data_16368_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16368
_Entry.PDB_ID 2KKO
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 4 . 1 1 1 A 2 2 ALA H H 2 8.450 7.524 0.926 1
1 5 . 1 1 1 A 2 2 ALA HA H 2 4.390 4.055 0.335 1
1 9 . 1 1 1 A 2 2 ALA C C 2 178.300 178.288 0.012 1
1 10 . 1 1 1 A 2 2 ALA CA C 2 52.500 54.007 -1.507 1
1 11 . 1 1 1 A 2 2 ALA CB C 2 19.200 18.305 0.895 1
1 12 . 1 1 1 A 2 2 ALA N N 2 125.100 121.400 3.700 1
1 13 . 1 1 1 A 3 3 GLY H H 3 8.450 8.636 -0.186 1
1 14 . 1 1 1 A 3 3 GLY HA2 H 3 4.030 3.856 0.174 1
1 15 . 1 1 1 A 3 3 GLY HA3 H 3 4.030 3.856 0.174 1
1 16 . 1 1 1 A 3 3 GLY C C 3 174.100 173.181 0.919 1
1 17 . 1 1 1 A 3 3 GLY CA C 3 45.200 47.471 -2.271 1
1 18 . 1 1 1 A 3 3 GLY N N 3 108.000 113.935 -5.935 1
1 19 . 1 1 1 A 4 4 GLN H H 4 8.550 8.193 0.357 1
1 20 . 1 1 1 A 4 4 GLN HA H 4 4.340 4.723 -0.383 1
1 27 . 1 1 1 A 4 4 GLN C C 4 176.700 173.570 3.130 1
1 28 . 1 1 1 A 4 4 GLN CA C 4 56.600 54.614 1.986 1
1 29 . 1 1 1 A 4 4 GLN CB C 4 29.300 31.659 -2.359 1
1 31 . 1 1 1 A 4 4 GLN N N 4 120.500 119.172 1.328 1
1 33 . 1 1 1 A 5 5 SER H H 5 8.540 8.960 -0.420 1
1 34 . 1 1 1 A 5 5 SER HA H 5 4.390 4.687 -0.297 1
1 38 . 1 1 1 A 5 5 SER C C 5 174.800 173.908 0.892 1
1 39 . 1 1 1 A 5 5 SER CA C 5 59.100 58.503 0.597 1
1 40 . 1 1 1 A 5 5 SER CB C 5 63.500 63.608 -0.108 1
1 41 . 1 1 1 A 5 5 SER N N 5 117.100 118.811 -1.711 1
1 42 . 1 1 1 A 6 6 ASP H H 6 8.300 8.700 -0.400 1
1 43 . 1 1 1 A 6 6 ASP HA H 6 4.540 4.804 -0.264 1
1 46 . 1 1 1 A 6 6 ASP C C 6 177.300 176.754 0.546 1
1 47 . 1 1 1 A 6 6 ASP CA C 6 55.100 54.418 0.682 1
1 48 . 1 1 1 A 6 6 ASP CB C 6 40.800 40.978 -0.178 1
1 49 . 1 1 1 A 6 6 ASP N N 6 122.700 127.431 -4.731 1
1 50 . 1 1 1 A 7 7 ARG H H 7 8.270 7.919 0.351 1
1 51 . 1 1 1 A 7 7 ARG HA H 7 4.150 4.149 0.001 1
1 58 . 1 1 1 A 7 7 ARG C C 7 177.600 179.236 -1.636 1
1 59 . 1 1 1 A 7 7 ARG CA C 7 58.000 58.460 -0.460 1
1 60 . 1 1 1 A 7 7 ARG CB C 7 30.100 30.098 0.002 1
1 63 . 1 1 1 A 7 7 ARG N N 7 122.100 120.572 1.528 1
1 64 . 1 1 1 A 8 8 LYS H H 8 8.130 8.120 0.010 1
1 65 . 1 1 1 A 8 8 LYS HA H 8 4.090 4.124 -0.034 1
1 74 . 1 1 1 A 8 8 LYS C C 8 177.600 179.018 -1.418 1
1 75 . 1 1 1 A 8 8 LYS CA C 8 58.400 58.626 -0.226 1
1 76 . 1 1 1 A 8 8 LYS CB C 8 31.700 32.063 -0.363 1
1 80 . 1 1 1 A 8 8 LYS N N 8 120.900 119.927 0.973 1
1 81 . 1 1 1 A 9 9 ALA H H 9 8.050 8.359 -0.309 1
1 82 . 1 1 1 A 9 9 ALA HA H 9 3.950 4.073 -0.123 1
1 86 . 1 1 1 A 9 9 ALA C C 9 179.800 180.544 -0.744 1
1 87 . 1 1 1 A 9 9 ALA CA C 9 55.100 54.872 0.228 1
1 88 . 1 1 1 A 9 9 ALA CB C 9 18.100 18.113 -0.013 1
1 89 . 1 1 1 A 9 9 ALA N N 9 121.600 121.802 -0.202 1
1 90 . 1 1 1 A 10 10 ALA H H 10 7.910 7.785 0.125 1
1 91 . 1 1 1 A 10 10 ALA HA H 10 4.200 4.101 0.099 1
1 95 . 1 1 1 A 10 10 ALA C C 10 180.500 180.044 0.456 1
1 96 . 1 1 1 A 10 10 ALA CA C 10 54.600 54.673 -0.073 1
1 97 . 1 1 1 A 10 10 ALA CB C 10 18.100 18.438 -0.338 1
1 98 . 1 1 1 A 10 10 ALA N N 10 120.200 120.433 -0.233 1
1 99 . 1 1 1 A 11 11 LEU H H 11 8.080 7.535 0.545 1
1 100 . 1 1 1 A 11 11 LEU HA H 11 4.120 4.153 -0.033 1
1 110 . 1 1 1 A 11 11 LEU C C 11 179.600 179.018 0.582 1
1 111 . 1 1 1 A 11 11 LEU CA C 11 57.800 57.538 0.262 1
1 112 . 1 1 1 A 11 11 LEU CB C 11 41.700 41.565 0.135 1
1 115 . 1 1 1 A 11 11 LEU N N 11 120.900 121.397 -0.497 1
1 116 . 1 1 1 A 12 12 LEU H H 12 8.480 8.353 0.127 1
1 117 . 1 1 1 A 12 12 LEU HA H 12 4.040 3.983 0.057 1
1 127 . 1 1 1 A 12 12 LEU C C 12 178.900 178.754 0.146 1
1 128 . 1 1 1 A 12 12 LEU CA C 12 58.100 58.019 0.081 1
1 129 . 1 1 1 A 12 12 LEU CB C 12 40.100 40.562 -0.462 1
1 133 . 1 1 1 A 12 12 LEU N N 12 118.700 117.940 0.760 1
1 134 . 1 1 1 A 13 13 ASP H H 13 7.990 8.482 -0.492 1
1 135 . 1 1 1 A 13 13 ASP HA H 13 4.420 4.235 0.185 1
1 138 . 1 1 1 A 13 13 ASP C C 13 178.900 178.904 -0.004 1
1 139 . 1 1 1 A 13 13 ASP CA C 13 57.500 58.047 -0.547 1
1 140 . 1 1 1 A 13 13 ASP CB C 13 40.500 42.131 -1.631 1
1 141 . 1 1 1 A 13 13 ASP N N 13 119.500 119.992 -0.492 1
1 142 . 1 1 1 A 14 14 GLN H H 14 7.620 7.537 0.083 1
1 143 . 1 1 1 A 14 14 GLN HA H 14 4.230 4.159 0.071 1
1 150 . 1 1 1 A 14 14 GLN C C 14 178.400 178.496 -0.096 1
1 151 . 1 1 1 A 14 14 GLN CA C 14 58.100 58.569 -0.469 1
1 152 . 1 1 1 A 14 14 GLN CB C 14 27.800 28.252 -0.452 1
1 154 . 1 1 1 A 14 14 GLN N N 14 118.900 119.791 -0.891 1
1 156 . 1 1 1 A 15 15 VAL H H 15 8.480 8.099 0.381 1
1 157 . 1 1 1 A 15 15 VAL HA H 15 3.380 3.617 -0.237 1
1 165 . 1 1 1 A 15 15 VAL C C 15 177.600 178.444 -0.844 1
1 166 . 1 1 1 A 15 15 VAL CA C 15 66.600 66.282 0.318 1
1 167 . 1 1 1 A 15 15 VAL CB C 15 30.500 31.665 -1.165 1
1 170 . 1 1 1 A 15 15 VAL N N 15 121.300 120.175 1.125 1
1 171 . 1 1 1 A 16 16 ALA H H 16 8.080 8.416 -0.336 1
1 172 . 1 1 1 A 16 16 ALA HA H 16 4.450 3.976 0.474 1
1 176 . 1 1 1 A 16 16 ALA C C 16 179.100 179.251 -0.151 1
1 177 . 1 1 1 A 16 16 ALA CA C 16 54.600 55.124 -0.524 1
1 178 . 1 1 1 A 16 16 ALA CB C 16 17.700 18.085 -0.385 1
1 179 . 1 1 1 A 16 16 ALA N N 16 121.400 121.901 -0.501 1
1 180 . 1 1 1 A 17 17 ARG H H 17 7.480 7.945 -0.465 1
1 181 . 1 1 1 A 17 17 ARG HA H 17 3.910 4.092 -0.182 1
1 187 . 1 1 1 A 17 17 ARG C C 17 179.700 178.451 1.249 1
1 188 . 1 1 1 A 17 17 ARG CA C 17 59.700 59.360 0.340 1
1 189 . 1 1 1 A 17 17 ARG CB C 17 30.400 29.860 0.540 1
1 191 . 1 1 1 A 17 17 ARG N N 17 116.900 119.100 -2.200 1
1 192 . 1 1 1 A 18 18 VAL H H 18 7.960 7.869 0.091 1
1 193 . 1 1 1 A 18 18 VAL HA H 18 3.690 3.824 -0.134 1
1 201 . 1 1 1 A 18 18 VAL C C 18 177.900 178.750 -0.850 1
1 202 . 1 1 1 A 18 18 VAL CA C 18 66.600 66.124 0.476 1
1 203 . 1 1 1 A 18 18 VAL CB C 18 31.300 31.252 0.048 1
1 206 . 1 1 1 A 18 18 VAL N N 18 123.000 118.426 4.574 1
1 207 . 1 1 1 A 19 19 GLY H H 19 8.270 8.289 -0.019 1
1 208 . 1 1 1 A 19 19 GLY HA2 H 19 3.430 3.778 -0.348 1
1 209 . 1 1 1 A 19 19 GLY HA3 H 19 3.430 3.785 -0.355 1
1 210 . 1 1 1 A 19 19 GLY C C 19 174.400 175.615 -1.215 1
1 211 . 1 1 1 A 19 19 GLY CA C 19 48.500 47.287 1.213 1
1 212 . 1 1 1 A 19 19 GLY N N 19 105.400 108.231 -2.831 1
1 213 . 1 1 1 A 20 20 LYS H H 20 8.250 8.383 -0.133 1
1 214 . 1 1 1 A 20 20 LYS HA H 20 3.710 4.006 -0.296 1
1 223 . 1 1 1 A 20 20 LYS C C 20 179.400 179.098 0.302 1
1 224 . 1 1 1 A 20 20 LYS CA C 20 59.300 59.788 -0.488 1
1 225 . 1 1 1 A 20 20 LYS CB C 20 32.600 32.189 0.411 1
1 229 . 1 1 1 A 20 20 LYS N N 20 118.700 122.116 -3.416 1
1 230 . 1 1 1 A 21 21 ALA H H 21 7.640 7.644 -0.004 1
1 231 . 1 1 1 A 21 21 ALA HA H 21 3.790 4.057 -0.267 1
1 235 . 1 1 1 A 21 21 ALA C C 21 177.900 179.685 -1.785 1
1 236 . 1 1 1 A 21 21 ALA CA C 21 55.200 54.874 0.326 1
1 237 . 1 1 1 A 21 21 ALA CB C 21 19.200 18.090 1.110 1
1 238 . 1 1 1 A 21 21 ALA N N 21 121.700 122.420 -0.720 1
1 239 . 1 1 1 A 22 22 LEU H H 22 7.330 7.921 -0.591 1
1 240 . 1 1 1 A 22 22 LEU HA H 22 4.140 4.109 0.031 1
1 250 . 1 1 1 A 22 22 LEU C C 22 176.800 177.886 -1.086 1
1 251 . 1 1 1 A 22 22 LEU CA C 22 54.600 57.401 -2.801 1
1 252 . 1 1 1 A 22 22 LEU CB C 22 42.900 41.546 1.354 1
1 256 . 1 1 1 A 22 22 LEU N N 22 114.200 120.373 -6.173 1
1 257 . 1 1 1 A 23 23 ALA H H 23 7.160 8.105 -0.945 1
1 258 . 1 1 1 A 23 23 ALA HA H 23 4.720 4.324 0.396 1
1 262 . 1 1 1 A 23 23 ALA C C 23 176.700 177.125 -0.425 1
1 263 . 1 1 1 A 23 23 ALA CA C 23 53.000 52.089 0.911 1
1 264 . 1 1 1 A 23 23 ALA CB C 23 18.200 18.172 0.028 1
1 265 . 1 1 1 A 23 23 ALA N N 23 118.200 119.966 -1.766 1
1 266 . 1 1 1 A 24 24 ASN H H 24 7.440 8.511 -1.071 1
1 267 . 1 1 1 A 24 24 ASN HA H 24 4.730 4.960 -0.230 1
1 272 . 1 1 1 A 24 24 ASN C C 24 174.800 175.757 -0.957 1
1 273 . 1 1 1 A 24 24 ASN CA C 24 53.500 54.544 -1.044 1
1 274 . 1 1 1 A 24 24 ASN CB C 24 41.700 41.377 0.323 1
1 275 . 1 1 1 A 24 24 ASN N N 24 116.800 124.286 -7.486 1
1 277 . 1 1 1 A 25 25 GLY H H 25 9.370 8.251 1.119 1
1 278 . 1 1 1 A 25 25 GLY HA2 H 25 3.650 4.001 -0.351 1
1 279 . 1 1 1 A 25 25 GLY HA3 H 25 4.110 4.019 0.091 1
1 280 . 1 1 1 A 25 25 GLY C C 25 175.300 175.889 -0.589 1
1 281 . 1 1 1 A 25 25 GLY CA C 25 47.600 45.754 1.846 1
1 282 . 1 1 1 A 25 25 GLY N N 25 114.800 107.545 7.255 1
1 283 . 1 1 1 A 26 26 ARG H H 26 8.050 8.043 0.007 1
1 284 . 1 1 1 A 26 26 ARG HA H 26 4.150 4.040 0.110 1
1 289 . 1 1 1 A 26 26 ARG C C 26 179.300 178.356 0.944 1
1 290 . 1 1 1 A 26 26 ARG CA C 26 57.000 59.037 -2.037 1
1 291 . 1 1 1 A 26 26 ARG CB C 26 29.900 29.720 0.180 1
1 294 . 1 1 1 A 26 26 ARG N N 26 120.500 121.029 -0.529 1
1 295 . 1 1 1 A 27 27 ARG H H 27 7.930 7.791 0.139 1
1 296 . 1 1 1 A 27 27 ARG HA H 27 3.710 4.162 -0.452 1
1 301 . 1 1 1 A 27 27 ARG C C 27 178.300 177.391 0.909 1
1 302 . 1 1 1 A 27 27 ARG CA C 27 61.000 58.099 2.901 1
1 303 . 1 1 1 A 27 27 ARG CB C 27 30.400 30.194 0.206 1
1 305 . 1 1 1 A 27 27 ARG N N 27 117.900 118.373 -0.473 1
1 306 . 1 1 1 A 28 28 LEU H H 28 7.640 7.665 -0.025 1
1 307 . 1 1 1 A 28 28 LEU HA H 28 3.950 4.064 -0.114 1
1 317 . 1 1 1 A 28 28 LEU C C 28 178.200 179.205 -1.005 1
1 318 . 1 1 1 A 28 28 LEU CA C 28 57.600 56.431 1.169 1
1 319 . 1 1 1 A 28 28 LEU CB C 28 41.900 41.892 0.008 1
1 323 . 1 1 1 A 28 28 LEU N N 28 117.600 117.691 -0.091 1
1 324 . 1 1 1 A 29 29 GLN H H 29 8.110 7.846 0.264 1
1 325 . 1 1 1 A 29 29 GLN HA H 29 3.880 4.094 -0.214 1
1 332 . 1 1 1 A 29 29 GLN C C 29 179.400 178.609 0.791 1
1 333 . 1 1 1 A 29 29 GLN CA C 29 59.100 58.543 0.557 1
1 334 . 1 1 1 A 29 29 GLN CB C 29 28.800 28.186 0.614 1
1 336 . 1 1 1 A 29 29 GLN N N 29 119.300 118.458 0.842 1
1 338 . 1 1 1 A 30 30 ILE H H 30 7.530 7.899 -0.369 1
1 339 . 1 1 1 A 30 30 ILE HA H 30 3.340 3.618 -0.278 1
1 349 . 1 1 1 A 30 30 ILE C C 30 176.700 178.125 -1.425 1
1 350 . 1 1 1 A 30 30 ILE CA C 30 65.900 65.293 0.607 1
1 351 . 1 1 1 A 30 30 ILE CB C 30 37.400 38.013 -0.613 1
1 355 . 1 1 1 A 30 30 ILE N N 30 118.600 120.771 -2.171 1
1 356 . 1 1 1 A 31 31 LEU H H 31 7.500 7.526 -0.026 1
1 357 . 1 1 1 A 31 31 LEU HA H 31 3.520 3.678 -0.158 1
1 367 . 1 1 1 A 31 31 LEU C C 31 177.300 178.593 -1.293 1
1 368 . 1 1 1 A 31 31 LEU CA C 31 58.100 57.850 0.250 1
1 369 . 1 1 1 A 31 31 LEU CB C 31 41.100 40.293 0.807 1
1 373 . 1 1 1 A 31 31 LEU N N 31 119.900 118.886 1.014 1
1 374 . 1 1 1 A 32 32 ASP H H 32 7.950 8.347 -0.397 1
1 375 . 1 1 1 A 32 32 ASP HA H 32 4.300 4.529 -0.229 1
1 378 . 1 1 1 A 32 32 ASP C C 32 178.300 178.429 -0.129 1
1 379 . 1 1 1 A 32 32 ASP CA C 32 57.400 57.859 -0.459 1
1 380 . 1 1 1 A 32 32 ASP CB C 32 42.400 42.228 0.172 1
1 381 . 1 1 1 A 32 32 ASP N N 32 116.900 119.336 -2.436 1
1 382 . 1 1 1 A 33 33 LEU H H 33 7.350 7.451 -0.101 1
1 383 . 1 1 1 A 33 33 LEU HA H 33 4.130 4.140 -0.010 1
1 393 . 1 1 1 A 33 33 LEU C C 33 180.000 179.005 0.995 1
1 394 . 1 1 1 A 33 33 LEU CA C 33 57.600 57.539 0.061 1
1 395 . 1 1 1 A 33 33 LEU CB C 33 42.300 41.955 0.345 1
1 399 . 1 1 1 A 33 33 LEU N N 33 118.600 120.210 -1.610 1
1 400 . 1 1 1 A 34 34 LEU H H 34 8.300 8.279 0.021 1
1 401 . 1 1 1 A 34 34 LEU HA H 34 4.490 4.453 0.037 1
1 411 . 1 1 1 A 34 34 LEU C C 34 178.900 179.177 -0.277 1
1 412 . 1 1 1 A 34 34 LEU CA C 34 55.800 57.315 -1.515 1
1 413 . 1 1 1 A 34 34 LEU CB C 34 41.300 41.385 -0.085 1
1 417 . 1 1 1 A 34 34 LEU N N 34 117.800 118.696 -0.896 1
1 418 . 1 1 1 A 35 35 ALA H H 35 8.160 7.951 0.209 1
1 419 . 1 1 1 A 35 35 ALA HA H 35 4.050 4.157 -0.107 1
1 423 . 1 1 1 A 35 35 ALA C C 35 179.000 178.066 0.934 1
1 424 . 1 1 1 A 35 35 ALA CA C 35 54.900 54.245 0.655 1
1 425 . 1 1 1 A 35 35 ALA CB C 35 17.500 18.175 -0.675 1
1 426 . 1 1 1 A 35 35 ALA N N 35 123.900 121.917 1.983 1
1 427 . 1 1 1 A 36 36 GLN H H 36 7.600 7.943 -0.343 1
1 428 . 1 1 1 A 36 36 GLN HA H 36 4.340 4.415 -0.075 1
1 435 . 1 1 1 A 36 36 GLN C C 36 176.100 175.316 0.784 1
1 436 . 1 1 1 A 36 36 GLN CA C 36 55.800 55.738 0.062 1
1 437 . 1 1 1 A 36 36 GLN CB C 36 29.000 29.479 -0.479 1
1 439 . 1 1 1 A 36 36 GLN N N 36 113.300 114.411 -1.111 1
1 441 . 1 1 1 A 37 37 GLY H H 37 7.550 7.221 0.329 1
1 442 . 1 1 1 A 37 37 GLY HA2 H 37 3.730 4.044 -0.314 1
1 443 . 1 1 1 A 37 37 GLY HA3 H 37 4.490 4.048 0.442 1
1 444 . 1 1 1 A 37 37 GLY C C 37 171.500 173.002 -1.502 1
1 445 . 1 1 1 A 37 37 GLY CA C 37 44.500 44.984 -0.484 1
1 446 . 1 1 1 A 37 37 GLY N N 37 108.400 107.959 0.441 1
1 447 . 1 1 1 A 38 38 GLU H H 38 8.120 8.508 -0.388 1
1 448 . 1 1 1 A 38 38 GLU HA H 38 4.820 4.562 0.258 1
1 453 . 1 1 1 A 38 38 GLU C C 38 177.000 176.536 0.464 1
1 454 . 1 1 1 A 38 38 GLU CA C 38 56.400 56.472 -0.072 1
1 455 . 1 1 1 A 38 38 GLU CB C 38 31.200 30.105 1.095 1
1 457 . 1 1 1 A 38 38 GLU N N 38 119.600 120.297 -0.697 1
1 458 . 1 1 1 A 39 39 ARG H H 39 8.580 8.795 -0.215 1
1 459 . 1 1 1 A 39 39 ARG HA H 39 4.970 5.144 -0.174 1
1 467 . 1 1 1 A 39 39 ARG C C 39 174.800 175.499 -0.699 1
1 468 . 1 1 1 A 39 39 ARG CA C 39 53.900 54.219 -0.319 1
1 469 . 1 1 1 A 39 39 ARG CB C 39 36.400 34.577 1.823 1
1 472 . 1 1 1 A 39 39 ARG N N 39 121.500 122.714 -1.214 1
1 474 . 1 1 1 A 40 40 ALA H H 40 8.910 8.833 0.077 1
1 475 . 1 1 1 A 40 40 ALA HA H 40 4.920 4.546 0.374 1
1 479 . 1 1 1 A 40 40 ALA C C 40 179.200 178.364 0.836 1
1 480 . 1 1 1 A 40 40 ALA CA C 40 51.100 51.600 -0.500 1
1 481 . 1 1 1 A 40 40 ALA CB C 40 19.200 19.599 -0.399 1
1 482 . 1 1 1 A 40 40 ALA N N 40 125.100 123.584 1.516 1
1 483 . 1 1 1 A 41 41 VAL H H 41 8.420 8.521 -0.101 1
1 484 . 1 1 1 A 41 41 VAL HA H 41 3.430 3.613 -0.183 1
1 492 . 1 1 1 A 41 41 VAL C C 41 176.800 177.448 -0.648 1
1 493 . 1 1 1 A 41 41 VAL CA C 41 67.600 67.066 0.534 1
1 494 . 1 1 1 A 41 41 VAL CB C 41 31.600 31.891 -0.291 1
1 497 . 1 1 1 A 41 41 VAL N N 41 120.900 120.600 0.300 1
1 498 . 1 1 1 A 42 42 GLU H H 42 9.640 8.375 1.265 1
1 499 . 1 1 1 A 42 42 GLU HA H 42 3.880 3.876 0.004 1
1 504 . 1 1 1 A 42 42 GLU C C 42 178.300 178.512 -0.212 1
1 505 . 1 1 1 A 42 42 GLU CA C 42 60.600 59.564 1.036 1
1 506 . 1 1 1 A 42 42 GLU CB C 42 28.300 29.393 -1.093 1
1 508 . 1 1 1 A 42 42 GLU N N 42 119.000 119.848 -0.848 1
1 509 . 1 1 1 A 43 43 ALA H H 43 6.870 7.710 -0.840 1
1 510 . 1 1 1 A 43 43 ALA HA H 43 4.290 4.041 0.249 1
1 514 . 1 1 1 A 43 43 ALA C C 43 180.700 179.688 1.012 1
1 515 . 1 1 1 A 43 43 ALA CA C 43 54.100 55.042 -0.942 1
1 516 . 1 1 1 A 43 43 ALA CB C 43 19.100 18.410 0.690 1
1 517 . 1 1 1 A 43 43 ALA N N 43 120.500 121.833 -1.333 1
1 518 . 1 1 1 A 44 44 ILE H H 44 7.970 8.061 -0.091 1
1 519 . 1 1 1 A 44 44 ILE HA H 44 3.470 3.624 -0.154 1
1 529 . 1 1 1 A 44 44 ILE C C 44 178.300 178.160 0.140 1
1 530 . 1 1 1 A 44 44 ILE CA C 44 64.700 65.549 -0.849 1
1 531 . 1 1 1 A 44 44 ILE CB C 44 38.100 38.087 0.013 1
1 535 . 1 1 1 A 44 44 ILE N N 44 120.500 118.168 2.332 1
1 536 . 1 1 1 A 45 45 ALA H H 45 8.460 8.298 0.162 1
1 537 . 1 1 1 A 45 45 ALA HA H 45 3.720 4.020 -0.300 1
1 541 . 1 1 1 A 45 45 ALA C C 45 178.500 179.899 -1.399 1
1 542 . 1 1 1 A 45 45 ALA CA C 45 56.200 55.322 0.878 1
1 543 . 1 1 1 A 45 45 ALA CB C 45 17.400 18.536 -1.136 1
1 544 . 1 1 1 A 45 45 ALA N N 45 124.500 122.280 2.220 1
1 545 . 1 1 1 A 46 46 THR H H 46 8.080 7.964 0.116 1
1 546 . 1 1 1 A 46 46 THR HA H 46 3.900 3.879 0.021 1
1 551 . 1 1 1 A 46 46 THR C C 46 177.200 176.207 0.993 1
1 552 . 1 1 1 A 46 46 THR CA C 46 66.400 66.539 -0.139 1
1 553 . 1 1 1 A 46 46 THR CB C 46 68.800 68.349 0.451 1
1 555 . 1 1 1 A 46 46 THR N N 46 112.400 113.322 -0.922 1
1 556 . 1 1 1 A 47 47 ALA H H 47 7.930 7.974 -0.044 1
1 557 . 1 1 1 A 47 47 ALA HA H 47 4.200 4.136 0.064 1
1 561 . 1 1 1 A 47 47 ALA C C 47 179.200 179.193 0.007 1
1 562 . 1 1 1 A 47 47 ALA CA C 47 54.800 55.170 -0.370 1
1 563 . 1 1 1 A 47 47 ALA CB C 47 19.800 18.263 1.537 1
1 564 . 1 1 1 A 47 47 ALA N N 47 121.400 123.705 -2.305 1
1 565 . 1 1 1 A 48 48 THR H H 48 7.560 7.554 0.006 1
1 566 . 1 1 1 A 48 48 THR HA H 48 4.390 4.448 -0.058 1
1 571 . 1 1 1 A 48 48 THR C C 48 175.700 175.483 0.217 1
1 572 . 1 1 1 A 48 48 THR CA C 48 61.800 62.318 -0.518 1
1 573 . 1 1 1 A 48 48 THR CB C 48 71.000 70.215 0.785 1
1 575 . 1 1 1 A 48 48 THR N N 48 103.500 106.688 -3.188 1
1 576 . 1 1 1 A 49 49 GLY H H 49 7.820 8.106 -0.286 1
1 577 . 1 1 1 A 49 49 GLY HA2 H 49 3.870 3.937 -0.067 1
1 578 . 1 1 1 A 49 49 GLY HA3 H 49 4.100 3.938 0.162 1
1 579 . 1 1 1 A 49 49 GLY C C 49 174.400 174.038 0.362 1
1 580 . 1 1 1 A 49 49 GLY CA C 49 46.300 46.331 -0.031 1
1 581 . 1 1 1 A 49 49 GLY N N 49 111.100 112.166 -1.066 1
1 582 . 1 1 1 A 50 50 MET H H 50 7.930 8.137 -0.207 1
1 583 . 1 1 1 A 50 50 MET HA H 50 4.540 4.830 -0.290 1
1 591 . 1 1 1 A 50 50 MET C C 50 174.800 174.923 -0.123 1
1 592 . 1 1 1 A 50 50 MET CA C 50 55.100 54.418 0.682 1
1 593 . 1 1 1 A 50 50 MET CB C 50 37.200 35.458 1.742 1
1 596 . 1 1 1 A 50 50 MET N N 50 119.300 118.595 0.705 1
1 597 . 1 1 1 A 51 51 ASN H H 51 8.040 8.682 -0.642 1
1 598 . 1 1 1 A 51 51 ASN HA H 51 4.580 4.726 -0.146 1
1 601 . 1 1 1 A 51 51 ASN C C 51 176.100 176.765 -0.665 1
1 602 . 1 1 1 A 51 51 ASN CA C 51 52.800 53.485 -0.685 1
1 603 . 1 1 1 A 51 51 ASN CB C 51 41.100 40.572 0.528 1
1 604 . 1 1 1 A 51 51 ASN N N 51 118.000 120.339 -2.339 1
1 605 . 1 1 1 A 52 52 LEU H H 52 8.560 8.628 -0.068 1
1 606 . 1 1 1 A 52 52 LEU HA H 52 3.760 3.930 -0.170 1
1 616 . 1 1 1 A 52 52 LEU C C 52 179.600 178.461 1.139 1
1 617 . 1 1 1 A 52 52 LEU CA C 52 59.000 57.751 1.249 1
1 618 . 1 1 1 A 52 52 LEU CB C 52 41.800 41.361 0.439 1
1 622 . 1 1 1 A 52 52 LEU N N 52 120.600 126.599 -5.999 1
1 623 . 1 1 1 A 53 53 THR H H 53 8.230 7.968 0.262 1
1 624 . 1 1 1 A 53 53 THR HA H 53 3.880 3.889 -0.009 1
1 629 . 1 1 1 A 53 53 THR C C 53 176.900 176.660 0.240 1
1 630 . 1 1 1 A 53 53 THR CA C 53 66.500 66.709 -0.209 1
1 631 . 1 1 1 A 53 53 THR CB C 53 68.400 68.609 -0.209 1
1 633 . 1 1 1 A 53 53 THR N N 53 115.800 116.021 -0.221 1
1 634 . 1 1 1 A 54 54 THR H H 54 8.420 8.099 0.321 1
1 635 . 1 1 1 A 54 54 THR HA H 54 3.880 3.780 0.100 1
1 640 . 1 1 1 A 54 54 THR C C 54 177.300 176.173 1.127 1
1 641 . 1 1 1 A 54 54 THR CA C 54 66.600 66.452 0.148 1
1 642 . 1 1 1 A 54 54 THR CB C 54 66.600 68.641 -2.041 1
1 644 . 1 1 1 A 54 54 THR N N 54 122.300 116.505 5.795 1
1 645 . 1 1 1 A 55 55 ALA H H 55 8.860 8.723 0.137 1
1 646 . 1 1 1 A 55 55 ALA HA H 55 4.020 3.924 0.096 1
1 650 . 1 1 1 A 55 55 ALA C C 55 179.000 179.051 -0.051 1
1 651 . 1 1 1 A 55 55 ALA CA C 55 56.100 55.349 0.751 1
1 652 . 1 1 1 A 55 55 ALA CB C 55 17.000 18.165 -1.165 1
1 653 . 1 1 1 A 55 55 ALA N N 55 125.600 124.099 1.501 1
1 654 . 1 1 1 A 56 56 SER H H 56 8.440 8.379 0.061 1
1 655 . 1 1 1 A 56 56 SER HA H 56 3.920 4.006 -0.086 1
1 658 . 1 1 1 A 56 56 SER C C 56 176.400 177.134 -0.734 1
1 659 . 1 1 1 A 56 56 SER CA C 56 62.600 61.340 1.260 1
1 660 . 1 1 1 A 56 56 SER CB C 56 62.700 63.032 -0.332 1
1 661 . 1 1 1 A 56 56 SER N N 56 112.700 112.780 -0.080 1
1 662 . 1 1 1 A 57 57 ALA H H 57 8.090 7.929 0.161 1
1 663 . 1 1 1 A 57 57 ALA HA H 57 4.130 4.041 0.089 1
1 667 . 1 1 1 A 57 57 ALA C C 57 181.200 179.687 1.513 1
1 668 . 1 1 1 A 57 57 ALA CA C 57 55.200 55.251 -0.051 1
1 669 . 1 1 1 A 57 57 ALA CB C 57 17.900 18.031 -0.131 1
1 670 . 1 1 1 A 57 57 ALA N N 57 124.000 122.796 1.204 1
1 671 . 1 1 1 A 58 58 ASN H H 58 7.970 8.314 -0.344 1
1 672 . 1 1 1 A 58 58 ASN HA H 58 4.480 4.482 -0.002 1
1 677 . 1 1 1 A 58 58 ASN C C 58 177.500 177.304 0.196 1
1 678 . 1 1 1 A 58 58 ASN CA C 58 56.900 55.180 1.720 1
1 679 . 1 1 1 A 58 58 ASN CB C 58 39.800 37.424 2.376 1
1 680 . 1 1 1 A 58 58 ASN N N 58 117.600 115.793 1.807 1
1 682 . 1 1 1 A 59 59 LEU H H 59 8.530 8.203 0.327 1
1 683 . 1 1 1 A 59 59 LEU HA H 59 3.710 3.821 -0.111 1
1 693 . 1 1 1 A 59 59 LEU C C 59 178.400 179.263 -0.863 1
1 694 . 1 1 1 A 59 59 LEU CA C 59 58.600 57.783 0.817 1
1 695 . 1 1 1 A 59 59 LEU CB C 59 40.500 40.741 -0.241 1
1 699 . 1 1 1 A 59 59 LEU N N 59 122.600 120.837 1.763 1
1 700 . 1 1 1 A 60 60 GLN H H 60 8.200 7.963 0.237 1
1 701 . 1 1 1 A 60 60 GLN HA H 60 4.020 4.175 -0.155 1
1 708 . 1 1 1 A 60 60 GLN C C 60 178.700 178.540 0.160 1
1 709 . 1 1 1 A 60 60 GLN CA C 60 58.800 58.910 -0.110 1
1 710 . 1 1 1 A 60 60 GLN CB C 60 27.700 28.305 -0.605 1
1 712 . 1 1 1 A 60 60 GLN N N 60 118.900 118.301 0.599 1
1 714 . 1 1 1 A 61 61 ALA H H 61 7.580 7.739 -0.159 1
1 715 . 1 1 1 A 61 61 ALA HA H 61 4.230 4.138 0.092 1
1 719 . 1 1 1 A 61 61 ALA C C 61 181.300 180.603 0.697 1
1 720 . 1 1 1 A 61 61 ALA CA C 61 55.100 54.981 0.119 1
1 721 . 1 1 1 A 61 61 ALA CB C 61 17.600 18.178 -0.578 1
1 722 . 1 1 1 A 61 61 ALA N N 61 122.200 123.108 -0.908 1
1 723 . 1 1 1 A 62 62 LEU H H 62 7.830 8.186 -0.356 1
1 724 . 1 1 1 A 62 62 LEU HA H 62 3.980 4.023 -0.043 1
1 734 . 1 1 1 A 62 62 LEU C C 62 178.500 179.176 -0.676 1
1 735 . 1 1 1 A 62 62 LEU CA C 62 58.100 57.523 0.577 1
1 736 . 1 1 1 A 62 62 LEU CB C 62 43.300 40.955 2.345 1
1 739 . 1 1 1 A 62 62 LEU N N 62 119.000 118.188 0.812 1
1 740 . 1 1 1 A 63 63 LYS H H 63 8.580 8.277 0.303 1
1 741 . 1 1 1 A 63 63 LYS HA H 63 4.130 4.447 -0.317 1
1 750 . 1 1 1 A 63 63 LYS C C 63 180.500 179.002 1.498 1
1 751 . 1 1 1 A 63 63 LYS CA C 63 59.700 59.366 0.334 1
1 752 . 1 1 1 A 63 63 LYS CB C 63 32.600 32.336 0.264 1
1 756 . 1 1 1 A 63 63 LYS N N 63 123.400 121.481 1.919 1
1 757 . 1 1 1 A 64 64 SER H H 64 8.640 8.579 0.061 1
1 758 . 1 1 1 A 64 64 SER HA H 64 4.300 4.180 0.120 1
1 761 . 1 1 1 A 64 64 SER C C 64 175.000 176.870 -1.870 1
1 762 . 1 1 1 A 64 64 SER CA C 64 61.400 60.947 0.453 1
1 763 . 1 1 1 A 64 64 SER CB C 64 63.000 62.440 0.560 1
1 764 . 1 1 1 A 64 64 SER N N 64 117.700 115.424 2.276 1
1 765 . 1 1 1 A 65 65 GLY H H 65 7.280 7.843 -0.563 1
1 766 . 1 1 1 A 65 65 GLY HA2 H 65 3.240 3.916 -0.676 1
1 767 . 1 1 1 A 65 65 GLY HA3 H 65 3.980 3.918 0.062 1
1 768 . 1 1 1 A 65 65 GLY C C 65 171.300 175.076 -3.776 1
1 769 . 1 1 1 A 65 65 GLY CA C 65 45.100 46.277 -1.177 1
1 770 . 1 1 1 A 65 65 GLY N N 65 104.400 109.040 -4.640 1
1 771 . 1 1 1 A 66 66 GLY H H 66 7.730 7.604 0.126 1
1 772 . 1 1 1 A 66 66 GLY HA2 H 66 3.650 4.015 -0.365 1
1 773 . 1 1 1 A 66 66 GLY HA3 H 66 3.750 4.017 -0.267 1
1 774 . 1 1 1 A 66 66 GLY C C 66 173.700 175.271 -1.571 1
1 775 . 1 1 1 A 66 66 GLY CA C 66 45.400 45.173 0.227 1
1 776 . 1 1 1 A 66 66 GLY N N 66 104.700 107.801 -3.101 1
1 777 . 1 1 1 A 67 67 LEU H H 67 7.520 8.179 -0.659 1
1 778 . 1 1 1 A 67 67 LEU HA H 67 4.310 4.230 0.080 1
1 788 . 1 1 1 A 67 67 LEU C C 67 177.700 176.910 0.790 1
1 789 . 1 1 1 A 67 67 LEU CA C 67 55.500 56.384 -0.884 1
1 790 . 1 1 1 A 67 67 LEU CB C 67 42.400 42.683 -0.283 1
1 794 . 1 1 1 A 67 67 LEU N N 67 110.600 118.765 -8.165 1
1 795 . 1 1 1 A 68 68 VAL H H 68 6.890 7.087 -0.197 1
1 796 . 1 1 1 A 68 68 VAL HA H 68 5.190 5.035 0.155 1
1 804 . 1 1 1 A 68 68 VAL C C 68 173.700 174.685 -0.985 1
1 805 . 1 1 1 A 68 68 VAL CA C 68 57.400 58.853 -1.453 1
1 806 . 1 1 1 A 68 68 VAL CB C 68 36.400 35.318 1.082 1
1 809 . 1 1 1 A 68 68 VAL N N 68 106.400 112.148 -5.748 1
1 810 . 1 1 1 A 69 69 GLU H H 69 8.880 9.296 -0.416 1
1 811 . 1 1 1 A 69 69 GLU HA H 69 4.660 4.909 -0.249 1
1 816 . 1 1 1 A 69 69 GLU C C 69 173.300 175.019 -1.719 1
1 817 . 1 1 1 A 69 69 GLU CA C 69 54.300 54.564 -0.264 1
1 818 . 1 1 1 A 69 69 GLU CB C 69 34.100 33.902 0.198 1
1 820 . 1 1 1 A 69 69 GLU N N 69 120.400 121.052 -0.652 1
1 821 . 1 1 1 A 70 70 ALA H H 70 8.730 8.877 -0.147 1
1 822 . 1 1 1 A 70 70 ALA HA H 70 4.990 5.249 -0.259 1
1 826 . 1 1 1 A 70 70 ALA C C 70 176.500 174.927 1.573 1
1 827 . 1 1 1 A 70 70 ALA CA C 70 50.000 50.058 -0.058 1
1 828 . 1 1 1 A 70 70 ALA CB C 70 22.300 22.327 -0.027 1
1 829 . 1 1 1 A 70 70 ALA N N 70 122.800 121.864 0.936 1
1 830 . 1 1 1 A 71 71 ARG H H 71 8.670 9.305 -0.635 1
1 831 . 1 1 1 A 71 71 ARG HA H 71 4.630 5.062 -0.432 1
1 843 . 1 1 1 A 71 71 ARG C C 71 173.500 173.888 -0.388 1
1 844 . 1 1 1 A 71 71 ARG CA C 71 54.600 54.148 0.452 1
1 845 . 1 1 1 A 71 71 ARG CB C 71 33.600 33.920 -0.320 1
1 849 . 1 1 1 A 71 71 ARG N N 71 120.100 122.525 -2.425 1
1 851 . 1 1 1 A 72 72 ARG H H 72 8.780 8.922 -0.142 1
1 852 . 1 1 1 A 72 72 ARG HA H 72 5.100 4.927 0.173 1
1 859 . 1 1 1 A 72 72 ARG C C 72 176.000 174.738 1.262 1
1 860 . 1 1 1 A 72 72 ARG CA C 72 54.900 54.951 -0.051 1
1 861 . 1 1 1 A 72 72 ARG CB C 72 32.500 31.839 0.661 1
1 864 . 1 1 1 A 72 72 ARG N N 72 123.600 127.536 -3.936 1
1 865 . 1 1 1 A 73 73 GLU H H 73 8.720 8.700 0.020 1
1 866 . 1 1 1 A 73 73 GLU HA H 73 4.510 4.705 -0.195 1
1 871 . 1 1 1 A 73 73 GLU C C 73 175.900 176.747 -0.847 1
1 872 . 1 1 1 A 73 73 GLU CA C 73 55.700 55.101 0.599 1
1 873 . 1 1 1 A 73 73 GLU CB C 73 31.800 31.070 0.730 1
1 875 . 1 1 1 A 73 73 GLU N N 73 126.800 127.278 -0.478 1
1 876 . 1 1 1 A 74 74 GLY H H 74 9.190 8.897 0.293 1
1 877 . 1 1 1 A 74 74 GLY HA2 H 74 3.700 3.884 -0.184 1
1 878 . 1 1 1 A 74 74 GLY HA3 H 74 4.170 3.904 0.266 1
1 879 . 1 1 1 A 74 74 GLY C C 74 175.400 174.712 0.688 1
1 880 . 1 1 1 A 74 74 GLY CA C 74 47.100 47.260 -0.160 1
1 881 . 1 1 1 A 74 74 GLY N N 74 118.500 116.332 2.168 1
1 882 . 1 1 1 A 75 75 THR H H 75 8.780 8.622 0.158 1
1 883 . 1 1 1 A 75 75 THR HA H 75 4.290 4.450 -0.160 1
1 888 . 1 1 1 A 75 75 THR C C 75 174.600 173.321 1.279 1
1 889 . 1 1 1 A 75 75 THR CA C 75 62.000 61.700 0.300 1
1 890 . 1 1 1 A 75 75 THR CB C 75 69.000 69.923 -0.923 1
1 892 . 1 1 1 A 75 75 THR N N 75 118.000 119.498 -1.498 1
1 893 . 1 1 1 A 76 76 ARG H H 76 8.030 7.534 0.496 1
1 894 . 1 1 1 A 76 76 ARG HA H 76 4.610 4.909 -0.299 1
1 901 . 1 1 1 A 76 76 ARG C C 76 174.800 174.480 0.320 1
1 902 . 1 1 1 A 76 76 ARG CA C 76 55.500 54.425 1.075 1
1 903 . 1 1 1 A 76 76 ARG CB C 76 32.700 32.836 -0.136 1
1 906 . 1 1 1 A 76 76 ARG N N 76 122.600 121.501 1.099 1
1 907 . 1 1 1 A 77 77 GLN H H 77 8.580 8.622 -0.042 1
1 908 . 1 1 1 A 77 77 GLN HA H 77 4.910 4.683 0.227 1
1 915 . 1 1 1 A 77 77 GLN C C 77 173.900 173.798 0.102 1
1 916 . 1 1 1 A 77 77 GLN CA C 77 54.700 54.369 0.331 1
1 917 . 1 1 1 A 77 77 GLN CB C 77 31.800 29.578 2.222 1
