46.848 2.727 33.250 1.00 23.28 C ATOM 2144 C PRO A 130 45.934 3.528 32.324 1.00 21.64 C ATOM 2145 O PRO A 130 45.486 4.607 32.727 1.00 22.30 O ATOM 2146 CB PRO A 130 48.298 2.867 32.769 1.00 23.56 C ATOM 2147 CG PRO A 130 48.929 1.588 33.078 1.00 25.13 C ATOM 2148 CD PRO A 130 47.857 0.544 32.921 1.00 24.15 C ATOM 2149 HA PRO A 130 46.654 3.113 34.251 1.00 0.00 H ATOM 2150 HD3 PRO A 130 47.857 0.134 31.911 1.00 0.00 H ATOM 2151 HD2 PRO A 130 47.991 -0.264 33.640 1.00 0.00 H ATOM 2152 HG3 PRO A 130 49.308 1.590 34.100 1.00 0.00 H ATOM 2153 HG2 PRO A 130 49.750 1.394 32.388 1.00 0.00 H ATOM 2154 HB2 PRO A 130 48.328 3.059 31.697 1.00 0.00 H ATOM 2155 HB3 PRO A 130 48.799 3.678 33.297 1.00 0.00 H ATOM 2156 N LEU A 131 45.621 2.984 31.143 1.00 21.78 N ATOM 2157 CA LEU A 131 44.749 3.684 30.196 1.00 21.04 C ATOM 2158 C LEU A 131 43.319 3.775 30.765 1.00 22.22 C ATOM 2159 O LEU A 131 42.667 4.821 30.672 1.00 21.86 O ATOM 2160 CB LEU A 131 44.766 3.010 28.826 1.00 21.06 C ATOM 2161 CG LEU A 131 46.151 2.930 28.163 1.00 20.11 C ATOM 2162 CD1 LEU A 131 46.099 2.204 26.843 1.00 24.74 C ATOM 2163 CD2 LEU A 131 46.707 4.328 27.995 1.00 22.34 C ATOM 2164 HA LEU A 131 45.127 4.697 30.057 1.00 0.00 H ATOM 2165 HB2 LEU A 131 44.387 1.995 28.943 1.00 0.00 H ATOM 2166 HB3 LEU A 131 44.105 3.570 28.164 1.00 0.00 H ATOM 2167 HG LEU A 131 46.813 2.355 28.810 1.00 0.00 H ATOM 2168 HD21 LEU A 131 46.034 4.912 27.367 1.00 0.00 H ATOM 2169 HD22 LEU A 131 46.797 4.802 28.972 1.00 0.00 H ATOM 2170 HD23 LEU A 131 47.689 4.273 27.525 1.00 0.00 H ATOM 2171 HD11 LEU A 131 45.736 1.189 27.002 1.00 0.00 H ATOM 2172 HD12 LEU A 131 45.425 2.730 26.167 1.00 0.00 H ATOM 2173 HD13 LEU A 131 47.098 2.170 26.409 1.00 0.00 H ATOM 2174 H LEU A 131 46.003 2.049 30.893 1.00 0.00 H ATOM 2175 N LEU A 132 42.861 2.687 31.382 1.00 21.77 N ATOM 2176 CA LEU A 132 41.574 2.687 32.069 1.00 23.46 C ATOM 2177 C LEU A 132 41.560 3.650 33.263 1.00 22.85 C ATOM 2178 O LEU A 132 40.613 4.401 33.473 1.00 23.93 O ATOM 2179 CB LEU A 132 41.225 1.265 32.521 1.00 23.45 C ATOM 2180 CG LEU A 132 40.879 0.259 31.422 1.00 26.12 C ATOM 2181 CD1 LEU A 132 40.855 -1.160 32.010 1.00 24.68 C ATOM 2182 CD2 LEU A 132 39.510 0.574 30.806 1.00 25.59 C ATOM 2183 HA LEU A 132 40.820 3.038 31.365 1.00 0.00 H ATOM 2184 HB2 LEU A 132 42.081 0.873 33.070 1.00 0.00 H ATOM 2185 HB3 LEU A 132 40.367 1.332 33.189 1.00 0.00 H ATOM 2186 HG LEU A 132 41.638 0.327 30.643 1.00 0.00 H ATOM 2187 HD21 LEU A 132 38.745 0.526 31.581 1.00 0.00 H ATOM 2188 HD22 LEU A 132 39.529 1.575 30.374 1.00 0.00 H ATOM 2189 HD23 LEU A 132 39.287 -0.155 30.027 1.00 0.00 H ATOM 2190 HD11 LEU A 132 41.835 -1.397 32.423 1.00 0.00 H ATOM 2191 HD12 LEU A 132 40.105 -1.212 32.799 1.00 0.00 H ATOM 2192 HD13 LEU A 132 40.608 -1.874 31.224 1.00 0.00 H ATOM 2193 H LEU A 132 43.433 1.819 31.374 1.00 0.00 H ATOM 2194 N ASP A 133 42.643 3.642 34.034 1.00 23.25 N ATOM 2195 CA ASP A 133 42.795 4.548 35.166 1.00 22.66 C ATOM 2196 C ASP A 133 42.699 6.020 34.744 1.00 21.98 C ATOM 2197 O ASP A 133 42.146 6.841 35.464 1.00 22.86 O ATOM 2198 CB ASP A 133 44.141 4.303 35.859 1.00 23.93 C ATOM 2199 CG ASP A 133 44.228 2.940 36.556 1.00 25.46 C ATOM 2200 OD1 ASP A 133 43.187 2.304 36.801 1.00 25.99 O ATOM 2201 OD2 ASP A 133 45.366 2.506 36.844 1.00 30.06 O ATOM 2202 HA ASP A 133 41.977 4.343 35.856 1.00 0.00 H ATOM 2203 HB2 ASP A 133 44.931 4.359 35.110 1.00 0.00 H ATOM 2204 HB3 ASP A 133 44.293 5.083 36.605 1.00 0.00 H ATOM 2205 H ASP A 133 43.406 2.968 33.823 1.00 0.00 H ATOM 2206 N MET A 134 43.284 6.346 33.584 1.00 21.76 N ATOM 2207 CA MET A 134 43.214 7.697 33.035 1.00 22.62 C ATOM 2208 C MET A 134 41.783 8.178 32.738 1.00 22.68 C ATOM 2209 O MET A 134 41.447 9.334 32.982 1.00 23.21 O ATOM 2210 CB MET A 134 44.094 7.780 31.779 1.00 21.58 C ATOM 2211 CG MET A 134 45.586 7.731 32.134 1.00 23.52 C ATOM 2212 SD MET A 134 46.649 7.715 30.689 1.00 25.40 S ATOM 2213 CE MET A 134 46.125 9.251 29.963 1.00 20.05 C ATOM 2214 HA MET A 134 43.588 8.373 33.803 1.00 0.00 H ATOM 2215 HB2 MET A 134 43.858 6.941 31.124 1.00 0.00 H ATOM 2216 HB3 MET A 134 43.884 8.715 31.260 1.00 0.00 H ATOM 2217 HG2 MET A 134 45.776 6.829 32.715 1.00 0.00 H ATOM 2218 HG3 MET A 134 45.829 8.607 32.735 1.00 0.00 H ATOM 2219 HE1 MET A 134 45.058 9.203 29.744 1.00 0.00 H ATOM 2220 HE2 MET A 134 46.318 10.066 30.661 1.00 0.00 H ATOM 2221 HE3 MET A 134 46.679 9.423 29.040 1.00 0.00 H ATOM 2222 H MET A 134 43.804 5.615 33.058 1.00 0.00 H ATOM 2223 N ALA A 135 40.952 7.285 32.224 1.00 24.49 N ATOM 2224 CA ALA A 135 39.540 7.631 32.008 1.00 25.08 C ATOM 2225 C ALA A 135 38.808 7.894 33.329 1.00 25.28 C ATOM 2226 O ALA A 135 38.079 8.886 33.467 1.00 25.65 O ATOM 2227 CB ALA A 135 38.842 6.541 31.224 1.00 24.81 C ATOM 2228 HA ALA A 135 39.514 8.555 31.430 1.00 0.00 H ATOM 2229 HB1 ALA A 135 39.330 6.421 30.257 1.00 0.00 H ATOM 2230 HB2 ALA A 135 38.897 5.604 31.779 1.00 0.00 H ATOM 2231 HB3 ALA A 135 37.798 6.815 31.074 1.00 0.00 H ATOM 2232 H ALA A 135 41.299 6.337 31.973 1.00 0.00 H ATOM 2233 N ALA A 136 39.036 7.033 34.325 1.00 25.88 N ATOM 2234 CA ALA A 136 38.405 7.178 35.638 1.00 25.95 C ATOM 2235 C ALA A 136 38.814 8.461 36.367 1.00 26.31 C ATOM 2236 O ALA A 136 38.006 9.094 37.040 1.00 26.67 O ATOM 2237 CB ALA A 136 38.697 5.960 36.505 1.00 25.73 C ATOM 2238 HA ALA A 136 37.332 7.251 35.459 1.00 0.00 H ATOM 2239 HB1 ALA A 136 38.305 5.067 36.019 1.00 0.00 H ATOM 2240 HB2 ALA A 136 39.774 5.860 36.637 1.00 0.00 H ATOM 2241 HB3 ALA A 136 38.220 6.085 37.477 1.00 0.00 H ATOM 2242 H ALA A 136 39.682 6.235 34.162 1.00 0.00 H ATOM 2243 N ALA A 137 40.083 8.852 36.216 1.00 26.53 N ATOM 2244 CA ALA A 137 40.593 10.029 36.902 1.00 28.48 C ATOM 2245 C ALA A 137 39.975 11.313 36.344 1.00 29.25 C ATOM 2246 O ALA A 137 39.937 12.331 37.025 1.00 30.48 O ATOM 2247 CB ALA A 137 42.124 10.067 36.829 1.00 27.57 C ATOM 2248 HA ALA A 137 40.303 9.964 37.951 1.00 0.00 H ATOM 2249 HB1 ALA A 137 42.531 9.174 37.303 1.00 0.00 H ATOM 2250 HB2 ALA A 137 42.436 10.100 35.785 1.00 0.00 H ATOM 2251 HB3 ALA A 137 42.489 10.954 37.347 1.00 0.00 H ATOM 2252 H ALA A 137 40.716 8.306 35.598 1.00 0.00 H ATOM 2253 N LEU A 138 39.456 11.243 35.118 1.00 31.27 N ATOM 2254 CA LEU A 138 38.833 12.413 34.496 1.00 32.97 C ATOM 2255 C LEU A 138 37.455 12.775 35.059 1.00 34.60 C ATOM 2256 O LEU A 138 37.153 13.962 35.234 1.00 35.41 O ATOM 2257 CB LEU A 138 38.798 12.274 32.970 1.00 33.08 C ATOM 2258 CG LEU A 138 40.172 12.648 32.402 1.00 33.14 C ATOM 2259 CD1 LEU A 138 40.338 12.174 30.995 1.00 33.75 C ATOM 2260 CD2 LEU A 138 40.449 14.160 32.523 1.00 34.27 C ATOM 2261 HA LEU A 138 39.473 13.255 34.758 1.00 0.00 H ATOM 2262 HB2 LEU A 138 38.559 11.245 32.702 1.00 0.00 H ATOM 2263 HB3 LEU A 138 38.039 12.940 32.560 1.00 0.00 H ATOM 2264 HG LEU A 138 40.917 12.132 33.008 1.00 0.00 H ATOM 2265 HD21 LEU A 138 39.688 14.713 31.972 1.00 0.00 H