1 919 . 1 1 1 A 77 77 GLN N N 77 121.900 122.644 -0.744 1
1 921 . 1 1 1 A 78 78 TYR H H 78 8.890 9.248 -0.358 1
1 922 . 1 1 1 A 78 78 TYR HA H 78 4.750 5.107 -0.357 1
1 929 . 1 1 1 A 78 78 TYR C C 78 175.600 174.555 1.045 1
1 930 . 1 1 1 A 78 78 TYR CA C 78 57.000 56.477 0.523 1
1 931 . 1 1 1 A 78 78 TYR CB C 78 41.400 39.883 1.517 1
1 936 . 1 1 1 A 78 78 TYR N N 78 121.800 126.893 -5.093 1
1 937 . 1 1 1 A 79 79 TYR H H 79 9.010 9.648 -0.638 1
1 938 . 1 1 1 A 79 79 TYR HA H 79 5.410 5.353 0.057 1
1 945 . 1 1 1 A 79 79 TYR C C 79 173.100 174.801 -1.701 1
1 946 . 1 1 1 A 79 79 TYR CA C 79 57.300 56.848 0.452 1
1 947 . 1 1 1 A 79 79 TYR CB C 79 43.300 40.988 2.312 1
1 952 . 1 1 1 A 79 79 TYR N N 79 122.500 122.891 -0.391 1
1 953 . 1 1 1 A 80 80 ARG H H 80 8.720 9.019 -0.299 1
1 954 . 1 1 1 A 80 80 ARG HA H 80 5.120 4.873 0.247 1
1 962 . 1 1 1 A 80 80 ARG C C 80 175.500 174.945 0.555 1
1 963 . 1 1 1 A 80 80 ARG CA C 80 53.200 54.092 -0.892 1
1 964 . 1 1 1 A 80 80 ARG CB C 80 33.900 34.284 -0.384 1
1 967 . 1 1 1 A 80 80 ARG N N 80 114.500 122.291 -7.791 1
1 969 . 1 1 1 A 81 81 ILE H H 81 9.300 8.677 0.623 1
1 970 . 1 1 1 A 81 81 ILE HA H 81 4.150 4.147 0.003 1
1 980 . 1 1 1 A 81 81 ILE C C 81 177.800 177.505 0.295 1
1 981 . 1 1 1 A 81 81 ILE CA C 81 62.300 62.189 0.111 1
1 982 . 1 1 1 A 81 81 ILE CB C 81 37.800 37.792 0.008 1
1 986 . 1 1 1 A 81 81 ILE N N 81 122.100 126.193 -4.093 1
1 987 . 1 1 1 A 82 82 ALA H H 82 7.930 8.836 -0.906 1
1 988 . 1 1 1 A 82 82 ALA HA H 82 3.930 4.031 -0.101 1
1 992 . 1 1 1 A 82 82 ALA C C 82 176.300 177.241 -0.941 1
1 993 . 1 1 1 A 82 82 ALA CA C 82 54.200 55.339 -1.139 1
1 994 . 1 1 1 A 82 82 ALA CB C 82 18.500 19.226 -0.726 1
1 995 . 1 1 1 A 82 82 ALA N N 82 127.200 128.746 -1.546 1
1 996 . 1 1 1 A 83 83 GLY H H 83 6.980 7.541 -0.561 1
1 997 . 1 1 1 A 83 83 GLY HA2 H 83 4.090 4.056 0.034 1
1 998 . 1 1 1 A 83 83 GLY HA3 H 83 4.440 4.057 0.383 1
1 999 . 1 1 1 A 83 83 GLY C C 83 173.600 174.545 -0.945 1
1 1000 . 1 1 1 A 83 83 GLY CA C 83 45.200 45.314 -0.114 1
1 1001 . 1 1 1 A 83 83 GLY N N 83 101.800 103.158 -1.358 1
1 1002 . 1 1 1 A 84 84 GLU H H 84 8.930 9.144 -0.214 1
1 1003 . 1 1 1 A 84 84 GLU HA H 84 4.120 4.141 -0.021 1
1 1008 . 1 1 1 A 84 84 GLU C C 84 178.300 178.424 -0.124 1
1 1009 . 1 1 1 A 84 84 GLU CA C 84 58.900 58.702 0.198 1
1 1010 . 1 1 1 A 84 84 GLU CB C 84 29.400 29.084 0.316 1
1 1012 . 1 1 1 A 84 84 GLU N N 84 120.300 118.511 1.789 1
1 1013 . 1 1 1 A 85 85 ASP H H 85 8.950 8.129 0.821 1
1 1014 . 1 1 1 A 85 85 ASP HA H 85 4.310 4.317 -0.007 1
1 1017 . 1 1 1 A 85 85 ASP C C 85 178.000 179.055 -1.055 1
1 1018 . 1 1 1 A 85 85 ASP CA C 85 57.100 57.306 -0.206 1
1 1019 . 1 1 1 A 85 85 ASP CB C 85 38.900 40.627 -1.727 1
1 1020 . 1 1 1 A 85 85 ASP N N 85 119.400 120.619 -1.219 1
1 1021 . 1 1 1 A 86 86 VAL H H 86 7.620 8.158 -0.538 1
1 1022 . 1 1 1 A 86 86 VAL HA H 86 3.480 3.600 -0.120 1
1 1030 . 1 1 1 A 86 86 VAL C C 86 177.400 177.929 -0.529 1
1 1031 . 1 1 1 A 86 86 VAL CA C 86 66.800 66.467 0.333 1
1 1032 . 1 1 1 A 86 86 VAL CB C 86 31.300 31.479 -0.179 1
1 1035 . 1 1 1 A 86 86 VAL N N 86 121.600 119.701 1.899 1
1 1036 . 1 1 1 A 87 87 ALA H H 87 7.520 8.012 -0.492 1
1 1037 . 1 1 1 A 87 87 ALA HA H 87 4.110 4.054 0.056 1
1 1041 . 1 1 1 A 87 87 ALA C C 87 181.200 179.944 1.256 1
1 1042 . 1 1 1 A 87 87 ALA CA C 87 55.800 55.947 -0.147 1
1 1043 . 1 1 1 A 87 87 ALA CB C 87 17.600 18.432 -0.832 1
1 1044 . 1 1 1 A 87 87 ALA N N 87 122.700 122.028 0.672 1
1 1045 . 1 1 1 A 88 88 ARG H H 88 8.380 8.753 -0.373 1
1 1046 . 1 1 1 A 88 88 ARG HA H 88 4.090 4.051 0.039 1
1 1054 . 1 1 1 A 88 88 ARG C C 88 179.100 178.912 0.188 1
1 1055 . 1 1 1 A 88 88 ARG CA C 88 59.600 58.870 0.730 1
1 1056 . 1 1 1 A 88 88 ARG CB C 88 30.500 29.771 0.729 1
1 1059 . 1 1 1 A 88 88 ARG N N 88 119.200 117.780 1.420 1
1 1061 . 1 1 1 A 89 89 LEU H H 89 8.480 7.649 0.831 1
1 1062 . 1 1 1 A 89 89 LEU HA H 89 4.040 4.047 -0.007 1
1 1071 . 1 1 1 A 89 89 LEU C C 89 177.200 178.603 -1.403 1
1 1072 . 1 1 1 A 89 89 LEU CA C 89 58.300 57.784 0.516 1
1 1073 . 1 1 1 A 89 89 LEU CB C 89 41.300 41.901 -0.601 1
1 1076 . 1 1 1 A 89 89 LEU N N 89 123.300 121.970 1.330 1
1 1077 . 1 1 1 A 90 90 PHE H H 90 8.890 8.747 0.143 1
1 1078 . 1 1 1 A 90 90 PHE HA H 90 4.380 3.981 0.399 1
1 1086 . 1 1 1 A 90 90 PHE C C 90 177.500 177.765 -0.265 1
1 1087 . 1 1 1 A 90 90 PHE CA C 90 59.400 62.375 -2.975 1
1 1088 . 1 1 1 A 90 90 PHE CB C 90 38.600 38.723 -0.123 1
1 1094 . 1 1 1 A 90 90 PHE N N 90 119.400 119.321 0.079 1
1 1095 . 1 1 1 A 91 91 ALA H H 91 7.920 8.407 -0.487 1
1 1096 . 1 1 1 A 91 91 ALA HA H 91 3.940 3.921 0.019 1
1 1100 . 1 1 1 A 91 91 ALA C C 91 180.200 179.783 0.417 1
1 1101 . 1 1 1 A 91 91 ALA CA C 91 55.100 55.244 -0.144 1
1 1102 . 1 1 1 A 91 91 ALA CB C 91 18.000 17.894 0.106 1
1 1103 . 1 1 1 A 91 91 ALA N N 91 120.500 121.325 -0.825 1
1 1104 . 1 1 1 A 92 92 LEU H H 92 8.190 8.294 -0.104 1
1 1105 . 1 1 1 A 92 92 LEU HA H 92 4.300 4.051 0.249 1
1 1115 . 1 1 1 A 92 92 LEU C C 92 178.900 178.299 0.601 1
1 1116 . 1 1 1 A 92 92 LEU CA C 92 57.500 58.029 -0.529 1
1 1117 . 1 1 1 A 92 92 LEU CB C 92 42.100 41.669 0.431 1
1 1121 . 1 1 1 A 92 92 LEU N N 92 120.200 119.399 0.801 1
1 1122 . 1 1 1 A 93 93 VAL H H 93 8.890 7.996 0.894 1
1 1123 . 1 1 1 A 93 93 VAL HA H 93 3.810 3.755 0.055 1
1 1131 . 1 1 1 A 93 93 VAL C C 93 176.900 177.951 -1.051 1
1 1132 . 1 1 1 A 93 93 VAL CA C 93 66.000 65.364 0.636 1
1 1133 . 1 1 1 A 93 93 VAL CB C 93 31.200 31.239 -0.039 1
1 1136 . 1 1 1 A 93 93 VAL N N 93 117.100 115.826 1.274 1
1 1137 . 1 1 1 A 94 94 GLN H H 94 6.920 7.530 -0.610 1
1 1138 . 1 1 1 A 94 94 GLN HA H 94 3.790 3.866 -0.076 1
1 1145 . 1 1 1 A 94 94 GLN C C 94 177.400 178.377 -0.977 1
1 1146 . 1 1 1 A 94 94 GLN CA C 94 60.000 58.752 1.248 1
1 1147 . 1 1 1 A 94 94 GLN CB C 94 30.300 28.214 2.086 1
1 1149 . 1 1 1 A 94 94 GLN N N 94 117.800 121.177 -3.377 1
1 1151 . 1 1 1 A 95 95 VAL H H 95 7.420 8.022 -0.602 1
1 1152 . 1 1 1 A 95 95 VAL HA H 95 3.760 3.566 0.194 1
1 1160 . 1 1 1 A 95 95 VAL C C 95 178.300 178.093 0.207 1
1 1161 . 1 1 1 A 95 95 VAL CA C 95 66.600 66.374 0.226 1
1 1162 . 1 1 1 A 95 95 VAL CB C 95 31.900 31.553 0.347 1
1 1165 . 1 1 1 A 95 95 VAL N N 95 121.500 119.542 1.958 1
1 1166 . 1 1 1 A 96 96 VAL H H 96 8.340 8.406 -0.066 1
1 1167 . 1 1 1 A 96 96 VAL HA H 96 3.810 3.762 0.048 1
1 1175 . 1 1 1 A 96 96 VAL C C 96 178.400 177.386 1.014 1
1 1176 . 1 1 1 A 96 96 VAL CA C 96 66.100 64.949 1.151 1
1 1177 . 1 1 1 A 96 96 VAL CB C 96 32.200 31.209 0.991 1
1 1180 . 1 1 1 A 96 96 VAL N N 96 120.000 120.043 -0.043 1
1 1181 . 1 1 1 A 97 97 ALA H H 97 8.140 7.830 0.310 1
1 1182 . 1 1 1 A 97 97 ALA HA H 97 4.010 4.122 -0.112 1
1 1186 . 1 1 1 A 97 97 ALA C C 97 178.800 179.213 -0.413 1
1 1187 . 1 1 1 A 97 97 ALA CA C 97 54.900 55.394 -0.494 1
1 1188 . 1 1 1 A 97 97 ALA CB C 97 19.900 18.101 1.799 1
1 1189 . 1 1 1 A 97 97 ALA N N 97 121.400 123.766 -2.366 1
1 1190 . 1 1 1 A 98 98 ASP H H 98 8.170 8.449 -0.279 1
1 1191 . 1 1 1 A 98 98 ASP HA H 98 4.320 4.334 -0.014 1
1 1194 . 1 1 1 A 98 98 ASP C C 98 178.100 178.521 -0.421 1
1 1195 . 1 1 1 A 98 98 ASP CA C 98 57.100 57.804 -0.704 1
1 1196 . 1 1 1 A 98 98 ASP CB C 98 41.800 41.876 -0.076 1
1 1197 . 1 1 1 A 98 98 ASP N N 98 118.500 118.557 -0.057 1
1 1198 . 1 1 1 A 99 99 GLU H H 99 8.220 8.215 0.005 1
1 1199 . 1 1 1 A 99 99 GLU HA H 99 4.000 4.139 -0.139 1
1 1204 . 1 1 1 A 99 99 GLU C C 99 178.300 177.259 1.041 1
1 1205 . 1 1 1 A 99 99 GLU CA C 99 58.300 58.058 0.242 1
1 1206 . 1 1 1 A 99 99 GLU CB C 99 29.800 28.915 0.885 1
1 1208 . 1 1 1 A 99 99 GLU N N 99 116.600 117.566 -0.966 1
1 1209 . 1 1 1 A 100 100 HIS H H 100 7.980 7.401 0.579 1
1 1210 . 1 1 1 A 100 100 HIS HA H 100 4.600 4.601 -0.001 1
1 1214 . 1 1 1 A 100 100 HIS C C 100 175.900 177.524 -1.624 1
1 1215 . 1 1 1 A 100 100 HIS CA C 100 57.500 58.056 -0.556 1
1 1216 . 1 1 1 A 100 100 HIS CB C 100 30.800 31.116 -0.316 1
1 1218 . 1 1 1 A 100 100 HIS N N 100 114.000 117.111 -3.111 1
1 1219 . 1 1 1 A 101 101 LEU H H 101 7.920 8.196 -0.276 1
1 1220 . 1 1 1 A 101 101 LEU HA H 101 4.370 3.999 0.371 1
1 1230 . 1 1 1 A 101 101 LEU C C 101 177.700 177.840 -0.140 1
1 1231 . 1 1 1 A 101 101 LEU CA C 101 55.900 57.619 -1.719 1
1 1232 . 1 1 1 A 101 101 LEU CB C 101 42.100 42.177 -0.077 1
1 1236 . 1 1 1 A 101 101 LEU N N 101 118.500 118.540 -0.040 1
1 1237 . 1 1 1 A 102 102 GLU H H 102 8.100 8.279 -0.179 1
1 1238 . 1 1 1 A 102 102 GLU HA H 102 4.160 4.533 -0.373 1
1 1243 . 1 1 1 A 102 102 GLU C C 102 176.700 175.019 1.681 1
1 1244 . 1 1 1 A 102 102 GLU CA C 102 57.000 55.087 1.913 1
1 1245 . 1 1 1 A 102 102 GLU CB C 102 29.900 28.592 1.308 1
1 1247 . 1 1 1 A 102 102 GLU N N 102 119.100 117.922 1.178 1
1 1248 . 1 1 1 A 103 103 HIS H H 103 8.010 8.782 -0.772 1
1 1249 . 1 1 1 A 103 103 HIS HA H 103 4.520 4.850 -0.330 1
1 1252 . 1 1 1 A 103 103 HIS CA C 103 56.100 54.800 1.300 1
1 1253 . 1 1 1 A 103 103 HIS CB C 103 29.700 29.276 0.424 1
1 1254 . 1 1 1 A 103 103 HIS N N 103 117.300 125.626 -8.326 1
1 1255 . 1 1 1 A 107 107 HIS HA H 107 4.560 4.698 -0.138 1
1 1258 . 1 1 1 A 107 107 HIS C C 107 173.900 173.126 0.774 1
1 1259 . 1 1 1 A 107 107 HIS CA C 107 55.900 55.939 -0.039 1
1 1260 . 1 1 1 A 107 107 HIS CB C 107 30.200 33.015 -2.815 1
1 4 . 2 1 1 A 2 2 ALA H H 2 8.450 8.357 0.093 1
1 5 . 2 1 1 A 2 2 ALA HA H 2 4.390 4.062 0.328 1
1 9 . 2 1 1 A 2 2 ALA C C 2 178.300 178.380 -0.080 1
1 10 . 2 1 1 A 2 2 ALA CA C 2 52.500 52.745 -0.245 1
1 11 . 2 1 1 A 2 2 ALA CB C 2 19.200 19.488 -0.288 1
1 12 . 2 1 1 A 2 2 ALA N N 2 125.100 123.839 1.261 1
1 13 . 2 1 1 A 3 3 GLY H H 3 8.450 7.927 0.523 1
1 14 . 2 1 1 A 3 3 GLY HA2 H 3 4.030 3.974 0.056 1
1 15 . 2 1 1 A 3 3 GLY HA3 H 3 4.030 3.974 0.056 1
1 16 . 2 1 1 A 3 3 GLY C C 3 174.100 174.842 -0.742 1
1 17 . 2 1 1 A 3 3 GLY CA C 3 45.200 45.552 -0.352 1
1 18 . 2 1 1 A 3 3 GLY N N 3 108.000 106.312 1.688 1
1 19 . 2 1 1 A 4 4 GLN H H 4 8.550 8.390 0.160 1
1 20 . 2 1 1 A 4 4 GLN HA H 4 4.340 3.894 0.446 1
1 27 . 2 1 1 A 4 4 GLN C C 4 176.700 176.431 0.269 1
1 28 . 2 1 1 A 4 4 GLN CA C 4 56.600 58.283 -1.683 1
1 29 . 2 1 1 A 4 4 GLN CB C 4 29.300 26.497 2.803 1
1 31 . 2 1 1 A 4 4 GLN N N 4 120.500 115.589 4.911 1
1 33 . 2 1 1 A 5 5 SER H H 5 8.540 8.518 0.022 1
1 34 . 2 1 1 A 5 5 SER HA H 5 4.390 4.296 0.094 1
1 38 . 2 1 1 A 5 5 SER C C 5 174.800 174.501 0.299 1
1 39 . 2 1 1 A 5 5 SER CA C 5 59.100 60.990 -1.890 1
1 40 . 2 1 1 A 5 5 SER CB C 5 63.500 63.004 0.496 1
1 41 . 2 1 1 A 5 5 SER N N 5 117.100 114.310 2.790 1
1 42 . 2 1 1 A 6 6 ASP H H 6 8.300 7.731 0.569 1
1 43 . 2 1 1 A 6 6 ASP HA H 6 4.540 4.812 -0.272 1
1 46 . 2 1 1 A 6 6 ASP C C 6 177.300 175.934 1.366 1
1 47 . 2 1 1 A 6 6 ASP CA C 6 55.100 53.739 1.361 1
1 48 . 2 1 1 A 6 6 ASP CB C 6 40.800 40.324 0.476 1
1 49 . 2 1 1 A 6 6 ASP N N 6 122.700 122.025 0.675 1
1 50 . 2 1 1 A 7 7 ARG H H 7 8.270 8.796 -0.526 1
1 51 . 2 1 1 A 7 7 ARG HA H 7 4.150 4.197 -0.047 1
1 58 . 2 1 1 A 7 7 ARG C C 7 177.600 178.641 -1.041 1
1 59 . 2 1 1 A 7 7 ARG CA C 7 58.000 58.367 -0.367 1
1 60 . 2 1 1 A 7 7 ARG CB C 7 30.100 30.206 -0.106 1
1 63 . 2 1 1 A 7 7 ARG N N 7 122.100 125.087 -2.987 1
1 64 . 2 1 1 A 8 8 LYS H H 8 8.130 8.190 -0.060 1
1 65 . 2 1 1 A 8 8 LYS HA H 8 4.090 4.006 0.084 1
1 74 . 2 1 1 A 8 8 LYS C C 8 177.600 178.858 -1.258 1
1 75 . 2 1 1 A 8 8 LYS CA C 8 58.400 59.527 -1.127 1
1 76 . 2 1 1 A 8 8 LYS CB C 8 31.700 32.297 -0.597 1
1 80 . 2 1 1 A 8 8 LYS N N 8 120.900 119.910 0.990 1
1 81 . 2 1 1 A 9 9 ALA H H 9 8.050 8.159 -0.109 1
1 82 . 2 1 1 A 9 9 ALA HA H 9 3.950 4.066 -0.116 1
1 86 . 2 1 1 A 9 9 ALA C C 9 179.800 180.254 -0.454 1
1 87 . 2 1 1 A 9 9 ALA CA C 9 55.100 55.191 -0.091 1
1 88 . 2 1 1 A 9 9 ALA CB C 9 18.100 17.939 0.161 1
1 89 . 2 1 1 A 9 9 ALA N N 9 121.600 122.397 -0.797 1
1 90 . 2 1 1 A 10 10 ALA H H 10 7.910 7.862 0.048 1
1 91 . 2 1 1 A 10 10 ALA HA H 10 4.200 4.117 0.083 1
1 95 . 2 1 1 A 10 10 ALA C C 10 180.500 179.540 0.960 1
1 96 . 2 1 1 A 10 10 ALA CA C 10 54.600 54.733 -0.133 1
1 97 . 2 1 1 A 10 10 ALA CB C 10 18.100 18.409 -0.309 1
1 98 . 2 1 1 A 10 10 ALA N N 10 120.200 120.842 -0.642 1
1 99 . 2 1 1 A 11 11 LEU H H 11 8.080 7.989 0.091 1
1 100 . 2 1 1 A 11 11 LEU HA H 11 4.120 4.157 -0.037 1
1 110 . 2 1 1 A 11 11 LEU C C 11 179.600 178.627 0.973 1
1 111 . 2 1 1 A 11 11 LEU CA C 11 57.800 57.620 0.180 1
1 112 . 2 1 1 A 11 11 LEU CB C 11 41.700 41.872 -0.172 1
1 115 . 2 1 1 A 11 11 LEU N N 11 120.900 121.017 -0.117 1
1 116 . 2 1 1 A 12 12 LEU H H 12 8.480 8.842 -0.362 1
1 117 . 2 1 1 A 12 12 LEU HA H 12 4.040 3.937 0.103 1
1 127 . 2 1 1 A 12 12 LEU C C 12 178.900 178.906 -0.006 1
1 128 . 2 1 1 A 12 12 LEU CA C 12 58.100 58.052 0.048 1
1 129 . 2 1 1 A 12 12 LEU CB C 12 40.100 40.503 -0.403 1
1 133 . 2 1 1 A 12 12 LEU N N 12 118.700 118.197 0.503 1
1 134 . 2 1 1 A 13 13 ASP H H 13 7.990 8.224 -0.234 1
1 135 . 2 1 1 A 13 13 ASP HA H 13 4.420 4.322 0.098 1
1 138 . 2 1 1 A 13 13 ASP C C 13 178.900 178.600 0.300 1
1 139 . 2 1 1 A 13 13 ASP CA C 13 57.500 57.722 -0.222 1
1 140 . 2 1 1 A 13 13 ASP CB C 13 40.500 41.236 -0.736 1
1 141 . 2 1 1 A 13 13 ASP N N 13 119.500 120.006 -0.506 1
1 142 . 2 1 1 A 14 14 GLN H H 14 7.620 7.595 0.025 1
1 143 . 2 1 1 A 14 14 GLN HA H 14 4.230 4.159 0.071 1
1 150 . 2 1 1 A 14 14 GLN C C 14 178.400 178.564 -0.164 1
1 151 . 2 1 1 A 14 14 GLN CA C 14 58.100 58.553 -0.453 1
1 152 . 2 1 1 A 14 14 GLN CB C 14 27.800 28.334 -0.534 1
1 154 . 2 1 1 A 14 14 GLN N N 14 118.900 119.548 -0.648 1
1 156 . 2 1 1 A 15 15 VAL H H 15 8.480 8.292 0.188 1
1 157 . 2 1 1 A 15 15 VAL HA H 15 3.380 3.606 -0.226 1
1 165 . 2 1 1 A 15 15 VAL C C 15 177.600 178.729 -1.129 1
1 166 . 2 1 1 A 15 15 VAL CA C 15 66.600 66.276 0.324 1
1 167 . 2 1 1 A 15 15 VAL CB C 15 30.500 31.516 -1.016 1
1 170 . 2 1 1 A 15 15 VAL N N 15 121.300 120.262 1.038 1
1 171 . 2 1 1 A 16 16 ALA H H 16 8.080 8.350 -0.270 1
1 172 . 2 1 1 A 16 16 ALA HA H 16 4.450 4.053 0.397 1
1 176 . 2 1 1 A 16 16 ALA C C 16 179.100 179.525 -0.425 1
1 177 . 2 1 1 A 16 16 ALA CA C 16 54.600 55.023 -0.423 1
1 178 . 2 1 1 A 16 16 ALA CB C 16 17.700 17.963 -0.263 1
1 179 . 2 1 1 A 16 16 ALA N N 16 121.400 121.889 -0.489 1
1 180 . 2 1 1 A 17 17 ARG H H 17 7.480 7.869 -0.389 1
1 181 . 2 1 1 A 17 17 ARG HA H 17 3.910 4.094 -0.184 1
1 187 . 2 1 1 A 17 17 ARG C C 17 179.700 178.857 0.843 1
1 188 . 2 1 1 A 17 17 ARG CA C 17 59.700 59.488 0.212 1
1 189 . 2 1 1 A 17 17 ARG CB C 17 30.400 29.869 0.531 1
1 191 . 2 1 1 A 17 17 ARG N N 17 116.900 119.050 -2.150 1
1 192 . 2 1 1 A 18 18 VAL H H 18 7.960 8.101 -0.141 1
1 193 . 2 1 1 A 18 18 VAL HA H 18 3.690 3.764 -0.074 1
1 201 . 2 1 1 A 18 18 VAL C C 18 177.900 177.925 -0.025 1
1 202 . 2 1 1 A 18 18 VAL CA C 18 66.600 65.621 0.979 1
1 203 . 2 1 1 A 18 18 VAL CB C 18 31.300 31.628 -0.328 1
1 206 . 2 1 1 A 18 18 VAL N N 18 123.000 119.100 3.900 1
1 207 . 2 1 1 A 19 19 GLY H H 19 8.270 8.658 -0.388 1
1 208 . 2 1 1 A 19 19 GLY HA2 H 19 3.430 3.720 -0.290 1
1 209 . 2 1 1 A 19 19 GLY HA3 H 19 3.430 3.729 -0.299 1
1 210 . 2 1 1 A 19 19 GLY C C 19 174.400 175.772 -1.372 1
1 211 . 2 1 1 A 19 19 GLY CA C 19 48.500 46.948 1.552 1
1 212 . 2 1 1 A 19 19 GLY N N 19 105.400 107.527 -2.127 1
1 213 . 2 1 1 A 20 20 LYS H H 20 8.250 8.328 -0.078 1
1 214 . 2 1 1 A 20 20 LYS HA H 20 3.710 4.021 -0.311 1
1 223 . 2 1 1 A 20 20 LYS C C 20 179.400 179.269 0.131 1
1 224 . 2 1 1 A 20 20 LYS CA C 20 59.300 59.784 -0.484 1
1 225 . 2 1 1 A 20 20 LYS CB C 20 32.600 32.232 0.368 1
1 229 . 2 1 1 A 20 20 LYS N N 20 118.700 122.133 -3.433 1
1 230 . 2 1 1 A 21 21 ALA H H 21 7.640 7.434 0.206 1
1 231 . 2 1 1 A 21 21 ALA HA H 21 3.790 4.113 -0.323 1
1 235 . 2 1 1 A 21 21 ALA C C 21 177.900 178.707 -0.807 1
1 236 . 2 1 1 A 21 21 ALA CA C 21 55.200 54.183 1.017 1
1 237 . 2 1 1 A 21 21 ALA CB C 21 19.200 18.145 1.055 1
1 238 . 2 1 1 A 21 21 ALA N N 21 121.700 121.643 0.057 1
1 239 . 2 1 1 A 22 22 LEU H H 22 7.330 7.453 -0.123 1
1 240 . 2 1 1 A 22 22 LEU HA H 22 4.140 4.312 -0.172 1
1 250 . 2 1 1 A 22 22 LEU C C 22 176.800 177.896 -1.096 1
1 251 . 2 1 1 A 22 22 LEU CA C 22 54.600 56.813 -2.213 1
1 252 . 2 1 1 A 22 22 LEU CB C 22 42.900 42.618 0.282 1
1 256 . 2 1 1 A 22 22 LEU N N 22 114.200 115.817 -1.617 1
1 257 . 2 1 1 A 23 23 ALA H H 23 7.160 7.690 -0.530 1
1 258 . 2 1 1 A 23 23 ALA HA H 23 4.720 4.377 0.343 1
1 262 . 2 1 1 A 23 23 ALA C C 23 176.700 176.066 0.634 1
1 263 . 2 1 1 A 23 23 ALA CA C 23 53.000 51.750 1.250 1
1 264 . 2 1 1 A 23 23 ALA CB C 23 18.200 17.496 0.704 1
1 265 . 2 1 1 A 23 23 ALA N N 23 118.200 119.852 -1.652 1
1 266 . 2 1 1 A 24 24 ASN H H 24 7.440 8.054 -0.614 1
1 267 . 2 1 1 A 24 24 ASN HA H 24 4.730 5.337 -0.607 1
1 272 . 2 1 1 A 24 24 ASN C C 24 174.800 174.810 -0.010 1
1 273 . 2 1 1 A 24 24 ASN CA C 24 53.500 51.460 2.040 1
1 274 . 2 1 1 A 24 24 ASN CB C 24 41.700 42.685 -0.985 1
1 275 . 2 1 1 A 24 24 ASN N N 24 116.800 118.919 -2.119 1
1 277 . 2 1 1 A 25 25 GLY H H 25 9.370 8.482 0.888 1
1 278 . 2 1 1 A 25 25 GLY HA2 H 25 3.650 4.093 -0.443 1
1 279 . 2 1 1 A 25 25 GLY HA3 H 25 4.110 4.102 0.008 1
1 280 . 2 1 1 A 25 25 GLY C C 25 175.300 174.740 0.560 1
1 281 . 2 1 1 A 25 25 GLY CA C 25 47.600 44.711 2.889 1
1 282 . 2 1 1 A 25 25 GLY N N 25 114.800 107.839 6.961 1
1 283 . 2 1 1 A 26 26 ARG H H 26 8.050 8.748 -0.698 1
1 284 . 2 1 1 A 26 26 ARG HA H 26 4.150 4.145 0.005 1
1 289 . 2 1 1 A 26 26 ARG C C 26 179.300 177.786 1.514 1
1 290 . 2 1 1 A 26 26 ARG CA C 26 57.000 57.965 -0.965 1
1 291 . 2 1 1 A 26 26 ARG CB C 26 29.900 29.277 0.623 1
1 294 . 2 1 1 A 26 26 ARG N N 26 120.500 121.357 -0.857 1
1 295 . 2 1 1 A 27 27 ARG H H 27 7.930 8.024 -0.094 1
1 296 . 2 1 1 A 27 27 ARG HA H 27 3.710 4.051 -0.341 1
1 301 . 2 1 1 A 27 27 ARG C C 27 178.300 178.898 -0.598 1
1 302 . 2 1 1 A 27 27 ARG CA C 27 61.000 59.036 1.964 1
1 303 . 2 1 1 A 27 27 ARG CB C 27 30.400 29.829 0.571 1
1 305 . 2 1 1 A 27 27 ARG N N 27 117.900 118.967 -1.067 1
1 306 . 2 1 1 A 28 28 LEU H H 28 7.640 8.364 -0.724 1
1 307 . 2 1 1 A 28 28 LEU HA H 28 3.950 4.014 -0.064 1
1 317 . 2 1 1 A 28 28 LEU C C 28 178.200 179.132 -0.932 1
1 318 . 2 1 1 A 28 28 LEU CA C 28 57.600 56.605 0.995 1
1 319 . 2 1 1 A 28 28 LEU CB C 28 41.900 41.277 0.623 1
1 323 . 2 1 1 A 28 28 LEU N N 28 117.600 120.075 -2.475 1
1 324 . 2 1 1 A 29 29 GLN H H 29 8.110 8.012 0.098 1
1 325 . 2 1 1 A 29 29 GLN HA H 29 3.880 4.045 -0.165 1
1 332 . 2 1 1 A 29 29 GLN C C 29 179.400 177.951 1.449 1
1 333 . 2 1 1 A 29 29 GLN CA C 29 59.100 58.912 0.188 1
1 334 . 2 1 1 A 29 29 GLN CB C 29 28.800 28.195 0.605 1
1 336 . 2 1 1 A 29 29 GLN N N 29 119.300 119.393 -0.093 1
1 338 . 2 1 1 A 30 30 ILE H H 30 7.530 7.694 -0.164 1
1 339 . 2 1 1 A 30 30 ILE HA H 30 3.340 3.617 -0.277 1
1 349 . 2 1 1 A 30 30 ILE C C 30 176.700 178.925 -2.225 1
1 350 . 2 1 1 A 30 30 ILE CA C 30 65.900 64.978 0.922 1
1 351 . 2 1 1 A 30 30 ILE CB C 30 37.400 37.707 -0.307 1
1 355 . 2 1 1 A 30 30 ILE N N 30 118.600 120.570 -1.970 1
1 356 . 2 1 1 A 31 31 LEU H H 31 7.500 8.007 -0.507 1
1 357 . 2 1 1 A 31 31 LEU HA H 31 3.520 3.683 -0.163 1
1 367 . 2 1 1 A 31 31 LEU C C 31 177.300 178.730 -1.430 1
1 368 . 2 1 1 A 31 31 LEU CA C 31 58.100 57.913 0.187 1
1 369 . 2 1 1 A 31 31 LEU CB C 31 41.100 40.814 0.286 1
1 373 . 2 1 1 A 31 31 LEU N N 31 119.900 119.936 -0.036 1
1 374 . 2 1 1 A 32 32 ASP H H 32 7.950 7.961 -0.011 1
1 375 . 2 1 1 A 32 32 ASP HA H 32 4.300 4.473 -0.173 1
1 378 . 2 1 1 A 32 32 ASP C C 32 178.300 178.345 -0.045 1
1 379 . 2 1 1 A 32 32 ASP CA C 32 57.400 57.435 -0.035 1
1 380 . 2 1 1 A 32 32 ASP CB C 32 42.400 41.793 0.607 1
1 381 . 2 1 1 A 32 32 ASP N N 32 116.900 118.965 -2.065 1
1 382 . 2 1 1 A 33 33 LEU H H 33 7.350 7.457 -0.107 1
1 383 . 2 1 1 A 33 33 LEU HA H 33 4.130 4.120 0.010 1
1 393 . 2 1 1 A 33 33 LEU C C 33 180.000 178.909 1.091 1
1 394 . 2 1 1 A 33 33 LEU CA C 33 57.600 57.904 -0.304 1
1 395 . 2 1 1 A 33 33 LEU CB C 33 42.300 41.595 0.705 1
1 399 . 2 1 1 A 33 33 LEU N N 33 118.600 120.427 -1.827 1
1 400 . 2 1 1 A 34 34 LEU H H 34 8.300 8.204 0.096 1
1 401 . 2 1 1 A 34 34 LEU HA H 34 4.490 4.377 0.113 1
1 411 . 2 1 1 A 34 34 LEU C C 34 178.900 179.486 -0.586 1
1 412 . 2 1 1 A 34 34 LEU CA C 34 55.800 56.673 -0.873 1
1 413 . 2 1 1 A 34 34 LEU CB C 34 41.300 41.572 -0.272 1
1 417 . 2 1 1 A 34 34 LEU N N 34 117.800 118.322 -0.522 1
1 418 . 2 1 1 A 35 35 ALA H H 35 8.160 7.702 0.458 1
1 419 . 2 1 1 A 35 35 ALA HA H 35 4.050 4.087 -0.037 1
1 423 . 2 1 1 A 35 35 ALA C C 35 179.000 178.939 0.061 1
1 424 . 2 1 1 A 35 35 ALA CA C 35 54.900 54.867 0.033 1
1 425 . 2 1 1 A 35 35 ALA CB C 35 17.500 18.145 -0.645 1
1 426 . 2 1 1 A 35 35 ALA N N 35 123.900 121.868 2.032 1
1 427 . 2 1 1 A 36 36 GLN H H 36 7.600 7.913 -0.313 1
1 428 . 2 1 1 A 36 36 GLN HA H 36 4.340 4.217 0.123 1
1 435 . 2 1 1 A 36 36 GLN C C 36 176.100 175.857 0.243 1
1 436 . 2 1 1 A 36 36 GLN CA C 36 55.800 56.472 -0.672 1
1 437 . 2 1 1 A 36 36 GLN CB C 36 29.000 29.448 -0.448 1
1 439 . 2 1 1 A 36 36 GLN N N 36 113.300 114.000 -0.700 1
1 441 . 2 1 1 A 37 37 GLY H H 37 7.550 7.246 0.304 1
1 442 . 2 1 1 A 37 37 GLY HA2 H 37 3.730 4.088 -0.358 1
1 443 . 2 1 1 A 37 37 GLY HA3 H 37 4.490 4.090 0.400 1
1 444 . 2 1 1 A 37 37 GLY C C 37 171.500 172.498 -0.998 1
1 445 . 2 1 1 A 37 37 GLY CA C 37 44.500 45.200 -0.700 1
1 446 . 2 1 1 A 37 37 GLY N N 37 108.400 106.146 2.254 1
1 447 . 2 1 1 A 38 38 GLU H H 38 8.120 8.493 -0.373 1
1 448 . 2 1 1 A 38 38 GLU HA H 38 4.820 4.725 0.095 1
1 453 . 2 1 1 A 38 38 GLU C C 38 177.000 175.638 1.362 1
1 454 . 2 1 1 A 38 38 GLU CA C 38 56.400 56.482 -0.082 1
1 455 . 2 1 1 A 38 38 GLU CB C 38 31.200 30.190 1.010 1
1 457 . 2 1 1 A 38 38 GLU N N 38 119.600 117.858 1.742 1
1 458 . 2 1 1 A 39 39 ARG H H 39 8.580 8.394 0.186 1
1 459 . 2 1 1 A 39 39 ARG HA H 39 4.970 5.150 -0.180 1
1 467 . 2 1 1 A 39 39 ARG C C 39 174.800 174.889 -0.089 1
1 468 . 2 1 1 A 39 39 ARG CA C 39 53.900 54.469 -0.569 1
1 469 . 2 1 1 A 39 39 ARG CB C 39 36.400 33.976 2.424 1
1 472 . 2 1 1 A 39 39 ARG N N 39 121.500 121.472 0.028 1
1 474 . 2 1 1 A 40 40 ALA H H 40 8.910 8.740 0.170 1
1 475 . 2 1 1 A 40 40 ALA HA H 40 4.920 4.284 0.636 1
1 479 . 2 1 1 A 40 40 ALA C C 40 179.200 178.313 0.887 1
1 480 . 2 1 1 A 40 40 ALA CA C 40 51.100 51.730 -0.630 1
1 481 . 2 1 1 A 40 40 ALA CB C 40 19.200 18.960 0.240 1
1 482 . 2 1 1 A 40 40 ALA N N 40 125.100 127.730 -2.630 1
1 483 . 2 1 1 A 41 41 VAL H H 41 8.420 8.737 -0.317 1
1 484 . 2 1 1 A 41 41 VAL HA H 41 3.430 3.616 -0.186 1
1 492 . 2 1 1 A 41 41 VAL C C 41 176.800 177.506 -0.706 1
1 493 . 2 1 1 A 41 41 VAL CA C 41 67.600 66.672 0.928 1
1 494 . 2 1 1 A 41 41 VAL CB C 41 31.600 31.745 -0.145 1
1 497 . 2 1 1 A 41 41 VAL N N 41 120.900 121.178 -0.278 1
1 498 . 2 1 1 A 42 42 GLU H H 42 9.640 8.422 1.218 1
1 499 . 2 1 1 A 42 42 GLU HA H 42 3.880 3.883 -0.003 1
1 504 . 2 1 1 A 42 42 GLU C C 42 178.300 178.592 -0.292 1
1 505 . 2 1 1 A 42 42 GLU CA C 42 60.600 59.575 1.025 1
1 506 . 2 1 1 A 42 42 GLU CB C 42 28.300 29.452 -1.152 1
1 508 . 2 1 1 A 42 42 GLU N N 42 119.000 120.010 -1.010 1
1 509 . 2 1 1 A 43 43 ALA H H 43 6.870 7.626 -0.756 1
1 510 . 2 1 1 A 43 43 ALA HA H 43 4.290 4.011 0.279 1
1 514 . 2 1 1 A 43 43 ALA C C 43 180.700 179.528 1.172 1
1 515 . 2 1 1 A 43 43 ALA CA C 43 54.100 54.900 -0.800 1
1 516 . 2 1 1 A 43 43 ALA CB C 43 19.100 18.081 1.019 1
1 517 . 2 1 1 A 43 43 ALA N N 43 120.500 121.371 -0.871 1
1 518 . 2 1 1 A 44 44 ILE H H 44 7.970 8.264 -0.294 1
1 519 . 2 1 1 A 44 44 ILE HA H 44 3.470 3.602 -0.132 1
1 529 . 2 1 1 A 44 44 ILE C C 44 178.300 178.100 0.200 1
1 530 . 2 1 1 A 44 44 ILE CA C 44 64.700 65.501 -0.801 1
1 531 . 2 1 1 A 44 44 ILE CB C 44 38.100 37.730 0.370 1
1 535 . 2 1 1 A 44 44 ILE N N 44 120.500 119.145 1.355 1
1 536 . 2 1 1 A 45 45 ALA H H 45 8.460 8.467 -0.007 1
1 537 . 2 1 1 A 45 45 ALA HA H 45 3.720 4.030 -0.310 1
1 541 . 2 1 1 A 45 45 ALA C C 45 178.500 179.736 -1.236 1
1 542 . 2 1 1 A 45 45 ALA CA C 45 56.200 55.352 0.848 1
1 543 . 2 1 1 A 45 45 ALA CB C 45 17.400 18.509 -1.109 1
1 544 . 2 1 1 A 45 45 ALA N N 45 124.500 122.134 2.366 1
1 545 . 2 1 1 A 46 46 THR H H 46 8.080 7.950 0.130 1
1 546 . 2 1 1 A 46 46 THR HA H 46 3.900 3.839 0.061 1
1 551 . 2 1 1 A 46 46 THR C C 46 177.200 176.466 0.734 1
1 552 . 2 1 1 A 46 46 THR CA C 46 66.400 66.979 -0.579 1
1 553 . 2 1 1 A 46 46 THR CB C 46 68.800 68.885 -0.085 1
1 555 . 2 1 1 A 46 46 THR N N 46 112.400 113.892 -1.492 1
1 556 . 2 1 1 A 47 47 ALA H H 47 7.930 8.291 -0.361 1
1 557 . 2 1 1 A 47 47 ALA HA H 47 4.200 4.105 0.095 1
1 561 . 2 1 1 A 47 47 ALA C C 47 179.200 179.717 -0.517 1
1 562 . 2 1 1 A 47 47 ALA CA C 47 54.800 55.308 -0.508 1
1 563 . 2 1 1 A 47 47 ALA CB C 47 19.800 18.028 1.772 1
1 564 . 2 1 1 A 47 47 ALA N N 47 121.400 123.756 -2.356 1
1 565 . 2 1 1 A 48 48 THR H H 48 7.560 7.782 -0.222 1
1 566 . 2 1 1 A 48 48 THR HA H 48 4.390 4.377 0.013 1
1 571 . 2 1 1 A 48 48 THR C C 48 175.700 176.020 -0.320 1
1 572 . 2 1 1 A 48 48 THR CA C 48 61.800 62.859 -1.059 1
1 573 . 2 1 1 A 48 48 THR CB C 48 71.000 70.423 0.577 1
1 575 . 2 1 1 A 48 48 THR N N 48 103.500 107.013 -3.513 1
1 576 . 2 1 1 A 49 49 GLY H H 49 7.820 8.537 -0.717 1
1 577 . 2 1 1 A 49 49 GLY HA2 H 49 3.870 3.925 -0.055 1
1 578 . 2 1 1 A 49 49 GLY HA3 H 49 4.100 3.926 0.174 1
1 579 . 2 1 1 A 49 49 GLY C C 49 174.400 173.770 0.630 1
1 580 . 2 1 1 A 49 49 GLY CA C 49 46.300 46.329 -0.029 1
1 581 . 2 1 1 A 49 49 GLY N N 49 111.100 112.142 -1.042 1
1 582 . 2 1 1 A 50 50 MET H H 50 7.930 8.129 -0.199 1
1 583 . 2 1 1 A 50 50 MET HA H 50 4.540 4.955 -0.415 1
1 591 . 2 1 1 A 50 50 MET C C 50 174.800 175.095 -0.295 1
1 592 . 2 1 1 A 50 50 MET CA C 50 55.100 54.297 0.803 1
1 593 . 2 1 1 A 50 50 MET CB C 50 37.200 37.137 0.063 1