ATOM 2266 HD22 LEU A 138 40.422 14.450 33.573 1.00 0.00 H ATOM 2267 HD23 LEU A 138 41.433 14.382 32.109 1.00 0.00 H ATOM 2268 HD11 LEU A 138 40.238 11.089 30.964 1.00 0.00 H ATOM 2269 HD12 LEU A 138 39.572 12.629 30.367 1.00 0.00 H ATOM 2270 HD13 LEU A 138 41.325 12.460 30.631 1.00 0.00 H ATOM 2271 H LEU A 138 39.494 10.344 34.596 1.00 0.00 H ATOM 2272 N GLU A 139 36.645 11.757 35.354 1.00 35.82 N ATOM 2273 CA GLU A 139 35.255 11.929 35.832 1.00 37.06 C ATOM 2274 C GLU A 139 35.049 12.959 36.944 1.00 36.91 C ATOM 2275 O GLU A 139 35.936 13.200 37.765 1.00 37.64 O ATOM 2276 CB GLU A 139 34.688 10.584 36.280 1.00 37.34 C ATOM 2277 CG GLU A 139 34.620 9.560 35.162 1.00 39.46 C ATOM 2278 CD GLU A 139 34.628 8.130 35.667 1.00 41.31 C ATOM 2279 OE1 GLU A 139 34.651 7.917 36.899 1.00 42.76 O ATOM 2280 OE2 GLU A 139 34.628 7.216 34.823 1.00 42.30 O ATOM 2281 HA GLU A 139 34.720 12.329 34.971 1.00 0.00 H ATOM 2282 HB2 GLU A 139 35.321 10.188 37.074 1.00 0.00 H ATOM 2283 HB3 GLU A 139 33.681 10.744 36.665 1.00 0.00 H ATOM 2284 HG2 GLU A 139 33.703 9.724 34.596 1.00 0.00 H ATOM 2285 HG3 GLU A 139 35.480 9.702 34.507 1.00 0.00 H ATOM 2286 H GLU A 139 37.010 10.790 35.242 1.00 0.00 H TER 2287 GLU A 139 HETATM 2288 O HOH 1 53.172 12.681 3.264 1.00 41.07 O HETATM 2289 O HOH 2 46.432 16.535 13.220 1.00 31.75 O HETATM 2290 O HOH 3 41.964 18.390 12.761 1.00 25.47 O HETATM 2291 O HOH 4 39.606 19.862 10.202 1.00 39.44 O HETATM 2292 O HOH 5 33.284 9.354 6.594 1.00 39.30 O HETATM 2293 O HOH 6 47.663 -5.849 -5.655 1.00 14.56 O HETATM 2294 O HOH 7 43.924 -2.268 -1.045 1.00 35.50 O HETATM 2295 O HOH 8 43.494 -7.780 31.768 1.00 24.46 O HETATM 2296 O HOH 9 59.232 0.962 9.810 1.00 20.12 O HETATM 2297 O HOH 10 33.777 3.157 20.815 1.00 20.20 O HETATM 2298 O HOH 11 53.654 5.274 26.736 1.00 13.55 O HETATM 2299 O HOH 12 36.680 12.759 19.527 1.00 17.62 O HETATM 2300 O HOH 13 51.888 -6.689 11.550 1.00 18.12 O HETATM 2301 O HOH 14 49.359 -7.763 18.790 1.00 22.70 O HETATM 2302 O HOH 15 49.348 11.304 20.047 1.00 15.21 O HETATM 2303 O HOH 16 50.479 13.937 25.453 1.00 19.29 O HETATM 2304 O HOH 17 46.337 -6.515 2.590 1.00 16.97 O HETATM 2305 O HOH 18 56.564 -3.865 16.582 1.00 17.79 O HETATM 2306 O HOH 19 52.332 -8.821 18.417 1.00 23.51 O HETATM 2307 O HOH 20 44.047 14.042 29.029 1.00 20.88 O HETATM 2308 O HOH 21 41.700 -8.937 15.057 1.00 21.99 O HETATM 2309 O HOH 22 45.840 -3.819 2.889 1.00 17.59 O HETATM 2310 O HOH 23 41.646 6.596 38.265 1.00 24.98 O HETATM 2311 O HOH 24 39.941 -3.736 11.192 1.00 23.79 O HETATM 2312 O HOH 25 34.389 8.100 13.753 1.00 21.02 O HETATM 2313 O HOH 26 55.144 -2.672 3.111 1.00 15.70 O HETATM 2314 O HOH 27 40.133 -2.918 35.493 1.00 26.14 O HETATM 2315 O HOH 28 37.246 -5.050 29.531 1.00 17.81 O HETATM 2316 O HOH 29 44.011 -9.482 33.943 1.00 23.27 O HETATM 2317 O HOH 30 54.879 1.417 27.232 1.00 30.55 O HETATM 2318 O HOH 31 36.762 1.226 1.481 1.00 22.59 O HETATM 2319 O HOH 32 48.746 -8.994 25.144 1.00 35.81 O HETATM 2320 O HOH 33 40.553 -7.777 18.703 1.00 39.81 O HETATM 2321 O HOH 34 39.968 -6.844 0.224 1.00 38.10 O HETATM 2322 O HOH 35 41.643 -4.863 -1.296 1.00 26.63 O HETATM 2323 O HOH 36 53.636 -9.040 10.978 1.00 25.62 O HETATM 2324 O HOH 37 44.573 -5.135 5.068 1.00 14.95 O HETATM 2325 O HOH 38 56.718 4.816 18.578 1.00 22.18 O HETATM 2326 O HOH 39 51.920 14.303 22.424 1.00 22.71 O HETATM 2327 O HOH 40 58.949 6.086 22.227 1.00 28.62 O HETATM 2328 O HOH 41 36.082 -0.150 8.617 1.00 27.83 