1 596 . 2 1 1 A 50 50 MET N N 50 119.300 118.292 1.008 1
1 597 . 2 1 1 A 51 51 ASN H H 51 8.040 8.861 -0.821 1
1 598 . 2 1 1 A 51 51 ASN HA H 51 4.580 4.825 -0.245 1
1 601 . 2 1 1 A 51 51 ASN C C 51 176.100 177.319 -1.219 1
1 602 . 2 1 1 A 51 51 ASN CA C 51 52.800 53.384 -0.584 1
1 603 . 2 1 1 A 51 51 ASN CB C 51 41.100 39.376 1.724 1
1 604 . 2 1 1 A 51 51 ASN N N 51 118.000 118.836 -0.836 1
1 605 . 2 1 1 A 52 52 LEU H H 52 8.560 8.750 -0.190 1
1 606 . 2 1 1 A 52 52 LEU HA H 52 3.760 3.936 -0.176 1
1 616 . 2 1 1 A 52 52 LEU C C 52 179.600 178.447 1.153 1
1 617 . 2 1 1 A 52 52 LEU CA C 52 59.000 58.006 0.994 1
1 618 . 2 1 1 A 52 52 LEU CB C 52 41.800 41.980 -0.180 1
1 622 . 2 1 1 A 52 52 LEU N N 52 120.600 124.002 -3.402 1
1 623 . 2 1 1 A 53 53 THR H H 53 8.230 8.052 0.178 1
1 624 . 2 1 1 A 53 53 THR HA H 53 3.880 3.972 -0.092 1
1 629 . 2 1 1 A 53 53 THR C C 53 176.900 176.889 0.011 1
1 630 . 2 1 1 A 53 53 THR CA C 53 66.500 66.453 0.047 1
1 631 . 2 1 1 A 53 53 THR CB C 53 68.400 68.457 -0.057 1
1 633 . 2 1 1 A 53 53 THR N N 53 115.800 113.659 2.141 1
1 634 . 2 1 1 A 54 54 THR H H 54 8.420 8.103 0.317 1
1 635 . 2 1 1 A 54 54 THR HA H 54 3.880 3.826 0.054 1
1 640 . 2 1 1 A 54 54 THR C C 54 177.300 176.263 1.037 1
1 641 . 2 1 1 A 54 54 THR CA C 54 66.600 66.546 0.054 1
1 642 . 2 1 1 A 54 54 THR CB C 54 66.600 68.721 -2.121 1
1 644 . 2 1 1 A 54 54 THR N N 54 122.300 117.219 5.081 1
1 645 . 2 1 1 A 55 55 ALA H H 55 8.860 8.358 0.502 1
1 646 . 2 1 1 A 55 55 ALA HA H 55 4.020 3.925 0.095 1
1 650 . 2 1 1 A 55 55 ALA C C 55 179.000 179.353 -0.353 1
1 651 . 2 1 1 A 55 55 ALA CA C 55 56.100 55.332 0.768 1
1 652 . 2 1 1 A 55 55 ALA CB C 55 17.000 17.918 -0.918 1
1 653 . 2 1 1 A 55 55 ALA N N 55 125.600 123.389 2.211 1
1 654 . 2 1 1 A 56 56 SER H H 56 8.440 8.353 0.087 1
1 655 . 2 1 1 A 56 56 SER HA H 56 3.920 4.096 -0.176 1
1 658 . 2 1 1 A 56 56 SER C C 56 176.400 176.946 -0.546 1
1 659 . 2 1 1 A 56 56 SER CA C 56 62.600 61.431 1.169 1
1 660 . 2 1 1 A 56 56 SER CB C 56 62.700 62.188 0.512 1
1 661 . 2 1 1 A 56 56 SER N N 56 112.700 113.064 -0.364 1
1 662 . 2 1 1 A 57 57 ALA H H 57 8.090 7.852 0.238 1
1 663 . 2 1 1 A 57 57 ALA HA H 57 4.130 4.000 0.130 1
1 667 . 2 1 1 A 57 57 ALA C C 57 181.200 179.633 1.567 1
1 668 . 2 1 1 A 57 57 ALA CA C 57 55.200 55.290 -0.090 1
1 669 . 2 1 1 A 57 57 ALA CB C 57 17.900 17.812 0.088 1
1 670 . 2 1 1 A 57 57 ALA N N 57 124.000 124.258 -0.258 1
1 671 . 2 1 1 A 58 58 ASN H H 58 7.970 8.293 -0.323 1
1 672 . 2 1 1 A 58 58 ASN HA H 58 4.480 4.415 0.065 1
1 677 . 2 1 1 A 58 58 ASN C C 58 177.500 178.321 -0.821 1
1 678 . 2 1 1 A 58 58 ASN CA C 58 56.900 56.404 0.496 1
1 679 . 2 1 1 A 58 58 ASN CB C 58 39.800 37.903 1.897 1
1 680 . 2 1 1 A 58 58 ASN N N 58 117.600 117.913 -0.313 1
1 682 . 2 1 1 A 59 59 LEU H H 59 8.530 8.303 0.227 1
1 683 . 2 1 1 A 59 59 LEU HA H 59 3.710 3.695 0.015 1
1 693 . 2 1 1 A 59 59 LEU C C 59 178.400 179.217 -0.817 1
1 694 . 2 1 1 A 59 59 LEU CA C 59 58.600 57.691 0.909 1
1 695 . 2 1 1 A 59 59 LEU CB C 59 40.500 40.442 0.058 1
1 699 . 2 1 1 A 59 59 LEU N N 59 122.600 120.863 1.737 1
1 700 . 2 1 1 A 60 60 GLN H H 60 8.200 7.901 0.299 1
1 701 . 2 1 1 A 60 60 GLN HA H 60 4.020 4.140 -0.120 1
1 708 . 2 1 1 A 60 60 GLN C C 60 178.700 178.438 0.262 1
1 709 . 2 1 1 A 60 60 GLN CA C 60 58.800 58.936 -0.136 1
1 710 . 2 1 1 A 60 60 GLN CB C 60 27.700 28.287 -0.587 1
1 712 . 2 1 1 A 60 60 GLN N N 60 118.900 118.209 0.691 1
1 714 . 2 1 1 A 61 61 ALA H H 61 7.580 7.667 -0.087 1
1 715 . 2 1 1 A 61 61 ALA HA H 61 4.230 3.997 0.233 1
1 719 . 2 1 1 A 61 61 ALA C C 61 181.300 179.985 1.315 1
1 720 . 2 1 1 A 61 61 ALA CA C 61 55.100 54.974 0.126 1
1 721 . 2 1 1 A 61 61 ALA CB C 61 17.600 18.346 -0.746 1
1 722 . 2 1 1 A 61 61 ALA N N 61 122.200 123.116 -0.916 1
1 723 . 2 1 1 A 62 62 LEU H H 62 7.830 8.162 -0.332 1
1 724 . 2 1 1 A 62 62 LEU HA H 62 3.980 3.931 0.049 1
1 734 . 2 1 1 A 62 62 LEU C C 62 178.500 179.285 -0.785 1
1 735 . 2 1 1 A 62 62 LEU CA C 62 58.100 57.534 0.566 1
1 736 . 2 1 1 A 62 62 LEU CB C 62 43.300 41.322 1.978 1
1 739 . 2 1 1 A 62 62 LEU N N 62 119.000 118.443 0.557 1
1 740 . 2 1 1 A 63 63 LYS H H 63 8.580 8.283 0.297 1
1 741 . 2 1 1 A 63 63 LYS HA H 63 4.130 4.462 -0.332 1
1 750 . 2 1 1 A 63 63 LYS C C 63 180.500 179.330 1.170 1
1 751 . 2 1 1 A 63 63 LYS CA C 63 59.700 58.957 0.743 1
1 752 . 2 1 1 A 63 63 LYS CB C 63 32.600 32.153 0.447 1
1 756 . 2 1 1 A 63 63 LYS N N 63 123.400 121.644 1.756 1
1 757 . 2 1 1 A 64 64 SER H H 64 8.640 8.086 0.554 1
1 758 . 2 1 1 A 64 64 SER HA H 64 4.300 4.332 -0.032 1
1 761 . 2 1 1 A 64 64 SER C C 64 175.000 176.430 -1.430 1
1 762 . 2 1 1 A 64 64 SER CA C 64 61.400 62.023 -0.623 1
1 763 . 2 1 1 A 64 64 SER CB C 64 63.000 62.799 0.201 1
1 764 . 2 1 1 A 64 64 SER N N 64 117.700 117.505 0.195 1
1 765 . 2 1 1 A 65 65 GLY H H 65 7.280 7.568 -0.288 1
1 766 . 2 1 1 A 65 65 GLY HA2 H 65 3.240 3.938 -0.698 1
1 767 . 2 1 1 A 65 65 GLY HA3 H 65 3.980 3.942 0.038 1
1 768 . 2 1 1 A 65 65 GLY C C 65 171.300 174.549 -3.249 1
1 769 . 2 1 1 A 65 65 GLY CA C 65 45.100 45.411 -0.311 1
1 770 . 2 1 1 A 65 65 GLY N N 65 104.400 108.590 -4.190 1
1 771 . 2 1 1 A 66 66 GLY H H 66 7.730 7.816 -0.086 1
1 772 . 2 1 1 A 66 66 GLY HA2 H 66 3.650 3.986 -0.336 1
1 773 . 2 1 1 A 66 66 GLY HA3 H 66 3.750 3.989 -0.239 1
1 774 . 2 1 1 A 66 66 GLY C C 66 173.700 175.219 -1.519 1
1 775 . 2 1 1 A 66 66 GLY CA C 66 45.400 45.675 -0.275 1
1 776 . 2 1 1 A 66 66 GLY N N 66 104.700 108.507 -3.807 1
1 777 . 2 1 1 A 67 67 LEU H H 67 7.520 8.227 -0.707 1
1 778 . 2 1 1 A 67 67 LEU HA H 67 4.310 4.148 0.162 1
1 788 . 2 1 1 A 67 67 LEU C C 67 177.700 177.054 0.646 1
1 789 . 2 1 1 A 67 67 LEU CA C 67 55.500 56.919 -1.419 1
1 790 . 2 1 1 A 67 67 LEU CB C 67 42.400 42.245 0.155 1
1 794 . 2 1 1 A 67 67 LEU N N 67 110.600 119.246 -8.646 1
1 795 . 2 1 1 A 68 68 VAL H H 68 6.890 7.540 -0.650 1
1 796 . 2 1 1 A 68 68 VAL HA H 68 5.190 4.989 0.201 1
1 804 . 2 1 1 A 68 68 VAL C C 68 173.700 174.560 -0.860 1
1 805 . 2 1 1 A 68 68 VAL CA C 68 57.400 58.592 -1.192 1
1 806 . 2 1 1 A 68 68 VAL CB C 68 36.400 35.680 0.720 1
1 809 . 2 1 1 A 68 68 VAL N N 68 106.400 111.786 -5.386 1
1 810 . 2 1 1 A 69 69 GLU H H 69 8.880 9.104 -0.224 1
1 811 . 2 1 1 A 69 69 GLU HA H 69 4.660 5.007 -0.347 1
1 816 . 2 1 1 A 69 69 GLU C C 69 173.300 174.887 -1.587 1
1 817 . 2 1 1 A 69 69 GLU CA C 69 54.300 54.584 -0.284 1
1 818 . 2 1 1 A 69 69 GLU CB C 69 34.100 33.077 1.023 1
1 820 . 2 1 1 A 69 69 GLU N N 69 120.400 120.910 -0.510 1
1 821 . 2 1 1 A 70 70 ALA H H 70 8.730 8.609 0.121 1
1 822 . 2 1 1 A 70 70 ALA HA H 70 4.990 4.141 0.849 1
1 826 . 2 1 1 A 70 70 ALA C C 70 176.500 175.949 0.551 1
1 827 . 2 1 1 A 70 70 ALA CA C 70 50.000 50.194 -0.194 1
1 828 . 2 1 1 A 70 70 ALA CB C 70 22.300 20.058 2.242 1
1 829 . 2 1 1 A 70 70 ALA N N 70 122.800 123.765 -0.965 1
1 830 . 2 1 1 A 71 71 ARG H H 71 8.670 8.946 -0.276 1
1 831 . 2 1 1 A 71 71 ARG HA H 71 4.630 4.703 -0.073 1
1 843 . 2 1 1 A 71 71 ARG C C 71 173.500 174.738 -1.238 1
1 844 . 2 1 1 A 71 71 ARG CA C 71 54.600 54.752 -0.152 1
1 845 . 2 1 1 A 71 71 ARG CB C 71 33.600 31.626 1.974 1
1 849 . 2 1 1 A 71 71 ARG N N 71 120.100 124.639 -4.539 1
1 851 . 2 1 1 A 72 72 ARG H H 72 8.780 8.995 -0.215 1
1 852 . 2 1 1 A 72 72 ARG HA H 72 5.100 4.769 0.331 1
1 859 . 2 1 1 A 72 72 ARG C C 72 176.000 174.591 1.409 1
1 860 . 2 1 1 A 72 72 ARG CA C 72 54.900 55.300 -0.400 1
1 861 . 2 1 1 A 72 72 ARG CB C 72 32.500 30.719 1.781 1
1 864 . 2 1 1 A 72 72 ARG N N 72 123.600 126.560 -2.960 1
1 865 . 2 1 1 A 73 73 GLU H H 73 8.720 8.806 -0.086 1
1 866 . 2 1 1 A 73 73 GLU HA H 73 4.510 4.652 -0.142 1
1 871 . 2 1 1 A 73 73 GLU C C 73 175.900 176.730 -0.830 1
1 872 . 2 1 1 A 73 73 GLU CA C 73 55.700 55.086 0.614 1
1 873 . 2 1 1 A 73 73 GLU CB C 73 31.800 31.052 0.748 1
1 875 . 2 1 1 A 73 73 GLU N N 73 126.800 125.048 1.752 1
1 876 . 2 1 1 A 74 74 GLY H H 74 9.190 8.937 0.253 1
1 877 . 2 1 1 A 74 74 GLY HA2 H 74 3.700 3.880 -0.180 1
1 878 . 2 1 1 A 74 74 GLY HA3 H 74 4.170 3.893 0.277 1
1 879 . 2 1 1 A 74 74 GLY C C 74 175.400 174.903 0.497 1
1 880 . 2 1 1 A 74 74 GLY CA C 74 47.100 47.152 -0.052 1
1 881 . 2 1 1 A 74 74 GLY N N 74 118.500 116.873 1.627 1
1 882 . 2 1 1 A 75 75 THR H H 75 8.780 8.792 -0.012 1
1 883 . 2 1 1 A 75 75 THR HA H 75 4.290 4.417 -0.127 1
1 888 . 2 1 1 A 75 75 THR C C 75 174.600 174.253 0.347 1
1 889 . 2 1 1 A 75 75 THR CA C 75 62.000 62.552 -0.552 1
1 890 . 2 1 1 A 75 75 THR CB C 75 69.000 69.748 -0.748 1
1 892 . 2 1 1 A 75 75 THR N N 75 118.000 120.005 -2.005 1
1 893 . 2 1 1 A 76 76 ARG H H 76 8.030 7.471 0.559 1
1 894 . 2 1 1 A 76 76 ARG HA H 76 4.610 4.901 -0.291 1
1 901 . 2 1 1 A 76 76 ARG C C 76 174.800 174.969 -0.169 1
1 902 . 2 1 1 A 76 76 ARG CA C 76 55.500 54.685 0.815 1
1 903 . 2 1 1 A 76 76 ARG CB C 76 32.700 32.643 0.057 1
1 906 . 2 1 1 A 76 76 ARG N N 76 122.600 121.941 0.659 1
1 907 . 2 1 1 A 77 77 GLN H H 77 8.580 8.705 -0.125 1
1 908 . 2 1 1 A 77 77 GLN HA H 77 4.910 5.011 -0.101 1
1 915 . 2 1 1 A 77 77 GLN C C 77 173.900 174.597 -0.697 1
1 916 . 2 1 1 A 77 77 GLN CA C 77 54.700 54.682 0.018 1
1 917 . 2 1 1 A 77 77 GLN CB C 77 31.800 30.604 1.196 1
1 919 . 2 1 1 A 77 77 GLN N N 77 121.900 121.664 0.236 1
1 921 . 2 1 1 A 78 78 TYR H H 78 8.890 9.522 -0.632 1
1 922 . 2 1 1 A 78 78 TYR HA H 78 4.750 5.432 -0.682 1
1 929 . 2 1 1 A 78 78 TYR C C 78 175.600 174.453 1.147 1
1 930 . 2 1 1 A 78 78 TYR CA C 78 57.000 56.474 0.526 1
1 931 . 2 1 1 A 78 78 TYR CB C 78 41.400 41.130 0.270 1
1 936 . 2 1 1 A 78 78 TYR N N 78 121.800 123.063 -1.263 1
1 937 . 2 1 1 A 79 79 TYR H H 79 9.010 9.262 -0.252 1
1 938 . 2 1 1 A 79 79 TYR HA H 79 5.410 5.339 0.071 1
1 945 . 2 1 1 A 79 79 TYR C C 79 173.100 174.332 -1.232 1
1 946 . 2 1 1 A 79 79 TYR CA C 79 57.300 56.437 0.863 1
1 947 . 2 1 1 A 79 79 TYR CB C 79 43.300 41.777 1.523 1
1 952 . 2 1 1 A 79 79 TYR N N 79 122.500 120.906 1.594 1
1 953 . 2 1 1 A 80 80 ARG H H 80 8.720 8.637 0.083 1
1 954 . 2 1 1 A 80 80 ARG HA H 80 5.120 4.985 0.135 1
1 962 . 2 1 1 A 80 80 ARG C C 80 175.500 174.968 0.532 1
1 963 . 2 1 1 A 80 80 ARG CA C 80 53.200 53.933 -0.733 1
1 964 . 2 1 1 A 80 80 ARG CB C 80 33.900 34.045 -0.145 1
1 967 . 2 1 1 A 80 80 ARG N N 80 114.500 122.603 -8.103 1
1 969 . 2 1 1 A 81 81 ILE H H 81 9.300 8.686 0.614 1
1 970 . 2 1 1 A 81 81 ILE HA H 81 4.150 4.144 0.006 1
1 980 . 2 1 1 A 81 81 ILE C C 81 177.800 177.280 0.520 1
1 981 . 2 1 1 A 81 81 ILE CA C 81 62.300 62.402 -0.102 1
1 982 . 2 1 1 A 81 81 ILE CB C 81 37.800 37.860 -0.060 1
1 986 . 2 1 1 A 81 81 ILE N N 81 122.100 126.741 -4.641 1
1 987 . 2 1 1 A 82 82 ALA H H 82 7.930 8.716 -0.786 1
1 988 . 2 1 1 A 82 82 ALA HA H 82 3.930 4.072 -0.142 1
1 992 . 2 1 1 A 82 82 ALA C C 82 176.300 177.495 -1.195 1
1 993 . 2 1 1 A 82 82 ALA CA C 82 54.200 55.417 -1.217 1
1 994 . 2 1 1 A 82 82 ALA CB C 82 18.500 19.143 -0.643 1
1 995 . 2 1 1 A 82 82 ALA N N 82 127.200 129.567 -2.367 1
1 996 . 2 1 1 A 83 83 GLY H H 83 6.980 7.834 -0.854 1
1 997 . 2 1 1 A 83 83 GLY HA2 H 83 4.090 4.187 -0.097 1
1 998 . 2 1 1 A 83 83 GLY HA3 H 83 4.440 4.189 0.251 1
1 999 . 2 1 1 A 83 83 GLY C C 83 173.600 174.814 -1.214 1
1 1000 . 2 1 1 A 83 83 GLY CA C 83 45.200 44.334 0.866 1
1 1001 . 2 1 1 A 83 83 GLY N N 83 101.800 103.372 -1.572 1
1 1002 . 2 1 1 A 84 84 GLU H H 84 8.930 8.894 0.036 1
1 1003 . 2 1 1 A 84 84 GLU HA H 84 4.120 4.010 0.110 1
1 1008 . 2 1 1 A 84 84 GLU C C 84 178.300 177.744 0.556 1
1 1009 . 2 1 1 A 84 84 GLU CA C 84 58.900 58.824 0.076 1
1 1010 . 2 1 1 A 84 84 GLU CB C 84 29.400 29.688 -0.288 1
1 1012 . 2 1 1 A 84 84 GLU N N 84 120.300 121.030 -0.730 1
1 1013 . 2 1 1 A 85 85 ASP H H 85 8.950 8.159 0.791 1
1 1014 . 2 1 1 A 85 85 ASP HA H 85 4.310 4.363 -0.053 1
1 1017 . 2 1 1 A 85 85 ASP C C 85 178.000 178.840 -0.840 1
1 1018 . 2 1 1 A 85 85 ASP CA C 85 57.100 57.378 -0.278 1
1 1019 . 2 1 1 A 85 85 ASP CB C 85 38.900 40.921 -2.021 1
1 1020 . 2 1 1 A 85 85 ASP N N 85 119.400 119.223 0.177 1
1 1021 . 2 1 1 A 86 86 VAL H H 86 7.620 7.860 -0.240 1
1 1022 . 2 1 1 A 86 86 VAL HA H 86 3.480 3.603 -0.123 1
1 1030 . 2 1 1 A 86 86 VAL C C 86 177.400 177.898 -0.498 1
1 1031 . 2 1 1 A 86 86 VAL CA C 86 66.800 66.501 0.299 1
1 1032 . 2 1 1 A 86 86 VAL CB C 86 31.300 31.432 -0.132 1
1 1035 . 2 1 1 A 86 86 VAL N N 86 121.600 120.042 1.558 1
1 1036 . 2 1 1 A 87 87 ALA H H 87 7.520 8.132 -0.612 1
1 1037 . 2 1 1 A 87 87 ALA HA H 87 4.110 4.005 0.105 1
1 1041 . 2 1 1 A 87 87 ALA C C 87 181.200 179.917 1.283 1
1 1042 . 2 1 1 A 87 87 ALA CA C 87 55.800 55.764 0.036 1
1 1043 . 2 1 1 A 87 87 ALA CB C 87 17.600 18.792 -1.192 1
1 1044 . 2 1 1 A 87 87 ALA N N 87 122.700 121.792 0.908 1
1 1045 . 2 1 1 A 88 88 ARG H H 88 8.380 8.130 0.250 1
1 1046 . 2 1 1 A 88 88 ARG HA H 88 4.090 4.040 0.050 1
1 1054 . 2 1 1 A 88 88 ARG C C 88 179.100 178.854 0.246 1
1 1055 . 2 1 1 A 88 88 ARG CA C 88 59.600 59.185 0.415 1
1 1056 . 2 1 1 A 88 88 ARG CB C 88 30.500 29.978 0.522 1
1 1059 . 2 1 1 A 88 88 ARG N N 88 119.200 118.661 0.539 1
1 1061 . 2 1 1 A 89 89 LEU H H 89 8.480 7.766 0.714 1
1 1062 . 2 1 1 A 89 89 LEU HA H 89 4.040 4.032 0.008 1
1 1071 . 2 1 1 A 89 89 LEU C C 89 177.200 178.665 -1.465 1
1 1072 . 2 1 1 A 89 89 LEU CA C 89 58.300 58.390 -0.090 1
1 1073 . 2 1 1 A 89 89 LEU CB C 89 41.300 42.085 -0.785 1
1 1076 . 2 1 1 A 89 89 LEU N N 89 123.300 121.405 1.895 1
1 1077 . 2 1 1 A 90 90 PHE H H 90 8.890 8.603 0.287 1
1 1078 . 2 1 1 A 90 90 PHE HA H 90 4.380 4.049 0.331 1
1 1086 . 2 1 1 A 90 90 PHE C C 90 177.500 177.838 -0.338 1
1 1087 . 2 1 1 A 90 90 PHE CA C 90 59.400 62.210 -2.810 1
1 1088 . 2 1 1 A 90 90 PHE CB C 90 38.600 39.107 -0.507 1
1 1094 . 2 1 1 A 90 90 PHE N N 90 119.400 119.658 -0.258 1
1 1095 . 2 1 1 A 91 91 ALA H H 91 7.920 8.123 -0.203 1
1 1096 . 2 1 1 A 91 91 ALA HA H 91 3.940 4.033 -0.093 1
1 1100 . 2 1 1 A 91 91 ALA C C 91 180.200 179.847 0.353 1
1 1101 . 2 1 1 A 91 91 ALA CA C 91 55.100 55.192 -0.092 1
1 1102 . 2 1 1 A 91 91 ALA CB C 91 18.000 18.164 -0.164 1
1 1103 . 2 1 1 A 91 91 ALA N N 91 120.500 121.265 -0.765 1
1 1104 . 2 1 1 A 92 92 LEU H H 92 8.190 8.110 0.080 1
1 1105 . 2 1 1 A 92 92 LEU HA H 92 4.300 4.072 0.228 1
1 1115 . 2 1 1 A 92 92 LEU C C 92 178.900 178.595 0.305 1
1 1116 . 2 1 1 A 92 92 LEU CA C 92 57.500 57.960 -0.460 1
1 1117 . 2 1 1 A 92 92 LEU CB C 92 42.100 41.592 0.508 1
1 1121 . 2 1 1 A 92 92 LEU N N 92 120.200 119.575 0.625 1
1 1122 . 2 1 1 A 93 93 VAL H H 93 8.890 8.130 0.760 1
1 1123 . 2 1 1 A 93 93 VAL HA H 93 3.810 3.398 0.412 1
1 1131 . 2 1 1 A 93 93 VAL C C 93 176.900 178.052 -1.152 1
1 1132 . 2 1 1 A 93 93 VAL CA C 93 66.000 66.704 -0.704 1
1 1133 . 2 1 1 A 93 93 VAL CB C 93 31.200 31.222 -0.022 1
1 1136 . 2 1 1 A 93 93 VAL N N 93 117.100 119.477 -2.377 1
1 1137 . 2 1 1 A 94 94 GLN H H 94 6.920 7.845 -0.925 1
1 1138 . 2 1 1 A 94 94 GLN HA H 94 3.790 3.793 -0.003 1
1 1145 . 2 1 1 A 94 94 GLN C C 94 177.400 178.306 -0.906 1
1 1146 . 2 1 1 A 94 94 GLN CA C 94 60.000 58.636 1.364 1
1 1147 . 2 1 1 A 94 94 GLN CB C 94 30.300 28.046 2.254 1
1 1149 . 2 1 1 A 94 94 GLN N N 94 117.800 120.277 -2.477 1
1 1151 . 2 1 1 A 95 95 VAL H H 95 7.420 7.925 -0.505 1
1 1152 . 2 1 1 A 95 95 VAL HA H 95 3.760 3.528 0.232 1
1 1160 . 2 1 1 A 95 95 VAL C C 95 178.300 177.991 0.309 1
1 1161 . 2 1 1 A 95 95 VAL CA C 95 66.600 66.452 0.148 1
1 1162 . 2 1 1 A 95 95 VAL CB C 95 31.900 31.571 0.329 1
1 1165 . 2 1 1 A 95 95 VAL N N 95 121.500 119.931 1.569 1
1 1166 . 2 1 1 A 96 96 VAL H H 96 8.340 8.572 -0.232 1
1 1167 . 2 1 1 A 96 96 VAL HA H 96 3.810 3.518 0.292 1
1 1175 . 2 1 1 A 96 96 VAL C C 96 178.400 178.301 0.099 1
1 1176 . 2 1 1 A 96 96 VAL CA C 96 66.100 66.452 -0.352 1
1 1177 . 2 1 1 A 96 96 VAL CB C 96 32.200 31.586 0.614 1
1 1180 . 2 1 1 A 96 96 VAL N N 96 120.000 120.148 -0.148 1
1 1181 . 2 1 1 A 97 97 ALA H H 97 8.140 8.177 -0.037 1
1 1182 . 2 1 1 A 97 97 ALA HA H 97 4.010 3.968 0.042 1
1 1186 . 2 1 1 A 97 97 ALA C C 97 178.800 178.671 0.129 1
1 1187 . 2 1 1 A 97 97 ALA CA C 97 54.900 55.837 -0.937 1
1 1188 . 2 1 1 A 97 97 ALA CB C 97 19.900 18.124 1.776 1
1 1189 . 2 1 1 A 97 97 ALA N N 97 121.400 121.914 -0.514 1
1 1190 . 2 1 1 A 98 98 ASP H H 98 8.170 8.221 -0.051 1
1 1191 . 2 1 1 A 98 98 ASP HA H 98 4.320 4.251 0.069 1
1 1194 . 2 1 1 A 98 98 ASP C C 98 178.100 178.239 -0.139 1
1 1195 . 2 1 1 A 98 98 ASP CA C 98 57.100 57.768 -0.668 1
1 1196 . 2 1 1 A 98 98 ASP CB C 98 41.800 41.646 0.154 1
1 1197 . 2 1 1 A 98 98 ASP N N 98 118.500 118.335 0.165 1
1 1198 . 2 1 1 A 99 99 GLU H H 99 8.220 8.744 -0.524 1
1 1199 . 2 1 1 A 99 99 GLU HA H 99 4.000 4.020 -0.020 1
1 1204 . 2 1 1 A 99 99 GLU C C 99 178.300 177.153 1.147 1
1 1205 . 2 1 1 A 99 99 GLU CA C 99 58.300 58.362 -0.062 1
1 1206 . 2 1 1 A 99 99 GLU CB C 99 29.800 27.840 1.960 1
1 1208 . 2 1 1 A 99 99 GLU N N 99 116.600 116.892 -0.292 1
1 1209 . 2 1 1 A 100 100 HIS H H 100 7.980 7.313 0.667 1
1 1210 . 2 1 1 A 100 100 HIS HA H 100 4.600 4.590 0.010 1
1 1214 . 2 1 1 A 100 100 HIS C C 100 175.900 176.393 -0.493 1
1 1215 . 2 1 1 A 100 100 HIS CA C 100 57.500 56.331 1.169 1
1 1216 . 2 1 1 A 100 100 HIS CB C 100 30.800 31.182 -0.382 1
1 1218 . 2 1 1 A 100 100 HIS N N 100 114.000 117.788 -3.788 1
1 1219 . 2 1 1 A 101 101 LEU H H 101 7.920 8.179 -0.259 1
1 1220 . 2 1 1 A 101 101 LEU HA H 101 4.370 3.915 0.455 1
1 1230 . 2 1 1 A 101 101 LEU C C 101 177.700 177.356 0.344 1
1 1231 . 2 1 1 A 101 101 LEU CA C 101 55.900 57.523 -1.623 1
1 1232 . 2 1 1 A 101 101 LEU CB C 101 42.100 41.907 0.193 1
1 1236 . 2 1 1 A 101 101 LEU N N 101 118.500 121.515 -3.015 1
1 1237 . 2 1 1 A 102 102 GLU H H 102 8.100 7.810 0.290 1
1 1238 . 2 1 1 A 102 102 GLU HA H 102 4.160 4.047 0.113 1
1 1243 . 2 1 1 A 102 102 GLU C C 102 176.700 175.525 1.175 1
1 1244 . 2 1 1 A 102 102 GLU CA C 102 57.000 56.890 0.110 1
1 1245 . 2 1 1 A 102 102 GLU CB C 102 29.900 30.273 -0.373 1
1 1247 . 2 1 1 A 102 102 GLU N N 102 119.100 119.783 -0.683 1
1 1248 . 2 1 1 A 103 103 HIS H H 103 8.010 8.743 -0.733 1
1 1249 . 2 1 1 A 103 103 HIS HA H 103 4.520 5.100 -0.580 1
1 1252 . 2 1 1 A 103 103 HIS CA C 103 56.100 54.566 1.534 1
1 1253 . 2 1 1 A 103 103 HIS CB C 103 29.700 33.571 -3.871 1
1 1254 . 2 1 1 A 103 103 HIS N N 103 117.300 124.565 -7.265 1
1 1255 . 2 1 1 A 107 107 HIS HA H 107 4.560 4.202 0.358 1
1 1258 . 2 1 1 A 107 107 HIS C C 107 173.900 174.059 -0.159 1
1 1259 . 2 1 1 A 107 107 HIS CA C 107 55.900 57.302 -1.402 1
1 1260 . 2 1 1 A 107 107 HIS CB C 107 30.200 30.858 -0.658 1
1 4 . 3 1 1 A 2 2 ALA H H 2 8.450 8.323 0.127 1
1 5 . 3 1 1 A 2 2 ALA HA H 2 4.390 4.797 -0.407 1
1 9 . 3 1 1 A 2 2 ALA C C 2 178.300 177.226 1.074 1
1 10 . 3 1 1 A 2 2 ALA CA C 2 52.500 51.107 1.393 1
1 11 . 3 1 1 A 2 2 ALA CB C 2 19.200 22.989 -3.789 1
1 12 . 3 1 1 A 2 2 ALA N N 2 125.100 124.654 0.446 1
1 13 . 3 1 1 A 3 3 GLY H H 3 8.450 8.827 -0.377 1
1 14 . 3 1 1 A 3 3 GLY HA2 H 3 4.030 3.824 0.206 1
1 15 . 3 1 1 A 3 3 GLY HA3 H 3 4.030 3.824 0.206 1
1 16 . 3 1 1 A 3 3 GLY C C 3 174.100 174.269 -0.169 1
1 17 . 3 1 1 A 3 3 GLY CA C 3 45.200 47.316 -2.116 1
1 18 . 3 1 1 A 3 3 GLY N N 3 108.000 108.404 -0.404 1
1 19 . 3 1 1 A 4 4 GLN H H 4 8.550 7.693 0.857 1
1 20 . 3 1 1 A 4 4 GLN HA H 4 4.340 4.039 0.301 1
1 27 . 3 1 1 A 4 4 GLN C C 4 176.700 175.867 0.833 1
1 28 . 3 1 1 A 4 4 GLN CA C 4 56.600 56.574 0.026 1
1 29 . 3 1 1 A 4 4 GLN CB C 4 29.300 27.438 1.862 1
1 31 . 3 1 1 A 4 4 GLN N N 4 120.500 114.980 5.520 1
1 33 . 3 1 1 A 5 5 SER H H 5 8.540 8.427 0.113 1
1 34 . 3 1 1 A 5 5 SER HA H 5 4.390 4.625 -0.235 1
1 38 . 3 1 1 A 5 5 SER C C 5 174.800 174.621 0.179 1
1 39 . 3 1 1 A 5 5 SER CA C 5 59.100 58.264 0.836 1
1 40 . 3 1 1 A 5 5 SER CB C 5 63.500 63.605 -0.105 1
1 41 . 3 1 1 A 5 5 SER N N 5 117.100 118.462 -1.362 1
1 42 . 3 1 1 A 6 6 ASP H H 6 8.300 8.265 0.035 1
1 43 . 3 1 1 A 6 6 ASP HA H 6 4.540 4.654 -0.114 1
1 46 . 3 1 1 A 6 6 ASP C C 6 177.300 175.839 1.461 1
1 47 . 3 1 1 A 6 6 ASP CA C 6 55.100 53.703 1.397 1
1 48 . 3 1 1 A 6 6 ASP CB C 6 40.800 39.836 0.964 1
1 49 . 3 1 1 A 6 6 ASP N N 6 122.700 120.397 2.303 1
1 50 . 3 1 1 A 7 7 ARG H H 7 8.270 8.240 0.030 1
1 51 . 3 1 1 A 7 7 ARG HA H 7 4.150 4.044 0.106 1
1 58 . 3 1 1 A 7 7 ARG C C 7 177.600 179.409 -1.809 1
1 59 . 3 1 1 A 7 7 ARG CA C 7 58.000 59.435 -1.435 1
1 60 . 3 1 1 A 7 7 ARG CB C 7 30.100 29.896 0.204 1
1 63 . 3 1 1 A 7 7 ARG N N 7 122.100 123.162 -1.062 1
1 64 . 3 1 1 A 8 8 LYS H H 8 8.130 8.119 0.011 1
1 65 . 3 1 1 A 8 8 LYS HA H 8 4.090 4.095 -0.005 1
1 74 . 3 1 1 A 8 8 LYS C C 8 177.600 178.853 -1.253 1
1 75 . 3 1 1 A 8 8 LYS CA C 8 58.400 58.537 -0.137 1
1 76 . 3 1 1 A 8 8 LYS CB C 8 31.700 32.171 -0.471 1
1 80 . 3 1 1 A 8 8 LYS N N 8 120.900 120.020 0.880 1
1 81 . 3 1 1 A 9 9 ALA H H 9 8.050 8.152 -0.102 1
1 82 . 3 1 1 A 9 9 ALA HA H 9 3.950 4.070 -0.120 1
1 86 . 3 1 1 A 9 9 ALA C C 9 179.800 180.352 -0.552 1
1 87 . 3 1 1 A 9 9 ALA CA C 9 55.100 54.826 0.274 1
1 88 . 3 1 1 A 9 9 ALA CB C 9 18.100 18.044 0.056 1
1 89 . 3 1 1 A 9 9 ALA N N 9 121.600 121.545 0.055 1
1 90 . 3 1 1 A 10 10 ALA H H 10 7.910 7.671 0.239 1
1 91 . 3 1 1 A 10 10 ALA HA H 10 4.200 4.205 -0.005 1
1 95 . 3 1 1 A 10 10 ALA C C 10 180.500 180.218 0.282 1
1 96 . 3 1 1 A 10 10 ALA CA C 10 54.600 54.763 -0.163 1
1 97 . 3 1 1 A 10 10 ALA CB C 10 18.100 18.404 -0.304 1
1 98 . 3 1 1 A 10 10 ALA N N 10 120.200 120.397 -0.197 1
1 99 . 3 1 1 A 11 11 LEU H H 11 8.080 8.089 -0.009 1
1 100 . 3 1 1 A 11 11 LEU HA H 11 4.120 4.034 0.086 1
1 110 . 3 1 1 A 11 11 LEU C C 11 179.600 180.137 -0.537 1
1 111 . 3 1 1 A 11 11 LEU CA C 11 57.800 57.685 0.115 1
1 112 . 3 1 1 A 11 11 LEU CB C 11 41.700 41.220 0.480 1
1 115 . 3 1 1 A 11 11 LEU N N 11 120.900 119.388 1.512 1
1 116 . 3 1 1 A 12 12 LEU H H 12 8.480 7.751 0.729 1
1 117 . 3 1 1 A 12 12 LEU HA H 12 4.040 3.953 0.087 1
1 127 . 3 1 1 A 12 12 LEU C C 12 178.900 179.405 -0.505 1
1 128 . 3 1 1 A 12 12 LEU CA C 12 58.100 58.018 0.082 1
1 129 . 3 1 1 A 12 12 LEU CB C 12 40.100 40.556 -0.456 1
1 133 . 3 1 1 A 12 12 LEU N N 12 118.700 120.616 -1.916 1
1 134 . 3 1 1 A 13 13 ASP H H 13 7.990 7.911 0.079 1
1 135 . 3 1 1 A 13 13 ASP HA H 13 4.420 4.416 0.004 1
1 138 . 3 1 1 A 13 13 ASP C C 13 178.900 178.863 0.037 1
1 139 . 3 1 1 A 13 13 ASP CA C 13 57.500 57.378 0.122 1
1 140 . 3 1 1 A 13 13 ASP CB C 13 40.500 40.041 0.459 1
1 141 . 3 1 1 A 13 13 ASP N N 13 119.500 120.696 -1.196 1
1 142 . 3 1 1 A 14 14 GLN H H 14 7.620 7.572 0.048 1
1 143 . 3 1 1 A 14 14 GLN HA H 14 4.230 4.166 0.064 1
1 150 . 3 1 1 A 14 14 GLN C C 14 178.400 178.387 0.013 1
1 151 . 3 1 1 A 14 14 GLN CA C 14 58.100 58.553 -0.453 1
1 152 . 3 1 1 A 14 14 GLN CB C 14 27.800 28.306 -0.506 1
1 154 . 3 1 1 A 14 14 GLN N N 14 118.900 120.023 -1.123 1
1 156 . 3 1 1 A 15 15 VAL H H 15 8.480 8.406 0.074 1
1 157 . 3 1 1 A 15 15 VAL HA H 15 3.380 3.700 -0.320 1
1 165 . 3 1 1 A 15 15 VAL C C 15 177.600 178.377 -0.777 1
1 166 . 3 1 1 A 15 15 VAL CA C 15 66.600 66.311 0.289 1
1 167 . 3 1 1 A 15 15 VAL CB C 15 30.500 31.425 -0.925 1
1 170 . 3 1 1 A 15 15 VAL N N 15 121.300 120.206 1.094 1
1 171 . 3 1 1 A 16 16 ALA H H 16 8.080 8.332 -0.252 1
1 172 . 3 1 1 A 16 16 ALA HA H 16 4.450 3.896 0.554 1
1 176 . 3 1 1 A 16 16 ALA C C 16 179.100 179.816 -0.716 1
1 177 . 3 1 1 A 16 16 ALA CA C 16 54.600 55.143 -0.543 1
1 178 . 3 1 1 A 16 16 ALA CB C 16 17.700 17.993 -0.293 1
1 179 . 3 1 1 A 16 16 ALA N N 16 121.400 122.032 -0.632 1
1 180 . 3 1 1 A 17 17 ARG H H 17 7.480 7.502 -0.022 1
1 181 . 3 1 1 A 17 17 ARG HA H 17 3.910 4.054 -0.144 1
1 187 . 3 1 1 A 17 17 ARG C C 17 179.700 179.189 0.511 1
1 188 . 3 1 1 A 17 17 ARG CA C 17 59.700 59.071 0.629 1
1 189 . 3 1 1 A 17 17 ARG CB C 17 30.400 29.760 0.640 1
1 191 . 3 1 1 A 17 17 ARG N N 17 116.900 117.748 -0.848 1
1 192 . 3 1 1 A 18 18 VAL H H 18 7.960 7.776 0.184 1
1 193 . 3 1 1 A 18 18 VAL HA H 18 3.690 3.691 -0.001 1
1 201 . 3 1 1 A 18 18 VAL C C 18 177.900 177.973 -0.073 1
1 202 . 3 1 1 A 18 18 VAL CA C 18 66.600 66.167 0.433 1
1 203 . 3 1 1 A 18 18 VAL CB C 18 31.300 31.686 -0.386 1
1 206 . 3 1 1 A 18 18 VAL N N 18 123.000 121.056 1.944 1
1 207 . 3 1 1 A 19 19 GLY H H 19 8.270 8.127 0.143 1
1 208 . 3 1 1 A 19 19 GLY HA2 H 19 3.430 3.768 -0.338 1
1 209 . 3 1 1 A 19 19 GLY HA3 H 19 3.430 3.775 -0.345 1
1 210 . 3 1 1 A 19 19 GLY C C 19 174.400 175.505 -1.105 1
1 211 . 3 1 1 A 19 19 GLY CA C 19 48.500 47.257 1.243 1
1 212 . 3 1 1 A 19 19 GLY N N 19 105.400 107.491 -2.091 1
1 213 . 3 1 1 A 20 20 LYS H H 20 8.250 8.566 -0.316 1
1 214 . 3 1 1 A 20 20 LYS HA H 20 3.710 4.042 -0.332 1
1 223 . 3 1 1 A 20 20 LYS C C 20 179.400 178.562 0.838 1
1 224 . 3 1 1 A 20 20 LYS CA C 20 59.300 58.735 0.565 1
1 225 . 3 1 1 A 20 20 LYS CB C 20 32.600 32.441 0.159 1
1 229 . 3 1 1 A 20 20 LYS N N 20 118.700 121.799 -3.099 1
1 230 . 3 1 1 A 21 21 ALA H H 21 7.640 7.814 -0.174 1
1 231 . 3 1 1 A 21 21 ALA HA H 21 3.790 4.133 -0.343 1
1 235 . 3 1 1 A 21 21 ALA C C 21 177.900 178.675 -0.775 1
1 236 . 3 1 1 A 21 21 ALA CA C 21 55.200 54.428 0.772 1
1 237 . 3 1 1 A 21 21 ALA CB C 21 19.200 18.261 0.939 1
1 238 . 3 1 1 A 21 21 ALA N N 21 121.700 121.132 0.568 1
1 239 . 3 1 1 A 22 22 LEU H H 22 7.330 7.434 -0.104 1
1 240 . 3 1 1 A 22 22 LEU HA H 22 4.140 4.379 -0.239 1
1 250 . 3 1 1 A 22 22 LEU C C 22 176.800 177.454 -0.654 1
1 251 . 3 1 1 A 22 22 LEU CA C 22 54.600 54.795 -0.195 1
1 252 . 3 1 1 A 22 22 LEU CB C 22 42.900 41.784 1.116 1
1 256 . 3 1 1 A 22 22 LEU N N 22 114.200 117.135 -2.935 1
1 257 . 3 1 1 A 23 23 ALA H H 23 7.160 7.546 -0.386 1
1 258 . 3 1 1 A 23 23 ALA HA H 23 4.720 4.340 0.380 1
1 262 . 3 1 1 A 23 23 ALA C C 23 176.700 176.471 0.229 1
1 263 . 3 1 1 A 23 23 ALA CA C 23 53.000 52.457 0.543 1
1 264 . 3 1 1 A 23 23 ALA CB C 23 18.200 18.694 -0.494 1
1 265 . 3 1 1 A 23 23 ALA N N 23 118.200 121.517 -3.317 1
1 266 . 3 1 1 A 24 24 ASN H H 24 7.440 7.749 -0.309 1
1 267 . 3 1 1 A 24 24 ASN HA H 24 4.730 5.053 -0.323 1
1 272 . 3 1 1 A 24 24 ASN C C 24 174.800 175.461 -0.661 1
1 273 . 3 1 1 A 24 24 ASN CA C 24 53.500 51.687 1.813 1
1 274 . 3 1 1 A 24 24 ASN CB C 24 41.700 40.955 0.745 1
1 275 . 3 1 1 A 24 24 ASN N N 24 116.800 117.234 -0.434 1
1 277 . 3 1 1 A 25 25 GLY H H 25 9.370 8.927 0.443 1
1 278 . 3 1 1 A 25 25 GLY HA2 H 25 3.650 3.825 -0.175 1
1 279 . 3 1 1 A 25 25 GLY HA3 H 25 4.110 3.842 0.268 1
1 280 . 3 1 1 A 25 25 GLY C C 25 175.300 175.314 -0.014 1
1 281 . 3 1 1 A 25 25 GLY CA C 25 47.600 47.314 0.286 1
1 282 . 3 1 1 A 25 25 GLY N N 25 114.800 115.563 -0.763 1
1 283 . 3 1 1 A 26 26 ARG H H 26 8.050 8.033 0.017 1
1 284 . 3 1 1 A 26 26 ARG HA H 26 4.150 4.034 0.116 1
1 289 . 3 1 1 A 26 26 ARG C C 26 179.300 178.764 0.536 1
1 290 . 3 1 1 A 26 26 ARG CA C 26 57.000 59.092 -2.092 1
1 291 . 3 1 1 A 26 26 ARG CB C 26 29.900 30.016 -0.116 1
1 294 . 3 1 1 A 26 26 ARG N N 26 120.500 122.194 -1.694 1
1 295 . 3 1 1 A 27 27 ARG H H 27 7.930 7.584 0.346 1
1 296 . 3 1 1 A 27 27 ARG HA H 27 3.710 4.129 -0.419 1
1 301 . 3 1 1 A 27 27 ARG C C 27 178.300 178.681 -0.381 1
1 302 . 3 1 1 A 27 27 ARG CA C 27 61.000 58.484 2.516 1
1 303 . 3 1 1 A 27 27 ARG CB C 27 30.400 29.611 0.789 1
1 305 . 3 1 1 A 27 27 ARG N N 27 117.900 120.408 -2.508 1
1 306 . 3 1 1 A 28 28 LEU H H 28 7.640 7.997 -0.357 1
1 307 . 3 1 1 A 28 28 LEU HA H 28 3.950 4.057 -0.107 1
1 317 . 3 1 1 A 28 28 LEU C C 28 178.200 179.533 -1.333 1
1 318 . 3 1 1 A 28 28 LEU CA C 28 57.600 56.747 0.853 1
1 319 . 3 1 1 A 28 28 LEU CB C 28 41.900 41.619 0.281 1
1 323 . 3 1 1 A 28 28 LEU N N 28 117.600 119.384 -1.784 1
1 324 . 3 1 1 A 29 29 GLN H H 29 8.110 7.855 0.255 1
1 325 . 3 1 1 A 29 29 GLN HA H 29 3.880 4.133 -0.253 1
1 332 . 3 1 1 A 29 29 GLN C C 29 179.400 178.927 0.473 1
1 333 . 3 1 1 A 29 29 GLN CA C 29 59.100 58.641 0.459 1
1 334 . 3 1 1 A 29 29 GLN CB C 29 28.800 28.260 0.540 1
1 336 . 3 1 1 A 29 29 GLN N N 29 119.300 118.649 0.651 1
1 338 . 3 1 1 A 30 30 ILE H H 30 7.530 7.841 -0.311 1
1 339 . 3 1 1 A 30 30 ILE HA H 30 3.340 3.570 -0.230 1
1 349 . 3 1 1 A 30 30 ILE C C 30 176.700 178.617 -1.917 1
1 350 . 3 1 1 A 30 30 ILE CA C 30 65.900 65.544 0.356 1
1 351 . 3 1 1 A 30 30 ILE CB C 30 37.400 37.545 -0.145 1
1 355 . 3 1 1 A 30 30 ILE N N 30 118.600 120.772 -2.172 1
1 356 . 3 1 1 A 31 31 LEU H H 31 7.500 7.937 -0.437 1
1 357 . 3 1 1 A 31 31 LEU HA H 31 3.520 3.729 -0.209 1
1 367 . 3 1 1 A 31 31 LEU C C 31 177.300 178.651 -1.351 1
1 368 . 3 1 1 A 31 31 LEU CA C 31 58.100 57.861 0.239 1
1 369 . 3 1 1 A 31 31 LEU CB C 31 41.100 40.005 1.095 1
1 373 . 3 1 1 A 31 31 LEU N N 31 119.900 119.226 0.674 1
1 374 . 3 1 1 A 32 32 ASP H H 32 7.950 8.118 -0.168 1
1 375 . 3 1 1 A 32 32 ASP HA H 32 4.300 4.352 -0.052 1
1 378 . 3 1 1 A 32 32 ASP C C 32 178.300 178.300 0.000 1
1 379 . 3 1 1 A 32 32 ASP CA C 32 57.400 57.776 -0.376 1
1 380 . 3 1 1 A 32 32 ASP CB C 32 42.400 41.662 0.738 1
1 381 . 3 1 1 A 32 32 ASP N N 32 116.900 119.781 -2.881 1
1 382 . 3 1 1 A 33 33 LEU H H 33 7.350 7.605 -0.255 1
1 383 . 3 1 1 A 33 33 LEU HA H 33 4.130 4.098 0.032 1
1 393 . 3 1 1 A 33 33 LEU C C 33 180.000 178.915 1.085 1
1 394 . 3 1 1 A 33 33 LEU CA C 33 57.600 57.797 -0.197 1
1 395 . 3 1 1 A 33 33 LEU CB C 33 42.300 41.641 0.659 1
1 399 . 3 1 1 A 33 33 LEU N N 33 118.600 120.340 -1.740 1
1 400 . 3 1 1 A 34 34 LEU H H 34 8.300 8.268 0.032 1
1 401 . 3 1 1 A 34 34 LEU HA H 34 4.490 4.476 0.014 1
1 411 . 3 1 1 A 34 34 LEU C C 34 178.900 178.733 0.167 1
1 412 . 3 1 1 A 34 34 LEU CA C 34 55.800 57.231 -1.431 1
1 413 . 3 1 1 A 34 34 LEU CB C 34 41.300 41.182 0.118 1
1 417 . 3 1 1 A 34 34 LEU N N 34 117.800 118.561 -0.761 1
1 418 . 3 1 1 A 35 35 ALA H H 35 8.160 7.753 0.407 1
1 419 . 3 1 1 A 35 35 ALA HA H 35 4.050 4.151 -0.101 1
1 423 . 3 1 1 A 35 35 ALA C C 35 179.000 178.138 0.862 1
1 424 . 3 1 1 A 35 35 ALA CA C 35 54.900 54.076 0.824 1
1 425 . 3 1 1 A 35 35 ALA CB C 35 17.500 18.265 -0.765 1
1 426 . 3 1 1 A 35 35 ALA N N 35 123.900 121.425 2.475 1
1 427 . 3 1 1 A 36 36 GLN H H 36 7.600 7.889 -0.289 1
1 428 . 3 1 1 A 36 36 GLN HA H 36 4.340 4.394 -0.054 1
1 435 . 3 1 1 A 36 36 GLN C C 36 176.100 175.441 0.659 1
1 436 . 3 1 1 A 36 36 GLN CA C 36 55.800 55.997 -0.197 1
1 437 . 3 1 1 A 36 36 GLN CB C 36 29.000 29.327 -0.327 1
1 439 . 3 1 1 A 36 36 GLN N N 36 113.300 114.443 -1.143 1
1 441 . 3 1 1 A 37 37 GLY H H 37 7.550 7.052 0.498 1
1 442 . 3 1 1 A 37 37 GLY HA2 H 37 3.730 4.035 -0.305 1
1 443 . 3 1 1 A 37 37 GLY HA3 H 37 4.490 4.037 0.453 1
1 444 . 3 1 1 A 37 37 GLY C C 37 171.500 172.798 -1.298 1
1 445 . 3 1 1 A 37 37 GLY CA C 37 44.500 44.450 0.050 1
1 446 . 3 1 1 A 37 37 GLY N N 37 108.400 107.606 0.794 1
1 447 . 3 1 1 A 38 38 GLU H H 38 8.120 8.418 -0.298 1
1 448 . 3 1 1 A 38 38 GLU HA H 38 4.820 4.515 0.305 1
1 453 . 3 1 1 A 38 38 GLU C C 38 177.000 175.693 1.307 1
1 454 . 3 1 1 A 38 38 GLU CA C 38 56.400 56.404 -0.004 1
1 455 . 3 1 1 A 38 38 GLU CB C 38 31.200 30.110 1.090 1
1 457 . 3 1 1 A 38 38 GLU N N 38 119.600 118.940 0.660 1
1 458 . 3 1 1 A 39 39 ARG H H 39 8.580 8.471 0.109 1
1 459 . 3 1 1 A 39 39 ARG HA H 39 4.970 4.862 0.108 1
1 467 . 3 1 1 A 39 39 ARG C C 39 174.800 174.744 0.056 1
1 468 . 3 1 1 A 39 39 ARG CA C 39 53.900 55.006 -1.106 1
1 469 . 3 1 1 A 39 39 ARG CB C 39 36.400 34.356 2.044 1
1 472 . 3 1 1 A 39 39 ARG N N 39 121.500 121.152 0.348 1
1 474 . 3 1 1 A 40 40 ALA H H 40 8.910 8.867 0.043 1
1 475 . 3 1 1 A 40 40 ALA HA H 40 4.920 4.332 0.588 1
1 479 . 3 1 1 A 40 40 ALA C C 40 179.200 178.493 0.707 1
1 480 . 3 1 1 A 40 40 ALA CA C 40 51.100 52.053 -0.953 1
1 481 . 3 1 1 A 40 40 ALA CB C 40 19.200 19.316 -0.116 1
1 482 . 3 1 1 A 40 40 ALA N N 40 125.100 127.147 -2.047 1
1 483 . 3 1 1 A 41 41 VAL H H 41 8.420 8.444 -0.024 1
1 484 . 3 1 1 A 41 41 VAL HA H 41 3.430 3.611 -0.181 1
1 492 . 3 1 1 A 41 41 VAL C C 41 176.800 177.122 -0.322 1
1 493 . 3 1 1 A 41 41 VAL CA C 41 67.600 66.931 0.669 1
1 494 . 3 1 1 A 41 41 VAL CB C 41 31.600 32.014 -0.414 1
1 497 . 3 1 1 A 41 41 VAL N N 41 120.900 120.890 0.010 1
1 498 . 3 1 1 A 42 42 GLU H H 42 9.640 8.348 1.292 1
1 499 . 3 1 1 A 42 42 GLU HA H 42 3.880 3.999 -0.119 1
1 504 . 3 1 1 A 42 42 GLU C C 42 178.300 179.101 -0.801 1
1 505 . 3 1 1 A 42 42 GLU CA C 42 60.600 59.406 1.194 1
1 506 . 3 1 1 A 42 42 GLU CB C 42 28.300 29.298 -0.998 1
1 508 . 3 1 1 A 42 42 GLU N N 42 119.000 119.235 -0.235 1
1 509 . 3 1 1 A 43 43 ALA H H 43 6.870 7.823 -0.953 1
1 510 . 3 1 1 A 43 43 ALA HA H 43 4.290 4.106 0.184 1
1 514 . 3 1 1 A 43 43 ALA C C 43 180.700 179.711 0.989 1
1 515 . 3 1 1 A 43 43 ALA CA C 43 54.100 55.077 -0.977 1
1 516 . 3 1 1 A 43 43 ALA CB C 43 19.100 18.218 0.882 1
1 517 . 3 1 1 A 43 43 ALA N N 43 120.500 122.612 -2.112 1
1 518 . 3 1 1 A 44 44 ILE H H 44 7.970 8.053 -0.083 1
1 519 . 3 1 1 A 44 44 ILE HA H 44 3.470 3.644 -0.174 1
1 529 . 3 1 1 A 44 44 ILE C C 44 178.300 177.970 0.330 1
1 530 . 3 1 1 A 44 44 ILE CA C 44 64.700 65.596 -0.896 1
1 531 . 3 1 1 A 44 44 ILE CB C 44 38.100 38.154 -0.054 1
1 535 . 3 1 1 A 44 44 ILE N N 44 120.500 119.300 1.200 1
1 536 . 3 1 1 A 45 45 ALA H H 45 8.460 8.121 0.339 1
1 537 . 3 1 1 A 45 45 ALA HA H 45 3.720 4.034 -0.314 1
1 541 . 3 1 1 A 45 45 ALA C C 45 178.500 179.684 -1.184 1
1 542 . 3 1 1 A 45 45 ALA CA C 45 56.200 55.306 0.894 1
1 543 . 3 1 1 A 45 45 ALA CB C 45 17.400 18.415 -1.015 1
1 544 . 3 1 1 A 45 45 ALA N N 45 124.500 122.319 2.181 1
1 545 . 3 1 1 A 46 46 THR H H 46 8.080 8.378 -0.298 1
1 546 . 3 1 1 A 46 46 THR HA H 46 3.900 3.855 0.045 1
1 551 . 3 1 1 A 46 46 THR C C 46 177.200 176.373 0.827 1
1 552 . 3 1 1 A 46 46 THR CA C 46 66.400 67.126 -0.726 1
1 553 . 3 1 1 A 46 46 THR CB C 46 68.800 68.584 0.216 1
1 555 . 3 1 1 A 46 46 THR N N 46 112.400 113.837 -1.437 1
1 556 . 3 1 1 A 47 47 ALA H H 47 7.930 8.220 -0.290 1
1 557 . 3 1 1 A 47 47 ALA HA H 47 4.200 4.127 0.073 1
1 561 . 3 1 1 A 47 47 ALA C C 47 179.200 179.798 -0.598 1
1 562 . 3 1 1 A 47 47 ALA CA C 47 54.800 55.323 -0.523 1
1 563 . 3 1 1 A 47 47 ALA CB C 47 19.800 17.996 1.804 1
1 564 . 3 1 1 A 47 47 ALA N N 47 121.400 123.886 -2.486 1
1 565 . 3 1 1 A 48 48 THR H H 48 7.560 7.655 -0.095 1
1 566 . 3 1 1 A 48 48 THR HA H 48 4.390 4.319 0.071 1
1 571 . 3 1 1 A 48 48 THR C C 48 175.700 176.242 -0.542 1
1 572 . 3 1 1 A 48 48 THR CA C 48 61.800 63.031 -1.231 1
1 573 . 3 1 1 A 48 48 THR CB C 48 71.000 70.541 0.459 1
1 575 . 3 1 1 A 48 48 THR N N 48 103.500 106.901 -3.401 1
1 576 . 3 1 1 A 49 49 GLY H H 49 7.820 8.451 -0.631 1
1 577 . 3 1 1 A 49 49 GLY HA2 H 49 3.870 3.920 -0.050 1
1 578 . 3 1 1 A 49 49 GLY HA3 H 49 4.100 3.921 0.179 1
1 579 . 3 1 1 A 49 49 GLY C C 49 174.400 174.111 0.289 1
1 580 . 3 1 1 A 49 49 GLY CA C 49 46.300 45.498 0.802 1
1 581 . 3 1 1 A 49 49 GLY N N 49 111.100 111.793 -0.693 1
1 582 . 3 1 1 A 50 50 MET H H 50 7.930 7.927 0.003 1
1 583 . 3 1 1 A 50 50 MET HA H 50 4.540 4.810 -0.270 1
1 591 . 3 1 1 A 50 50 MET C C 50 174.800 175.544 -0.744 1
1 592 . 3 1 1 A 50 50 MET CA C 50 55.100 54.768 0.332 1
1 593 . 3 1 1 A 50 50 MET CB C 50 37.200 35.123 2.077 1
1 596 . 3 1 1 A 50 50 MET N N 50 119.300 119.720 -0.420 1
1 597 . 3 1 1 A 51 51 ASN H H 51 8.040 8.775 -0.735 1
1 598 . 3 1 1 A 51 51 ASN HA H 51 4.580 4.906 -0.326 1
1 601 . 3 1 1 A 51 51 ASN C C 51 176.100 177.243 -1.143 1
1 602 . 3 1 1 A 51 51 ASN CA C 51 52.800 53.048 -0.248 1
1 603 . 3 1 1 A 51 51 ASN CB C 51 41.100 39.272 1.828 1
1 604 . 3 1 1 A 51 51 ASN N N 51 118.000 118.780 -0.780 1
1 605 . 3 1 1 A 52 52 LEU H H 52 8.560 8.782 -0.222 1
1 606 . 3 1 1 A 52 52 LEU HA H 52 3.760 3.909 -0.149 1
1 616 . 3 1 1 A 52 52 LEU C C 52 179.600 179.061 0.539 1
1 617 . 3 1 1 A 52 52 LEU CA C 52 59.000 57.839 1.161 1
1 618 . 3 1 1 A 52 52 LEU CB C 52 41.800 41.310 0.490 1
1 622 . 3 1 1 A 52 52 LEU N N 52 120.600 123.743 -3.143 1
1 623 . 3 1 1 A 53 53 THR H H 53 8.230 8.165 0.065 1
1 624 . 3 1 1 A 53 53 THR HA H 53 3.880 4.038 -0.158 1
1 629 . 3 1 1 A 53 53 THR C C 53 176.900 177.168 -0.268 1
1 630 . 3 1 1 A 53 53 THR CA C 53 66.500 65.776 0.724 1
1 631 . 3 1 1 A 53 53 THR CB C 53 68.400 67.987 0.413 1
1 633 . 3 1 1 A 53 53 THR N N 53 115.800 111.050 4.750 1
1 634 . 3 1 1 A 54 54 THR H H 54 8.420 8.121 0.299 1
1 635 . 3 1 1 A 54 54 THR HA H 54 3.880 3.814 0.066 1
1 640 . 3 1 1 A 54 54 THR C C 54 177.300 176.149 1.151 1
1 641 . 3 1 1 A 54 54 THR CA C 54 66.600 66.732 -0.132 1
1 642 . 3 1 1 A 54 54 THR CB C 54 66.600 68.520 -1.920 1
1 644 . 3 1 1 A 54 54 THR N N 54 122.300 117.177 5.123 1
1 645 . 3 1 1 A 55 55 ALA H H 55 8.860 8.308 0.552 1
1 646 . 3 1 1 A 55 55 ALA HA H 55 4.020 3.954 0.066 1
1 650 . 3 1 1 A 55 55 ALA C C 55 179.000 179.433 -0.433 1
1 651 . 3 1 1 A 55 55 ALA CA C 55 56.100 55.310 0.790 1
1 652 . 3 1 1 A 55 55 ALA CB C 55 17.000 18.353 -1.353 1
1 653 . 3 1 1 A 55 55 ALA N N 55 125.600 123.393 2.207 1
1 654 . 3 1 1 A 56 56 SER H H 56 8.440 8.603 -0.163 1
1 655 . 3 1 1 A 56 56 SER HA H 56 3.920 4.065 -0.145 1
1 658 . 3 1 1 A 56 56 SER C C 56 176.400 177.272 -0.872 1
1 659 . 3 1 1 A 56 56 SER CA C 56 62.600 61.332 1.268 1
1 660 . 3 1 1 A 56 56 SER CB C 56 62.700 62.223 0.477 1
1 661 . 3 1 1 A 56 56 SER N N 56 112.700 112.865 -0.165 1
1 662 . 3 1 1 A 57 57 ALA H H 57 8.090 7.930 0.160 1
1 663 . 3 1 1 A 57 57 ALA HA H 57 4.130 3.992 0.138 1
1 667 . 3 1 1 A 57 57 ALA C C 57 181.200 180.049 1.151 1
1 668 . 3 1 1 A 57 57 ALA CA C 57 55.200 55.225 -0.025 1
1 669 . 3 1 1 A 57 57 ALA CB C 57 17.900 18.165 -0.265 1
1 670 . 3 1 1 A 57 57 ALA N N 57 124.000 124.361 -0.361 1
1 671 . 3 1 1 A 58 58 ASN H H 58 7.970 7.762 0.208 1
1 672 . 3 1 1 A 58 58 ASN HA H 58 4.480 4.432 0.048 1
1 677 . 3 1 1 A 58 58 ASN C C 58 177.500 178.309 -0.809 1
1 678 . 3 1 1 A 58 58 ASN CA C 58 56.900 56.472 0.428 1
1 679 . 3 1 1 A 58 58 ASN CB C 58 39.800 37.766 2.034 1
1 680 . 3 1 1 A 58 58 ASN N N 58 117.600 117.140 0.460 1
1 682 . 3 1 1 A 59 59 LEU H H 59 8.530 8.387 0.143 1
1 683 . 3 1 1 A 59 59 LEU HA H 59 3.710 3.731 -0.021 1
1 693 . 3 1 1 A 59 59 LEU C C 59 178.400 179.262 -0.862 1
1 694 . 3 1 1 A 59 59 LEU CA C 59 58.600 57.744 0.856 1
1 695 . 3 1 1 A 59 59 LEU CB C 59 40.500 40.725 -0.225 1
1 699 . 3 1 1 A 59 59 LEU N N 59 122.600 120.998 1.602 1
1 700 . 3 1 1 A 60 60 GLN H H 60 8.200 8.232 -0.032 1
1 701 . 3 1 1 A 60 60 GLN HA H 60 4.020 4.131 -0.111 1
1 708 . 3 1 1 A 60 60 GLN C C 60 178.700 178.568 0.132 1
1 709 . 3 1 1 A 60 60 GLN CA C 60 58.800 58.907 -0.107 1
1 710 . 3 1 1 A 60 60 GLN CB C 60 27.700 28.222 -0.522 1
1 712 . 3 1 1 A 60 60 GLN N N 60 118.900 118.040 0.860 1
1 714 . 3 1 1 A 61 61 ALA H H 61 7.580 7.814 -0.234 1
1 715 . 3 1 1 A 61 61 ALA HA H 61 4.230 4.058 0.172 1
1 719 . 3 1 1 A 61 61 ALA C C 61 181.300 180.225 1.075 1
1 720 . 3 1 1 A 61 61 ALA CA C 61 55.100 54.999 0.101 1
1 721 . 3 1 1 A 61 61 ALA CB C 61 17.600 18.368 -0.768 1
1 722 . 3 1 1 A 61 61 ALA N N 61 122.200 122.855 -0.655 1
1 723 . 3 1 1 A 62 62 LEU H H 62 7.830 8.243 -0.413 1
1 724 . 3 1 1 A 62 62 LEU HA H 62 3.980 4.021 -0.041 1
1 734 . 3 1 1 A 62 62 LEU C C 62 178.500 179.159 -0.659 1
1 735 . 3 1 1 A 62 62 LEU CA C 62 58.100 57.490 0.610 1
1 736 . 3 1 1 A 62 62 LEU CB C 62 43.300 41.176 2.124 1
1 739 . 3 1 1 A 62 62 LEU N N 62 119.000 118.253 0.747 1
1 740 . 3 1 1 A 63 63 LYS H H 63 8.580 8.186 0.394 1
1 741 . 3 1 1 A 63 63 LYS HA H 63 4.130 4.295 -0.165 1
1 750 . 3 1 1 A 63 63 LYS C C 63 180.500 179.090 1.410 1
1 751 . 3 1 1 A 63 63 LYS CA C 63 59.700 58.783 0.917 1
1 752 . 3 1 1 A 63 63 LYS CB C 63 32.600 32.105 0.495 1
1 756 . 3 1 1 A 63 63 LYS N N 63 123.400 121.566 1.834 1
1 757 . 3 1 1 A 64 64 SER H H 64 8.640 8.348 0.292 1
1 758 . 3 1 1 A 64 64 SER HA H 64 4.300 4.280 0.020 1
1 761 . 3 1 1 A 64 64 SER C C 64 175.000 177.253 -2.253 1
1 762 . 3 1 1 A 64 64 SER CA C 64 61.400 62.646 -1.246 1
1 763 . 3 1 1 A 64 64 SER CB C 64 63.000 62.560 0.440 1
1 764 . 3 1 1 A 64 64 SER N N 64 117.700 117.779 -0.079 1
1 765 . 3 1 1 A 65 65 GLY H H 65 7.280 8.053 -0.773 1
1 766 . 3 1 1 A 65 65 GLY HA2 H 65 3.240 3.920 -0.680 1
1 767 . 3 1 1 A 65 65 GLY HA3 H 65 3.980 3.920 0.060 1
1 768 . 3 1 1 A 65 65 GLY C C 65 171.300 174.892 -3.592 1
1 769 . 3 1 1 A 65 65 GLY CA C 65 45.100 46.041 -0.941 1
1 770 . 3 1 1 A 65 65 GLY N N 65 104.400 109.302 -4.902 1
1 771 . 3 1 1 A 66 66 GLY H H 66 7.730 7.771 -0.041 1
1 772 . 3 1 1 A 66 66 GLY HA2 H 66 3.650 4.011 -0.361 1
1 773 . 3 1 1 A 66 66 GLY HA3 H 66 3.750 4.013 -0.263 1
1 774 . 3 1 1 A 66 66 GLY C C 66 173.700 174.749 -1.049 1
1 775 . 3 1 1 A 66 66 GLY CA C 66 45.400 45.949 -0.549 1
1 776 . 3 1 1 A 66 66 GLY N N 66 104.700 108.023 -3.323 1
1 777 . 3 1 1 A 67 67 LEU H H 67 7.520 8.270 -0.750 1
1 778 . 3 1 1 A 67 67 LEU HA H 67 4.310 4.351 -0.041 1
1 788 . 3 1 1 A 67 67 LEU C C 67 177.700 176.775 0.925 1
1 789 . 3 1 1 A 67 67 LEU CA C 67 55.500 55.786 -0.286 1
1 790 . 3 1 1 A 67 67 LEU CB C 67 42.400 43.275 -0.875 1
1 794 . 3 1 1 A 67 67 LEU N N 67 110.600 118.266 -7.666 1
1 795 . 3 1 1 A 68 68 VAL H H 68 6.890 7.445 -0.555 1
1 796 . 3 1 1 A 68 68 VAL HA H 68 5.190 4.957 0.233 1
1 804 . 3 1 1 A 68 68 VAL C C 68 173.700 174.979 -1.279 1
1 805 . 3 1 1 A 68 68 VAL CA C 68 57.400 58.956 -1.556 1
1 806 . 3 1 1 A 68 68 VAL CB C 68 36.400 34.849 1.551 1
1 809 . 3 1 1 A 68 68 VAL N N 68 106.400 113.040 -6.640 1
1 810 . 3 1 1 A 69 69 GLU H H 69 8.880 9.416 -0.536 1
1 811 . 3 1 1 A 69 69 GLU HA H 69 4.660 5.151 -0.491 1
1 816 . 3 1 1 A 69 69 GLU C C 69 173.300 174.369 -1.069 1
1 817 . 3 1 1 A 69 69 GLU CA C 69 54.300 54.127 0.173 1
1 818 . 3 1 1 A 69 69 GLU CB C 69 34.100 33.842 0.258 1
1 820 . 3 1 1 A 69 69 GLU N N 69 120.400 121.171 -0.771 1
1 821 . 3 1 1 A 70 70 ALA H H 70 8.730 8.824 -0.094 1
1 822 . 3 1 1 A 70 70 ALA HA H 70 4.990 5.268 -0.278 1
1 826 . 3 1 1 A 70 70 ALA C C 70 176.500 175.694 0.806 1
1 827 . 3 1 1 A 70 70 ALA CA C 70 50.000 49.712 0.288 1
1 828 . 3 1 1 A 70 70 ALA CB C 70 22.300 21.975 0.325 1
1 829 . 3 1 1 A 70 70 ALA N N 70 122.800 122.381 0.419 1
1 830 . 3 1 1 A 71 71 ARG H H 71 8.670 9.166 -0.496 1
1 831 . 3 1 1 A 71 71 ARG HA H 71 4.630 4.760 -0.130 1
1 843 . 3 1 1 A 71 71 ARG C C 71 173.500 175.098 -1.598 1
1 844 . 3 1 1 A 71 71 ARG CA C 71 54.600 55.074 -0.474 1
1 845 . 3 1 1 A 71 71 ARG CB C 71 33.600 32.715 0.885 1
1 849 . 3 1 1 A 71 71 ARG N N 71 120.100 121.723 -1.623 1
1 851 . 3 1 1 A 72 72 ARG H H 72 8.780 8.880 -0.100 1
1 852 . 3 1 1 A 72 72 ARG HA H 72 5.100 4.998 0.102 1
1 859 . 3 1 1 A 72 72 ARG C C 72 176.000 175.279 0.721 1
1 860 . 3 1 1 A 72 72 ARG CA C 72 54.900 54.389 0.511 1
1 861 . 3 1 1 A 72 72 ARG CB C 72 32.500 31.360 1.140 1
1 864 . 3 1 1 A 72 72 ARG N N 72 123.600 122.574 1.026 1
1 865 . 3 1 1 A 73 73 GLU H H 73 8.720 8.794 -0.074 1
1 866 . 3 1 1 A 73 73 GLU HA H 73 4.510 4.703 -0.193 1
1 871 . 3 1 1 A 73 73 GLU C C 73 175.900 176.793 -0.893 1
1 872 . 3 1 1 A 73 73 GLU CA C 73 55.700 55.686 0.014 1
1 873 . 3 1 1 A 73 73 GLU CB C 73 31.800 30.146 1.654 1
1 875 . 3 1 1 A 73 73 GLU N N 73 126.800 123.764 3.036 1
1 876 . 3 1 1 A 74 74 GLY H H 74 9.190 8.884 0.306 1
1 877 . 3 1 1 A 74 74 GLY HA2 H 74 3.700 3.873 -0.173 1
1 878 . 3 1 1 A 74 74 GLY HA3 H 74 4.170 3.880 0.290 1
1 879 . 3 1 1 A 74 74 GLY C C 74 175.400 174.865 0.535 1
1 880 . 3 1 1 A 74 74 GLY CA C 74 47.100 47.273 -0.173 1
1 881 . 3 1 1 A 74 74 GLY N N 74 118.500 115.956 2.544 1
1 882 . 3 1 1 A 75 75 THR H H 75 8.780 8.731 0.049 1
1 883 . 3 1 1 A 75 75 THR HA H 75 4.290 4.475 -0.185 1
1 888 . 3 1 1 A 75 75 THR C C 75 174.600 174.316 0.284 1
1 889 . 3 1 1 A 75 75 THR CA C 75 62.000 62.237 -0.237 1
1 890 . 3 1 1 A 75 75 THR CB C 75 69.000 69.943 -0.943 1
1 892 . 3 1 1 A 75 75 THR N N 75 118.000 120.733 -2.733 1
1 893 . 3 1 1 A 76 76 ARG H H 76 8.030 7.724 0.306 1
1 894 . 3 1 1 A 76 76 ARG HA H 76 4.610 4.810 -0.200 1
1 901 . 3 1 1 A 76 76 ARG C C 76 174.800 174.846 -0.046 1
1 902 . 3 1 1 A 76 76 ARG CA C 76 55.500 54.971 0.529 1
1 903 . 3 1 1 A 76 76 ARG CB C 76 32.700 32.351 0.349 1
1 906 . 3 1 1 A 76 76 ARG N N 76 122.600 122.010 0.590 1
1 907 . 3 1 1 A 77 77 GLN H H 77 8.580 8.575 0.005 1
1 908 . 3 1 1 A 77 77 GLN HA H 77 4.910 5.346 -0.436 1
1 915 . 3 1 1 A 77 77 GLN C C 77 173.900 174.496 -0.596 1
1 916 . 3 1 1 A 77 77 GLN CA C 77 54.700 54.357 0.343 1
1 917 . 3 1 1 A 77 77 GLN CB C 77 31.800 30.848 0.952 1
1 919 . 3 1 1 A 77 77 GLN N N 77 121.900 121.672 0.228 1
1 921 . 3 1 1 A 78 78 TYR H H 78 8.890 9.122 -0.232 1
1 922 . 3 1 1 A 78 78 TYR HA H 78 4.750 5.282 -0.532 1
1 929 . 3 1 1 A 78 78 TYR C C 78 175.600 174.495 1.105 1
1 930 . 3 1 1 A 78 78 TYR CA C 78 57.000 56.469 0.531 1
1 931 . 3 1 1 A 78 78 TYR CB C 78 41.400 41.106 0.294 1
1 936 . 3 1 1 A 78 78 TYR N N 78 121.800 122.866 -1.066 1
1 937 . 3 1 1 A 79 79 TYR H H 79 9.010 9.467 -0.457 1
1 938 . 3 1 1 A 79 79 TYR HA H 79 5.410 5.458 -0.048 1
1 945 . 3 1 1 A 79 79 TYR C C 79 173.100 174.805 -1.705 1
1 946 . 3 1 1 A 79 79 TYR CA C 79 57.300 56.818 0.482 1
1 947 . 3 1 1 A 79 79 TYR CB C 79 43.300 41.658 1.642 1
1 952 . 3 1 1 A 79 79 TYR N N 79 122.500 121.143 1.357 1
1 953 . 3 1 1 A 80 80 ARG H H 80 8.720 9.182 -0.462 1
1 954 . 3 1 1 A 80 80 ARG HA H 80 5.120 4.866 0.254 1
1 962 . 3 1 1 A 80 80 ARG C C 80 175.500 174.831 0.669 1
1 963 . 3 1 1 A 80 80 ARG CA C 80 53.200 54.160 -0.960 1
1 964 . 3 1 1 A 80 80 ARG CB C 80 33.900 34.408 -0.508 1
1 967 . 3 1 1 A 80 80 ARG N N 80 114.500 122.056 -7.556 1
1 969 . 3 1 1 A 81 81 ILE H H 81 9.300 8.827 0.473 1
1 970 . 3 1 1 A 81 81 ILE HA H 81 4.150 4.193 -0.043 1
1 980 . 3 1 1 A 81 81 ILE C C 81 177.800 177.318 0.482 1
1 981 . 3 1 1 A 81 81 ILE CA C 81 62.300 62.303 -0.003 1
1 982 . 3 1 1 A 81 81 ILE CB C 81 37.800 37.665 0.135 1
1 986 . 3 1 1 A 81 81 ILE N N 81 122.100 126.273 -4.173 1
1 987 . 3 1 1 A 82 82 ALA H H 82 7.930 8.557 -0.627 1
1 988 . 3 1 1 A 82 82 ALA HA H 82 3.930 4.652 -0.722 1
1 992 . 3 1 1 A 82 82 ALA C C 82 176.300 176.656 -0.356 1
1 993 . 3 1 1 A 82 82 ALA CA C 82 54.200 52.041 2.159 1
1 994 . 3 1 1 A 82 82 ALA CB C 82 18.500 19.192 -0.692 1
1 995 . 3 1 1 A 82 82 ALA N N 82 127.200 129.615 -2.415 1
1 996 . 3 1 1 A 83 83 GLY H H 83 6.980 7.320 -0.340 1
1 997 . 3 1 1 A 83 83 GLY HA2 H 83 4.090 4.114 -0.024 1
1 998 . 3 1 1 A 83 83 GLY HA3 H 83 4.440 4.116 0.324 1
1 999 . 3 1 1 A 83 83 GLY C C 83 173.600 174.512 -0.912 1
1 1000 . 3 1 1 A 83 83 GLY CA C 83 45.200 45.679 -0.479 1
1 1001 . 3 1 1 A 83 83 GLY N N 83 101.800 106.104 -4.304 1
1 1002 . 3 1 1 A 84 84 GLU H H 84 8.930 8.943 -0.013 1
1 1003 . 3 1 1 A 84 84 GLU HA H 84 4.120 4.145 -0.025 1
1 1008 . 3 1 1 A 84 84 GLU C C 84 178.300 178.521 -0.221 1
1 1009 . 3 1 1 A 84 84 GLU CA C 84 58.900 58.558 0.342 1
1 1010 . 3 1 1 A 84 84 GLU CB C 84 29.400 29.204 0.196 1
1 1012 . 3 1 1 A 84 84 GLU N N 84 120.300 119.869 0.431 1
1 1013 . 3 1 1 A 85 85 ASP H H 85 8.950 8.614 0.336 1
1 1014 . 3 1 1 A 85 85 ASP HA H 85 4.310 4.372 -0.062 1
1 1017 . 3 1 1 A 85 85 ASP C C 85 178.000 178.735 -0.735 1
1 1018 . 3 1 1 A 85 85 ASP CA C 85 57.100 56.924 0.176 1
1 1019 . 3 1 1 A 85 85 ASP CB C 85 38.900 40.129 -1.229 1
1 1020 . 3 1 1 A 85 85 ASP N N 85 119.400 120.993 -1.593 1
1 1021 . 3 1 1 A 86 86 VAL H H 86 7.620 8.036 -0.416 1
1 1022 . 3 1 1 A 86 86 VAL HA H 86 3.480 3.537 -0.057 1
1 1030 . 3 1 1 A 86 86 VAL C C 86 177.400 178.069 -0.669 1
1 1031 . 3 1 1 A 86 86 VAL CA C 86 66.800 66.415 0.385 1
1 1032 . 3 1 1 A 86 86 VAL CB C 86 31.300 31.565 -0.265 1
1 1035 . 3 1 1 A 86 86 VAL N N 86 121.600 120.933 0.667 1
1 1036 . 3 1 1 A 87 87 ALA H H 87 7.520 7.994 -0.474 1
1 1037 . 3 1 1 A 87 87 ALA HA H 87 4.110 4.004 0.106 1
1 1041 . 3 1 1 A 87 87 ALA C C 87 181.200 180.062 1.138 1
1 1042 . 3 1 1 A 87 87 ALA CA C 87 55.800 55.886 -0.086 1
1 1043 . 3 1 1 A 87 87 ALA CB C 87 17.600 18.644 -1.044 1
1 1044 . 3 1 1 A 87 87 ALA N N 87 122.700 122.093 0.607 1
1 1045 . 3 1 1 A 88 88 ARG H H 88 8.380 8.580 -0.200 1
1 1046 . 3 1 1 A 88 88 ARG HA H 88 4.090 4.031 0.059 1
1 1054 . 3 1 1 A 88 88 ARG C C 88 179.100 178.980 0.120 1
1 1055 . 3 1 1 A 88 88 ARG CA C 88 59.600 59.196 0.404 1
1 1056 . 3 1 1 A 88 88 ARG CB C 88 30.500 29.991 0.509 1
1 1059 . 3 1 1 A 88 88 ARG N N 88 119.200 118.124 1.076 1
1 1061 . 3 1 1 A 89 89 LEU H H 89 8.480 7.745 0.735 1
1 1062 . 3 1 1 A 89 89 LEU HA H 89 4.040 4.071 -0.031 1
1 1071 . 3 1 1 A 89 89 LEU C C 89 177.200 178.787 -1.587 1
1 1072 . 3 1 1 A 89 89 LEU CA C 89 58.300 58.082 0.218 1
1 1073 . 3 1 1 A 89 89 LEU CB C 89 41.300 41.957 -0.657 1
1 1076 . 3 1 1 A 89 89 LEU N N 89 123.300 121.560 1.740 1
1 1077 . 3 1 1 A 90 90 PHE H H 90 8.890 8.468 0.422 1
1 1078 . 3 1 1 A 90 90 PHE HA H 90 4.380 4.011 0.369 1
1 1086 . 3 1 1 A 90 90 PHE C C 90 177.500 178.074 -0.574 1
1 1087 . 3 1 1 A 90 90 PHE CA C 90 59.400 62.069 -2.669 1
1 1088 . 3 1 1 A 90 90 PHE CB C 90 38.600 39.224 -0.624 1
1 1094 . 3 1 1 A 90 90 PHE N N 90 119.400 119.479 -0.079 1
1 1095 . 3 1 1 A 91 91 ALA H H 91 7.920 8.359 -0.439 1
1 1096 . 3 1 1 A 91 91 ALA HA H 91 3.940 3.969 -0.029 1
1 1100 . 3 1 1 A 91 91 ALA C C 91 180.200 179.801 0.399 1
1 1101 . 3 1 1 A 91 91 ALA CA C 91 55.100 55.461 -0.361 1
1 1102 . 3 1 1 A 91 91 ALA CB C 91 18.000 17.825 0.175 1
1 1103 . 3 1 1 A 91 91 ALA N N 91 120.500 121.403 -0.903 1
1 1104 . 3 1 1 A 92 92 LEU H H 92 8.190 8.448 -0.258 1
1 1105 . 3 1 1 A 92 92 LEU HA H 92 4.300 4.018 0.282 1
1 1115 . 3 1 1 A 92 92 LEU C C 92 178.900 178.340 0.560 1
1 1116 . 3 1 1 A 92 92 LEU CA C 92 57.500 58.005 -0.505 1
1 1117 . 3 1 1 A 92 92 LEU CB C 92 42.100 41.779 0.321 1
1 1121 . 3 1 1 A 92 92 LEU N N 92 120.200 119.622 0.578 1
1 1122 . 3 1 1 A 93 93 VAL H H 93 8.890 8.214 0.676 1
1 1123 . 3 1 1 A 93 93 VAL HA H 93 3.810 3.750 0.060 1
1 1131 . 3 1 1 A 93 93 VAL C C 93 176.900 177.403 -0.503 1
1 1132 . 3 1 1 A 93 93 VAL CA C 93 66.000 64.945 1.055 1
1 1133 . 3 1 1 A 93 93 VAL CB C 93 31.200 31.141 0.059 1
1 1136 . 3 1 1 A 93 93 VAL N N 93 117.100 118.469 -1.369 1
1 1137 . 3 1 1 A 94 94 GLN H H 94 6.920 7.667 -0.747 1
1 1138 . 3 1 1 A 94 94 GLN HA H 94 3.790 3.771 0.019 1
1 1145 . 3 1 1 A 94 94 GLN C C 94 177.400 178.267 -0.867 1
1 1146 . 3 1 1 A 94 94 GLN CA C 94 60.000 58.722 1.278 1
1 1147 . 3 1 1 A 94 94 GLN CB C 94 30.300 27.824 2.476 1
1 1149 . 3 1 1 A 94 94 GLN N N 94 117.800 120.533 -2.733 1
1 1151 . 3 1 1 A 95 95 VAL H H 95 7.420 7.708 -0.288 1
1 1152 . 3 1 1 A 95 95 VAL HA H 95 3.760 3.526 0.234 1
1 1160 . 3 1 1 A 95 95 VAL C C 95 178.300 178.411 -0.111 1
1 1161 . 3 1 1 A 95 95 VAL CA C 95 66.600 66.467 0.133 1
1 1162 . 3 1 1 A 95 95 VAL CB C 95 31.900 31.501 0.399 1
1 1165 . 3 1 1 A 95 95 VAL N N 95 121.500 120.040 1.460 1
1 1166 . 3 1 1 A 96 96 VAL H H 96 8.340 8.165 0.175 1
1 1167 . 3 1 1 A 96 96 VAL HA H 96 3.810 3.660 0.150 1
1 1175 . 3 1 1 A 96 96 VAL C C 96 178.400 178.184 0.216 1
1 1176 . 3 1 1 A 96 96 VAL CA C 96 66.100 66.419 -0.319 1
1 1177 . 3 1 1 A 96 96 VAL CB C 96 32.200 31.419 0.781 1
1 1180 . 3 1 1 A 96 96 VAL N N 96 120.000 120.238 -0.238 1
1 1181 . 3 1 1 A 97 97 ALA H H 97 8.140 7.415 0.725 1
1 1182 . 3 1 1 A 97 97 ALA HA H 97 4.010 4.208 -0.198 1
1 1186 . 3 1 1 A 97 97 ALA C C 97 178.800 178.570 0.230 1
1 1187 . 3 1 1 A 97 97 ALA CA C 97 54.900 54.532 0.368 1
1 1188 . 3 1 1 A 97 97 ALA CB C 97 19.900 19.053 0.847 1
1 1189 . 3 1 1 A 97 97 ALA N N 97 121.400 121.956 -0.556 1
1 1190 . 3 1 1 A 98 98 ASP H H 98 8.170 8.688 -0.518 1
1 1191 . 3 1 1 A 98 98 ASP HA H 98 4.320 4.251 0.069 1
1 1194 . 3 1 1 A 98 98 ASP C C 98 178.100 178.135 -0.035 1
1 1195 . 3 1 1 A 98 98 ASP CA C 98 57.100 57.664 -0.564 1
1 1196 . 3 1 1 A 98 98 ASP CB C 98 41.800 41.110 0.690 1
1 1197 . 3 1 1 A 98 98 ASP N N 98 118.500 118.150 0.350 1
1 1198 . 3 1 1 A 99 99 GLU H H 99 8.220 8.218 0.002 1
1 1199 . 3 1 1 A 99 99 GLU HA H 99 4.000 4.080 -0.080 1