O HETATM 2329 O HOH 42 44.892 16.511 22.153 1.00 34.56 O HETATM 2330 O HOH 43 41.642 10.390 0.471 1.00 33.12 O HETATM 2331 O HOH 44 44.024 -14.226 8.277 1.00 25.20 O HETATM 2332 O HOH 45 43.444 11.241 33.175 1.00 20.42 O HETATM 2333 O HOH 46 49.987 2.513 1.756 1.00 23.49 O HETATM 2334 O HOH 47 47.232 -3.128 -7.688 1.00 24.76 O HETATM 2335 O HOH 48 43.567 2.196 0.771 1.00 26.00 O HETATM 2336 O HOH 49 38.887 -13.076 24.325 1.00 33.87 O HETATM 2337 O HOH 50 44.771 17.232 11.353 1.00 30.93 O HETATM 2338 O HOH 51 41.971 -5.605 4.297 1.00 23.10 O HETATM 2339 O HOH 52 44.910 12.415 30.995 1.00 19.09 O HETATM 2340 O HOH 53 37.273 -14.378 21.652 1.00 42.65 O HETATM 2341 O HOH 54 59.169 3.337 8.925 1.00 30.96 O HETATM 2342 O HOH 55 46.673 0.014 -8.977 1.00 33.08 O HETATM 2343 O HOH 56 33.405 9.485 16.087 1.00 35.37 O HETATM 2344 O HOH 57 38.257 11.217 0.722 1.00 31.91 O HETATM 2345 O HOH 58 39.066 9.368 -1.461 1.00 39.85 O HETATM 2346 O HOH 59 38.427 -2.196 20.561 1.00 24.13 O HETATM 2347 O HOH 60 50.733 -15.036 15.413 1.00 38.03 O HETATM 2348 O HOH 61 58.576 -5.206 15.049 1.00 29.84 O HETATM 2349 O HOH 62 31.123 10.094 27.266 1.00 31.90 O HETATM 2350 O HOH 63 44.452 14.375 2.642 1.00 31.54 O HETATM 2351 O HOH 64 49.813 -6.800 21.358 1.00 23.88 O HETATM 2352 O HOH 65 50.476 12.784 1.790 1.00 46.33 O HETATM 2353 O HOH 66 52.671 12.625 18.635 1.00 29.86 O HETATM 2354 O HOH 67 41.121 -12.519 27.082 1.00 28.72 O HETATM 2355 O HOH 68 31.922 3.309 27.595 1.00 34.12 O HETATM 2356 O HOH 69 33.899 12.883 17.229 1.00 37.33 O HETATM 2357 O HOH 70 58.533 8.287 19.630 1.00 28.69 O HETATM 2358 O HOH 71 34.338 -0.970 4.535 1.00 30.13 O HETATM 2359 O HOH 72 54.558 -2.886 34.946 1.00 26.71 O HETATM 2360 O HOH 73 55.558 9.475 9.549 1.00 26.36 O HETATM 2361 O HOH 74 37.881 3.163 33.488 1.00 31.27 O HETATM 2362 O HOH 75 56.687 -9.810 13.908 1.00 33.39 O HETATM 2363 O HOH 76 35.942 5.149 33.536 1.00 36.91 O HETATM 2364 O HOH 77 36.217 19.531 17.146 1.00 32.69 O HETATM 2365 O HOH 78 43.634 -10.832 5.642 1.00 25.66 O HETATM 2366 O HOH 79 42.555 -8.308 17.762 1.00 26.67 O HETATM 2367 O HOH 80 46.709 -15.901 15.989 1.00 41.41 O HETATM 2368 O HOH 81 47.204 -11.313 22.213 1.00 44.45 O HETATM 2369 O HOH 82 44.465 -7.484 28.639 1.00 29.79 O HETATM 2370 O HOH 83 59.003 4.475 19.799 1.00 25.20 O HETATM 2371 O HOH 84 32.742 5.760 13.649 1.00 40.64 O HETATM 2372 O HOH 85 43.381 20.814 12.454 1.00 38.58 O HETATM 2373 O HOH 86 41.071 -12.527 2.823 1.00 41.61 O HETATM 2374 O HOH 87 39.112 -8.088 15.809 1.00 47.66 O HETATM 2375 O HOH 88 61.759 4.342 10.029 1.00 47.64 O HETATM 2376 O HOH 89 47.665 1.459 36.542 1.00 47.87 O HETATM 2377 O HOH 90 40.200 8.138 39.822 1.00 31.14 O HETATM 2378 O HOH 91 53.612 13.181 27.200 1.00 24.24 O HETATM 2379 O HOH 92 55.170 -1.255 25.854 1.00 32.80 O HETATM 2380 O HOH 93 44.965 18.860 19.904 1.00 41.05 O HETATM 2381 O HOH 94 55.281 18.065 18.713 1.00 47.51 O HETATM 2382 O HOH 95 39.084 -7.340 6.805 1.00 38.74 O HETATM 2383 O HOH 96 41.077 3.919 -2.273 1.00 41.43 O HETATM 2384 O HOH 97 45.728 1.061 0.041 1.00 37.48 O HETATM 2385 O HOH 98 51.608 -5.168 22.734 1.00 42.34 O HETATM 2386 O HOH 99 39.630 -4.715 5.218 1.00 33.65 O HETATM 2387 O HOH 100 39.588 -2.889 7.407 1.00 41.79 O HETATM 2388 O HOH 101 38.083 -1.260 9.308 1.00 40.40 O HETATM 2389 O HOH 102 34.717 21.112 11.498 1.00 47.85 O HETATM 2390 O HOH 103 48.343 -1.186 36.326 1.00 37.14 O HETATM 2391 O HOH 104 49.211 16.625 12.524 1.00 37.29 O HETATM 2392 O HOH 105 39.131 13.785 0.975 1.00 41.83 O HETATM 2393 O HOH 106 51.299 -4.580 25.325 1.00 42.59 O HETATM 2394 O HOH 107 46.577 21.689 16.107 1.00 47.56 O HETATM 2395 O HOH 108 59.782 -5.595 12.595 1.00 38.27 O HETATM 2396 O HOH 109 61.336 -3.820 0.147 1.00 40.84 O HETATM 2397 O HOH 110 56.749 5.052 15.362 1.00 16.62 O HETATM 2398 O HOH 111 55.969 7.098 16.876 1.00 15.94 O HETATM 2399 O HOH 112 54.423 4.416 19.986 1.00 12.49 O HETATM 2400 O HOH 113 50.480 5.186 20.541 1.00 11.90 O HETATM 2401 O HOH 114 57.612 -2.090 21.394 1.00 26.17 O HETATM 2402 O HOH 115 30.508 2.363 17.984 1.00 50.32 O HETATM 2403 O HOH 116 37.830 -3.218 12.808 1.00 35.16 O HETATM 2404 O HOH 117 27.546 -4.190 16.019 1.00 46.81 O HETATM 2405 N TYR A 118 31.968 3.479 11.513 1.00 0.24 N HETATM 2406 CA TYR A 118 32.883 2.500 12.065 1.00 0.07 C HETATM 2407 C TYR A 118 32.518 2.163 13.500 1.00 0.23 C HETATM 2408 O TYR A 118 32.194 3.048 14.306 1.00 -0.39 O HETATM 2409 N TYR A 118 32.584 0.869 13.794 1.00 -0.26 N HETATM 2410 CA TYR A 118 32.487 0.352 15.152 1.00 0.16 C HETATM 2411 CB TYR A 118 31.193 -0.446 15.324 1.00 0.12 C HETATM 2412 OG TYR A 118 31.205 -1.144 16.554 1.00 -0.27 O HETATM 2413 P TYR A 118 29.835 -0.969 17.375 1.00 0.20 P HETATM 2414 O1P TYR A 118 30.177 -0.991 18.952 1.00 -0.55 O HETATM 2415 O2P TYR A 118 29.107 0.422 16.996 1.00 -0.55 O HETATM 2416 O3P TYR A 118 28.851 -2.189 17.006 1.00 -0.55 O HETATM 2417 H14 TYR A 118 31.099 -1.167 14.499 1.00 0.07 H HETATM 2418 H15 TYR A 118 30.337 0.244 15.307 1.00 0.07 H HETATM 2419 C TYR A 118 33.706 -0.541 15.410 1.00 0.21 C HETATM 2420 O TYR A 118 34.167 -1.229 14.488 1.00 -0.39 O HETATM 2421 N TYR A 118 34.243 -0.523 16.653 1.00 -0.25 N HETATM 2422 CA TYR A 118 35.370 -1.391 17.030 1.00 0.13 C HETATM 2423 C TYR A 118 35.034 -2.890 17.019 1.00 0.20 C HETATM 2424 O TYR A 118 35.039 -3.525 18.070 1.00 -0.39 O HETATM 2425 N TYR A 118 34.779 -3.441 15.832 1.00 -0.26 N HETATM 2426 CA TYR A 118 34.361 -4.845 15.689 1.00 0.16 C HETATM 2427 C TYR A 118 35.424 -5.682 14.976 1.00 0.21 C HETATM 2428 O TYR A 118 36.347 -5.134 14.363 1.00 -0.39 O HETATM 2429 N TYR A 118 35.279 -7.006 15.051 1.00 -0.26 N HETATM 2430 CA TYR A 118 36.221 -7.931 14.421 1.00 0.15 C HETATM 2431 C TYR A 118 36.149 -7.881 12.888 1.00 0.21 C HETATM 2432 O TYR A 118 35.051 -7.860 12.320 1.00 -0.39 O HETATM 2433 N TYR A 118 37.320 -7.857 12.215 1.00 -0.26 N HETATM 2434 CA TYR A 118 37.363 -7.867 10.753 1.00 0.10 C HETATM 2435 C TYR A 118 37.241 -9.274 10.159 1.00 0.06 C HETATM 2436 O TYR A 118 36.849 -10.230 10.881 1.00 -0.57 O HETATM 2437 O36 TYR A 118 37.532 -9.475 8.950 1.00 -0.57 O HETATM 2438 CB TYR A 118 38.748 -7.295 10.455 1.00 -0.02 C HETATM 2439 CG TYR A 118 39.584 -7.777 11.583 1.00 -0.03 C HETATM 2440 CD TYR A 118 38.678 -7.802 12.794 1.00 0.04 C HETATM 2441 H40 TYR A 118 38.876 -8.689 13.414 1.00 0.05 H HETATM 2442 H41 TYR A 118 38.809 -6.894 13.401 1.00 0.05 H HETATM 2443 H38 TYR A 118 40.429 -7.093 11.752 1.00 0.03 H HETATM 2444 H39 TYR A 118 39.966 -8.786 11.371 1.00 0.03 H HETATM 2445 H36 TYR A 118 38.720 -6.196 10.430 1.00 0.03 H HETATM 2446 H37 TYR A 118 39.130 -7.674 9.495 1.00 0.03 H HETATM 2447 H35 TYR A 118 36.569 -7.229 10.338 1.00 0.07 H HETATM 2448 CB TYR A 118 35.988 -9.362 14.926 1.00 0.08 C HETATM 2449 OG TYR A 118 36.887 -10.275 14.322 1.00 -0.39 O HETATM 2450 H34 TYR A 118 36.764 -10.263 13.380 1.00 0.21 H HETATM 2451 H32 TYR