1 1204 . 3 1 1 A 99 99 GLU C C 99 178.300 179.012 -0.712 1
1 1205 . 3 1 1 A 99 99 GLU CA C 99 58.300 59.282 -0.982 1
1 1206 . 3 1 1 A 99 99 GLU CB C 99 29.800 29.684 0.116 1
1 1208 . 3 1 1 A 99 99 GLU N N 99 116.600 119.520 -2.920 1
1 1209 . 3 1 1 A 100 100 HIS H H 100 7.980 8.251 -0.271 1
1 1210 . 3 1 1 A 100 100 HIS HA H 100 4.600 3.910 0.690 1
1 1214 . 3 1 1 A 100 100 HIS C C 100 175.900 177.329 -1.429 1
1 1215 . 3 1 1 A 100 100 HIS CA C 100 57.500 57.359 0.141 1
1 1216 . 3 1 1 A 100 100 HIS CB C 100 30.800 28.657 2.143 1
1 1218 . 3 1 1 A 100 100 HIS N N 100 114.000 117.812 -3.812 1
1 1219 . 3 1 1 A 101 101 LEU H H 101 7.920 7.802 0.118 1
1 1220 . 3 1 1 A 101 101 LEU HA H 101 4.370 3.732 0.638 1
1 1230 . 3 1 1 A 101 101 LEU C C 101 177.700 178.244 -0.544 1
1 1231 . 3 1 1 A 101 101 LEU CA C 101 55.900 57.857 -1.957 1
1 1232 . 3 1 1 A 101 101 LEU CB C 101 42.100 41.505 0.595 1
1 1236 . 3 1 1 A 101 101 LEU N N 101 118.500 123.155 -4.655 1
1 1237 . 3 1 1 A 102 102 GLU H H 102 8.100 7.847 0.253 1
1 1238 . 3 1 1 A 102 102 GLU HA H 102 4.160 4.527 -0.367 1
1 1243 . 3 1 1 A 102 102 GLU C C 102 176.700 177.327 -0.627 1
1 1244 . 3 1 1 A 102 102 GLU CA C 102 57.000 55.641 1.359 1
1 1245 . 3 1 1 A 102 102 GLU CB C 102 29.900 30.197 -0.297 1
1 1247 . 3 1 1 A 102 102 GLU N N 102 119.100 117.930 1.170 1
1 1248 . 3 1 1 A 103 103 HIS H H 103 8.010 8.142 -0.132 1
1 1249 . 3 1 1 A 103 103 HIS HA H 103 4.520 4.906 -0.386 1
1 1252 . 3 1 1 A 103 103 HIS CA C 103 56.100 55.454 0.646 1
1 1253 . 3 1 1 A 103 103 HIS CB C 103 29.700 29.630 0.070 1
1 1254 . 3 1 1 A 103 103 HIS N N 103 117.300 120.800 -3.500 1
1 1255 . 3 1 1 A 107 107 HIS HA H 107 4.560 4.892 -0.332 1
1 1258 . 3 1 1 A 107 107 HIS C C 107 173.900 172.562 1.338 1
1 1259 . 3 1 1 A 107 107 HIS CA C 107 55.900 54.608 1.292 1
1 1260 . 3 1 1 A 107 107 HIS CB C 107 30.200 31.077 -0.877 1
1 4 . 4 1 1 A 2 2 ALA H H 2 8.450 8.885 -0.435 1
1 5 . 4 1 1 A 2 2 ALA HA H 2 4.390 5.022 -0.632 1
1 9 . 4 1 1 A 2 2 ALA C C 2 178.300 175.870 2.430 1
1 10 . 4 1 1 A 2 2 ALA CA C 2 52.500 50.414 2.086 1
1 11 . 4 1 1 A 2 2 ALA CB C 2 19.200 20.585 -1.385 1
1 12 . 4 1 1 A 2 2 ALA N N 2 125.100 123.095 2.005 1
1 13 . 4 1 1 A 3 3 GLY H H 3 8.450 8.980 -0.530 1
1 14 . 4 1 1 A 3 3 GLY HA2 H 3 4.030 4.021 0.009 1
1 15 . 4 1 1 A 3 3 GLY HA3 H 3 4.030 4.021 0.009 1
1 16 . 4 1 1 A 3 3 GLY C C 3 174.100 174.564 -0.464 1
1 17 . 4 1 1 A 3 3 GLY CA C 3 45.200 45.556 -0.356 1
1 18 . 4 1 1 A 3 3 GLY N N 3 108.000 112.052 -4.052 1
1 19 . 4 1 1 A 4 4 GLN H H 4 8.550 8.797 -0.247 1
1 20 . 4 1 1 A 4 4 GLN HA H 4 4.340 4.349 -0.009 1
1 27 . 4 1 1 A 4 4 GLN C C 4 176.700 177.062 -0.362 1
1 28 . 4 1 1 A 4 4 GLN CA C 4 56.600 57.250 -0.650 1
1 29 . 4 1 1 A 4 4 GLN CB C 4 29.300 29.331 -0.031 1
1 31 . 4 1 1 A 4 4 GLN N N 4 120.500 124.929 -4.429 1
1 33 . 4 1 1 A 5 5 SER H H 5 8.540 7.995 0.545 1
1 34 . 4 1 1 A 5 5 SER HA H 5 4.390 4.528 -0.138 1
1 38 . 4 1 1 A 5 5 SER C C 5 174.800 174.666 0.134 1
1 39 . 4 1 1 A 5 5 SER CA C 5 59.100 58.688 0.412 1
1 40 . 4 1 1 A 5 5 SER CB C 5 63.500 63.799 -0.299 1
1 41 . 4 1 1 A 5 5 SER N N 5 117.100 113.306 3.794 1
1 42 . 4 1 1 A 6 6 ASP H H 6 8.300 7.960 0.340 1
1 43 . 4 1 1 A 6 6 ASP HA H 6 4.540 5.006 -0.466 1
1 46 . 4 1 1 A 6 6 ASP C C 6 177.300 176.372 0.928 1
1 47 . 4 1 1 A 6 6 ASP CA C 6 55.100 53.713 1.387 1
1 48 . 4 1 1 A 6 6 ASP CB C 6 40.800 41.413 -0.613 1
1 49 . 4 1 1 A 6 6 ASP N N 6 122.700 120.424 2.276 1
1 50 . 4 1 1 A 7 7 ARG H H 7 8.270 8.058 0.212 1
1 51 . 4 1 1 A 7 7 ARG HA H 7 4.150 3.966 0.184 1
1 58 . 4 1 1 A 7 7 ARG C C 7 177.600 178.723 -1.123 1
1 59 . 4 1 1 A 7 7 ARG CA C 7 58.000 59.291 -1.291 1
1 60 . 4 1 1 A 7 7 ARG CB C 7 30.100 29.785 0.315 1
1 63 . 4 1 1 A 7 7 ARG N N 7 122.100 120.590 1.510 1
1 64 . 4 1 1 A 8 8 LYS H H 8 8.130 8.150 -0.020 1
1 65 . 4 1 1 A 8 8 LYS HA H 8 4.090 4.133 -0.043 1
1 74 . 4 1 1 A 8 8 LYS C C 8 177.600 178.031 -0.431 1
1 75 . 4 1 1 A 8 8 LYS CA C 8 58.400 58.587 -0.187 1
1 76 . 4 1 1 A 8 8 LYS CB C 8 31.700 31.264 0.436 1
1 80 . 4 1 1 A 8 8 LYS N N 8 120.900 118.758 2.142 1
1 81 . 4 1 1 A 9 9 ALA H H 9 8.050 8.028 0.022 1
1 82 . 4 1 1 A 9 9 ALA HA H 9 3.950 4.069 -0.119 1
1 86 . 4 1 1 A 9 9 ALA C C 9 179.800 180.192 -0.392 1
1 87 . 4 1 1 A 9 9 ALA CA C 9 55.100 54.877 0.223 1
1 88 . 4 1 1 A 9 9 ALA CB C 9 18.100 18.175 -0.075 1
1 89 . 4 1 1 A 9 9 ALA N N 9 121.600 122.778 -1.178 1
1 90 . 4 1 1 A 10 10 ALA H H 10 7.910 7.555 0.355 1
1 91 . 4 1 1 A 10 10 ALA HA H 10 4.200 4.098 0.102 1
1 95 . 4 1 1 A 10 10 ALA C C 10 180.500 180.384 0.116 1
1 96 . 4 1 1 A 10 10 ALA CA C 10 54.600 55.052 -0.452 1
1 97 . 4 1 1 A 10 10 ALA CB C 10 18.100 18.400 -0.300 1
1 98 . 4 1 1 A 10 10 ALA N N 10 120.200 120.374 -0.174 1
1 99 . 4 1 1 A 11 11 LEU H H 11 8.080 8.148 -0.068 1
1 100 . 4 1 1 A 11 11 LEU HA H 11 4.120 4.045 0.075 1
1 110 . 4 1 1 A 11 11 LEU C C 11 179.600 179.796 -0.196 1
1 111 . 4 1 1 A 11 11 LEU CA C 11 57.800 57.486 0.314 1
1 112 . 4 1 1 A 11 11 LEU CB C 11 41.700 41.158 0.542 1
1 115 . 4 1 1 A 11 11 LEU N N 11 120.900 119.819 1.081 1
1 116 . 4 1 1 A 12 12 LEU H H 12 8.480 8.159 0.321 1
1 117 . 4 1 1 A 12 12 LEU HA H 12 4.040 3.953 0.087 1
1 127 . 4 1 1 A 12 12 LEU C C 12 178.900 178.908 -0.008 1
1 128 . 4 1 1 A 12 12 LEU CA C 12 58.100 58.016 0.084 1
1 129 . 4 1 1 A 12 12 LEU CB C 12 40.100 40.614 -0.514 1
1 133 . 4 1 1 A 12 12 LEU N N 12 118.700 119.633 -0.933 1
1 134 . 4 1 1 A 13 13 ASP H H 13 7.990 8.207 -0.217 1
1 135 . 4 1 1 A 13 13 ASP HA H 13 4.420 4.288 0.132 1
1 138 . 4 1 1 A 13 13 ASP C C 13 178.900 178.769 0.131 1
1 139 . 4 1 1 A 13 13 ASP CA C 13 57.500 57.847 -0.347 1
1 140 . 4 1 1 A 13 13 ASP CB C 13 40.500 41.521 -1.021 1
1 141 . 4 1 1 A 13 13 ASP N N 13 119.500 120.057 -0.557 1
1 142 . 4 1 1 A 14 14 GLN H H 14 7.620 7.548 0.072 1
1 143 . 4 1 1 A 14 14 GLN HA H 14 4.230 4.158 0.072 1
1 150 . 4 1 1 A 14 14 GLN C C 14 178.400 178.576 -0.176 1
1 151 . 4 1 1 A 14 14 GLN CA C 14 58.100 58.673 -0.573 1
1 152 . 4 1 1 A 14 14 GLN CB C 14 27.800 28.423 -0.623 1
1 154 . 4 1 1 A 14 14 GLN N N 14 118.900 119.588 -0.688 1
1 156 . 4 1 1 A 15 15 VAL H H 15 8.480 8.000 0.480 1
1 157 . 4 1 1 A 15 15 VAL HA H 15 3.380 3.611 -0.231 1
1 165 . 4 1 1 A 15 15 VAL C C 15 177.600 178.197 -0.597 1
1 166 . 4 1 1 A 15 15 VAL CA C 15 66.600 66.221 0.379 1
1 167 . 4 1 1 A 15 15 VAL CB C 15 30.500 31.557 -1.057 1
1 170 . 4 1 1 A 15 15 VAL N N 15 121.300 120.060 1.240 1
1 171 . 4 1 1 A 16 16 ALA H H 16 8.080 8.497 -0.417 1
1 172 . 4 1 1 A 16 16 ALA HA H 16 4.450 3.858 0.592 1
1 176 . 4 1 1 A 16 16 ALA C C 16 179.100 179.286 -0.186 1
1 177 . 4 1 1 A 16 16 ALA CA C 16 54.600 55.523 -0.923 1
1 178 . 4 1 1 A 16 16 ALA CB C 16 17.700 18.294 -0.594 1
1 179 . 4 1 1 A 16 16 ALA N N 16 121.400 121.872 -0.472 1
1 180 . 4 1 1 A 17 17 ARG H H 17 7.480 7.824 -0.344 1
1 181 . 4 1 1 A 17 17 ARG HA H 17 3.910 4.076 -0.166 1
1 187 . 4 1 1 A 17 17 ARG C C 17 179.700 178.451 1.249 1
1 188 . 4 1 1 A 17 17 ARG CA C 17 59.700 59.398 0.302 1
1 189 . 4 1 1 A 17 17 ARG CB C 17 30.400 29.822 0.578 1
1 191 . 4 1 1 A 17 17 ARG N N 17 116.900 119.241 -2.341 1
1 192 . 4 1 1 A 18 18 VAL H H 18 7.960 7.740 0.220 1
1 193 . 4 1 1 A 18 18 VAL HA H 18 3.690 3.887 -0.197 1
1 201 . 4 1 1 A 18 18 VAL C C 18 177.900 178.800 -0.900 1
1 202 . 4 1 1 A 18 18 VAL CA C 18 66.600 65.968 0.632 1
1 203 . 4 1 1 A 18 18 VAL CB C 18 31.300 31.116 0.184 1
1 206 . 4 1 1 A 18 18 VAL N N 18 123.000 117.881 5.119 1
1 207 . 4 1 1 A 19 19 GLY H H 19 8.270 8.706 -0.436 1
1 208 . 4 1 1 A 19 19 GLY HA2 H 19 3.430 3.715 -0.285 1
1 209 . 4 1 1 A 19 19 GLY HA3 H 19 3.430 3.720 -0.290 1
1 210 . 4 1 1 A 19 19 GLY C C 19 174.400 175.660 -1.260 1
1 211 . 4 1 1 A 19 19 GLY CA C 19 48.500 47.577 0.923 1
1 212 . 4 1 1 A 19 19 GLY N N 19 105.400 108.647 -3.247 1
1 213 . 4 1 1 A 20 20 LYS H H 20 8.250 8.223 0.027 1
1 214 . 4 1 1 A 20 20 LYS HA H 20 3.710 4.008 -0.298 1
1 223 . 4 1 1 A 20 20 LYS C C 20 179.400 179.274 0.126 1
1 224 . 4 1 1 A 20 20 LYS CA C 20 59.300 59.768 -0.468 1
1 225 . 4 1 1 A 20 20 LYS CB C 20 32.600 32.328 0.272 1
1 229 . 4 1 1 A 20 20 LYS N N 20 118.700 122.392 -3.692 1
1 230 . 4 1 1 A 21 21 ALA H H 21 7.640 7.667 -0.027 1
1 231 . 4 1 1 A 21 21 ALA HA H 21 3.790 4.111 -0.321 1
1 235 . 4 1 1 A 21 21 ALA C C 21 177.900 178.785 -0.885 1
1 236 . 4 1 1 A 21 21 ALA CA C 21 55.200 54.742 0.458 1
1 237 . 4 1 1 A 21 21 ALA CB C 21 19.200 18.622 0.578 1
1 238 . 4 1 1 A 21 21 ALA N N 21 121.700 122.069 -0.369 1
1 239 . 4 1 1 A 22 22 LEU H H 22 7.330 8.043 -0.713 1
1 240 . 4 1 1 A 22 22 LEU HA H 22 4.140 4.503 -0.363 1
1 250 . 4 1 1 A 22 22 LEU C C 22 176.800 177.616 -0.816 1
1 251 . 4 1 1 A 22 22 LEU CA C 22 54.600 54.428 0.172 1
1 252 . 4 1 1 A 22 22 LEU CB C 22 42.900 41.471 1.429 1
1 256 . 4 1 1 A 22 22 LEU N N 22 114.200 116.902 -2.702 1
1 257 . 4 1 1 A 23 23 ALA H H 23 7.160 7.688 -0.528 1
1 258 . 4 1 1 A 23 23 ALA HA H 23 4.720 4.271 0.449 1
1 262 . 4 1 1 A 23 23 ALA C C 23 176.700 177.569 -0.869 1
1 263 . 4 1 1 A 23 23 ALA CA C 23 53.000 52.099 0.901 1
1 264 . 4 1 1 A 23 23 ALA CB C 23 18.200 19.421 -1.221 1
1 265 . 4 1 1 A 23 23 ALA N N 23 118.200 122.633 -4.433 1
1 266 . 4 1 1 A 24 24 ASN H H 24 7.440 8.216 -0.776 1
1 267 . 4 1 1 A 24 24 ASN HA H 24 4.730 4.663 0.067 1
1 272 . 4 1 1 A 24 24 ASN C C 24 174.800 174.543 0.257 1
1 273 . 4 1 1 A 24 24 ASN CA C 24 53.500 55.337 -1.837 1
1 274 . 4 1 1 A 24 24 ASN CB C 24 41.700 37.258 4.442 1
1 275 . 4 1 1 A 24 24 ASN N N 24 116.800 114.699 2.101 1
1 277 . 4 1 1 A 25 25 GLY H H 25 9.370 8.658 0.712 1
1 278 . 4 1 1 A 25 25 GLY HA2 H 25 3.650 4.131 -0.481 1
1 279 . 4 1 1 A 25 25 GLY HA3 H 25 4.110 4.133 -0.023 1
1 280 . 4 1 1 A 25 25 GLY C C 25 175.300 175.619 -0.319 1
1 281 . 4 1 1 A 25 25 GLY CA C 25 47.600 44.011 3.589 1
1 282 . 4 1 1 A 25 25 GLY N N 25 114.800 108.502 6.298 1
1 283 . 4 1 1 A 26 26 ARG H H 26 8.050 8.709 -0.659 1
1 284 . 4 1 1 A 26 26 ARG HA H 26 4.150 4.169 -0.019 1
1 289 . 4 1 1 A 26 26 ARG C C 26 179.300 177.563 1.737 1
1 290 . 4 1 1 A 26 26 ARG CA C 26 57.000 57.951 -0.951 1
1 291 . 4 1 1 A 26 26 ARG CB C 26 29.900 29.689 0.211 1
1 294 . 4 1 1 A 26 26 ARG N N 26 120.500 122.289 -1.789 1
1 295 . 4 1 1 A 27 27 ARG H H 27 7.930 8.339 -0.409 1
1 296 . 4 1 1 A 27 27 ARG HA H 27 3.710 4.155 -0.445 1
1 301 . 4 1 1 A 27 27 ARG C C 27 178.300 177.095 1.205 1
1 302 . 4 1 1 A 27 27 ARG CA C 27 61.000 58.030 2.970 1
1 303 . 4 1 1 A 27 27 ARG CB C 27 30.400 29.271 1.129 1
1 305 . 4 1 1 A 27 27 ARG N N 27 117.900 118.260 -0.360 1
1 306 . 4 1 1 A 28 28 LEU H H 28 7.640 7.690 -0.050 1
1 307 . 4 1 1 A 28 28 LEU HA H 28 3.950 4.142 -0.192 1
1 317 . 4 1 1 A 28 28 LEU C C 28 178.200 178.979 -0.779 1
1 318 . 4 1 1 A 28 28 LEU CA C 28 57.600 56.332 1.268 1
1 319 . 4 1 1 A 28 28 LEU CB C 28 41.900 41.556 0.344 1
1 323 . 4 1 1 A 28 28 LEU N N 28 117.600 120.298 -2.698 1
1 324 . 4 1 1 A 29 29 GLN H H 29 8.110 7.852 0.258 1
1 325 . 4 1 1 A 29 29 GLN HA H 29 3.880 4.134 -0.254 1
1 332 . 4 1 1 A 29 29 GLN C C 29 179.400 178.628 0.772 1
1 333 . 4 1 1 A 29 29 GLN CA C 29 59.100 58.666 0.434 1
1 334 . 4 1 1 A 29 29 GLN CB C 29 28.800 28.303 0.497 1
1 336 . 4 1 1 A 29 29 GLN N N 29 119.300 118.381 0.919 1
1 338 . 4 1 1 A 30 30 ILE H H 30 7.530 7.648 -0.118 1
1 339 . 4 1 1 A 30 30 ILE HA H 30 3.340 3.628 -0.288 1
1 349 . 4 1 1 A 30 30 ILE C C 30 176.700 178.186 -1.486 1
1 350 . 4 1 1 A 30 30 ILE CA C 30 65.900 65.563 0.337 1
1 351 . 4 1 1 A 30 30 ILE CB C 30 37.400 38.101 -0.701 1
1 355 . 4 1 1 A 30 30 ILE N N 30 118.600 120.746 -2.146 1
1 356 . 4 1 1 A 31 31 LEU H H 31 7.500 8.087 -0.587 1
1 357 . 4 1 1 A 31 31 LEU HA H 31 3.520 3.729 -0.209 1
1 367 . 4 1 1 A 31 31 LEU C C 31 177.300 178.694 -1.394 1
1 368 . 4 1 1 A 31 31 LEU CA C 31 58.100 57.888 0.212 1
1 369 . 4 1 1 A 31 31 LEU CB C 31 41.100 40.537 0.563 1
1 373 . 4 1 1 A 31 31 LEU N N 31 119.900 118.505 1.395 1
1 374 . 4 1 1 A 32 32 ASP H H 32 7.950 8.545 -0.595 1
1 375 . 4 1 1 A 32 32 ASP HA H 32 4.300 4.302 -0.002 1
1 378 . 4 1 1 A 32 32 ASP C C 32 178.300 178.436 -0.136 1
1 379 . 4 1 1 A 32 32 ASP CA C 32 57.400 57.874 -0.474 1
1 380 . 4 1 1 A 32 32 ASP CB C 32 42.400 41.580 0.820 1
1 381 . 4 1 1 A 32 32 ASP N N 32 116.900 119.953 -3.053 1
1 382 . 4 1 1 A 33 33 LEU H H 33 7.350 7.554 -0.204 1
1 383 . 4 1 1 A 33 33 LEU HA H 33 4.130 4.106 0.024 1
1 393 . 4 1 1 A 33 33 LEU C C 33 180.000 178.285 1.715 1
1 394 . 4 1 1 A 33 33 LEU CA C 33 57.600 57.331 0.269 1
1 395 . 4 1 1 A 33 33 LEU CB C 33 42.300 41.186 1.114 1
1 399 . 4 1 1 A 33 33 LEU N N 33 118.600 120.478 -1.878 1
1 400 . 4 1 1 A 34 34 LEU H H 34 8.300 7.831 0.469 1
1 401 . 4 1 1 A 34 34 LEU HA H 34 4.490 4.549 -0.059 1
1 411 . 4 1 1 A 34 34 LEU C C 34 178.900 178.607 0.293 1
1 412 . 4 1 1 A 34 34 LEU CA C 34 55.800 55.781 0.019 1
1 413 . 4 1 1 A 34 34 LEU CB C 34 41.300 41.957 -0.657 1
1 417 . 4 1 1 A 34 34 LEU N N 34 117.800 117.540 0.260 1
1 418 . 4 1 1 A 35 35 ALA H H 35 8.160 7.394 0.766 1
1 419 . 4 1 1 A 35 35 ALA HA H 35 4.050 4.159 -0.109 1
1 423 . 4 1 1 A 35 35 ALA C C 35 179.000 179.312 -0.312 1
1 424 . 4 1 1 A 35 35 ALA CA C 35 54.900 54.240 0.660 1
1 425 . 4 1 1 A 35 35 ALA CB C 35 17.500 18.721 -1.221 1
1 426 . 4 1 1 A 35 35 ALA N N 35 123.900 121.422 2.478 1
1 427 . 4 1 1 A 36 36 GLN H H 36 7.600 8.011 -0.411 1
1 428 . 4 1 1 A 36 36 GLN HA H 36 4.340 4.229 0.111 1
1 435 . 4 1 1 A 36 36 GLN C C 36 176.100 175.533 0.567 1
1 436 . 4 1 1 A 36 36 GLN CA C 36 55.800 55.525 0.275 1
1 437 . 4 1 1 A 36 36 GLN CB C 36 29.000 28.582 0.418 1
1 439 . 4 1 1 A 36 36 GLN N N 36 113.300 113.691 -0.391 1
1 441 . 4 1 1 A 37 37 GLY H H 37 7.550 7.312 0.238 1
1 442 . 4 1 1 A 37 37 GLY HA2 H 37 3.730 4.096 -0.366 1
1 443 . 4 1 1 A 37 37 GLY HA3 H 37 4.490 4.101 0.389 1
1 444 . 4 1 1 A 37 37 GLY C C 37 171.500 171.537 -0.037 1
1 445 . 4 1 1 A 37 37 GLY CA C 37 44.500 45.772 -1.272 1
1 446 . 4 1 1 A 37 37 GLY N N 37 108.400 107.415 0.985 1
1 447 . 4 1 1 A 38 38 GLU H H 38 8.120 8.542 -0.422 1
1 448 . 4 1 1 A 38 38 GLU HA H 38 4.820 5.020 -0.200 1
1 453 . 4 1 1 A 38 38 GLU C C 38 177.000 175.236 1.764 1
1 454 . 4 1 1 A 38 38 GLU CA C 38 56.400 55.487 0.913 1
1 455 . 4 1 1 A 38 38 GLU CB C 38 31.200 31.390 -0.190 1
1 457 . 4 1 1 A 38 38 GLU N N 38 119.600 120.892 -1.292 1
1 458 . 4 1 1 A 39 39 ARG H H 39 8.580 8.818 -0.238 1
1 459 . 4 1 1 A 39 39 ARG HA H 39 4.970 5.223 -0.253 1
1 467 . 4 1 1 A 39 39 ARG C C 39 174.800 175.202 -0.402 1
1 468 . 4 1 1 A 39 39 ARG CA C 39 53.900 54.215 -0.315 1
1 469 . 4 1 1 A 39 39 ARG CB C 39 36.400 34.056 2.344 1
1 472 . 4 1 1 A 39 39 ARG N N 39 121.500 127.387 -5.887 1
1 474 . 4 1 1 A 40 40 ALA H H 40 8.910 8.844 0.066 1
1 475 . 4 1 1 A 40 40 ALA HA H 40 4.920 4.622 0.298 1
1 479 . 4 1 1 A 40 40 ALA C C 40 179.200 178.278 0.922 1
1 480 . 4 1 1 A 40 40 ALA CA C 40 51.100 51.916 -0.816 1
1 481 . 4 1 1 A 40 40 ALA CB C 40 19.200 19.378 -0.178 1
1 482 . 4 1 1 A 40 40 ALA N N 40 125.100 128.221 -3.121 1
1 483 . 4 1 1 A 41 41 VAL H H 41 8.420 8.703 -0.283 1
1 484 . 4 1 1 A 41 41 VAL HA H 41 3.430 3.592 -0.162 1
1 492 . 4 1 1 A 41 41 VAL C C 41 176.800 177.144 -0.344 1
1 493 . 4 1 1 A 41 41 VAL CA C 41 67.600 66.920 0.680 1
1 494 . 4 1 1 A 41 41 VAL CB C 41 31.600 31.877 -0.277 1
1 497 . 4 1 1 A 41 41 VAL N N 41 120.900 120.761 0.139 1
1 498 . 4 1 1 A 42 42 GLU H H 42 9.640 8.565 1.075 1
1 499 . 4 1 1 A 42 42 GLU HA H 42 3.880 3.992 -0.112 1
1 504 . 4 1 1 A 42 42 GLU C C 42 178.300 178.837 -0.537 1
1 505 . 4 1 1 A 42 42 GLU CA C 42 60.600 59.492 1.108 1
1 506 . 4 1 1 A 42 42 GLU CB C 42 28.300 29.501 -1.201 1
1 508 . 4 1 1 A 42 42 GLU N N 42 119.000 119.506 -0.506 1
1 509 . 4 1 1 A 43 43 ALA H H 43 6.870 7.734 -0.864 1
1 510 . 4 1 1 A 43 43 ALA HA H 43 4.290 4.040 0.250 1
1 514 . 4 1 1 A 43 43 ALA C C 43 180.700 179.353 1.347 1
1 515 . 4 1 1 A 43 43 ALA CA C 43 54.100 54.942 -0.842 1
1 516 . 4 1 1 A 43 43 ALA CB C 43 19.100 17.878 1.222 1
1 517 . 4 1 1 A 43 43 ALA N N 43 120.500 121.910 -1.410 1
1 518 . 4 1 1 A 44 44 ILE H H 44 7.970 7.907 0.063 1
1 519 . 4 1 1 A 44 44 ILE HA H 44 3.470 3.601 -0.131 1
1 529 . 4 1 1 A 44 44 ILE C C 44 178.300 177.753 0.547 1
1 530 . 4 1 1 A 44 44 ILE CA C 44 64.700 65.454 -0.754 1
1 531 . 4 1 1 A 44 44 ILE CB C 44 38.100 38.000 0.100 1
1 535 . 4 1 1 A 44 44 ILE N N 44 120.500 119.170 1.330 1
1 536 . 4 1 1 A 45 45 ALA H H 45 8.460 8.639 -0.179 1
1 537 . 4 1 1 A 45 45 ALA HA H 45 3.720 4.032 -0.312 1
1 541 . 4 1 1 A 45 45 ALA C C 45 178.500 179.787 -1.287 1
1 542 . 4 1 1 A 45 45 ALA CA C 45 56.200 55.162 1.038 1
1 543 . 4 1 1 A 45 45 ALA CB C 45 17.400 18.024 -0.624 1
1 544 . 4 1 1 A 45 45 ALA N N 45 124.500 121.860 2.640 1
1 545 . 4 1 1 A 46 46 THR H H 46 8.080 7.780 0.300 1
1 546 . 4 1 1 A 46 46 THR HA H 46 3.900 3.847 0.053 1
1 551 . 4 1 1 A 46 46 THR C C 46 177.200 176.615 0.585 1
1 552 . 4 1 1 A 46 46 THR CA C 46 66.400 66.594 -0.194 1
1 553 . 4 1 1 A 46 46 THR CB C 46 68.800 68.796 0.004 1
1 555 . 4 1 1 A 46 46 THR N N 46 112.400 114.534 -2.134 1
1 556 . 4 1 1 A 47 47 ALA H H 47 7.930 8.267 -0.337 1
1 557 . 4 1 1 A 47 47 ALA HA H 47 4.200 4.124 0.076 1
1 561 . 4 1 1 A 47 47 ALA C C 47 179.200 179.651 -0.451 1
1 562 . 4 1 1 A 47 47 ALA CA C 47 54.800 55.186 -0.386 1
1 563 . 4 1 1 A 47 47 ALA CB C 47 19.800 18.088 1.712 1
1 564 . 4 1 1 A 47 47 ALA N N 47 121.400 124.028 -2.628 1
1 565 . 4 1 1 A 48 48 THR H H 48 7.560 7.664 -0.104 1
1 566 . 4 1 1 A 48 48 THR HA H 48 4.390 4.611 -0.221 1
1 571 . 4 1 1 A 48 48 THR C C 48 175.700 176.098 -0.398 1
1 572 . 4 1 1 A 48 48 THR CA C 48 61.800 62.834 -1.034 1
1 573 . 4 1 1 A 48 48 THR CB C 48 71.000 70.307 0.693 1
1 575 . 4 1 1 A 48 48 THR N N 48 103.500 107.212 -3.712 1
1 576 . 4 1 1 A 49 49 GLY H H 49 7.820 8.495 -0.675 1
1 577 . 4 1 1 A 49 49 GLY HA2 H 49 3.870 3.892 -0.022 1
1 578 . 4 1 1 A 49 49 GLY HA3 H 49 4.100 3.894 0.206 1
1 579 . 4 1 1 A 49 49 GLY C C 49 174.400 173.768 0.632 1
1 580 . 4 1 1 A 49 49 GLY CA C 49 46.300 46.067 0.233 1
1 581 . 4 1 1 A 49 49 GLY N N 49 111.100 112.315 -1.215 1
1 582 . 4 1 1 A 50 50 MET H H 50 7.930 7.896 0.034 1
1 583 . 4 1 1 A 50 50 MET HA H 50 4.540 4.886 -0.346 1
1 591 . 4 1 1 A 50 50 MET C C 50 174.800 175.040 -0.240 1
1 592 . 4 1 1 A 50 50 MET CA C 50 55.100 54.232 0.868 1
1 593 . 4 1 1 A 50 50 MET CB C 50 37.200 36.757 0.443 1
1 596 . 4 1 1 A 50 50 MET N N 50 119.300 118.458 0.842 1
1 597 . 4 1 1 A 51 51 ASN H H 51 8.040 8.828 -0.788 1
1 598 . 4 1 1 A 51 51 ASN HA H 51 4.580 4.903 -0.323 1
1 601 . 4 1 1 A 51 51 ASN C C 51 176.100 177.243 -1.143 1
1 602 . 4 1 1 A 51 51 ASN CA C 51 52.800 52.861 -0.061 1
1 603 . 4 1 1 A 51 51 ASN CB C 51 41.100 39.333 1.767 1
1 604 . 4 1 1 A 51 51 ASN N N 51 118.000 118.550 -0.550 1
1 605 . 4 1 1 A 52 52 LEU H H 52 8.560 8.806 -0.246 1
1 606 . 4 1 1 A 52 52 LEU HA H 52 3.760 3.922 -0.162 1
1 616 . 4 1 1 A 52 52 LEU C C 52 179.600 178.622 0.978 1
1 617 . 4 1 1 A 52 52 LEU CA C 52 59.000 57.890 1.110 1
1 618 . 4 1 1 A 52 52 LEU CB C 52 41.800 41.802 -0.002 1
1 622 . 4 1 1 A 52 52 LEU N N 52 120.600 123.912 -3.312 1
1 623 . 4 1 1 A 53 53 THR H H 53 8.230 8.127 0.103 1
1 624 . 4 1 1 A 53 53 THR HA H 53 3.880 3.945 -0.065 1
1 629 . 4 1 1 A 53 53 THR C C 53 176.900 177.200 -0.300 1
1 630 . 4 1 1 A 53 53 THR CA C 53 66.500 66.290 0.210 1
1 631 . 4 1 1 A 53 53 THR CB C 53 68.400 68.134 0.266 1
1 633 . 4 1 1 A 53 53 THR N N 53 115.800 113.596 2.204 1
1 634 . 4 1 1 A 54 54 THR H H 54 8.420 8.035 0.385 1
1 635 . 4 1 1 A 54 54 THR HA H 54 3.880 3.796 0.084 1
1 640 . 4 1 1 A 54 54 THR C C 54 177.300 176.126 1.174 1
1 641 . 4 1 1 A 54 54 THR CA C 54 66.600 66.678 -0.078 1
1 642 . 4 1 1 A 54 54 THR CB C 54 66.600 68.599 -1.999 1
1 644 . 4 1 1 A 54 54 THR N N 54 122.300 117.411 4.889 1
1 645 . 4 1 1 A 55 55 ALA H H 55 8.860 8.534 0.326 1
1 646 . 4 1 1 A 55 55 ALA HA H 55 4.020 3.990 0.030 1
1 650 . 4 1 1 A 55 55 ALA C C 55 179.000 179.486 -0.486 1
1 651 . 4 1 1 A 55 55 ALA CA C 55 56.100 55.350 0.750 1
1 652 . 4 1 1 A 55 55 ALA CB C 55 17.000 18.060 -1.060 1
1 653 . 4 1 1 A 55 55 ALA N N 55 125.600 123.669 1.931 1
1 654 . 4 1 1 A 56 56 SER H H 56 8.440 8.351 0.089 1
1 655 . 4 1 1 A 56 56 SER HA H 56 3.920 3.990 -0.070 1
1 658 . 4 1 1 A 56 56 SER C C 56 176.400 176.240 0.160 1
1 659 . 4 1 1 A 56 56 SER CA C 56 62.600 61.462 1.138 1
1 660 . 4 1 1 A 56 56 SER CB C 56 62.700 62.827 -0.127 1
1 661 . 4 1 1 A 56 56 SER N N 56 112.700 113.282 -0.582 1
1 662 . 4 1 1 A 57 57 ALA H H 57 8.090 8.198 -0.108 1
1 663 . 4 1 1 A 57 57 ALA HA H 57 4.130 3.991 0.139 1
1 667 . 4 1 1 A 57 57 ALA C C 57 181.200 179.962 1.238 1
1 668 . 4 1 1 A 57 57 ALA CA C 57 55.200 55.191 0.009 1
1 669 . 4 1 1 A 57 57 ALA CB C 57 17.900 18.154 -0.254 1
1 670 . 4 1 1 A 57 57 ALA N N 57 124.000 123.541 0.459 1
1 671 . 4 1 1 A 58 58 ASN H H 58 7.970 7.571 0.399 1
1 672 . 4 1 1 A 58 58 ASN HA H 58 4.480 4.557 -0.077 1
1 677 . 4 1 1 A 58 58 ASN C C 58 177.500 178.277 -0.777 1
1 678 . 4 1 1 A 58 58 ASN CA C 58 56.900 56.389 0.511 1
1 679 . 4 1 1 A 58 58 ASN CB C 58 39.800 38.650 1.150 1
1 680 . 4 1 1 A 58 58 ASN N N 58 117.600 116.726 0.874 1
1 682 . 4 1 1 A 59 59 LEU H H 59 8.530 8.735 -0.205 1
1 683 . 4 1 1 A 59 59 LEU HA H 59 3.710 3.849 -0.139 1
1 693 . 4 1 1 A 59 59 LEU C C 59 178.400 179.098 -0.698 1
1 694 . 4 1 1 A 59 59 LEU CA C 59 58.600 57.849 0.751 1
1 695 . 4 1 1 A 59 59 LEU CB C 59 40.500 40.910 -0.410 1
1 699 . 4 1 1 A 59 59 LEU N N 59 122.600 121.307 1.293 1
1 700 . 4 1 1 A 60 60 GLN H H 60 8.200 8.645 -0.445 1
1 701 . 4 1 1 A 60 60 GLN HA H 60 4.020 3.994 0.026 1
1 708 . 4 1 1 A 60 60 GLN C C 60 178.700 177.896 0.804 1
1 709 . 4 1 1 A 60 60 GLN CA C 60 58.800 59.005 -0.205 1
1 710 . 4 1 1 A 60 60 GLN CB C 60 27.700 28.644 -0.944 1
1 712 . 4 1 1 A 60 60 GLN N N 60 118.900 118.717 0.183 1
1 714 . 4 1 1 A 61 61 ALA H H 61 7.580 7.681 -0.101 1
1 715 . 4 1 1 A 61 61 ALA HA H 61 4.230 4.194 0.036 1
1 719 . 4 1 1 A 61 61 ALA C C 61 181.300 180.091 1.209 1
1 720 . 4 1 1 A 61 61 ALA CA C 61 55.100 55.167 -0.067 1
1 721 . 4 1 1 A 61 61 ALA CB C 61 17.600 18.459 -0.859 1
1 722 . 4 1 1 A 61 61 ALA N N 61 122.200 122.223 -0.023 1
1 723 . 4 1 1 A 62 62 LEU H H 62 7.830 8.260 -0.430 1
1 724 . 4 1 1 A 62 62 LEU HA H 62 3.980 3.937 0.043 1
1 734 . 4 1 1 A 62 62 LEU C C 62 178.500 179.187 -0.687 1
1 735 . 4 1 1 A 62 62 LEU CA C 62 58.100 57.854 0.246 1
1 736 . 4 1 1 A 62 62 LEU CB C 62 43.300 41.466 1.834 1
1 739 . 4 1 1 A 62 62 LEU N N 62 119.000 117.926 1.074 1
1 740 . 4 1 1 A 63 63 LYS H H 63 8.580 8.108 0.472 1
1 741 . 4 1 1 A 63 63 LYS HA H 63 4.130 4.058 0.072 1
1 750 . 4 1 1 A 63 63 LYS C C 63 180.500 179.163 1.337 1
1 751 . 4 1 1 A 63 63 LYS CA C 63 59.700 58.776 0.924 1
1 752 . 4 1 1 A 63 63 LYS CB C 63 32.600 31.980 0.620 1
1 756 . 4 1 1 A 63 63 LYS N N 63 123.400 121.397 2.003 1
1 757 . 4 1 1 A 64 64 SER H H 64 8.640 8.640 0.000 1
1 758 . 4 1 1 A 64 64 SER HA H 64 4.300 4.260 0.040 1
1 761 . 4 1 1 A 64 64 SER C C 64 175.000 176.050 -1.050 1
1 762 . 4 1 1 A 64 64 SER CA C 64 61.400 60.681 0.719 1
1 763 . 4 1 1 A 64 64 SER CB C 64 63.000 62.903 0.097 1
1 764 . 4 1 1 A 64 64 SER N N 64 117.700 115.020 2.680 1
1 765 . 4 1 1 A 65 65 GLY H H 65 7.280 7.612 -0.332 1
1 766 . 4 1 1 A 65 65 GLY HA2 H 65 3.240 3.944 -0.704 1
1 767 . 4 1 1 A 65 65 GLY HA3 H 65 3.980 3.945 0.035 1
1 768 . 4 1 1 A 65 65 GLY C C 65 171.300 174.699 -3.399 1
1 769 . 4 1 1 A 65 65 GLY CA C 65 45.100 45.503 -0.403 1
1 770 . 4 1 1 A 65 65 GLY N N 65 104.400 109.955 -5.555 1
1 771 . 4 1 1 A 66 66 GLY H H 66 7.730 7.851 -0.121 1
1 772 . 4 1 1 A 66 66 GLY HA2 H 66 3.650 4.023 -0.373 1
1 773 . 4 1 1 A 66 66 GLY HA3 H 66 3.750 4.025 -0.275 1
1 774 . 4 1 1 A 66 66 GLY C C 66 173.700 174.936 -1.236 1
1 775 . 4 1 1 A 66 66 GLY CA C 66 45.400 46.214 -0.814 1
1 776 . 4 1 1 A 66 66 GLY N N 66 104.700 108.207 -3.507 1
1 777 . 4 1 1 A 67 67 LEU H H 67 7.520 8.278 -0.758 1
1 778 . 4 1 1 A 67 67 LEU HA H 67 4.310 4.306 0.004 1
1 788 . 4 1 1 A 67 67 LEU C C 67 177.700 176.892 0.808 1
1 789 . 4 1 1 A 67 67 LEU CA C 67 55.500 55.882 -0.382 1
1 790 . 4 1 1 A 67 67 LEU CB C 67 42.400 42.707 -0.307 1
1 794 . 4 1 1 A 67 67 LEU N N 67 110.600 118.165 -7.565 1
1 795 . 4 1 1 A 68 68 VAL H H 68 6.890 7.415 -0.525 1
1 796 . 4 1 1 A 68 68 VAL HA H 68 5.190 4.990 0.200 1
1 804 . 4 1 1 A 68 68 VAL C C 68 173.700 174.817 -1.117 1
1 805 . 4 1 1 A 68 68 VAL CA C 68 57.400 58.652 -1.252 1
1 806 . 4 1 1 A 68 68 VAL CB C 68 36.400 35.051 1.349 1
1 809 . 4 1 1 A 68 68 VAL N N 68 106.400 112.683 -6.283 1
1 810 . 4 1 1 A 69 69 GLU H H 69 8.880 9.289 -0.409 1
1 811 . 4 1 1 A 69 69 GLU HA H 69 4.660 5.049 -0.389 1
1 816 . 4 1 1 A 69 69 GLU C C 69 173.300 175.246 -1.946 1
1 817 . 4 1 1 A 69 69 GLU CA C 69 54.300 54.711 -0.411 1
1 818 . 4 1 1 A 69 69 GLU CB C 69 34.100 32.253 1.847 1
1 820 . 4 1 1 A 69 69 GLU N N 69 120.400 121.406 -1.006 1
1 821 . 4 1 1 A 70 70 ALA H H 70 8.730 8.894 -0.164 1
1 822 . 4 1 1 A 70 70 ALA HA H 70 4.990 4.493 0.497 1
1 826 . 4 1 1 A 70 70 ALA C C 70 176.500 175.602 0.898 1
1 827 . 4 1 1 A 70 70 ALA CA C 70 50.000 50.168 -0.168 1
1 828 . 4 1 1 A 70 70 ALA CB C 70 22.300 20.093 2.207 1
1 829 . 4 1 1 A 70 70 ALA N N 70 122.800 122.697 0.103 1
1 830 . 4 1 1 A 71 71 ARG H H 71 8.670 9.282 -0.612 1
1 831 . 4 1 1 A 71 71 ARG HA H 71 4.630 4.775 -0.145 1
1 843 . 4 1 1 A 71 71 ARG C C 71 173.500 174.544 -1.044 1
1 844 . 4 1 1 A 71 71 ARG CA C 71 54.600 54.496 0.104 1
1 845 . 4 1 1 A 71 71 ARG CB C 71 33.600 31.489 2.111 1
1 849 . 4 1 1 A 71 71 ARG N N 71 120.100 123.269 -3.169 1
1 851 . 4 1 1 A 72 72 ARG H H 72 8.780 8.821 -0.041 1
1 852 . 4 1 1 A 72 72 ARG HA H 72 5.100 4.714 0.386 1
1 859 . 4 1 1 A 72 72 ARG C C 72 176.000 174.972 1.028 1
1 860 . 4 1 1 A 72 72 ARG CA C 72 54.900 56.269 -1.369 1