A 118 34.957 -9.663 14.687 1.00 0.06 H HETATM 2452 H33 TYR A 118 36.133 -9.385 16.016 1.00 0.06 H HETATM 2453 H31 TYR A 118 37.236 -7.627 14.717 1.00 0.08 H HETATM 2454 H30 TYR A 118 34.500 -7.379 15.555 1.00 0.19 H HETATM 2455 CB TYR A 118 33.026 -4.982 14.908 1.00 0.09 C HETATM 2456 OG1 TYR A 118 33.171 -4.399 13.608 1.00 -0.39 O HETATM 2457 H26 TYR A 118 33.393 -3.480 13.697 1.00 0.21 H HETATM 2458 CG2 TYR A 118 31.874 -4.309 15.647 1.00 -0.03 C HETATM 2459 H27 TYR A 118 30.947 -4.426 15.066 1.00 0.03 H HETATM 2460 H28 TYR A 118 32.095 -3.239 15.773 1.00 0.03 H HETATM 2461 H29 TYR A 118 31.749 -4.777 16.635 1.00 0.03 H HETATM 2462 H25 TYR A 118 32.793 -6.051 14.796 1.00 0.06 H HETATM 2463 H24 TYR A 118 34.215 -5.255 16.699 1.00 0.08 H HETATM 2464 H23 TYR A 118 34.875 -2.880 15.009 1.00 0.19 H HETATM 2465 CB TYR A 118 35.708 -0.931 18.466 1.00 -0.01 C HETATM 2466 CG TYR A 118 34.461 -0.301 18.969 1.00 -0.03 C HETATM 2467 CD TYR A 118 33.835 0.354 17.769 1.00 0.04 C HETATM 2468 H21 TYR A 118 32.740 0.387 17.864 1.00 0.05 H HETATM 2469 H22 TYR A 118 34.222 1.374 17.630 1.00 0.05 H HETATM 2470 H19 TYR A 118 34.692 0.449 19.740 1.00 0.03 H HETATM 2471 H20 TYR A 118 33.787 -1.062 19.388 1.00 0.03 H HETATM 2472 H17 TYR A 118 36.532 -0.203 18.455 1.00 0.03 H HETATM 2473 H18 TYR A 118 35.987 -1.791 19.092 1.00 0.03 H HETATM 2474 H16 TYR A 118 36.221 -1.217 16.355 1.00 0.08 H HETATM 2475 H13 TYR A 118 32.489 1.190 15.865 1.00 0.08 H HETATM 2476 H12 TYR A 118 32.706 0.217 13.045 1.00 0.19 H HETATM 2477 CB TYR A 118 34.334 2.999 12.030 1.00 0.04 C HETATM 2478 CG TYR A 118 35.307 1.990 12.600 1.00 -0.05 C HETATM 2479 CD1 TYR A 118 35.741 0.911 11.832 1.00 -0.07 C HETATM 2480 CE1 TYR A 118 36.625 -0.031 12.358 1.00 -0.04 C HETATM 2481 CZ TYR A 118 37.077 0.106 13.663 1.00 0.08 C HETATM 2482 CE2 TYR A 118 36.654 1.163 14.452 1.00 -0.04 C HETATM 2483 CD2 TYR A 118 35.774 2.097 13.917 1.00 -0.07 C HETATM 2484 H8 TYR A 118 35.442 2.926 14.532 1.00 0.05 H HETATM 2485 H10 TYR A 118 37.005 1.261 15.473 1.00 0.05 H HETATM 2486 OH TYR A 118 37.954 -0.818 14.170 1.00 -0.34 O HETATM 2487 H11 TYR A 118 38.142 -1.472 13.507 1.00 0.25 H HETATM 2488 H9 TYR A 118 36.957 -0.865 11.751 1.00 0.05 H HETATM 2489 H7 TYR A 118 35.387 0.802 10.813 1.00 0.05 H HETATM 2490 H5 TYR A 118 34.403 3.926 12.618 1.00 0.05 H HETATM 2491 H6 TYR A 118 34.611 3.205 10.986 1.00 0.05 H HETATM 2492 H4 TYR A 118 32.812 1.585 11.459 1.00 0.11 H HETATM 2493 H1 TYR A 118 32.231 3.686 10.562 1.00 0.20 H HETATM 2494 H2 TYR A 118 32.007 4.323 12.063 1.00 0.20 H HETATM 2495 H3 TYR A 118 31.030 3.110 11.530 1.00 0.20 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 2405 2406 2493 2494 2495 CONECT 2406 2405 2407 2477 2492 CONECT 2407 2406 2408 2409 CONECT 2408 2407 CONECT 2409 2407 2410 2476 CONECT 2410 2409 2411 2419 2475 CONECT 2411 2410 2412 2417 2418 CONECT 2412 2411 2413 CONECT 2413 2412 2414 2415 2416 CONECT 2414 2413 CONECT 2415 2413 CONECT 2416 2413 CONECT 2417 2411 CONECT 2418 2411 CONECT 2419 2410 2420 2421 CONECT 2420 2419 CONECT 2421 2419 2422 2467 CONECT 2422 2421 2423 2465 2474 CONECT 2423 2422 2424 2425 CONECT 2424 2423 CONECT 2425 2423 2426 2464 CONECT 2426 2425 2427 2455 2463 CONECT 2427 2426 2428 2429 CONECT 2428 2427 CONECT 2429 2427 2430 2454 CONECT 2430 2429 2431 2448 2453 CONECT 2431 2430 2432 2433 CONECT 2432 2431 CONECT 2433 2431 2434 2440 CONECT 2434 2433 2435 2438 2447 CONECT 2435 2434 2436 2437 