1 861 . 4 1 1 A 72 72 ARG CB C 72 32.500 31.164 1.336 1
1 864 . 4 1 1 A 72 72 ARG N N 72 123.600 126.763 -3.163 1
1 865 . 4 1 1 A 73 73 GLU H H 73 8.720 9.268 -0.548 1
1 866 . 4 1 1 A 73 73 GLU HA H 73 4.510 4.655 -0.145 1
1 871 . 4 1 1 A 73 73 GLU C C 73 175.900 176.736 -0.836 1
1 872 . 4 1 1 A 73 73 GLU CA C 73 55.700 55.099 0.601 1
1 873 . 4 1 1 A 73 73 GLU CB C 73 31.800 31.159 0.641 1
1 875 . 4 1 1 A 73 73 GLU N N 73 126.800 125.653 1.147 1
1 876 . 4 1 1 A 74 74 GLY H H 74 9.190 8.946 0.244 1
1 877 . 4 1 1 A 74 74 GLY HA2 H 74 3.700 3.876 -0.176 1
1 878 . 4 1 1 A 74 74 GLY HA3 H 74 4.170 3.882 0.288 1
1 879 . 4 1 1 A 74 74 GLY C C 74 175.400 174.886 0.514 1
1 880 . 4 1 1 A 74 74 GLY CA C 74 47.100 47.292 -0.192 1
1 881 . 4 1 1 A 74 74 GLY N N 74 118.500 116.595 1.905 1
1 882 . 4 1 1 A 75 75 THR H H 75 8.780 8.555 0.225 1
1 883 . 4 1 1 A 75 75 THR HA H 75 4.290 4.409 -0.119 1
1 888 . 4 1 1 A 75 75 THR C C 75 174.600 174.504 0.096 1
1 889 . 4 1 1 A 75 75 THR CA C 75 62.000 62.860 -0.860 1
1 890 . 4 1 1 A 75 75 THR CB C 75 69.000 70.092 -1.092 1
1 892 . 4 1 1 A 75 75 THR N N 75 118.000 120.593 -2.593 1
1 893 . 4 1 1 A 76 76 ARG H H 76 8.030 7.251 0.779 1
1 894 . 4 1 1 A 76 76 ARG HA H 76 4.610 4.884 -0.274 1
1 901 . 4 1 1 A 76 76 ARG C C 76 174.800 174.913 -0.113 1
1 902 . 4 1 1 A 76 76 ARG CA C 76 55.500 55.126 0.374 1
1 903 . 4 1 1 A 76 76 ARG CB C 76 32.700 32.448 0.252 1
1 906 . 4 1 1 A 76 76 ARG N N 76 122.600 118.841 3.759 1
1 907 . 4 1 1 A 77 77 GLN H H 77 8.580 8.539 0.041 1
1 908 . 4 1 1 A 77 77 GLN HA H 77 4.910 4.896 0.014 1
1 915 . 4 1 1 A 77 77 GLN C C 77 173.900 174.571 -0.671 1
1 916 . 4 1 1 A 77 77 GLN CA C 77 54.700 54.356 0.344 1
1 917 . 4 1 1 A 77 77 GLN CB C 77 31.800 31.303 0.497 1
1 919 . 4 1 1 A 77 77 GLN N N 77 121.900 120.654 1.246 1
1 921 . 4 1 1 A 78 78 TYR H H 78 8.890 9.485 -0.595 1
1 922 . 4 1 1 A 78 78 TYR HA H 78 4.750 5.378 -0.628 1
1 929 . 4 1 1 A 78 78 TYR C C 78 175.600 174.547 1.053 1
1 930 . 4 1 1 A 78 78 TYR CA C 78 57.000 56.178 0.822 1
1 931 . 4 1 1 A 78 78 TYR CB C 78 41.400 40.226 1.174 1
1 936 . 4 1 1 A 78 78 TYR N N 78 121.800 122.291 -0.491 1
1 937 . 4 1 1 A 79 79 TYR H H 79 9.010 9.768 -0.758 1
1 938 . 4 1 1 A 79 79 TYR HA H 79 5.410 5.628 -0.218 1
1 945 . 4 1 1 A 79 79 TYR C C 79 173.100 175.020 -1.920 1
1 946 . 4 1 1 A 79 79 TYR CA C 79 57.300 56.963 0.337 1
1 947 . 4 1 1 A 79 79 TYR CB C 79 43.300 41.781 1.519 1
1 952 . 4 1 1 A 79 79 TYR N N 79 122.500 122.620 -0.120 1
1 953 . 4 1 1 A 80 80 ARG H H 80 8.720 8.317 0.403 1
1 954 . 4 1 1 A 80 80 ARG HA H 80 5.120 4.681 0.439 1
1 962 . 4 1 1 A 80 80 ARG C C 80 175.500 174.560 0.940 1
1 963 . 4 1 1 A 80 80 ARG CA C 80 53.200 55.209 -2.009 1
1 964 . 4 1 1 A 80 80 ARG CB C 80 33.900 34.222 -0.322 1
1 967 . 4 1 1 A 80 80 ARG N N 80 114.500 121.679 -7.179 1
1 969 . 4 1 1 A 81 81 ILE H H 81 9.300 8.749 0.551 1
1 970 . 4 1 1 A 81 81 ILE HA H 81 4.150 4.142 0.008 1
1 980 . 4 1 1 A 81 81 ILE C C 81 177.800 176.004 1.796 1
1 981 . 4 1 1 A 81 81 ILE CA C 81 62.300 62.252 0.048 1
1 982 . 4 1 1 A 81 81 ILE CB C 81 37.800 37.532 0.268 1
1 986 . 4 1 1 A 81 81 ILE N N 81 122.100 126.584 -4.484 1
1 987 . 4 1 1 A 82 82 ALA H H 82 7.930 8.809 -0.879 1
1 988 . 4 1 1 A 82 82 ALA HA H 82 3.930 4.200 -0.270 1
1 992 . 4 1 1 A 82 82 ALA C C 82 176.300 177.058 -0.758 1
1 993 . 4 1 1 A 82 82 ALA CA C 82 54.200 55.154 -0.954 1
1 994 . 4 1 1 A 82 82 ALA CB C 82 18.500 18.934 -0.434 1
1 995 . 4 1 1 A 82 82 ALA N N 82 127.200 129.266 -2.066 1
1 996 . 4 1 1 A 83 83 GLY H H 83 6.980 7.906 -0.926 1
1 997 . 4 1 1 A 83 83 GLY HA2 H 83 4.090 4.086 0.004 1
1 998 . 4 1 1 A 83 83 GLY HA3 H 83 4.440 4.088 0.352 1
1 999 . 4 1 1 A 83 83 GLY C C 83 173.600 174.746 -1.146 1
1 1000 . 4 1 1 A 83 83 GLY CA C 83 45.200 44.485 0.715 1
1 1001 . 4 1 1 A 83 83 GLY N N 83 101.800 107.435 -5.635 1
1 1002 . 4 1 1 A 84 84 GLU H H 84 8.930 9.095 -0.165 1
1 1003 . 4 1 1 A 84 84 GLU HA H 84 4.120 4.108 0.012 1
1 1008 . 4 1 1 A 84 84 GLU C C 84 178.300 178.608 -0.308 1
1 1009 . 4 1 1 A 84 84 GLU CA C 84 58.900 58.550 0.350 1
1 1010 . 4 1 1 A 84 84 GLU CB C 84 29.400 29.073 0.327 1
1 1012 . 4 1 1 A 84 84 GLU N N 84 120.300 119.212 1.088 1
1 1013 . 4 1 1 A 85 85 ASP H H 85 8.950 8.501 0.449 1
1 1014 . 4 1 1 A 85 85 ASP HA H 85 4.310 4.364 -0.054 1
1 1017 . 4 1 1 A 85 85 ASP C C 85 178.000 178.661 -0.661 1
1 1018 . 4 1 1 A 85 85 ASP CA C 85 57.100 56.946 0.154 1
1 1019 . 4 1 1 A 85 85 ASP CB C 85 38.900 40.160 -1.260 1
1 1020 . 4 1 1 A 85 85 ASP N N 85 119.400 120.972 -1.572 1
1 1021 . 4 1 1 A 86 86 VAL H H 86 7.620 8.144 -0.524 1
1 1022 . 4 1 1 A 86 86 VAL HA H 86 3.480 3.567 -0.087 1
1 1030 . 4 1 1 A 86 86 VAL C C 86 177.400 177.953 -0.553 1
1 1031 . 4 1 1 A 86 86 VAL CA C 86 66.800 66.499 0.301 1
1 1032 . 4 1 1 A 86 86 VAL CB C 86 31.300 31.664 -0.364 1
1 1035 . 4 1 1 A 86 86 VAL N N 86 121.600 120.797 0.803 1
1 1036 . 4 1 1 A 87 87 ALA H H 87 7.520 7.920 -0.400 1
1 1037 . 4 1 1 A 87 87 ALA HA H 87 4.110 3.987 0.123 1
1 1041 . 4 1 1 A 87 87 ALA C C 87 181.200 180.074 1.126 1
1 1042 . 4 1 1 A 87 87 ALA CA C 87 55.800 55.886 -0.086 1
1 1043 . 4 1 1 A 87 87 ALA CB C 87 17.600 18.616 -1.016 1
1 1044 . 4 1 1 A 87 87 ALA N N 87 122.700 122.365 0.335 1
1 1045 . 4 1 1 A 88 88 ARG H H 88 8.380 8.647 -0.267 1
1 1046 . 4 1 1 A 88 88 ARG HA H 88 4.090 4.083 0.007 1
1 1054 . 4 1 1 A 88 88 ARG C C 88 179.100 178.976 0.124 1
1 1055 . 4 1 1 A 88 88 ARG CA C 88 59.600 59.417 0.183 1
1 1056 . 4 1 1 A 88 88 ARG CB C 88 30.500 29.773 0.727 1
1 1059 . 4 1 1 A 88 88 ARG N N 88 119.200 118.574 0.626 1
1 1061 . 4 1 1 A 89 89 LEU H H 89 8.480 7.810 0.670 1
1 1062 . 4 1 1 A 89 89 LEU HA H 89 4.040 4.022 0.018 1
1 1071 . 4 1 1 A 89 89 LEU C C 89 177.200 178.656 -1.456 1
1 1072 . 4 1 1 A 89 89 LEU CA C 89 58.300 57.810 0.490 1
1 1073 . 4 1 1 A 89 89 LEU CB C 89 41.300 42.057 -0.757 1
1 1076 . 4 1 1 A 89 89 LEU N N 89 123.300 121.083 2.217 1
1 1077 . 4 1 1 A 90 90 PHE H H 90 8.890 8.626 0.264 1
1 1078 . 4 1 1 A 90 90 PHE HA H 90 4.380 3.855 0.525 1
1 1086 . 4 1 1 A 90 90 PHE C C 90 177.500 177.762 -0.262 1
1 1087 . 4 1 1 A 90 90 PHE CA C 90 59.400 62.155 -2.755 1
1 1088 . 4 1 1 A 90 90 PHE CB C 90 38.600 39.187 -0.587 1
1 1094 . 4 1 1 A 90 90 PHE N N 90 119.400 119.246 0.154 1
1 1095 . 4 1 1 A 91 91 ALA H H 91 7.920 8.093 -0.173 1
1 1096 . 4 1 1 A 91 91 ALA HA H 91 3.940 3.865 0.075 1
1 1100 . 4 1 1 A 91 91 ALA C C 91 180.200 179.878 0.322 1
1 1101 . 4 1 1 A 91 91 ALA CA C 91 55.100 55.115 -0.015 1
1 1102 . 4 1 1 A 91 91 ALA CB C 91 18.000 17.908 0.092 1
1 1103 . 4 1 1 A 91 91 ALA N N 91 120.500 121.400 -0.900 1
1 1104 . 4 1 1 A 92 92 LEU H H 92 8.190 8.448 -0.258 1
1 1105 . 4 1 1 A 92 92 LEU HA H 92 4.300 4.012 0.288 1
1 1115 . 4 1 1 A 92 92 LEU C C 92 178.900 178.348 0.552 1
1 1116 . 4 1 1 A 92 92 LEU CA C 92 57.500 57.993 -0.493 1
1 1117 . 4 1 1 A 92 92 LEU CB C 92 42.100 41.648 0.452 1
1 1121 . 4 1 1 A 92 92 LEU N N 92 120.200 119.696 0.504 1
1 1122 . 4 1 1 A 93 93 VAL H H 93 8.890 8.397 0.493 1
1 1123 . 4 1 1 A 93 93 VAL HA H 93 3.810 3.736 0.074 1
1 1131 . 4 1 1 A 93 93 VAL C C 93 176.900 177.492 -0.592 1
1 1132 . 4 1 1 A 93 93 VAL CA C 93 66.000 65.002 0.998 1
1 1133 . 4 1 1 A 93 93 VAL CB C 93 31.200 31.088 0.112 1
1 1136 . 4 1 1 A 93 93 VAL N N 93 117.100 118.476 -1.376 1
1 1137 . 4 1 1 A 94 94 GLN H H 94 6.920 7.507 -0.587 1
1 1138 . 4 1 1 A 94 94 GLN HA H 94 3.790 3.818 -0.028 1
1 1145 . 4 1 1 A 94 94 GLN C C 94 177.400 178.278 -0.878 1
1 1146 . 4 1 1 A 94 94 GLN CA C 94 60.000 58.877 1.123 1
1 1147 . 4 1 1 A 94 94 GLN CB C 94 30.300 28.063 2.237 1
1 1149 . 4 1 1 A 94 94 GLN N N 94 117.800 120.614 -2.814 1
1 1151 . 4 1 1 A 95 95 VAL H H 95 7.420 7.826 -0.406 1
1 1152 . 4 1 1 A 95 95 VAL HA H 95 3.760 3.582 0.178 1
1 1160 . 4 1 1 A 95 95 VAL C C 95 178.300 178.246 0.054 1
1 1161 . 4 1 1 A 95 95 VAL CA C 95 66.600 66.362 0.238 1
1 1162 . 4 1 1 A 95 95 VAL CB C 95 31.900 31.463 0.437 1
1 1165 . 4 1 1 A 95 95 VAL N N 95 121.500 119.406 2.094 1
1 1166 . 4 1 1 A 96 96 VAL H H 96 8.340 8.293 0.047 1
1 1167 . 4 1 1 A 96 96 VAL HA H 96 3.810 3.655 0.155 1
1 1175 . 4 1 1 A 96 96 VAL C C 96 178.400 178.194 0.206 1
1 1176 . 4 1 1 A 96 96 VAL CA C 96 66.100 66.751 -0.651 1
1 1177 . 4 1 1 A 96 96 VAL CB C 96 32.200 31.605 0.595 1
1 1180 . 4 1 1 A 96 96 VAL N N 96 120.000 120.022 -0.022 1
1 1181 . 4 1 1 A 97 97 ALA H H 97 8.140 8.331 -0.191 1
1 1182 . 4 1 1 A 97 97 ALA HA H 97 4.010 4.028 -0.018 1
1 1186 . 4 1 1 A 97 97 ALA C C 97 178.800 179.203 -0.403 1
1 1187 . 4 1 1 A 97 97 ALA CA C 97 54.900 55.189 -0.289 1
1 1188 . 4 1 1 A 97 97 ALA CB C 97 19.900 18.043 1.857 1
1 1189 . 4 1 1 A 97 97 ALA N N 97 121.400 121.246 0.154 1
1 1190 . 4 1 1 A 98 98 ASP H H 98 8.170 8.108 0.062 1
1 1191 . 4 1 1 A 98 98 ASP HA H 98 4.320 4.446 -0.126 1
1 1194 . 4 1 1 A 98 98 ASP C C 98 178.100 178.731 -0.631 1
1 1195 . 4 1 1 A 98 98 ASP CA C 98 57.100 57.652 -0.552 1
1 1196 . 4 1 1 A 98 98 ASP CB C 98 41.800 41.014 0.786 1
1 1197 . 4 1 1 A 98 98 ASP N N 98 118.500 118.957 -0.457 1
1 1198 . 4 1 1 A 99 99 GLU H H 99 8.220 8.598 -0.378 1
1 1199 . 4 1 1 A 99 99 GLU HA H 99 4.000 4.134 -0.134 1
1 1204 . 4 1 1 A 99 99 GLU C C 99 178.300 178.681 -0.381 1
1 1205 . 4 1 1 A 99 99 GLU CA C 99 58.300 58.888 -0.588 1
1 1206 . 4 1 1 A 99 99 GLU CB C 99 29.800 29.456 0.344 1
1 1208 . 4 1 1 A 99 99 GLU N N 99 116.600 118.976 -2.376 1
1 1209 . 4 1 1 A 100 100 HIS H H 100 7.980 8.062 -0.082 1
1 1210 . 4 1 1 A 100 100 HIS HA H 100 4.600 4.491 0.109 1
1 1214 . 4 1 1 A 100 100 HIS C C 100 175.900 176.384 -0.484 1
1 1215 . 4 1 1 A 100 100 HIS CA C 100 57.500 58.737 -1.237 1
1 1216 . 4 1 1 A 100 100 HIS CB C 100 30.800 29.304 1.496 1
1 1218 . 4 1 1 A 100 100 HIS N N 100 114.000 118.585 -4.585 1
1 1219 . 4 1 1 A 101 101 LEU H H 101 7.920 7.825 0.095 1
1 1220 . 4 1 1 A 101 101 LEU HA H 101 4.370 4.271 0.099 1
1 1230 . 4 1 1 A 101 101 LEU C C 101 177.700 176.536 1.164 1
1 1231 . 4 1 1 A 101 101 LEU CA C 101 55.900 55.349 0.551 1
1 1232 . 4 1 1 A 101 101 LEU CB C 101 42.100 42.840 -0.740 1
1 1236 . 4 1 1 A 101 101 LEU N N 101 118.500 121.260 -2.760 1
1 1237 . 4 1 1 A 102 102 GLU H H 102 8.100 8.277 -0.177 1
1 1238 . 4 1 1 A 102 102 GLU HA H 102 4.160 4.230 -0.070 1
1 1243 . 4 1 1 A 102 102 GLU C C 102 176.700 176.123 0.577 1
1 1244 . 4 1 1 A 102 102 GLU CA C 102 57.000 58.385 -1.385 1
1 1245 . 4 1 1 A 102 102 GLU CB C 102 29.900 29.488 0.412 1
1 1247 . 4 1 1 A 102 102 GLU N N 102 119.100 119.687 -0.587 1
1 1248 . 4 1 1 A 103 103 HIS H H 103 8.010 7.579 0.431 1
1 1249 . 4 1 1 A 103 103 HIS HA H 103 4.520 4.100 0.420 1
1 1252 . 4 1 1 A 103 103 HIS CA C 103 56.100 57.255 -1.155 1
1 1253 . 4 1 1 A 103 103 HIS CB C 103 29.700 26.998 2.702 1
1 1254 . 4 1 1 A 103 103 HIS N N 103 117.300 118.902 -1.602 1
1 1255 . 4 1 1 A 107 107 HIS HA H 107 4.560 4.446 0.114 1
1 1258 . 4 1 1 A 107 107 HIS C C 107 173.900 174.537 -0.637 1
1 1259 . 4 1 1 A 107 107 HIS CA C 107 55.900 58.254 -2.354 1
1 1260 . 4 1 1 A 107 107 HIS CB C 107 30.200 28.264 1.936 1
1 4 . 5 1 1 A 2 2 ALA H H 2 8.450 8.644 -0.194 1
1 5 . 5 1 1 A 2 2 ALA HA H 2 4.390 3.902 0.488 1
1 9 . 5 1 1 A 2 2 ALA C C 2 178.300 177.468 0.832 1
1 10 . 5 1 1 A 2 2 ALA CA C 2 52.500 55.128 -2.628 1
1 11 . 5 1 1 A 2 2 ALA CB C 2 19.200 17.608 1.592 1
1 12 . 5 1 1 A 2 2 ALA N N 2 125.100 120.605 4.495 1
1 13 . 5 1 1 A 3 3 GLY H H 3 8.450 8.557 -0.107 1
1 14 . 5 1 1 A 3 3 GLY HA2 H 3 4.030 4.108 -0.078 1
1 15 . 5 1 1 A 3 3 GLY HA3 H 3 4.030 4.108 -0.078 1
1 16 . 5 1 1 A 3 3 GLY C C 3 174.100 172.424 1.676 1
1 17 . 5 1 1 A 3 3 GLY CA C 3 45.200 45.029 0.171 1
1 18 . 5 1 1 A 3 3 GLY N N 3 108.000 105.411 2.589 1
1 19 . 5 1 1 A 4 4 GLN H H 4 8.550 8.544 0.006 1
1 20 . 5 1 1 A 4 4 GLN HA H 4 4.340 5.045 -0.705 1
1 27 . 5 1 1 A 4 4 GLN C C 4 176.700 173.520 3.180 1
1 28 . 5 1 1 A 4 4 GLN CA C 4 56.600 54.667 1.933 1
1 29 . 5 1 1 A 4 4 GLN CB C 4 29.300 32.398 -3.098 1
1 31 . 5 1 1 A 4 4 GLN N N 4 120.500 123.094 -2.594 1
1 33 . 5 1 1 A 5 5 SER H H 5 8.540 8.687 -0.147 1
1 34 . 5 1 1 A 5 5 SER HA H 5 4.390 5.032 -0.642 1
1 38 . 5 1 1 A 5 5 SER C C 5 174.800 173.597 1.203 1
1 39 . 5 1 1 A 5 5 SER CA C 5 59.100 56.616 2.484 1
1 40 . 5 1 1 A 5 5 SER CB C 5 63.500 65.240 -1.740 1
1 41 . 5 1 1 A 5 5 SER N N 5 117.100 119.402 -2.302 1
1 42 . 5 1 1 A 6 6 ASP H H 6 8.300 8.814 -0.514 1
1 43 . 5 1 1 A 6 6 ASP HA H 6 4.540 4.901 -0.361 1
1 46 . 5 1 1 A 6 6 ASP C C 6 177.300 177.556 -0.256 1
1 47 . 5 1 1 A 6 6 ASP CA C 6 55.100 53.242 1.858 1
1 48 . 5 1 1 A 6 6 ASP CB C 6 40.800 40.689 0.111 1
1 49 . 5 1 1 A 6 6 ASP N N 6 122.700 125.426 -2.726 1
1 50 . 5 1 1 A 7 7 ARG H H 7 8.270 8.007 0.263 1
1 51 . 5 1 1 A 7 7 ARG HA H 7 4.150 4.014 0.136 1
1 58 . 5 1 1 A 7 7 ARG C C 7 177.600 178.734 -1.134 1
1 59 . 5 1 1 A 7 7 ARG CA C 7 58.000 59.698 -1.698 1
1 60 . 5 1 1 A 7 7 ARG CB C 7 30.100 30.137 -0.037 1
1 63 . 5 1 1 A 7 7 ARG N N 7 122.100 119.959 2.141 1
1 64 . 5 1 1 A 8 8 LYS H H 8 8.130 7.961 0.169 1
1 65 . 5 1 1 A 8 8 LYS HA H 8 4.090 4.150 -0.060 1
1 74 . 5 1 1 A 8 8 LYS C C 8 177.600 178.415 -0.815 1
1 75 . 5 1 1 A 8 8 LYS CA C 8 58.400 58.417 -0.017 1
1 76 . 5 1 1 A 8 8 LYS CB C 8 31.700 31.861 -0.161 1
1 80 . 5 1 1 A 8 8 LYS N N 8 120.900 119.907 0.993 1
1 81 . 5 1 1 A 9 9 ALA H H 9 8.050 7.912 0.138 1
1 82 . 5 1 1 A 9 9 ALA HA H 9 3.950 4.084 -0.134 1
1 86 . 5 1 1 A 9 9 ALA C C 9 179.800 179.669 0.131 1
1 87 . 5 1 1 A 9 9 ALA CA C 9 55.100 55.218 -0.118 1
1 88 . 5 1 1 A 9 9 ALA CB C 9 18.100 17.771 0.329 1
1 89 . 5 1 1 A 9 9 ALA N N 9 121.600 121.817 -0.217 1
1 90 . 5 1 1 A 10 10 ALA H H 10 7.910 8.184 -0.274 1
1 91 . 5 1 1 A 10 10 ALA HA H 10 4.200 4.137 0.063 1
1 95 . 5 1 1 A 10 10 ALA C C 10 180.500 180.143 0.357 1
1 96 . 5 1 1 A 10 10 ALA CA C 10 54.600 54.957 -0.357 1
1 97 . 5 1 1 A 10 10 ALA CB C 10 18.100 18.302 -0.202 1
1 98 . 5 1 1 A 10 10 ALA N N 10 120.200 121.112 -0.912 1
1 99 . 5 1 1 A 11 11 LEU H H 11 8.080 8.088 -0.008 1
1 100 . 5 1 1 A 11 11 LEU HA H 11 4.120 4.048 0.072 1
1 110 . 5 1 1 A 11 11 LEU C C 11 179.600 179.173 0.427 1
1 111 . 5 1 1 A 11 11 LEU CA C 11 57.800 57.826 -0.026 1
1 112 . 5 1 1 A 11 11 LEU CB C 11 41.700 42.056 -0.356 1
1 115 . 5 1 1 A 11 11 LEU N N 11 120.900 119.414 1.486 1
1 116 . 5 1 1 A 12 12 LEU H H 12 8.480 8.112 0.368 1
1 117 . 5 1 1 A 12 12 LEU HA H 12 4.040 4.031 0.009 1
1 127 . 5 1 1 A 12 12 LEU C C 12 178.900 179.519 -0.619 1
1 128 . 5 1 1 A 12 12 LEU CA C 12 58.100 57.920 0.180 1
1 129 . 5 1 1 A 12 12 LEU CB C 12 40.100 40.869 -0.769 1
1 133 . 5 1 1 A 12 12 LEU N N 12 118.700 118.215 0.485 1
1 134 . 5 1 1 A 13 13 ASP H H 13 7.990 8.352 -0.362 1
1 135 . 5 1 1 A 13 13 ASP HA H 13 4.420 4.354 0.066 1
1 138 . 5 1 1 A 13 13 ASP C C 13 178.900 179.092 -0.192 1
1 139 . 5 1 1 A 13 13 ASP CA C 13 57.500 57.367 0.133 1
1 140 . 5 1 1 A 13 13 ASP CB C 13 40.500 40.104 0.396 1
1 141 . 5 1 1 A 13 13 ASP N N 13 119.500 120.819 -1.319 1
1 142 . 5 1 1 A 14 14 GLN H H 14 7.620 7.911 -0.291 1
1 143 . 5 1 1 A 14 14 GLN HA H 14 4.230 4.138 0.092 1
1 150 . 5 1 1 A 14 14 GLN C C 14 178.400 178.320 0.080 1
1 151 . 5 1 1 A 14 14 GLN CA C 14 58.100 58.523 -0.423 1
1 152 . 5 1 1 A 14 14 GLN CB C 14 27.800 28.378 -0.578 1
1 154 . 5 1 1 A 14 14 GLN N N 14 118.900 119.875 -0.975 1
1 156 . 5 1 1 A 15 15 VAL H H 15 8.480 7.975 0.505 1
1 157 . 5 1 1 A 15 15 VAL HA H 15 3.380 4.134 -0.754 1
1 165 . 5 1 1 A 15 15 VAL C C 15 177.600 178.137 -0.537 1
1 166 . 5 1 1 A 15 15 VAL CA C 15 66.600 62.977 3.623 1
1 167 . 5 1 1 A 15 15 VAL CB C 15 30.500 31.846 -1.346 1
1 170 . 5 1 1 A 15 15 VAL N N 15 121.300 118.936 2.364 1
1 171 . 5 1 1 A 16 16 ALA H H 16 8.080 8.006 0.074 1
1 172 . 5 1 1 A 16 16 ALA HA H 16 4.450 4.028 0.422 1
1 176 . 5 1 1 A 16 16 ALA C C 16 179.100 179.812 -0.712 1
1 177 . 5 1 1 A 16 16 ALA CA C 16 54.600 55.371 -0.771 1
1 178 . 5 1 1 A 16 16 ALA CB C 16 17.700 18.154 -0.454 1
1 179 . 5 1 1 A 16 16 ALA N N 16 121.400 124.341 -2.941 1
1 180 . 5 1 1 A 17 17 ARG H H 17 7.480 8.058 -0.578 1
1 181 . 5 1 1 A 17 17 ARG HA H 17 3.910 4.061 -0.151 1
1 187 . 5 1 1 A 17 17 ARG C C 17 179.700 178.931 0.769 1
1 188 . 5 1 1 A 17 17 ARG CA C 17 59.700 59.253 0.447 1
1 189 . 5 1 1 A 17 17 ARG CB C 17 30.400 29.821 0.579 1
1 191 . 5 1 1 A 17 17 ARG N N 17 116.900 119.194 -2.294 1
1 192 . 5 1 1 A 18 18 VAL H H 18 7.960 7.975 -0.015 1
1 193 . 5 1 1 A 18 18 VAL HA H 18 3.690 3.655 0.035 1
1 201 . 5 1 1 A 18 18 VAL C C 18 177.900 177.993 -0.093 1
1 202 . 5 1 1 A 18 18 VAL CA C 18 66.600 65.583 1.017 1
1 203 . 5 1 1 A 18 18 VAL CB C 18 31.300 31.763 -0.463 1
1 206 . 5 1 1 A 18 18 VAL N N 18 123.000 119.185 3.815 1
1 207 . 5 1 1 A 19 19 GLY H H 19 8.270 8.089 0.181 1
1 208 . 5 1 1 A 19 19 GLY HA2 H 19 3.430 3.738 -0.308 1
1 209 . 5 1 1 A 19 19 GLY HA3 H 19 3.430 3.746 -0.316 1
1 210 . 5 1 1 A 19 19 GLY C C 19 174.400 175.635 -1.235 1
1 211 . 5 1 1 A 19 19 GLY CA C 19 48.500 47.119 1.381 1
1 212 . 5 1 1 A 19 19 GLY N N 19 105.400 107.463 -2.063 1
1 213 . 5 1 1 A 20 20 LYS H H 20 8.250 8.427 -0.177 1
1 214 . 5 1 1 A 20 20 LYS HA H 20 3.710 4.010 -0.300 1
1 223 . 5 1 1 A 20 20 LYS C C 20 179.400 179.367 0.033 1
1 224 . 5 1 1 A 20 20 LYS CA C 20 59.300 59.787 -0.487 1
1 225 . 5 1 1 A 20 20 LYS CB C 20 32.600 32.122 0.478 1
1 229 . 5 1 1 A 20 20 LYS N N 20 118.700 121.989 -3.289 1
1 230 . 5 1 1 A 21 21 ALA H H 21 7.640 7.602 0.038 1
1 231 . 5 1 1 A 21 21 ALA HA H 21 3.790 4.116 -0.326 1
1 235 . 5 1 1 A 21 21 ALA C C 21 177.900 179.064 -1.164 1
1 236 . 5 1 1 A 21 21 ALA CA C 21 55.200 54.750 0.450 1
1 237 . 5 1 1 A 21 21 ALA CB C 21 19.200 18.389 0.811 1
1 238 . 5 1 1 A 21 21 ALA N N 21 121.700 122.241 -0.541 1
1 239 . 5 1 1 A 22 22 LEU H H 22 7.330 7.668 -0.338 1
1 240 . 5 1 1 A 22 22 LEU HA H 22 4.140 4.321 -0.181 1
1 250 . 5 1 1 A 22 22 LEU C C 22 176.800 177.604 -0.804 1
1 251 . 5 1 1 A 22 22 LEU CA C 22 54.600 55.166 -0.566 1
1 252 . 5 1 1 A 22 22 LEU CB C 22 42.900 41.691 1.209 1
1 256 . 5 1 1 A 22 22 LEU N N 22 114.200 118.362 -4.162 1
1 257 . 5 1 1 A 23 23 ALA H H 23 7.160 7.748 -0.588 1
1 258 . 5 1 1 A 23 23 ALA HA H 23 4.720 4.286 0.434 1
1 262 . 5 1 1 A 23 23 ALA C C 23 176.700 176.690 0.010 1
1 263 . 5 1 1 A 23 23 ALA CA C 23 53.000 52.567 0.433 1
1 264 . 5 1 1 A 23 23 ALA CB C 23 18.200 18.552 -0.352 1
1 265 . 5 1 1 A 23 23 ALA N N 23 118.200 120.646 -2.446 1
1 266 . 5 1 1 A 24 24 ASN H H 24 7.440 7.699 -0.259 1
1 267 . 5 1 1 A 24 24 ASN HA H 24 4.730 5.019 -0.289 1
1 272 . 5 1 1 A 24 24 ASN C C 24 174.800 175.381 -0.581 1
1 273 . 5 1 1 A 24 24 ASN CA C 24 53.500 51.782 1.718 1
1 274 . 5 1 1 A 24 24 ASN CB C 24 41.700 40.641 1.059 1
1 275 . 5 1 1 A 24 24 ASN N N 24 116.800 117.055 -0.255 1
1 277 . 5 1 1 A 25 25 GLY H H 25 9.370 8.966 0.404 1
1 278 . 5 1 1 A 25 25 GLY HA2 H 25 3.650 3.842 -0.192 1
1 279 . 5 1 1 A 25 25 GLY HA3 H 25 4.110 3.856 0.254 1
1 280 . 5 1 1 A 25 25 GLY C C 25 175.300 175.372 -0.072 1
1 281 . 5 1 1 A 25 25 GLY CA C 25 47.600 47.332 0.268 1
1 282 . 5 1 1 A 25 25 GLY N N 25 114.800 115.133 -0.333 1
1 283 . 5 1 1 A 26 26 ARG H H 26 8.050 7.653 0.397 1
1 284 . 5 1 1 A 26 26 ARG HA H 26 4.150 4.053 0.097 1
1 289 . 5 1 1 A 26 26 ARG C C 26 179.300 178.486 0.814 1
1 290 . 5 1 1 A 26 26 ARG CA C 26 57.000 59.056 -2.056 1
1 291 . 5 1 1 A 26 26 ARG CB C 26 29.900 29.974 -0.074 1
1 294 . 5 1 1 A 26 26 ARG N N 26 120.500 121.925 -1.425 1
1 295 . 5 1 1 A 27 27 ARG H H 27 7.930 7.662 0.268 1
1 296 . 5 1 1 A 27 27 ARG HA H 27 3.710 4.086 -0.376 1
1 301 . 5 1 1 A 27 27 ARG C C 27 178.300 178.973 -0.673 1
1 302 . 5 1 1 A 27 27 ARG CA C 27 61.000 58.697 2.303 1
1 303 . 5 1 1 A 27 27 ARG CB C 27 30.400 29.973 0.427 1
1 305 . 5 1 1 A 27 27 ARG N N 27 117.900 118.966 -1.066 1
1 306 . 5 1 1 A 28 28 LEU H H 28 7.640 7.928 -0.288 1
1 307 . 5 1 1 A 28 28 LEU HA H 28 3.950 4.012 -0.062 1
1 317 . 5 1 1 A 28 28 LEU C C 28 178.200 179.281 -1.081 1
1 318 . 5 1 1 A 28 28 LEU CA C 28 57.600 57.231 0.369 1
1 319 . 5 1 1 A 28 28 LEU CB C 28 41.900 41.071 0.829 1
1 323 . 5 1 1 A 28 28 LEU N N 28 117.600 120.271 -2.671 1
1 324 . 5 1 1 A 29 29 GLN H H 29 8.110 8.161 -0.051 1
1 325 . 5 1 1 A 29 29 GLN HA H 29 3.880 4.153 -0.273 1
1 332 . 5 1 1 A 29 29 GLN C C 29 179.400 178.886 0.514 1
1 333 . 5 1 1 A 29 29 GLN CA C 29 59.100 58.777 0.323 1
1 334 . 5 1 1 A 29 29 GLN CB C 29 28.800 28.271 0.529 1
1 336 . 5 1 1 A 29 29 GLN N N 29 119.300 118.478 0.822 1
1 338 . 5 1 1 A 30 30 ILE H H 30 7.530 7.852 -0.322 1
1 339 . 5 1 1 A 30 30 ILE HA H 30 3.340 3.643 -0.303 1
1 349 . 5 1 1 A 30 30 ILE C C 30 176.700 178.362 -1.662 1
1 350 . 5 1 1 A 30 30 ILE CA C 30 65.900 65.223 0.677 1
1 351 . 5 1 1 A 30 30 ILE CB C 30 37.400 37.994 -0.594 1
1 355 . 5 1 1 A 30 30 ILE N N 30 118.600 120.632 -2.032 1
1 356 . 5 1 1 A 31 31 LEU H H 31 7.500 7.739 -0.239 1
1 357 . 5 1 1 A 31 31 LEU HA H 31 3.520 3.732 -0.212 1
1 367 . 5 1 1 A 31 31 LEU C C 31 177.300 178.624 -1.324 1
1 368 . 5 1 1 A 31 31 LEU CA C 31 58.100 57.850 0.250 1
1 369 . 5 1 1 A 31 31 LEU CB C 31 41.100 40.481 0.619 1
1 373 . 5 1 1 A 31 31 LEU N N 31 119.900 119.462 0.438 1
1 374 . 5 1 1 A 32 32 ASP H H 32 7.950 8.237 -0.287 1
1 375 . 5 1 1 A 32 32 ASP HA H 32 4.300 4.433 -0.133 1
1 378 . 5 1 1 A 32 32 ASP C C 32 178.300 178.677 -0.377 1
1 379 . 5 1 1 A 32 32 ASP CA C 32 57.400 57.535 -0.135 1
1 380 . 5 1 1 A 32 32 ASP CB C 32 42.400 41.339 1.061 1
1 381 . 5 1 1 A 32 32 ASP N N 32 116.900 120.147 -3.247 1
1 382 . 5 1 1 A 33 33 LEU H H 33 7.350 8.004 -0.654 1
1 383 . 5 1 1 A 33 33 LEU HA H 33 4.130 4.011 0.119 1
1 393 . 5 1 1 A 33 33 LEU C C 33 180.000 178.874 1.126 1
1 394 . 5 1 1 A 33 33 LEU CA C 33 57.600 58.264 -0.664 1
1 395 . 5 1 1 A 33 33 LEU CB C 33 42.300 41.576 0.724 1
1 399 . 5 1 1 A 33 33 LEU N N 33 118.600 120.025 -1.425 1
1 400 . 5 1 1 A 34 34 LEU H H 34 8.300 8.327 -0.027 1
1 401 . 5 1 1 A 34 34 LEU HA H 34 4.490 4.705 -0.215 1
1 411 . 5 1 1 A 34 34 LEU C C 34 178.900 179.322 -0.422 1
1 412 . 5 1 1 A 34 34 LEU CA C 34 55.800 56.845 -1.045 1
1 413 . 5 1 1 A 34 34 LEU CB C 34 41.300 41.461 -0.161 1
1 417 . 5 1 1 A 34 34 LEU N N 34 117.800 119.118 -1.318 1
1 418 . 5 1 1 A 35 35 ALA H H 35 8.160 7.726 0.434 1
1 419 . 5 1 1 A 35 35 ALA HA H 35 4.050 4.168 -0.118 1
1 423 . 5 1 1 A 35 35 ALA C C 35 179.000 179.532 -0.532 1
1 424 . 5 1 1 A 35 35 ALA CA C 35 54.900 55.061 -0.161 1
1 425 . 5 1 1 A 35 35 ALA CB C 35 17.500 18.322 -0.822 1
1 426 . 5 1 1 A 35 35 ALA N N 35 123.900 121.863 2.037 1
1 427 . 5 1 1 A 36 36 GLN H H 36 7.600 7.505 0.095 1
1 428 . 5 1 1 A 36 36 GLN HA H 36 4.340 4.151 0.189 1
1 435 . 5 1 1 A 36 36 GLN C C 36 176.100 175.949 0.151 1
1 436 . 5 1 1 A 36 36 GLN CA C 36 55.800 57.590 -1.790 1
1 437 . 5 1 1 A 36 36 GLN CB C 36 29.000 29.490 -0.490 1
1 439 . 5 1 1 A 36 36 GLN N N 36 113.300 114.228 -0.928 1
1 441 . 5 1 1 A 37 37 GLY H H 37 7.550 7.030 0.520 1
1 442 . 5 1 1 A 37 37 GLY HA2 H 37 3.730 4.087 -0.357 1
1 443 . 5 1 1 A 37 37 GLY HA3 H 37 4.490 4.088 0.402 1
1 444 . 5 1 1 A 37 37 GLY C C 37 171.500 171.886 -0.386 1
1 445 . 5 1 1 A 37 37 GLY CA C 37 44.500 45.728 -1.228 1
1 446 . 5 1 1 A 37 37 GLY N N 37 108.400 104.390 4.010 1
1 447 . 5 1 1 A 38 38 GLU H H 38 8.120 8.550 -0.430 1
1 448 . 5 1 1 A 38 38 GLU HA H 38 4.820 4.570 0.250 1
1 453 . 5 1 1 A 38 38 GLU C C 38 177.000 176.478 0.522 1
1 454 . 5 1 1 A 38 38 GLU CA C 38 56.400 56.239 0.161 1
1 455 . 5 1 1 A 38 38 GLU CB C 38 31.200 30.313 0.887 1
1 457 . 5 1 1 A 38 38 GLU N N 38 119.600 117.246 2.354 1
1 458 . 5 1 1 A 39 39 ARG H H 39 8.580 9.015 -0.435 1
1 459 . 5 1 1 A 39 39 ARG HA H 39 4.970 5.189 -0.219 1
1 467 . 5 1 1 A 39 39 ARG C C 39 174.800 175.619 -0.819 1
1 468 . 5 1 1 A 39 39 ARG CA C 39 53.900 54.020 -0.120 1
1 469 . 5 1 1 A 39 39 ARG CB C 39 36.400 33.977 2.423 1
1 472 . 5 1 1 A 39 39 ARG N N 39 121.500 122.798 -1.298 1
1 474 . 5 1 1 A 40 40 ALA H H 40 8.910 8.984 -0.074 1
1 475 . 5 1 1 A 40 40 ALA HA H 40 4.920 4.592 0.328 1
1 479 . 5 1 1 A 40 40 ALA C C 40 179.200 178.406 0.794 1
1 480 . 5 1 1 A 40 40 ALA CA C 40 51.100 51.890 -0.790 1
1 481 . 5 1 1 A 40 40 ALA CB C 40 19.200 19.442 -0.242 1
1 482 . 5 1 1 A 40 40 ALA N N 40 125.100 126.475 -1.375 1
1 483 . 5 1 1 A 41 41 VAL H H 41 8.420 8.432 -0.012 1
1 484 . 5 1 1 A 41 41 VAL HA H 41 3.430 3.627 -0.197 1
1 492 . 5 1 1 A 41 41 VAL C C 41 176.800 177.141 -0.341 1
1 493 . 5 1 1 A 41 41 VAL CA C 41 67.600 66.714 0.886 1
1 494 . 5 1 1 A 41 41 VAL CB C 41 31.600 31.660 -0.060 1
1 497 . 5 1 1 A 41 41 VAL N N 41 120.900 120.725 0.175 1
1 498 . 5 1 1 A 42 42 GLU H H 42 9.640 8.406 1.234 1
1 499 . 5 1 1 A 42 42 GLU HA H 42 3.880 3.979 -0.099 1
1 504 . 5 1 1 A 42 42 GLU C C 42 178.300 178.655 -0.355 1
1 505 . 5 1 1 A 42 42 GLU CA C 42 60.600 59.518 1.082 1
1 506 . 5 1 1 A 42 42 GLU CB C 42 28.300 29.240 -0.940 1
1 508 . 5 1 1 A 42 42 GLU N N 42 119.000 119.164 -0.164 1
1 509 . 5 1 1 A 43 43 ALA H H 43 6.870 7.835 -0.965 1
1 510 . 5 1 1 A 43 43 ALA HA H 43 4.290 4.086 0.204 1
1 514 . 5 1 1 A 43 43 ALA C C 43 180.700 180.086 0.614 1
1 515 . 5 1 1 A 43 43 ALA CA C 43 54.100 55.170 -1.070 1
1 516 . 5 1 1 A 43 43 ALA CB C 43 19.100 18.195 0.905 1
1 517 . 5 1 1 A 43 43 ALA N N 43 120.500 121.604 -1.104 1
1 518 . 5 1 1 A 44 44 ILE H H 44 7.970 8.062 -0.092 1
1 519 . 5 1 1 A 44 44 ILE HA H 44 3.470 3.625 -0.155 1
1 529 . 5 1 1 A 44 44 ILE C C 44 178.300 177.987 0.313 1
1 530 . 5 1 1 A 44 44 ILE CA C 44 64.700 65.580 -0.880 1
1 531 . 5 1 1 A 44 44 ILE CB C 44 38.100 38.011 0.089 1
1 535 . 5 1 1 A 44 44 ILE N N 44 120.500 119.661 0.839 1
1 536 . 5 1 1 A 45 45 ALA H H 45 8.460 8.123 0.337 1
1 537 . 5 1 1 A 45 45 ALA HA H 45 3.720 4.023 -0.303 1
1 541 . 5 1 1 A 45 45 ALA C C 45 178.500 179.834 -1.334 1
1 542 . 5 1 1 A 45 45 ALA CA C 45 56.200 55.365 0.835 1
1 543 . 5 1 1 A 45 45 ALA CB C 45 17.400 18.443 -1.043 1
1 544 . 5 1 1 A 45 45 ALA N N 45 124.500 122.189 2.311 1
1 545 . 5 1 1 A 46 46 THR H H 46 8.080 8.238 -0.158 1
1 546 . 5 1 1 A 46 46 THR HA H 46 3.900 3.870 0.030 1
1 551 . 5 1 1 A 46 46 THR C C 46 177.200 176.749 0.451 1
1 552 . 5 1 1 A 46 46 THR CA C 46 66.400 66.732 -0.332 1
1 553 . 5 1 1 A 46 46 THR CB C 46 68.800 68.639 0.161 1
1 555 . 5 1 1 A 46 46 THR N N 46 112.400 113.897 -1.497 1
1 556 . 5 1 1 A 47 47 ALA H H 47 7.930 8.176 -0.246 1
1 557 . 5 1 1 A 47 47 ALA HA H 47 4.200 4.192 0.008 1
1 561 . 5 1 1 A 47 47 ALA C C 47 179.200 178.815 0.385 1
1 562 . 5 1 1 A 47 47 ALA CA C 47 54.800 54.553 0.247 1
1 563 . 5 1 1 A 47 47 ALA CB C 47 19.800 18.275 1.525 1
1 564 . 5 1 1 A 47 47 ALA N N 47 121.400 124.029 -2.629 1
1 565 . 5 1 1 A 48 48 THR H H 48 7.560 7.411 0.149 1
1 566 . 5 1 1 A 48 48 THR HA H 48 4.390 4.509 -0.119 1
1 571 . 5 1 1 A 48 48 THR C C 48 175.700 175.700 0.000 1
1 572 . 5 1 1 A 48 48 THR CA C 48 61.800 62.239 -0.439 1
1 573 . 5 1 1 A 48 48 THR CB C 48 71.000 70.845 0.155 1
1 575 . 5 1 1 A 48 48 THR N N 48 103.500 106.807 -3.307 1
1 576 . 5 1 1 A 49 49 GLY H H 49 7.820 8.246 -0.426 1
1 577 . 5 1 1 A 49 49 GLY HA2 H 49 3.870 3.959 -0.089 1
1 578 . 5 1 1 A 49 49 GLY HA3 H 49 4.100 3.960 0.140 1
1 579 . 5 1 1 A 49 49 GLY C C 49 174.400 173.976 0.424 1
1 580 . 5 1 1 A 49 49 GLY CA C 49 46.300 46.355 -0.055 1
1 581 . 5 1 1 A 49 49 GLY N N 49 111.100 112.453 -1.353 1
1 582 . 5 1 1 A 50 50 MET H H 50 7.930 7.931 -0.001 1
1 583 . 5 1 1 A 50 50 MET HA H 50 4.540 4.890 -0.350 1
1 591 . 5 1 1 A 50 50 MET C C 50 174.800 174.549 0.251 1
1 592 . 5 1 1 A 50 50 MET CA C 50 55.100 54.249 0.851 1
1 593 . 5 1 1 A 50 50 MET CB C 50 37.200 36.624 0.576 1
1 596 . 5 1 1 A 50 50 MET N N 50 119.300 118.417 0.883 1
1 597 . 5 1 1 A 51 51 ASN H H 51 8.040 8.757 -0.717 1
1 598 . 5 1 1 A 51 51 ASN HA H 51 4.580 4.838 -0.258 1
1 601 . 5 1 1 A 51 51 ASN C C 51 176.100 176.379 -0.279 1
1 602 . 5 1 1 A 51 51 ASN CA C 51 52.800 53.050 -0.250 1
1 603 . 5 1 1 A 51 51 ASN CB C 51 41.100 39.969 1.131 1
1 604 . 5 1 1 A 51 51 ASN N N 51 118.000 119.881 -1.881 1
1 605 . 5 1 1 A 52 52 LEU H H 52 8.560 8.799 -0.239 1
1 606 . 5 1 1 A 52 52 LEU HA H 52 3.760 3.932 -0.172 1
1 616 . 5 1 1 A 52 52 LEU C C 52 179.600 179.033 0.567 1
1 617 . 5 1 1 A 52 52 LEU CA C 52 59.000 57.833 1.167 1
1 618 . 5 1 1 A 52 52 LEU CB C 52 41.800 41.361 0.439 1
1 622 . 5 1 1 A 52 52 LEU N N 52 120.600 125.813 -5.213 1
1 623 . 5 1 1 A 53 53 THR H H 53 8.230 7.684 0.546 1
1 624 . 5 1 1 A 53 53 THR HA H 53 3.880 4.043 -0.163 1
1 629 . 5 1 1 A 53 53 THR C C 53 176.900 176.897 0.003 1
1 630 . 5 1 1 A 53 53 THR CA C 53 66.500 65.942 0.558 1
1 631 . 5 1 1 A 53 53 THR CB C 53 68.400 67.566 0.834 1
1 633 . 5 1 1 A 53 53 THR N N 53 115.800 110.395 5.405 1
1 634 . 5 1 1 A 54 54 THR H H 54 8.420 8.134 0.286 1
1 635 . 5 1 1 A 54 54 THR HA H 54 3.880 3.896 -0.016 1
1 640 . 5 1 1 A 54 54 THR C C 54 177.300 176.637 0.663 1
1 641 . 5 1 1 A 54 54 THR CA C 54 66.600 66.574 0.026 1
1 642 . 5 1 1 A 54 54 THR CB C 54 66.600 68.819 -2.219 1
1 644 . 5 1 1 A 54 54 THR N N 54 122.300 116.624 5.676 1
1 645 . 5 1 1 A 55 55 ALA H H 55 8.860 8.516 0.344 1
1 646 . 5 1 1 A 55 55 ALA HA H 55 4.020 3.901 0.119 1
1 650 . 5 1 1 A 55 55 ALA C C 55 179.000 179.410 -0.410 1
1 651 . 5 1 1 A 55 55 ALA CA C 55 56.100 55.291 0.809 1
1 652 . 5 1 1 A 55 55 ALA CB C 55 17.000 17.968 -0.968 1
1 653 . 5 1 1 A 55 55 ALA N N 55 125.600 123.830 1.770 1
1 654 . 5 1 1 A 56 56 SER H H 56 8.440 8.316 0.124 1
1 655 . 5 1 1 A 56 56 SER HA H 56 3.920 3.946 -0.026 1
1 658 . 5 1 1 A 56 56 SER C C 56 176.400 177.144 -0.744 1
1 659 . 5 1 1 A 56 56 SER CA C 56 62.600 61.374 1.226 1
1 660 . 5 1 1 A 56 56 SER CB C 56 62.700 62.869 -0.169 1
1 661 . 5 1 1 A 56 56 SER N N 56 112.700 113.347 -0.647 1
1 662 . 5 1 1 A 57 57 ALA H H 57 8.090 8.357 -0.267 1
1 663 . 5 1 1 A 57 57 ALA HA H 57 4.130 4.048 0.082 1
1 667 . 5 1 1 A 57 57 ALA C C 57 181.200 180.067 1.133 1
1 668 . 5 1 1 A 57 57 ALA CA C 57 55.200 55.136 0.064 1
1 669 . 5 1 1 A 57 57 ALA CB C 57 17.900 18.390 -0.490 1
1 670 . 5 1 1 A 57 57 ALA N N 57 124.000 122.473 1.527 1
1 671 . 5 1 1 A 58 58 ASN H H 58 7.970 7.796 0.174 1
1 672 . 5 1 1 A 58 58 ASN HA H 58 4.480 4.441 0.039 1
1 677 . 5 1 1 A 58 58 ASN C C 58 177.500 178.294 -0.794 1
1 678 . 5 1 1 A 58 58 ASN CA C 58 56.900 56.376 0.524 1
1 679 . 5 1 1 A 58 58 ASN CB C 58 39.800 37.586 2.214 1
1 680 . 5 1 1 A 58 58 ASN N N 58 117.600 118.001 -0.401 1
1 682 . 5 1 1 A 59 59 LEU H H 59 8.530 8.536 -0.006 1
1 683 . 5 1 1 A 59 59 LEU HA H 59 3.710 3.794 -0.084 1
1 693 . 5 1 1 A 59 59 LEU C C 59 178.400 179.174 -0.774 1
1 694 . 5 1 1 A 59 59 LEU CA C 59 58.600 57.877 0.723 1
1 695 . 5 1 1 A 59 59 LEU CB C 59 40.500 40.661 -0.161 1
1 699 . 5 1 1 A 59 59 LEU N N 59 122.600 120.892 1.708 1
1 700 . 5 1 1 A 60 60 GLN H H 60 8.200 8.504 -0.304 1
1 701 . 5 1 1 A 60 60 GLN HA H 60 4.020 4.066 -0.046 1
1 708 . 5 1 1 A 60 60 GLN C C 60 178.700 178.697 0.003 1
1 709 . 5 1 1 A 60 60 GLN CA C 60 58.800 58.936 -0.136 1
1 710 . 5 1 1 A 60 60 GLN CB C 60 27.700 28.454 -0.754 1
1 712 . 5 1 1 A 60 60 GLN N N 60 118.900 118.123 0.777 1
1 714 . 5 1 1 A 61 61 ALA H H 61 7.580 7.478 0.102 1
1 715 . 5 1 1 A 61 61 ALA HA H 61 4.230 4.222 0.008 1
1 719 . 5 1 1 A 61 61 ALA C C 61 181.300 180.342 0.958 1
1 720 . 5 1 1 A 61 61 ALA CA C 61 55.100 54.959 0.141 1
1 721 . 5 1 1 A 61 61 ALA CB C 61 17.600 17.924 -0.324 1
1 722 . 5 1 1 A 61 61 ALA N N 61 122.200 122.703 -0.503 1
1 723 . 5 1 1 A 62 62 LEU H H 62 7.830 8.187 -0.357 1
1 724 . 5 1 1 A 62 62 LEU HA H 62 3.980 4.076 -0.096 1
1 734 . 5 1 1 A 62 62 LEU C C 62 178.500 178.457 0.043 1
1 735 . 5 1 1 A 62 62 LEU CA C 62 58.100 57.456 0.644 1
1 736 . 5 1 1 A 62 62 LEU CB C 62 43.300 41.974 1.326 1
1 739 . 5 1 1 A 62 62 LEU N N 62 119.000 120.263 -1.263 1
1 740 . 5 1 1 A 63 63 LYS H H 63 8.580 8.435 0.145 1
1 741 . 5 1 1 A 63 63 LYS HA H 63 4.130 4.066 0.064 1
1 750 . 5 1 1 A 63 63 LYS C C 63 180.500 179.222 1.278 1
1 751 . 5 1 1 A 63 63 LYS CA C 63 59.700 58.988 0.712 1
1 752 . 5 1 1 A 63 63 LYS CB C 63 32.600 32.249 0.351 1
1 756 . 5 1 1 A 63 63 LYS N N 63 123.400 119.847 3.553 1
1 757 . 5 1 1 A 64 64 SER H H 64 8.640 8.320 0.320 1
1 758 . 5 1 1 A 64 64 SER HA H 64 4.300 4.254 0.046 1
1 761 . 5 1 1 A 64 64 SER C C 64 175.000 176.417 -1.417 1
1 762 . 5 1 1 A 64 64 SER CA C 64 61.400 60.751 0.649 1
1 763 . 5 1 1 A 64 64 SER CB C 64 63.000 62.765 0.235 1
1 764 . 5 1 1 A 64 64 SER N N 64 117.700 115.125 2.575 1
1 765 . 5 1 1 A 65 65 GLY H H 65 7.280 7.811 -0.531 1
1 766 . 5 1 1 A 65 65 GLY HA2 H 65 3.240 3.921 -0.681 1
1 767 . 5 1 1 A 65 65 GLY HA3 H 65 3.980 3.923 0.057 1
1 768 . 5 1 1 A 65 65 GLY C C 65 171.300 174.585 -3.285 1
1 769 . 5 1 1 A 65 65 GLY CA C 65 45.100 45.771 -0.671 1
1 770 . 5 1 1 A 65 65 GLY N N 65 104.400 110.123 -5.723 1
1 771 . 5 1 1 A 66 66 GLY H H 66 7.730 7.879 -0.149 1
1 772 . 5 1 1 A 66 66 GLY HA2 H 66 3.650 3.982 -0.332 1
1 773 . 5 1 1 A 66 66 GLY HA3 H 66 3.750 3.984 -0.234 1
1 774 . 5 1 1 A 66 66 GLY C C 66 173.700 174.955 -1.255 1
1 775 . 5 1 1 A 66 66 GLY CA C 66 45.400 45.961 -0.561 1
1 776 . 5 1 1 A 66 66 GLY N N 66 104.700 108.097 -3.397 1
1 777 . 5 1 1 A 67 67 LEU H H 67 7.520 7.779 -0.259 1
1 778 . 5 1 1 A 67 67 LEU HA H 67 4.310 4.268 0.042 1
1 788 . 5 1 1 A 67 67 LEU C C 67 177.700 176.905 0.795 1
1 789 . 5 1 1 A 67 67 LEU CA C 67 55.500 55.885 -0.385 1
1 790 . 5 1 1 A 67 67 LEU CB C 67 42.400 42.709 -0.309 1
1 794 . 5 1 1 A 67 67 LEU N N 67 110.600 118.497 -7.897 1
1 795 . 5 1 1 A 68 68 VAL H H 68 6.890 7.397 -0.507 1
1 796 . 5 1 1 A 68 68 VAL HA H 68 5.190 5.173 0.017 1
1 804 . 5 1 1 A 68 68 VAL C C 68 173.700 174.707 -1.007 1
1 805 . 5 1 1 A 68 68 VAL CA C 68 57.400 58.526 -1.126 1
1 806 . 5 1 1 A 68 68 VAL CB C 68 36.400 35.386 1.014 1
1 809 . 5 1 1 A 68 68 VAL N N 68 106.400 111.511 -5.111 1
1 810 . 5 1 1 A 69 69 GLU H H 69 8.880 9.225 -0.345 1
1 811 . 5 1 1 A 69 69 GLU HA H 69 4.660 4.946 -0.286 1
1 816 . 5 1 1 A 69 69 GLU C C 69 173.300 174.784 -1.484 1
1 817 . 5 1 1 A 69 69 GLU CA C 69 54.300 54.612 -0.312 1
1 818 . 5 1 1 A 69 69 GLU CB C 69 34.100 32.987 1.113 1
1 820 . 5 1 1 A 69 69 GLU N N 69 120.400 121.302 -0.902 1
1 821 . 5 1 1 A 70 70 ALA H H 70 8.730 8.729 0.001 1
1 822 . 5 1 1 A 70 70 ALA HA H 70 4.990 4.507 0.483 1
1 826 . 5 1 1 A 70 70 ALA C C 70 176.500 175.529 0.971 1
1 827 . 5 1 1 A 70 70 ALA CA C 70 50.000 50.073 -0.073 1
1 828 . 5 1 1 A 70 70 ALA CB C 70 22.300 20.165 2.135 1
1 829 . 5 1 1 A 70 70 ALA N N 70 122.800 122.351 0.449 1
1 830 . 5 1 1 A 71 71 ARG H H 71 8.670 9.235 -0.565 1
1 831 . 5 1 1 A 71 71 ARG HA H 71 4.630 4.614 0.016 1
1 843 . 5 1 1 A 71 71 ARG C C 71 173.500 174.644 -1.144 1
1 844 . 5 1 1 A 71 71 ARG CA C 71 54.600 55.131 -0.531 1
1 845 . 5 1 1 A 71 71 ARG CB C 71 33.600 30.805 2.795 1
1 849 . 5 1 1 A 71 71 ARG N N 71 120.100 123.638 -3.538 1
1 851 . 5 1 1 A 72 72 ARG H H 72 8.780 8.856 -0.076 1
1 852 . 5 1 1 A 72 72 ARG HA H 72 5.100 4.809 0.291 1
1 859 . 5 1 1 A 72 72 ARG C C 72 176.000 175.090 0.910 1
1 860 . 5 1 1 A 72 72 ARG CA C 72 54.900 55.876 -0.976 1
1 861 . 5 1 1 A 72 72 ARG CB C 72 32.500 31.102 1.398 1
1 864 . 5 1 1 A 72 72 ARG N N 72 123.600 126.633 -3.033 1
1 865 . 5 1 1 A 73 73 GLU H H 73 8.720 9.066 -0.346 1
1 866 . 5 1 1 A 73 73 GLU HA H 73 4.510 4.722 -0.212 1
1 871 . 5 1 1 A 73 73 GLU C C 73 175.900 176.745 -0.845 1
1 872 . 5 1 1 A 73 73 GLU CA C 73 55.700 55.103 0.597 1
1 873 . 5 1 1 A 73 73 GLU CB C 73 31.800 31.296 0.504 1
1 875 . 5 1 1 A 73 73 GLU N N 73 126.800 127.017 -0.217 1
1 876 . 5 1 1 A 74 74 GLY H H 74 9.190 8.910 0.280 1
1 877 . 5 1 1 A 74 74 GLY HA2 H 74 3.700 3.883 -0.183 1
1 878 . 5 1 1 A 74 74 GLY HA3 H 74 4.170 3.897 0.273 1
1 879 . 5 1 1 A 74 74 GLY C C 74 175.400 174.822 0.578 1
1 880 . 5 1 1 A 74 74 GLY CA C 74 47.100 47.212 -0.112 1
1 881 . 5 1 1 A 74 74 GLY N N 74 118.500 116.580 1.920 1
1 882 . 5 1 1 A 75 75 THR H H 75 8.780 8.756 0.024 1
1 883 . 5 1 1 A 75 75 THR HA H 75 4.290 4.467 -0.177 1
1 888 . 5 1 1 A 75 75 THR C C 75 174.600 174.200 0.400 1
1 889 . 5 1 1 A 75 75 THR CA C 75 62.000 62.362 -0.362 1
1 890 . 5 1 1 A 75 75 THR CB C 75 69.000 69.956 -0.956 1
1 892 . 5 1 1 A 75 75 THR N N 75 118.000 120.252 -2.252 1
1 893 . 5 1 1 A 76 76 ARG H H 76 8.030 7.499 0.531 1
1 894 . 5 1 1 A 76 76 ARG HA H 76 4.610 4.833 -0.223 1
1 901 . 5 1 1 A 76 76 ARG C C 76 174.800 174.714 0.086 1
1 902 . 5 1 1 A 76 76 ARG CA C 76 55.500 54.622 0.878 1
1 903 . 5 1 1 A 76 76 ARG CB C 76 32.700 32.566 0.134 1
1 906 . 5 1 1 A 76 76 ARG N N 76 122.600 121.878 0.722 1
1 907 . 5 1 1 A 77 77 GLN H H 77 8.580 8.616 -0.036 1
1 908 . 5 1 1 A 77 77 GLN HA H 77 4.910 4.819 0.091 1
1 915 . 5 1 1 A 77 77 GLN C C 77 173.900 173.698 0.202 1
1 916 . 5 1 1 A 77 77 GLN CA C 77 54.700 54.179 0.521 1
1 917 . 5 1 1 A 77 77 GLN CB C 77 31.800 30.871 0.929 1
1 919 . 5 1 1 A 77 77 GLN N N 77 121.900 122.578 -0.678 1
1 921 . 5 1 1 A 78 78 TYR H H 78 8.890 9.451 -0.561 1
1 922 . 5 1 1 A 78 78 TYR HA H 78 4.750 5.247 -0.497 1
1 929 . 5 1 1 A 78 78 TYR C C 78 175.600 174.456 1.144 1
1 930 . 5 1 1 A 78 78 TYR CA C 78 57.000 56.181 0.819 1
1 931 . 5 1 1 A 78 78 TYR CB C 78 41.400 40.511 0.889 1
1 936 . 5 1 1 A 78 78 TYR N N 78 121.800 126.968 -5.168 1
1 937 . 5 1 1 A 79 79 TYR H H 79 9.010 9.659 -0.649 1
1 938 . 5 1 1 A 79 79 TYR HA H 79 5.410 5.354 0.056 1
1 945 . 5 1 1 A 79 79 TYR C C 79 173.100 175.455 -2.355 1
1 946 . 5 1 1 A 79 79 TYR CA C 79 57.300 57.365 -0.065 1
1 947 . 5 1 1 A 79 79 TYR CB C 79 43.300 41.276 2.024 1
1 952 . 5 1 1 A 79 79 TYR N N 79 122.500 123.217 -0.717 1
1 953 . 5 1 1 A 80 80 ARG H H 80 8.720 8.880 -0.160 1
1 954 . 5 1 1 A 80 80 ARG HA H 80 5.120 5.060 0.060 1
1 962 . 5 1 1 A 80 80 ARG C C 80 175.500 175.000 0.500 1
1 963 . 5 1 1 A 80 80 ARG CA C 80 53.200 54.440 -1.240 1
1 964 . 5 1 1 A 80 80 ARG CB C 80 33.900 33.861 0.039 1
1 967 . 5 1 1 A 80 80 ARG N N 80 114.500 119.660 -5.160 1
1 969 . 5 1 1 A 81 81 ILE H H 81 9.300 8.655 0.645 1
1 970 . 5 1 1 A 81 81 ILE HA H 81 4.150 4.170 -0.020 1
1 980 . 5 1 1 A 81 81 ILE C C 81 177.800 177.003 0.797 1
1 981 . 5 1 1 A 81 81 ILE CA C 81 62.300 62.074 0.226 1
1 982 . 5 1 1 A 81 81 ILE CB C 81 37.800 37.737 0.063 1
1 986 . 5 1 1 A 81 81 ILE N N 81 122.100 121.473 0.627 1
1 987 . 5 1 1 A 82 82 ALA H H 82 7.930 8.646 -0.716 1
1 988 . 5 1 1 A 82 82 ALA HA H 82 3.930 4.040 -0.110 1
1 992 . 5 1 1 A 82 82 ALA C C 82 176.300 177.413 -1.113 1
1 993 . 5 1 1 A 82 82 ALA CA C 82 54.200 55.359 -1.159 1
1 994 . 5 1 1 A 82 82 ALA CB C 82 18.500 19.317 -0.817 1
1 995 . 5 1 1 A 82 82 ALA N N 82 127.200 128.181 -0.981 1
1 996 . 5 1 1 A 83 83 GLY H H 83 6.980 7.629 -0.649 1
1 997 . 5 1 1 A 83 83 GLY HA2 H 83 4.090 4.113 -0.023 1
1 998 . 5 1 1 A 83 83 GLY HA3 H 83 4.440 4.114 0.326 1
1 999 . 5 1 1 A 83 83 GLY C C 83 173.600 174.594 -0.994 1
1 1000 . 5 1 1 A 83 83 GLY CA C 83 45.200 44.592 0.608 1
1 1001 . 5 1 1 A 83 83 GLY N N 83 101.800 103.001 -1.201 1
1 1002 . 5 1 1 A 84 84 GLU H H 84 8.930 9.167 -0.237 1
1 1003 . 5 1 1 A 84 84 GLU HA H 84 4.120 4.129 -0.009 1
1 1008 . 5 1 1 A 84 84 GLU C C 84 178.300 178.330 -0.030 1
1 1009 . 5 1 1 A 84 84 GLU CA C 84 58.900 59.426 -0.526 1
1 1010 . 5 1 1 A 84 84 GLU CB C 84 29.400 28.911 0.489 1
1 1012 . 5 1 1 A 84 84 GLU N N 84 120.300 118.815 1.485 1
1 1013 . 5 1 1 A 85 85 ASP H H 85 8.950 8.123 0.827 1
1 1014 . 5 1 1 A 85 85 ASP HA H 85 4.310 4.436 -0.126 1
1 1017 . 5 1 1 A 85 85 ASP C C 85 178.000 178.870 -0.870 1
1 1018 . 5 1 1 A 85 85 ASP CA C 85 57.100 57.261 -0.161 1
1 1019 . 5 1 1 A 85 85 ASP CB C 85 38.900 41.062 -2.162 1
1 1020 . 5 1 1 A 85 85 ASP N N 85 119.400 120.562 -1.162 1
1 1021 . 5 1 1 A 86 86 VAL H H 86 7.620 7.899 -0.279 1
1 1022 . 5 1 1 A 86 86 VAL HA H 86 3.480 3.545 -0.065 1
1 1030 . 5 1 1 A 86 86 VAL C C 86 177.400 177.951 -0.551 1
1 1031 . 5 1 1 A 86 86 VAL CA C 86 66.800 66.320 0.480 1
1 1032 . 5 1 1 A 86 86 VAL CB C 86 31.300 31.662 -0.362 1
1 1035 . 5 1 1 A 86 86 VAL N N 86 121.600 119.464 2.136 1
1 1036 . 5 1 1 A 87 87 ALA H H 87 7.520 8.053 -0.533 1
1 1037 . 5 1 1 A 87 87 ALA HA H 87 4.110 4.016 0.094 1
1 1041 . 5 1 1 A 87 87 ALA C C 87 181.200 179.737 1.463 1
1 1042 . 5 1 1 A 87 87 ALA CA C 87 55.800 55.397 0.403 1
1 1043 . 5 1 1 A 87 87 ALA CB C 87 17.600 18.025 -0.425 1
1 1044 . 5 1 1 A 87 87 ALA N N 87 122.700 121.871 0.829 1
1 1045 . 5 1 1 A 88 88 ARG H H 88 8.380 8.345 0.035 1
1 1046 . 5 1 1 A 88 88 ARG HA H 88 4.090 4.077 0.013 1
1 1054 . 5 1 1 A 88 88 ARG C C 88 179.100 179.022 0.078 1
1 1055 . 5 1 1 A 88 88 ARG CA C 88 59.600 59.272 0.328 1
1 1056 . 5 1 1 A 88 88 ARG CB C 88 30.500 29.662 0.838 1
1 1059 . 5 1 1 A 88 88 ARG N N 88 119.200 118.181 1.019 1
1 1061 . 5 1 1 A 89 89 LEU H H 89 8.480 7.682 0.798 1
1 1062 . 5 1 1 A 89 89 LEU HA H 89 4.040 4.080 -0.040 1
1 1071 . 5 1 1 A 89 89 LEU C C 89 177.200 178.679 -1.479 1
1 1072 . 5 1 1 A 89 89 LEU CA C 89 58.300 58.036 0.264 1
1 1073 . 5 1 1 A 89 89 LEU CB C 89 41.300 41.971 -0.671 1
1 1076 . 5 1 1 A 89 89 LEU N N 89 123.300 121.081 2.219 1
1 1077 . 5 1 1 A 90 90 PHE H H 90 8.890 8.269 0.621 1
1 1078 . 5 1 1 A 90 90 PHE HA H 90 4.380 4.025 0.355 1
1 1086 . 5 1 1 A 90 90 PHE C C 90 177.500 177.904 -0.404 1
1 1087 . 5 1 1 A 90 90 PHE CA C 90 59.400 62.395 -2.995 1
1 1088 . 5 1 1 A 90 90 PHE CB C 90 38.600 38.684 -0.084 1
1 1094 . 5 1 1 A 90 90 PHE N N 90 119.400 119.504 -0.104 1
1 1095 . 5 1 1 A 91 91 ALA H H 91 7.920 8.670 -0.750 1
1 1096 . 5 1 1 A 91 91 ALA HA H 91 3.940 3.930 0.010 1
1 1100 . 5 1 1 A 91 91 ALA C C 91 180.200 179.739 0.461 1
1 1101 . 5 1 1 A 91 91 ALA CA C 91 55.100 55.340 -0.240 1
1 1102 . 5 1 1 A 91 91 ALA CB C 91 18.000 17.807 0.193 1
1 1103 . 5 1 1 A 91 91 ALA N N 91 120.500 121.281 -0.781 1
1 1104 . 5 1 1 A 92 92 LEU H H 92 8.190 8.269 -0.079 1
1 1105 . 5 1 1 A 92 92 LEU HA H 92 4.300 4.000 0.300 1
1 1115 . 5 1 1 A 92 92 LEU C C 92 178.900 178.250 0.650 1
1 1116 . 5 1 1 A 92 92 LEU CA C 92 57.500 57.828 -0.328 1
1 1117 . 5 1 1 A 92 92 LEU CB C 92 42.100 41.760 0.340 1
1 1121 . 5 1 1 A 92 92 LEU N N 92 120.200 119.695 0.505 1
1 1122 . 5 1 1 A 93 93 VAL H H 93 8.890 7.975 0.915 1
1 1123 . 5 1 1 A 93 93 VAL HA H 93 3.810 3.765 0.045 1
1 1131 . 5 1 1 A 93 93 VAL C C 93 176.900 177.910 -1.010 1
1 1132 . 5 1 1 A 93 93 VAL CA C 93 66.000 65.362 0.638 1
1 1133 . 5 1 1 A 93 93 VAL CB C 93 31.200 31.271 -0.071 1
1 1136 . 5 1 1 A 93 93 VAL N N 93 117.100 115.591 1.509 1
1 1137 . 5 1 1 A 94 94 GLN H H 94 6.920 7.462 -0.542 1
1 1138 . 5 1 1 A 94 94 GLN HA H 94 3.790 3.805 -0.015 1
1 1145 . 5 1 1 A 94 94 GLN C C 94 177.400 178.447 -1.047 1
1 1146 . 5 1 1 A 94 94 GLN CA C 94 60.000 58.832 1.168 1
1 1147 . 5 1 1 A 94 94 GLN CB C 94 30.300 28.176 2.124 1
1 1149 . 5 1 1 A 94 94 GLN N N 94 117.800 121.102 -3.302 1
1 1151 . 5 1 1 A 95 95 VAL H H 95 7.420 7.944 -0.524 1
1 1152 . 5 1 1 A 95 95 VAL HA H 95 3.760 3.568 0.192 1
1 1160 . 5 1 1 A 95 95 VAL C C 95 178.300 177.843 0.457 1
1 1161 . 5 1 1 A 95 95 VAL CA C 95 66.600 66.515 0.085 1
1 1162 . 5 1 1 A 95 95 VAL CB C 95 31.900 31.465 0.435 1
1 1165 . 5 1 1 A 95 95 VAL N N 95 121.500 119.601 1.899 1
1 1166 . 5 1 1 A 96 96 VAL H H 96 8.340 8.527 -0.187 1
1 1167 . 5 1 1 A 96 96 VAL HA H 96 3.810 3.585 0.225 1
1 1175 . 5 1 1 A 96 96 VAL C C 96 178.400 178.289 0.111 1
1 1176 . 5 1 1 A 96 96 VAL CA C 96 66.100 66.607 -0.507 1
1 1177 . 5 1 1 A 96 96 VAL CB C 96 32.200 31.692 0.508 1
1 1180 . 5 1 1 A 96 96 VAL N N 96 120.000 119.991 0.009 1
1 1181 . 5 1 1 A 97 97 ALA H H 97 8.140 8.428 -0.288 1
1 1182 . 5 1 1 A 97 97 ALA HA H 97 4.010 3.937 0.073 1
1 1186 . 5 1 1 A 97 97 ALA C C 97 178.800 178.567 0.233 1
1 1187 . 5 1 1 A 97 97 ALA CA C 97 54.900 55.577 -0.677 1
1 1188 . 5 1 1 A 97 97 ALA CB C 97 19.900 18.080 1.820 1
1 1189 . 5 1 1 A 97 97 ALA N N 97 121.400 122.208 -0.808 1
1 1190 . 5 1 1 A 98 98 ASP H H 98 8.170 8.572 -0.402 1
1 1191 . 5 1 1 A 98 98 ASP HA H 98 4.320 4.210 0.110 1
1 1194 . 5 1 1 A 98 98 ASP C C 98 178.100 178.468 -0.368 1
1 1195 . 5 1 1 A 98 98 ASP CA C 98 57.100 57.791 -0.691 1
1 1196 . 5 1 1 A 98 98 ASP CB C 98 41.800 41.881 -0.081 1
1 1197 . 5 1 1 A 98 98 ASP N N 98 118.500 118.207 0.293 1
1 1198 . 5 1 1 A 99 99 GLU H H 99 8.220 8.467 -0.247 1
1 1199 . 5 1 1 A 99 99 GLU HA H 99 4.000 4.048 -0.048 1
1 1204 . 5 1 1 A 99 99 GLU C C 99 178.300 178.806 -0.506 1
1 1205 . 5 1 1 A 99 99 GLU CA C 99 58.300 59.447 -1.147 1
1 1206 . 5 1 1 A 99 99 GLU CB C 99 29.800 29.707 0.093 1
1 1208 . 5 1 1 A 99 99 GLU N N 99 116.600 118.069 -1.469 1
1 1209 . 5 1 1 A 100 100 HIS H H 100 7.980 7.582 0.398 1
1 1210 . 5 1 1 A 100 100 HIS HA H 100 4.600 4.544 0.056 1
1 1214 . 5 1 1 A 100 100 HIS C C 100 175.900 177.413 -1.513 1
1 1215 . 5 1 1 A 100 100 HIS CA C 100 57.500 57.752 -0.252 1
1 1216 . 5 1 1 A 100 100 HIS CB C 100 30.800 30.080 0.720 1
1 1218 . 5 1 1 A 100 100 HIS N N 100 114.000 117.181 -3.181 1
1 1219 . 5 1 1 A 101 101 LEU H H 101 7.920 8.184 -0.264 1
1 1220 . 5 1 1 A 101 101 LEU HA H 101 4.370 4.037 0.333 1
1 1230 . 5 1 1 A 101 101 LEU C C 101 177.700 177.456 0.244 1
1 1231 . 5 1 1 A 101 101 LEU CA C 101 55.900 58.276 -2.376 1
1 1232 . 5 1 1 A 101 101 LEU CB C 101 42.100 41.668 0.432 1
1 1236 . 5 1 1 A 101 101 LEU N N 101 118.500 122.775 -4.275 1
1 1237 . 5 1 1 A 102 102 GLU H H 102 8.100 7.973 0.127 1
1 1238 . 5 1 1 A 102 102 GLU HA H 102 4.160 4.401 -0.241 1
1 1243 . 5 1 1 A 102 102 GLU C C 102 176.700 175.536 1.164 1
1 1244 . 5 1 1 A 102 102 GLU CA C 102 57.000 55.557 1.443 1
1 1245 . 5 1 1 A 102 102 GLU CB C 102 29.900 28.589 1.311 1
1 1247 . 5 1 1 A 102 102 GLU N N 102 119.100 118.816 0.284 1
1 1248 . 5 1 1 A 103 103 HIS H H 103 8.010 8.471 -0.461 1
1 1249 . 5 1 1 A 103 103 HIS HA H 103 4.520 4.551 -0.031 1
1 1252 . 5 1 1 A 103 103 HIS CA C 103 56.100 56.010 0.090 1
1 1253 . 5 1 1 A 103 103 HIS CB C 103 29.700 29.982 -0.282 1
1 1254 . 5 1 1 A 103 103 HIS N N 103 117.300 122.029 -4.729 1
1 1255 . 5 1 1 A 107 107 HIS HA H 107 4.560 4.223 0.337 1
1 1258 . 5 1 1 A 107 107 HIS C C 107 173.900 174.353 -0.453 1
1 1259 . 5 1 1 A 107 107 HIS CA C 107 55.900 58.750 -2.850 1
1 1260 . 5 1 1 A 107 107 HIS CB C 107 30.200 30.419 -0.219 1
1 4 . 6 1 1 A 2 2 ALA H H 2 8.450 8.748 -0.298 1
1 5 . 6 1 1 A 2 2 ALA HA H 2 4.390 4.491 -0.101 1
1 9 . 6 1 1 A 2 2 ALA C C 2 178.300 177.293 1.007 1
1 10 . 6 1 1 A 2 2 ALA CA C 2 52.500 53.669 -1.169 1
1 11 . 6 1 1 A 2 2 ALA CB C 2 19.200 20.561 -1.361 1
1 12 . 6 1 1 A 2 2 ALA N N 2 125.100 122.499 2.601 1
1 13 . 6 1 1 A 3 3 GLY H H 3 8.450 7.655 0.795 1
1 14 . 6 1 1 A 3 3 GLY HA2 H 3 4.030 4.068 -0.038 1
1 15 . 6 1 1 A 3 3 GLY HA3 H 3 4.030 4.068 -0.038 1
1 16 . 6 1 1 A 3 3 GLY C C 3 174.100 173.480 0.620 1
1 17 . 6 1 1 A 3 3 GLY CA C 3 45.200 44.071 1.129 1
1 18 . 6 1 1 A 3 3 GLY N N 3 108.000 103.923 4.077 1
1 19 . 6 1 1 A 4 4 GLN H H 4 8.550 8.566 -0.016 1
1 20 . 6 1 1 A 4 4 GLN HA H 4 4.340 4.516 -0.176 1
1 27 . 6 1 1 A 4 4 GLN C C 4 176.700 175.976 0.724 1
1 28 . 6 1 1 A 4 4 GLN CA C 4 56.600 57.190 -0.590 1
1 29 . 6 1 1 A 4 4 GLN CB C 4 29.300 30.110 -0.810 1
1 31 . 6 1 1 A 4 4 GLN N N 4 120.500 119.712 0.788 1
1 33 . 6 1 1 A 5 5 SER H H 5 8.540 8.170 0.370 1
1 34 . 6 1 1 A 5 5 SER HA H 5 4.390 4.302 0.088 1
1 38 . 6 1 1 A 5 5 SER C C 5 174.800 174.522 0.278 1
1 39 . 6 1 1 A 5 5 SER CA C 5 59.100 59.916 -0.816 1
1 40 . 6 1 1 A 5 5 SER CB C 5 63.500 62.934 0.566 1
1 41 . 6 1 1 A 5 5 SER N N 5 117.100 114.641 2.459 1
1 42 . 6 1 1 A 6 6 ASP H H 6 8.300 8.532 -0.232 1
1 43 . 6 1 1 A 6 6 ASP HA H 6 4.540 4.398 0.142 1
1 46 . 6 1 1 A 6 6 ASP C C 6 177.300 178.312 -1.012 1
1 47 . 6 1 1 A 6 6 ASP CA C 6 55.100 56.696 -1.596 1
1 48 . 6 1 1 A 6 6 ASP CB C 6 40.800 41.168 -0.368 1
1 49 . 6 1 1 A 6 6 ASP N N 6 122.700 120.834 1.866 1
1 50 . 6 1 1 A 7 7 ARG H H 7 8.270 8.057 0.213 1
1 51 . 6 1 1 A 7 7 ARG HA H 7 4.150 3.966 0.184 1
1 58 . 6 1 1 A 7 7 ARG C C 7 177.600 178.575 -0.975 1
1 59 . 6 1 1 A 7 7 ARG CA C 7 58.000 59.371 -1.371 1
1 60 . 6 1 1 A 7 7 ARG CB C 7 30.100 29.741 0.359 1
1 63 . 6 1 1 A 7 7 ARG N N 7 122.100 119.078 3.022 1
1 64 . 6 1 1 A 8 8 LYS H H 8 8.130 7.926 0.204 1
1 65 . 6 1 1 A 8 8 LYS HA H 8 4.090 4.085 0.005 1
1 74 . 6 1 1 A 8 8 LYS C C 8 177.600 178.935 -1.335 1
1 75 . 6 1 1 A 8 8 LYS CA C 8 58.400 59.244 -0.844 1
1 76 . 6 1 1 A 8 8 LYS CB C 8 31.700 31.810 -0.110 1
1 80 . 6 1 1 A 8 8 LYS N N 8 120.900 117.930 2.970 1
1 81 . 6 1 1 A 9 9 ALA H H 9 8.050 7.976 0.074 1
1 82 . 6 1 1 A 9 9 ALA HA H 9 3.950 4.115 -0.165 1
1 86 . 6 1 1 A 9 9 ALA C C 9 179.800 180.132 -0.332 1
1 87 . 6 1 1 A 9 9 ALA CA C 9 55.100 54.937 0.163 1
1 88 . 6 1 1 A 9 9 ALA CB C 9 18.100 18.232 -0.132 1
1 89 . 6 1 1 A 9 9 ALA N N 9 121.600 122.021 -0.421 1
1 90 . 6 1 1 A 10 10 ALA H H 10 7.910 7.673 0.237 1
1 91 . 6 1 1 A 10 10 ALA HA H 10 4.200 4.122 0.078 1
1 95 . 6 1 1 A 10 10 ALA C C 10 180.500 180.382 0.118 1
1 96 . 6 1 1 A 10 10 ALA CA C 10 54.600 55.086 -0.486 1
1 97 . 6 1 1 A 10 10 ALA CB C 10 18.100 18.329 -0.229 1
1 98 . 6 1 1 A 10 10 ALA N N 10 120.200 120.644 -0.444 1
1 99 . 6 1 1 A 11 11 LEU H H 11 8.080 7.694 0.386 1
1 100 . 6 1 1 A 11 11 LEU HA H 11 4.120 4.040 0.080 1
1 110 . 6 1 1 A 11 11 LEU C C 11 179.600 179.494 0.106 1
1 111 . 6 1 1 A 11 11 LEU CA C 11 57.800 57.746 0.054 1
1 112 . 6 1 1 A 11 11 LEU CB C 11 41.700 41.768 -0.068 1
1 115 . 6 1 1 A 11 11 LEU N N 11 120.900 119.733 1.167 1
1 116 . 6 1 1 A 12 12 LEU H H 12 8.480 8.202 0.278 1
1 117 . 6 1 1 A 12 12 LEU HA H 12 4.040 3.990 0.050 1
1 127 . 6 1 1 A 12 12 LEU C C 12 178.900 179.082 -0.182 1
1 128 . 6 1 1 A 12 12 LEU CA C 12 58.100 57.817 0.283 1
1 129 . 6 1 1 A 12 12 LEU CB C 12 40.100 40.590 -0.490 1
1 133 . 6 1 1 A 12 12 LEU N N 12 118.700 118.482 0.218 1
1 134 . 6 1 1 A 13 13 ASP H H 13 7.990 8.587 -0.597 1
1 135 . 6 1 1 A 13 13 ASP HA H 13 4.420 4.260 0.160 1
1 138 . 6 1 1 A 13 13 ASP C C 13 178.900 178.398 0.502 1
1 139 . 6 1 1 A 13 13 ASP CA C 13 57.500 57.972 -0.472 1
1 140 . 6 1 1 A 13 13 ASP CB C 13 40.500 41.245 -0.745 1
1 141 . 6 1 1 A 13 13 ASP N N 13 119.500 119.878 -0.378 1
1 142 . 6 1 1 A 14 14 GLN H H 14 7.620 7.475 0.145 1
1 143 . 6 1 1 A 14 14 GLN HA H 14 4.230 4.111 0.119 1
1 150 . 6 1 1 A 14 14 GLN C C 14 178.400 178.478 -0.078 1
1 151 . 6 1 1 A 14 14 GLN CA C 14 58.100 58.675 -0.575 1
1 152 . 6 1 1 A 14 14 GLN CB C 14 27.800 28.291 -0.491 1
1 154 . 6 1 1 A 14 14 GLN N N 14 118.900 119.749 -0.849 1
1 156 . 6 1 1 A 15 15 VAL H H 15 8.480 7.950 0.530 1
1 157 . 6 1 1 A 15 15 VAL HA H 15 3.380 3.665 -0.285 1
1 165 . 6 1 1 A 15 15 VAL C C 15 177.600 178.344 -0.744 1
1 166 . 6 1 1 A 15 15 VAL CA C 15 66.600 66.389 0.211 1
1 167 . 6 1 1 A 15 15 VAL CB C 15 30.500 31.474 -0.974 1
1 170 . 6 1 1 A 15 15 VAL N N 15 121.300 119.904 1.396 1
1 171 . 6 1 1 A 16 16 ALA H H 16 8.080 8.399 -0.319 1
1 172 . 6 1 1 A 16 16 ALA HA H 16 4.450 3.867 0.583 1
1 176 . 6 1 1 A 16 16 ALA C C 16 179.100 179.949 -0.849 1
1 177 . 6 1 1 A 16 16 ALA CA C 16 54.600 55.252 -0.652 1
1 178 . 6 1 1 A 16 16 ALA CB C 16 17.700 18.131 -0.431 1
1 179 . 6 1 1 A 16 16 ALA N N 16 121.400 121.896 -0.496 1
1 180 . 6 1 1 A 17 17 ARG H H 17 7.480 7.594 -0.114 1
1 181 . 6 1 1 A 17 17 ARG HA H 17 3.910 4.057 -0.147 1
1 187 . 6 1 1 A 17 17 ARG C C 17 179.700 178.816 0.884 1
1 188 . 6 1 1 A 17 17 ARG CA C 17 59.700 59.378 0.322 1
1 189 . 6 1 1 A 17 17 ARG CB C 17 30.400 30.184 0.216 1
1 191 . 6 1 1 A 17 17 ARG N N 17 116.900 118.221 -1.321 1
1 192 . 6 1 1 A 18 18 VAL H H 18 7.960 7.824 0.136 1
1 193 . 6 1 1 A 18 18 VAL HA H 18 3.690 3.664 0.026 1
1 201 . 6 1 1 A 18 18 VAL C C 18 177.900 178.393 -0.493 1
1 202 . 6 1 1 A 18 18 VAL CA C 18 66.600 65.955 0.645 1
1 203 . 6 1 1 A 18 18 VAL CB C 18 31.300 31.654 -0.354 1