CONECT 2436 2435 CONECT 2437 2435 CONECT 2438 2434 2439 2445 2446 CONECT 2439 2438 2440 2443 2444 CONECT 2440 2433 2439 2441 2442 CONECT 2441 2440 CONECT 2442 2440 CONECT 2443 2439 CONECT 2444 2439 CONECT 2445 2438 CONECT 2446 2438 CONECT 2447 2434 CONECT 2448 2430 2449 2451 2452 CONECT 2449 2448 2450 CONECT 2450 2449 CONECT 2451 2448 CONECT 2452 2448 CONECT 2453 2430 CONECT 2454 2429 CONECT 2455 2426 2456 2458 2462 CONECT 2456 2455 2457 CONECT 2457 2456 CONECT 2458 2455 2459 2460 2461 CONECT 2459 2458 CONECT 2460 2458 CONECT 2461 2458 CONECT 2462 2455 CONECT 2463 2426 CONECT 2464 2425 CONECT 2465 2422 2466 2472 2473 CONECT 2466 2465 2467 2470 2471 CONECT 2467 2421 2466 2468 2469 CONECT 2468 2467 CONECT 2469 2467 CONECT 2470 2466 CONECT 2471 2466 CONECT 2472 2465 CONECT 2473 2465 CONECT 2474 2422 CONECT 2475 2410 CONECT 2476 2409 CONECT 2477 2406 2478 2490 2491 CONECT 2478 2477 2479 2483 CONECT 2479 2478 2480 2489 CONECT 2480 2479 2481 2488 CONECT 2481 2480 2482 2486 CONECT 2482 2481 2483 2485 CONECT 2483 2478 2482 2484 CONECT 2484 2483 CONECT 2485 2482 CONECT 2486 2481 2487 CONECT 2487 2486 CONECT 2488 2480 CONECT 2489 2479 CONECT 2490 2477 CONECT 2491 2477 CONECT 2492 2406 CONECT 2493 2405 CONECT 2494 2405 CONECT 2495 2405 MASTER 0 0 0 0 0 0 0 0 2494 1 95 11 END
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145aa, >3D9K_1|Chains... *
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145aa, >3D9L_1|Chains... at 100%
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1azg
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14-mer
1bt6
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14-mer
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PDBbind
14-mer
1n5z
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PDBbind
14-mer
1ntv
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PDBbind
14-mer
1oj5
RCSB PDB
PDBbind
14-mer
1oxg
RCSB PDB
PDBbind
14-mer
1sfi
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PDBbind
14-mer
1t29
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PDBbind
14-mer
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14-mer
1xh3
RCSB PDB
PDBbind
14-mer
1xn3
RCSB PDB
PDBbind
14-mer
1y19
RCSB PDB
PDBbind
14-mer
2fci
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PDBbind
14-mer
2fx9
RCSB PDB
PDBbind
14-mer
2hug
RCSB PDB
PDBbind
14-mer
2jnw
RCSB PDB
PDBbind
14-mer
2l0i
RCSB PDB
PDBbind
14-mer
2l6e
RCSB PDB
PDBbind
14-mer
2l75
RCSB PDB
PDBbind
14-mer
2lo6
RCSB PDB
PDBbind
14-mer
2loz
RCSB PDB
PDBbind
14-mer
2ltw
RCSB PDB
PDBbind
14-mer
2n8t
RCSB PDB
PDBbind
14-mer
2oi3
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PDBbind
14-mer
2w2u
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2xl2
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2xl3
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2xrw
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PDBbind
14-mer
2xs0
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PDBbind
14-mer
2y8o
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PDBbind
14-mer
3d9k
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PDBbind
14-mer
3d9l
RCSB PDB
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PDBbind
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3lrh
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3meu
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3pkn
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3rqe
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3wdz
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3wuu
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4aza
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4ch2
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PDBbind
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4ch8
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PDBbind
14-mer
4erq
RCSB PDB
PDBbind
14-mer
4ery
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PDBbind
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4erz
RCSB PDB
PDBbind
14-mer
4es0
RCSB PDB
PDBbind
14-mer
4ewr
RCSB PDB
PDBbind
14-mer
4fi9
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PDBbind
14-mer
4gly
RCSB PDB
PDBbind
14-mer
4gxl
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PDBbind
14-mer
4hgc
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4i7c
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4wv6
RCSB PDB
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14-mer
5aer
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5dpw
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14-mer
5e0l
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PDBbind
14-mer
5eoc
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PDBbind
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5h5s
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PDBbind
14-mer
5ixf
RCSB PDB
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5ly1
RCSB PDB
PDBbind
14-mer
5ly2
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14-mer
5unj
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PDBbind
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5vlh
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PDBbind
14-mer
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PDBbind
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5wbk
RCSB PDB
PDBbind
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5zoo
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14-mer
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
14-mer
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
14-mer
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Entry Information
PDB ID
3d9n
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CTD INTERACTING DOMAIN of RNA processing factor SCAF8
Ligand Name
14-mer
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Kd=90uM
Release Year
2008
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) J.Biol.Chem. Vol. 283: pp. 22659-22669
Ligand Properties
Formula
C
2
9
H
4
5
N
6
O
1
4
P
Molecular Weight
732.673
Exact Mass
732.273
No. of atoms
95
No. of bonds
97
Polar Surface Area
337.06
LOGP Value
-5.52 (
Computed with XLOGP3
)
-3.84 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 22
No. of Nitrogen and Oxygen Atoms: 20
No. of Rings: 3
Canonical SMILES
OC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])COP(O)(O)O
InChI String
InChI=1S/C29H45N6O14P/c1-15(37)23(26(41)31-19(13-36)27(42)35-11-3-5-22(35)29(44)45)33-25(40)21-4-2-10-34(21)28(43)20(14-49-50(46,47)48)32-24(39)18(30)12-16-6-8-17(38)9-7-16/h6-9,15,18-23,36-38,46-48,50H,2-5,10-14,30H2,1H3,(H,31,41)(H,32,39)(H,33,40)(H,44,45)/p+1/t15-,18+,19+,20+,21+,22+,23+/m1/s1
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):
Q9UPN6
P24928
Entrez Gene ID
NCBI Entrez Gene ID:
22828
5430
ASD
Information of known allosteric effects of PDB entries
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