1 206 . 6 1 1 A 18 18 VAL N N 18 123.000 120.899 2.101 1
1 207 . 6 1 1 A 19 19 GLY H H 19 8.270 8.338 -0.068 1
1 208 . 6 1 1 A 19 19 GLY HA2 H 19 3.430 3.775 -0.345 1
1 209 . 6 1 1 A 19 19 GLY HA3 H 19 3.430 3.783 -0.353 1
1 210 . 6 1 1 A 19 19 GLY C C 19 174.400 175.597 -1.197 1
1 211 . 6 1 1 A 19 19 GLY CA C 19 48.500 47.194 1.306 1
1 212 . 6 1 1 A 19 19 GLY N N 19 105.400 107.573 -2.173 1
1 213 . 6 1 1 A 20 20 LYS H H 20 8.250 8.109 0.141 1
1 214 . 6 1 1 A 20 20 LYS HA H 20 3.710 4.141 -0.431 1
1 223 . 6 1 1 A 20 20 LYS C C 20 179.400 178.379 1.021 1
1 224 . 6 1 1 A 20 20 LYS CA C 20 59.300 58.429 0.871 1
1 225 . 6 1 1 A 20 20 LYS CB C 20 32.600 32.220 0.380 1
1 229 . 6 1 1 A 20 20 LYS N N 20 118.700 121.548 -2.848 1
1 230 . 6 1 1 A 21 21 ALA H H 21 7.640 7.549 0.091 1
1 231 . 6 1 1 A 21 21 ALA HA H 21 3.790 4.095 -0.305 1
1 235 . 6 1 1 A 21 21 ALA C C 21 177.900 180.116 -2.216 1
1 236 . 6 1 1 A 21 21 ALA CA C 21 55.200 54.709 0.491 1
1 237 . 6 1 1 A 21 21 ALA CB C 21 19.200 18.488 0.712 1
1 238 . 6 1 1 A 21 21 ALA N N 21 121.700 121.581 0.119 1
1 239 . 6 1 1 A 22 22 LEU H H 22 7.330 7.782 -0.452 1
1 240 . 6 1 1 A 22 22 LEU HA H 22 4.140 4.152 -0.012 1
1 250 . 6 1 1 A 22 22 LEU C C 22 176.800 177.317 -0.517 1
1 251 . 6 1 1 A 22 22 LEU CA C 22 54.600 57.288 -2.688 1
1 252 . 6 1 1 A 22 22 LEU CB C 22 42.900 41.517 1.383 1
1 256 . 6 1 1 A 22 22 LEU N N 22 114.200 120.096 -5.896 1
1 257 . 6 1 1 A 23 23 ALA H H 23 7.160 7.433 -0.273 1
1 258 . 6 1 1 A 23 23 ALA HA H 23 4.720 4.300 0.420 1
1 262 . 6 1 1 A 23 23 ALA C C 23 176.700 177.629 -0.929 1
1 263 . 6 1 1 A 23 23 ALA CA C 23 53.000 52.745 0.255 1
1 264 . 6 1 1 A 23 23 ALA CB C 23 18.200 18.431 -0.231 1
1 265 . 6 1 1 A 23 23 ALA N N 23 118.200 121.429 -3.229 1
1 266 . 6 1 1 A 24 24 ASN H H 24 7.440 8.690 -1.250 1
1 267 . 6 1 1 A 24 24 ASN HA H 24 4.730 4.364 0.366 1
1 272 . 6 1 1 A 24 24 ASN C C 24 174.800 174.059 0.741 1
1 273 . 6 1 1 A 24 24 ASN CA C 24 53.500 53.944 -0.444 1
1 274 . 6 1 1 A 24 24 ASN CB C 24 41.700 37.341 4.359 1
1 275 . 6 1 1 A 24 24 ASN N N 24 116.800 122.229 -5.429 1
1 277 . 6 1 1 A 25 25 GLY H H 25 9.370 8.259 1.111 1
1 278 . 6 1 1 A 25 25 GLY HA2 H 25 3.650 4.206 -0.556 1
1 279 . 6 1 1 A 25 25 GLY HA3 H 25 4.110 4.208 -0.098 1
1 280 . 6 1 1 A 25 25 GLY C C 25 175.300 174.024 1.276 1
1 281 . 6 1 1 A 25 25 GLY CA C 25 47.600 45.876 1.724 1
1 282 . 6 1 1 A 25 25 GLY N N 25 114.800 111.741 3.059 1
1 283 . 6 1 1 A 26 26 ARG H H 26 8.050 9.005 -0.955 1
1 284 . 6 1 1 A 26 26 ARG HA H 26 4.150 4.252 -0.102 1
1 289 . 6 1 1 A 26 26 ARG C C 26 179.300 177.988 1.312 1
1 290 . 6 1 1 A 26 26 ARG CA C 26 57.000 57.116 -0.116 1
1 291 . 6 1 1 A 26 26 ARG CB C 26 29.900 30.132 -0.232 1
1 294 . 6 1 1 A 26 26 ARG N N 26 120.500 120.693 -0.193 1
1 295 . 6 1 1 A 27 27 ARG H H 27 7.930 7.942 -0.012 1
1 296 . 6 1 1 A 27 27 ARG HA H 27 3.710 4.038 -0.328 1
1 301 . 6 1 1 A 27 27 ARG C C 27 178.300 178.460 -0.160 1
1 302 . 6 1 1 A 27 27 ARG CA C 27 61.000 58.513 2.487 1
1 303 . 6 1 1 A 27 27 ARG CB C 27 30.400 30.114 0.286 1
1 305 . 6 1 1 A 27 27 ARG N N 27 117.900 119.323 -1.423 1
1 306 . 6 1 1 A 28 28 LEU H H 28 7.640 8.195 -0.555 1
1 307 . 6 1 1 A 28 28 LEU HA H 28 3.950 4.078 -0.128 1
1 317 . 6 1 1 A 28 28 LEU C C 28 178.200 178.938 -0.738 1
1 318 . 6 1 1 A 28 28 LEU CA C 28 57.600 57.003 0.597 1
1 319 . 6 1 1 A 28 28 LEU CB C 28 41.900 41.280 0.620 1
1 323 . 6 1 1 A 28 28 LEU N N 28 117.600 118.592 -0.992 1
1 324 . 6 1 1 A 29 29 GLN H H 29 8.110 8.394 -0.284 1
1 325 . 6 1 1 A 29 29 GLN HA H 29 3.880 4.102 -0.222 1
1 332 . 6 1 1 A 29 29 GLN C C 29 179.400 178.748 0.652 1
1 333 . 6 1 1 A 29 29 GLN CA C 29 59.100 58.519 0.581 1
1 334 . 6 1 1 A 29 29 GLN CB C 29 28.800 28.282 0.518 1
1 336 . 6 1 1 A 29 29 GLN N N 29 119.300 118.300 1.000 1
1 338 . 6 1 1 A 30 30 ILE H H 30 7.530 7.922 -0.392 1
1 339 . 6 1 1 A 30 30 ILE HA H 30 3.340 3.561 -0.221 1
1 349 . 6 1 1 A 30 30 ILE C C 30 176.700 178.166 -1.466 1
1 350 . 6 1 1 A 30 30 ILE CA C 30 65.900 65.664 0.236 1
1 351 . 6 1 1 A 30 30 ILE CB C 30 37.400 38.042 -0.642 1
1 355 . 6 1 1 A 30 30 ILE N N 30 118.600 120.693 -2.093 1
1 356 . 6 1 1 A 31 31 LEU H H 31 7.500 8.074 -0.574 1
1 357 . 6 1 1 A 31 31 LEU HA H 31 3.520 3.677 -0.157 1
1 367 . 6 1 1 A 31 31 LEU C C 31 177.300 178.597 -1.297 1
1 368 . 6 1 1 A 31 31 LEU CA C 31 58.100 57.798 0.302 1
1 369 . 6 1 1 A 31 31 LEU CB C 31 41.100 40.138 0.962 1
1 373 . 6 1 1 A 31 31 LEU N N 31 119.900 118.174 1.726 1
1 374 . 6 1 1 A 32 32 ASP H H 32 7.950 8.194 -0.244 1
1 375 . 6 1 1 A 32 32 ASP HA H 32 4.300 4.416 -0.116 1
1 378 . 6 1 1 A 32 32 ASP C C 32 178.300 178.446 -0.146 1
1 379 . 6 1 1 A 32 32 ASP CA C 32 57.400 57.757 -0.357 1
1 380 . 6 1 1 A 32 32 ASP CB C 32 42.400 41.608 0.792 1
1 381 . 6 1 1 A 32 32 ASP N N 32 116.900 119.994 -3.094 1
1 382 . 6 1 1 A 33 33 LEU H H 33 7.350 7.897 -0.547 1
1 383 . 6 1 1 A 33 33 LEU HA H 33 4.130 4.108 0.022 1
1 393 . 6 1 1 A 33 33 LEU C C 33 180.000 179.026 0.974 1
1 394 . 6 1 1 A 33 33 LEU CA C 33 57.600 57.811 -0.211 1
1 395 . 6 1 1 A 33 33 LEU CB C 33 42.300 41.728 0.572 1
1 399 . 6 1 1 A 33 33 LEU N N 33 118.600 120.526 -1.926 1
1 400 . 6 1 1 A 34 34 LEU H H 34 8.300 8.139 0.161 1
1 401 . 6 1 1 A 34 34 LEU HA H 34 4.490 4.448 0.042 1
1 411 . 6 1 1 A 34 34 LEU C C 34 178.900 179.258 -0.358 1
1 412 . 6 1 1 A 34 34 LEU CA C 34 55.800 56.917 -1.117 1
1 413 . 6 1 1 A 34 34 LEU CB C 34 41.300 41.422 -0.122 1
1 417 . 6 1 1 A 34 34 LEU N N 34 117.800 118.315 -0.515 1
1 418 . 6 1 1 A 35 35 ALA H H 35 8.160 7.864 0.296 1
1 419 . 6 1 1 A 35 35 ALA HA H 35 4.050 4.198 -0.148 1
1 423 . 6 1 1 A 35 35 ALA C C 35 179.000 178.111 0.889 1
1 424 . 6 1 1 A 35 35 ALA CA C 35 54.900 54.416 0.484 1
1 425 . 6 1 1 A 35 35 ALA CB C 35 17.500 18.331 -0.831 1
1 426 . 6 1 1 A 35 35 ALA N N 35 123.900 122.034 1.866 1
1 427 . 6 1 1 A 36 36 GLN H H 36 7.600 7.677 -0.077 1
1 428 . 6 1 1 A 36 36 GLN HA H 36 4.340 4.267 0.073 1
1 435 . 6 1 1 A 36 36 GLN C C 36 176.100 175.788 0.312 1
1 436 . 6 1 1 A 36 36 GLN CA C 36 55.800 56.234 -0.434 1
1 437 . 6 1 1 A 36 36 GLN CB C 36 29.000 29.591 -0.591 1
1 439 . 6 1 1 A 36 36 GLN N N 36 113.300 114.207 -0.907 1
1 441 . 6 1 1 A 37 37 GLY H H 37 7.550 7.248 0.302 1
1 442 . 6 1 1 A 37 37 GLY HA2 H 37 3.730 4.084 -0.354 1
1 443 . 6 1 1 A 37 37 GLY HA3 H 37 4.490 4.088 0.402 1
1 444 . 6 1 1 A 37 37 GLY C C 37 171.500 172.037 -0.537 1
1 445 . 6 1 1 A 37 37 GLY CA C 37 44.500 44.911 -0.411 1
1 446 . 6 1 1 A 37 37 GLY N N 37 108.400 106.227 2.173 1
1 447 . 6 1 1 A 38 38 GLU H H 38 8.120 8.476 -0.356 1
1 448 . 6 1 1 A 38 38 GLU HA H 38 4.820 4.518 0.302 1
1 453 . 6 1 1 A 38 38 GLU C C 38 177.000 175.755 1.245 1
1 454 . 6 1 1 A 38 38 GLU CA C 38 56.400 56.658 -0.258 1
1 455 . 6 1 1 A 38 38 GLU CB C 38 31.200 30.468 0.732 1
1 457 . 6 1 1 A 38 38 GLU N N 38 119.600 120.625 -1.025 1
1 458 . 6 1 1 A 39 39 ARG H H 39 8.580 8.728 -0.148 1
1 459 . 6 1 1 A 39 39 ARG HA H 39 4.970 4.960 0.010 1
1 467 . 6 1 1 A 39 39 ARG C C 39 174.800 175.302 -0.502 1
1 468 . 6 1 1 A 39 39 ARG CA C 39 53.900 54.630 -0.730 1
1 469 . 6 1 1 A 39 39 ARG CB C 39 36.400 33.340 3.060 1
1 472 . 6 1 1 A 39 39 ARG N N 39 121.500 126.233 -4.733 1
1 474 . 6 1 1 A 40 40 ALA H H 40 8.910 8.738 0.172 1
1 475 . 6 1 1 A 40 40 ALA HA H 40 4.920 4.384 0.536 1
1 479 . 6 1 1 A 40 40 ALA C C 40 179.200 178.200 1.000 1
1 480 . 6 1 1 A 40 40 ALA CA C 40 51.100 51.517 -0.417 1
1 481 . 6 1 1 A 40 40 ALA CB C 40 19.200 19.491 -0.291 1
1 482 . 6 1 1 A 40 40 ALA N N 40 125.100 123.933 1.167 1
1 483 . 6 1 1 A 41 41 VAL H H 41 8.420 8.748 -0.328 1
1 484 . 6 1 1 A 41 41 VAL HA H 41 3.430 3.574 -0.144 1
1 492 . 6 1 1 A 41 41 VAL C C 41 176.800 177.117 -0.317 1
1 493 . 6 1 1 A 41 41 VAL CA C 41 67.600 66.945 0.655 1
1 494 . 6 1 1 A 41 41 VAL CB C 41 31.600 31.807 -0.207 1
1 497 . 6 1 1 A 41 41 VAL N N 41 120.900 120.622 0.278 1
1 498 . 6 1 1 A 42 42 GLU H H 42 9.640 8.070 1.570 1
1 499 . 6 1 1 A 42 42 GLU HA H 42 3.880 4.000 -0.120 1
1 504 . 6 1 1 A 42 42 GLU C C 42 178.300 178.779 -0.479 1
1 505 . 6 1 1 A 42 42 GLU CA C 42 60.600 59.202 1.398 1
1 506 . 6 1 1 A 42 42 GLU CB C 42 28.300 29.813 -1.513 1
1 508 . 6 1 1 A 42 42 GLU N N 42 119.000 120.583 -1.583 1
1 509 . 6 1 1 A 43 43 ALA H H 43 6.870 7.857 -0.987 1
1 510 . 6 1 1 A 43 43 ALA HA H 43 4.290 4.041 0.249 1
1 514 . 6 1 1 A 43 43 ALA C C 43 180.700 180.040 0.660 1
1 515 . 6 1 1 A 43 43 ALA CA C 43 54.100 55.174 -1.074 1
1 516 . 6 1 1 A 43 43 ALA CB C 43 19.100 18.055 1.045 1
1 517 . 6 1 1 A 43 43 ALA N N 43 120.500 122.100 -1.600 1
1 518 . 6 1 1 A 44 44 ILE H H 44 7.970 8.231 -0.261 1
1 519 . 6 1 1 A 44 44 ILE HA H 44 3.470 3.610 -0.140 1
1 529 . 6 1 1 A 44 44 ILE C C 44 178.300 178.034 0.266 1
1 530 . 6 1 1 A 44 44 ILE CA C 44 64.700 65.541 -0.841 1
1 531 . 6 1 1 A 44 44 ILE CB C 44 38.100 37.902 0.198 1
1 535 . 6 1 1 A 44 44 ILE N N 44 120.500 119.146 1.354 1
1 536 . 6 1 1 A 45 45 ALA H H 45 8.460 8.205 0.255 1
1 537 . 6 1 1 A 45 45 ALA HA H 45 3.720 3.990 -0.270 1
1 541 . 6 1 1 A 45 45 ALA C C 45 178.500 179.701 -1.201 1
1 542 . 6 1 1 A 45 45 ALA CA C 45 56.200 55.297 0.903 1
1 543 . 6 1 1 A 45 45 ALA CB C 45 17.400 18.519 -1.119 1
1 544 . 6 1 1 A 45 45 ALA N N 45 124.500 122.159 2.341 1
1 545 . 6 1 1 A 46 46 THR H H 46 8.080 8.350 -0.270 1
1 546 . 6 1 1 A 46 46 THR HA H 46 3.900 3.864 0.036 1
1 551 . 6 1 1 A 46 46 THR C C 46 177.200 176.708 0.492 1
1 552 . 6 1 1 A 46 46 THR CA C 46 66.400 66.996 -0.596 1
1 553 . 6 1 1 A 46 46 THR CB C 46 68.800 68.787 0.013 1
1 555 . 6 1 1 A 46 46 THR N N 46 112.400 113.336 -0.936 1
1 556 . 6 1 1 A 47 47 ALA H H 47 7.930 8.277 -0.347 1
1 557 . 6 1 1 A 47 47 ALA HA H 47 4.200 4.123 0.077 1
1 561 . 6 1 1 A 47 47 ALA C C 47 179.200 179.515 -0.315 1
1 562 . 6 1 1 A 47 47 ALA CA C 47 54.800 55.161 -0.361 1
1 563 . 6 1 1 A 47 47 ALA CB C 47 19.800 18.186 1.614 1
1 564 . 6 1 1 A 47 47 ALA N N 47 121.400 124.296 -2.896 1
1 565 . 6 1 1 A 48 48 THR H H 48 7.560 7.575 -0.015 1
1 566 . 6 1 1 A 48 48 THR HA H 48 4.390 4.377 0.013 1
1 571 . 6 1 1 A 48 48 THR C C 48 175.700 176.214 -0.514 1
1 572 . 6 1 1 A 48 48 THR CA C 48 61.800 62.801 -1.001 1
1 573 . 6 1 1 A 48 48 THR CB C 48 71.000 70.487 0.513 1
1 575 . 6 1 1 A 48 48 THR N N 48 103.500 107.053 -3.553 1
1 576 . 6 1 1 A 49 49 GLY H H 49 7.820 8.354 -0.534 1
1 577 . 6 1 1 A 49 49 GLY HA2 H 49 3.870 3.924 -0.054 1
1 578 . 6 1 1 A 49 49 GLY HA3 H 49 4.100 3.925 0.175 1
1 579 . 6 1 1 A 49 49 GLY C C 49 174.400 173.959 0.441 1
1 580 . 6 1 1 A 49 49 GLY CA C 49 46.300 45.447 0.853 1
1 581 . 6 1 1 A 49 49 GLY N N 49 111.100 111.808 -0.708 1
1 582 . 6 1 1 A 50 50 MET H H 50 7.930 7.933 -0.003 1
1 583 . 6 1 1 A 50 50 MET HA H 50 4.540 4.829 -0.289 1
1 591 . 6 1 1 A 50 50 MET C C 50 174.800 175.582 -0.782 1
1 592 . 6 1 1 A 50 50 MET CA C 50 55.100 54.462 0.638 1
1 593 . 6 1 1 A 50 50 MET CB C 50 37.200 35.952 1.248 1
1 596 . 6 1 1 A 50 50 MET N N 50 119.300 119.314 -0.014 1
1 597 . 6 1 1 A 51 51 ASN H H 51 8.040 8.384 -0.344 1
1 598 . 6 1 1 A 51 51 ASN HA H 51 4.580 5.012 -0.432 1
1 601 . 6 1 1 A 51 51 ASN C C 51 176.100 176.320 -0.220 1
1 602 . 6 1 1 A 51 51 ASN CA C 51 52.800 51.032 1.768 1
1 603 . 6 1 1 A 51 51 ASN CB C 51 41.100 39.896 1.204 1
1 604 . 6 1 1 A 51 51 ASN N N 51 118.000 117.871 0.129 1
1 605 . 6 1 1 A 52 52 LEU H H 52 8.560 8.910 -0.350 1
1 606 . 6 1 1 A 52 52 LEU HA H 52 3.760 3.972 -0.212 1
1 616 . 6 1 1 A 52 52 LEU C C 52 179.600 178.961 0.639 1
1 617 . 6 1 1 A 52 52 LEU CA C 52 59.000 57.859 1.141 1
1 618 . 6 1 1 A 52 52 LEU CB C 52 41.800 41.366 0.434 1
1 622 . 6 1 1 A 52 52 LEU N N 52 120.600 121.151 -0.551 1
1 623 . 6 1 1 A 53 53 THR H H 53 8.230 8.110 0.120 1
1 624 . 6 1 1 A 53 53 THR HA H 53 3.880 4.030 -0.150 1
1 629 . 6 1 1 A 53 53 THR C C 53 176.900 177.286 -0.386 1
1 630 . 6 1 1 A 53 53 THR CA C 53 66.500 65.935 0.565 1
1 631 . 6 1 1 A 53 53 THR CB C 53 68.400 67.898 0.502 1
1 633 . 6 1 1 A 53 53 THR N N 53 115.800 110.589 5.211 1
1 634 . 6 1 1 A 54 54 THR H H 54 8.420 8.097 0.323 1
1 635 . 6 1 1 A 54 54 THR HA H 54 3.880 3.801 0.079 1
1 640 . 6 1 1 A 54 54 THR C C 54 177.300 176.228 1.072 1
1 641 . 6 1 1 A 54 54 THR CA C 54 66.600 67.034 -0.434 1
1 642 . 6 1 1 A 54 54 THR CB C 54 66.600 68.384 -1.784 1
1 644 . 6 1 1 A 54 54 THR N N 54 122.300 117.237 5.063 1
1 645 . 6 1 1 A 55 55 ALA H H 55 8.860 8.454 0.406 1
1 646 . 6 1 1 A 55 55 ALA HA H 55 4.020 3.924 0.096 1
1 650 . 6 1 1 A 55 55 ALA C C 55 179.000 179.471 -0.471 1
1 651 . 6 1 1 A 55 55 ALA CA C 55 56.100 55.320 0.780 1
1 652 . 6 1 1 A 55 55 ALA CB C 55 17.000 18.374 -1.374 1
1 653 . 6 1 1 A 55 55 ALA N N 55 125.600 123.572 2.028 1
1 654 . 6 1 1 A 56 56 SER H H 56 8.440 8.355 0.085 1
1 655 . 6 1 1 A 56 56 SER HA H 56 3.920 3.972 -0.052 1
1 658 . 6 1 1 A 56 56 SER C C 56 176.400 176.262 0.138 1
1 659 . 6 1 1 A 56 56 SER CA C 56 62.600 61.556 1.044 1
1 660 . 6 1 1 A 56 56 SER CB C 56 62.700 62.753 -0.053 1
1 661 . 6 1 1 A 56 56 SER N N 56 112.700 113.274 -0.574 1
1 662 . 6 1 1 A 57 57 ALA H H 57 8.090 7.933 0.157 1
1 663 . 6 1 1 A 57 57 ALA HA H 57 4.130 3.996 0.134 1
1 667 . 6 1 1 A 57 57 ALA C C 57 181.200 180.026 1.174 1
1 668 . 6 1 1 A 57 57 ALA CA C 57 55.200 55.241 -0.041 1
1 669 . 6 1 1 A 57 57 ALA CB C 57 17.900 18.189 -0.289 1
1 670 . 6 1 1 A 57 57 ALA N N 57 124.000 123.598 0.402 1
1 671 . 6 1 1 A 58 58 ASN H H 58 7.970 7.823 0.147 1
1 672 . 6 1 1 A 58 58 ASN HA H 58 4.480 4.477 0.003 1
1 677 . 6 1 1 A 58 58 ASN C C 58 177.500 178.327 -0.827 1
1 678 . 6 1 1 A 58 58 ASN CA C 58 56.900 56.325 0.575 1
1 679 . 6 1 1 A 58 58 ASN CB C 58 39.800 38.229 1.571 1
1 680 . 6 1 1 A 58 58 ASN N N 58 117.600 116.816 0.784 1
1 682 . 6 1 1 A 59 59 LEU H H 59 8.530 8.664 -0.134 1
1 683 . 6 1 1 A 59 59 LEU HA H 59 3.710 3.767 -0.057 1
1 693 . 6 1 1 A 59 59 LEU C C 59 178.400 178.983 -0.583 1
1 694 . 6 1 1 A 59 59 LEU CA C 59 58.600 57.773 0.827 1
1 695 . 6 1 1 A 59 59 LEU CB C 59 40.500 41.001 -0.501 1
1 699 . 6 1 1 A 59 59 LEU N N 59 122.600 121.537 1.063 1
1 700 . 6 1 1 A 60 60 GLN H H 60 8.200 8.159 0.041 1
1 701 . 6 1 1 A 60 60 GLN HA H 60 4.020 4.016 0.004 1
1 708 . 6 1 1 A 60 60 GLN C C 60 178.700 177.842 0.858 1
1 709 . 6 1 1 A 60 60 GLN CA C 60 58.800 58.929 -0.129 1
1 710 . 6 1 1 A 60 60 GLN CB C 60 27.700 28.744 -1.044 1
1 712 . 6 1 1 A 60 60 GLN N N 60 118.900 118.269 0.631 1
1 714 . 6 1 1 A 61 61 ALA H H 61 7.580 7.956 -0.376 1
1 715 . 6 1 1 A 61 61 ALA HA H 61 4.230 4.105 0.125 1
1 719 . 6 1 1 A 61 61 ALA C C 61 181.300 180.078 1.222 1
1 720 . 6 1 1 A 61 61 ALA CA C 61 55.100 55.149 -0.049 1
1 721 . 6 1 1 A 61 61 ALA CB C 61 17.600 18.229 -0.629 1
1 722 . 6 1 1 A 61 61 ALA N N 61 122.200 122.098 0.102 1
1 723 . 6 1 1 A 62 62 LEU H H 62 7.830 8.183 -0.353 1
1 724 . 6 1 1 A 62 62 LEU HA H 62 3.980 4.008 -0.028 1
1 734 . 6 1 1 A 62 62 LEU C C 62 178.500 179.099 -0.599 1
1 735 . 6 1 1 A 62 62 LEU CA C 62 58.100 57.646 0.454 1
1 736 . 6 1 1 A 62 62 LEU CB C 62 43.300 41.197 2.103 1
1 739 . 6 1 1 A 62 62 LEU N N 62 119.000 118.125 0.875 1
1 740 . 6 1 1 A 63 63 LYS H H 63 8.580 8.052 0.528 1
1 741 . 6 1 1 A 63 63 LYS HA H 63 4.130 4.050 0.080 1
1 750 . 6 1 1 A 63 63 LYS C C 63 180.500 179.382 1.118 1
1 751 . 6 1 1 A 63 63 LYS CA C 63 59.700 58.834 0.866 1
1 752 . 6 1 1 A 63 63 LYS CB C 63 32.600 32.089 0.511 1
1 756 . 6 1 1 A 63 63 LYS N N 63 123.400 121.863 1.537 1
1 757 . 6 1 1 A 64 64 SER H H 64 8.640 8.316 0.324 1
1 758 . 6 1 1 A 64 64 SER HA H 64 4.300 4.248 0.052 1
1 761 . 6 1 1 A 64 64 SER C C 64 175.000 177.178 -2.178 1
1 762 . 6 1 1 A 64 64 SER CA C 64 61.400 62.942 -1.542 1
1 763 . 6 1 1 A 64 64 SER CB C 64 63.000 62.488 0.512 1
1 764 . 6 1 1 A 64 64 SER N N 64 117.700 118.002 -0.302 1
1 765 . 6 1 1 A 65 65 GLY H H 65 7.280 7.799 -0.519 1
1 766 . 6 1 1 A 65 65 GLY HA2 H 65 3.240 3.909 -0.669 1
1 767 . 6 1 1 A 65 65 GLY HA3 H 65 3.980 3.910 0.070 1
1 768 . 6 1 1 A 65 65 GLY C C 65 171.300 174.967 -3.667 1
1 769 . 6 1 1 A 65 65 GLY CA C 65 45.100 46.043 -0.943 1
1 770 . 6 1 1 A 65 65 GLY N N 65 104.400 108.868 -4.468 1
1 771 . 6 1 1 A 66 66 GLY H H 66 7.730 7.566 0.164 1
1 772 . 6 1 1 A 66 66 GLY HA2 H 66 3.650 4.016 -0.366 1
1 773 . 6 1 1 A 66 66 GLY HA3 H 66 3.750 4.018 -0.268 1
1 774 . 6 1 1 A 66 66 GLY C C 66 173.700 175.104 -1.404 1
1 775 . 6 1 1 A 66 66 GLY CA C 66 45.400 45.605 -0.205 1
1 776 . 6 1 1 A 66 66 GLY N N 66 104.700 108.103 -3.403 1
1 777 . 6 1 1 A 67 67 LEU H H 67 7.520 8.078 -0.558 1
1 778 . 6 1 1 A 67 67 LEU HA H 67 4.310 4.246 0.064 1
1 788 . 6 1 1 A 67 67 LEU C C 67 177.700 176.940 0.760 1
1 789 . 6 1 1 A 67 67 LEU CA C 67 55.500 56.152 -0.652 1
1 790 . 6 1 1 A 67 67 LEU CB C 67 42.400 42.400 0.000 1
1 794 . 6 1 1 A 67 67 LEU N N 67 110.600 118.511 -7.911 1
1 795 . 6 1 1 A 68 68 VAL H H 68 6.890 7.375 -0.485 1
1 796 . 6 1 1 A 68 68 VAL HA H 68 5.190 5.025 0.165 1
1 804 . 6 1 1 A 68 68 VAL C C 68 173.700 174.703 -1.003 1
1 805 . 6 1 1 A 68 68 VAL CA C 68 57.400 58.726 -1.326 1
1 806 . 6 1 1 A 68 68 VAL CB C 68 36.400 35.210 1.190 1
1 809 . 6 1 1 A 68 68 VAL N N 68 106.400 112.250 -5.850 1
1 810 . 6 1 1 A 69 69 GLU H H 69 8.880 9.329 -0.449 1
1 811 . 6 1 1 A 69 69 GLU HA H 69 4.660 4.825 -0.165 1
1 816 . 6 1 1 A 69 69 GLU C C 69 173.300 175.140 -1.840 1
1 817 . 6 1 1 A 69 69 GLU CA C 69 54.300 54.740 -0.440 1
1 818 . 6 1 1 A 69 69 GLU CB C 69 34.100 33.132 0.968 1
1 820 . 6 1 1 A 69 69 GLU N N 69 120.400 121.483 -1.083 1
1 821 . 6 1 1 A 70 70 ALA H H 70 8.730 8.630 0.100 1
1 822 . 6 1 1 A 70 70 ALA HA H 70 4.990 4.936 0.054 1
1 826 . 6 1 1 A 70 70 ALA C C 70 176.500 175.221 1.279 1
1 827 . 6 1 1 A 70 70 ALA CA C 70 50.000 50.834 -0.834 1
1 828 . 6 1 1 A 70 70 ALA CB C 70 22.300 22.104 0.196 1
1 829 . 6 1 1 A 70 70 ALA N N 70 122.800 121.429 1.371 1
1 830 . 6 1 1 A 71 71 ARG H H 71 8.670 9.237 -0.567 1
1 831 . 6 1 1 A 71 71 ARG HA H 71 4.630 5.074 -0.444 1
1 843 . 6 1 1 A 71 71 ARG C C 71 173.500 175.190 -1.690 1
1 844 . 6 1 1 A 71 71 ARG CA C 71 54.600 54.377 0.223 1
1 845 . 6 1 1 A 71 71 ARG CB C 71 33.600 33.474 0.126 1
1 849 . 6 1 1 A 71 71 ARG N N 71 120.100 123.073 -2.973 1
1 851 . 6 1 1 A 72 72 ARG H H 72 8.780 8.635 0.145 1
1 852 . 6 1 1 A 72 72 ARG HA H 72 5.100 4.932 0.168 1
1 859 . 6 1 1 A 72 72 ARG C C 72 176.000 175.416 0.584 1
1 860 . 6 1 1 A 72 72 ARG CA C 72 54.900 55.641 -0.741 1
1 861 . 6 1 1 A 72 72 ARG CB C 72 32.500 31.711 0.789 1
1 864 . 6 1 1 A 72 72 ARG N N 72 123.600 124.724 -1.124 1
1 865 . 6 1 1 A 73 73 GLU H H 73 8.720 9.188 -0.468 1
1 866 . 6 1 1 A 73 73 GLU HA H 73 4.510 4.625 -0.115 1
1 871 . 6 1 1 A 73 73 GLU C C 73 175.900 176.549 -0.649 1
1 872 . 6 1 1 A 73 73 GLU CA C 73 55.700 55.236 0.464 1
1 873 . 6 1 1 A 73 73 GLU CB C 73 31.800 31.491 0.309 1
1 875 . 6 1 1 A 73 73 GLU N N 73 126.800 122.159 4.641 1
1 876 . 6 1 1 A 74 74 GLY H H 74 9.190 8.960 0.230 1
1 877 . 6 1 1 A 74 74 GLY HA2 H 74 3.700 3.879 -0.179 1
1 878 . 6 1 1 A 74 74 GLY HA3 H 74 4.170 3.889 0.281 1
1 879 . 6 1 1 A 74 74 GLY C C 74 175.400 174.901 0.499 1
1 880 . 6 1 1 A 74 74 GLY CA C 74 47.100 47.294 -0.194 1
1 881 . 6 1 1 A 74 74 GLY N N 74 118.500 116.149 2.351 1
1 882 . 6 1 1 A 75 75 THR H H 75 8.780 8.548 0.232 1
1 883 . 6 1 1 A 75 75 THR HA H 75 4.290 4.422 -0.132 1
1 888 . 6 1 1 A 75 75 THR C C 75 174.600 174.306 0.294 1
1 889 . 6 1 1 A 75 75 THR CA C 75 62.000 62.723 -0.723 1
1 890 . 6 1 1 A 75 75 THR CB C 75 69.000 69.831 -0.831 1
1 892 . 6 1 1 A 75 75 THR N N 75 118.000 120.605 -2.605 1
1 893 . 6 1 1 A 76 76 ARG H H 76 8.030 7.635 0.395 1
1 894 . 6 1 1 A 76 76 ARG HA H 76 4.610 4.767 -0.157 1
1 901 . 6 1 1 A 76 76 ARG C C 76 174.800 175.195 -0.395 1
1 902 . 6 1 1 A 76 76 ARG CA C 76 55.500 54.888 0.612 1
1 903 . 6 1 1 A 76 76 ARG CB C 76 32.700 31.802 0.898 1
1 906 . 6 1 1 A 76 76 ARG N N 76 122.600 120.551 2.049 1
1 907 . 6 1 1 A 77 77 GLN H H 77 8.580 8.507 0.073 1
1 908 . 6 1 1 A 77 77 GLN HA H 77 4.910 5.174 -0.264 1
1 915 . 6 1 1 A 77 77 GLN C C 77 173.900 174.124 -0.224 1
1 916 . 6 1 1 A 77 77 GLN CA C 77 54.700 54.382 0.318 1
1 917 . 6 1 1 A 77 77 GLN CB C 77 31.800 32.555 -0.755 1
1 919 . 6 1 1 A 77 77 GLN N N 77 121.900 122.183 -0.283 1
1 921 . 6 1 1 A 78 78 TYR H H 78 8.890 9.517 -0.627 1
1 922 . 6 1 1 A 78 78 TYR HA H 78 4.750 5.416 -0.666 1
1 929 . 6 1 1 A 78 78 TYR C C 78 175.600 174.476 1.124 1
1 930 . 6 1 1 A 78 78 TYR CA C 78 57.000 55.965 1.035 1
1 931 . 6 1 1 A 78 78 TYR CB C 78 41.400 40.348 1.052 1
1 936 . 6 1 1 A 78 78 TYR N N 78 121.800 127.084 -5.284 1
1 937 . 6 1 1 A 79 79 TYR H H 79 9.010 9.633 -0.623 1
1 938 . 6 1 1 A 79 79 TYR HA H 79 5.410 5.333 0.077 1
1 945 . 6 1 1 A 79 79 TYR C C 79 173.100 174.721 -1.621 1
1 946 . 6 1 1 A 79 79 TYR CA C 79 57.300 56.996 0.304 1
1 947 . 6 1 1 A 79 79 TYR CB C 79 43.300 40.940 2.360 1
1 952 . 6 1 1 A 79 79 TYR N N 79 122.500 122.761 -0.261 1
1 953 . 6 1 1 A 80 80 ARG H H 80 8.720 8.779 -0.059 1
1 954 . 6 1 1 A 80 80 ARG HA H 80 5.120 4.849 0.271 1
1 962 . 6 1 1 A 80 80 ARG C C 80 175.500 174.853 0.647 1
1 963 . 6 1 1 A 80 80 ARG CA C 80 53.200 54.463 -1.263 1
1 964 . 6 1 1 A 80 80 ARG CB C 80 33.900 34.281 -0.381 1
1 967 . 6 1 1 A 80 80 ARG N N 80 114.500 122.617 -8.117 1
1 969 . 6 1 1 A 81 81 ILE H H 81 9.300 8.640 0.660 1
1 970 . 6 1 1 A 81 81 ILE HA H 81 4.150 4.116 0.034 1
1 980 . 6 1 1 A 81 81 ILE C C 81 177.800 177.595 0.205 1
1 981 . 6 1 1 A 81 81 ILE CA C 81 62.300 62.422 -0.122 1
1 982 . 6 1 1 A 81 81 ILE CB C 81 37.800 37.845 -0.045 1
1 986 . 6 1 1 A 81 81 ILE N N 81 122.100 126.959 -4.859 1
1 987 . 6 1 1 A 82 82 ALA H H 82 7.930 8.741 -0.811 1
1 988 . 6 1 1 A 82 82 ALA HA H 82 3.930 3.994 -0.064 1
1 992 . 6 1 1 A 82 82 ALA C C 82 176.300 177.327 -1.027 1
1 993 . 6 1 1 A 82 82 ALA CA C 82 54.200 55.366 -1.166 1
1 994 . 6 1 1 A 82 82 ALA CB C 82 18.500 19.077 -0.577 1
1 995 . 6 1 1 A 82 82 ALA N N 82 127.200 128.882 -1.682 1
1 996 . 6 1 1 A 83 83 GLY H H 83 6.980 7.494 -0.514 1
1 997 . 6 1 1 A 83 83 GLY HA2 H 83 4.090 4.007 0.083 1
1 998 . 6 1 1 A 83 83 GLY HA3 H 83 4.440 4.009 0.431 1
1 999 . 6 1 1 A 83 83 GLY C C 83 173.600 174.732 -1.132 1
1 1000 . 6 1 1 A 83 83 GLY CA C 83 45.200 45.491 -0.291 1
1 1001 . 6 1 1 A 83 83 GLY N N 83 101.800 102.833 -1.033 1
1 1002 . 6 1 1 A 84 84 GLU H H 84 8.930 9.144 -0.214 1
1 1003 . 6 1 1 A 84 84 GLU HA H 84 4.120 3.943 0.177 1
1 1008 . 6 1 1 A 84 84 GLU C C 84 178.300 178.438 -0.138 1
1 1009 . 6 1 1 A 84 84 GLU CA C 84 58.900 59.843 -0.943 1
1 1010 . 6 1 1 A 84 84 GLU CB C 84 29.400 29.706 -0.306 1
1 1012 . 6 1 1 A 84 84 GLU N N 84 120.300 119.626 0.674 1
1 1013 . 6 1 1 A 85 85 ASP H H 85 8.950 8.164 0.786 1
1 1014 . 6 1 1 A 85 85 ASP HA H 85 4.310 4.354 -0.044 1
1 1017 . 6 1 1 A 85 85 ASP C C 85 178.000 178.780 -0.780 1
1 1018 . 6 1 1 A 85 85 ASP CA C 85 57.100 57.358 -0.258 1
1 1019 . 6 1 1 A 85 85 ASP CB C 85 38.900 40.885 -1.985 1
1 1020 . 6 1 1 A 85 85 ASP N N 85 119.400 119.779 -0.379 1
1 1021 . 6 1 1 A 86 86 VAL H H 86 7.620 7.919 -0.299 1
1 1022 . 6 1 1 A 86 86 VAL HA H 86 3.480 3.715 -0.235 1
1 1030 . 6 1 1 A 86 86 VAL C C 86 177.400 177.821 -0.421 1
1 1031 . 6 1 1 A 86 86 VAL CA C 86 66.800 66.234 0.566 1
1 1032 . 6 1 1 A 86 86 VAL CB C 86 31.300 31.095 0.205 1
1 1035 . 6 1 1 A 86 86 VAL N N 86 121.600 119.710 1.890 1
1 1036 . 6 1 1 A 87 87 ALA H H 87 7.520 8.688 -1.168 1
1 1037 . 6 1 1 A 87 87 ALA HA H 87 4.110 4.042 0.068 1
1 1041 . 6 1 1 A 87 87 ALA C C 87 181.200 179.821 1.379 1
1 1042 . 6 1 1 A 87 87 ALA CA C 87 55.800 55.788 0.012 1
1 1043 . 6 1 1 A 87 87 ALA CB C 87 17.600 18.164 -0.564 1
1 1044 . 6 1 1 A 87 87 ALA N N 87 122.700 121.646 1.054 1
1 1045 . 6 1 1 A 88 88 ARG H H 88 8.380 8.518 -0.138 1
1 1046 . 6 1 1 A 88 88 ARG HA H 88 4.090 4.073 0.017 1
1 1054 . 6 1 1 A 88 88 ARG C C 88 179.100 178.807 0.293 1
1 1055 . 6 1 1 A 88 88 ARG CA C 88 59.600 58.631 0.969 1
1 1056 . 6 1 1 A 88 88 ARG CB C 88 30.500 30.123 0.377 1
1 1059 . 6 1 1 A 88 88 ARG N N 88 119.200 117.996 1.204 1
1 1061 . 6 1 1 A 89 89 LEU H H 89 8.480 7.772 0.708 1
1 1062 . 6 1 1 A 89 89 LEU HA H 89 4.040 4.059 -0.019 1
1 1071 . 6 1 1 A 89 89 LEU C C 89 177.200 178.660 -1.460 1
1 1072 . 6 1 1 A 89 89 LEU CA C 89 58.300 57.936 0.364 1
1 1073 . 6 1 1 A 89 89 LEU CB C 89 41.300 41.943 -0.643 1
1 1076 . 6 1 1 A 89 89 LEU N N 89 123.300 122.283 1.017 1
1 1077 . 6 1 1 A 90 90 PHE H H 90 8.890 8.385 0.505 1
1 1078 . 6 1 1 A 90 90 PHE HA H 90 4.380 4.013 0.367 1
1 1086 . 6 1 1 A 90 90 PHE C C 90 177.500 177.828 -0.328 1
1 1087 . 6 1 1 A 90 90 PHE CA C 90 59.400 62.317 -2.917 1
1 1088 . 6 1 1 A 90 90 PHE CB C 90 38.600 38.836 -0.236 1
1 1094 . 6 1 1 A 90 90 PHE N N 90 119.400 119.384 0.016 1
1 1095 . 6 1 1 A 91 91 ALA H H 91 7.920 8.375 -0.455 1
1 1096 . 6 1 1 A 91 91 ALA HA H 91 3.940 3.938 0.002 1
1 1100 . 6 1 1 A 91 91 ALA C C 91 180.200 179.974 0.226 1
1 1101 . 6 1 1 A 91 91 ALA CA C 91 55.100 55.210 -0.110 1
1 1102 . 6 1 1 A 91 91 ALA CB C 91 18.000 18.209 -0.209 1
1 1103 . 6 1 1 A 91 91 ALA N N 91 120.500 121.380 -0.880 1
1 1104 . 6 1 1 A 92 92 LEU H H 92 8.190 8.679 -0.489 1
1 1105 . 6 1 1 A 92 92 LEU HA H 92 4.300 4.049 0.251 1
1 1115 . 6 1 1 A 92 92 LEU C C 92 178.900 178.263 0.637 1
1 1116 . 6 1 1 A 92 92 LEU CA C 92 57.500 57.905 -0.405 1
1 1117 . 6 1 1 A 92 92 LEU CB C 92 42.100 41.573 0.527 1
1 1121 . 6 1 1 A 92 92 LEU N N 92 120.200 119.571 0.629 1
1 1122 . 6 1 1 A 93 93 VAL H H 93 8.890 8.162 0.728 1
1 1123 . 6 1 1 A 93 93 VAL HA H 93 3.810 3.722 0.088 1
1 1131 . 6 1 1 A 93 93 VAL C C 93 176.900 177.372 -0.472 1
1 1132 . 6 1 1 A 93 93 VAL CA C 93 66.000 64.958 1.042 1
1 1133 . 6 1 1 A 93 93 VAL CB C 93 31.200 31.089 0.111 1
1 1136 . 6 1 1 A 93 93 VAL N N 93 117.100 118.453 -1.353 1
1 1137 . 6 1 1 A 94 94 GLN H H 94 6.920 7.485 -0.565 1
1 1138 . 6 1 1 A 94 94 GLN HA H 94 3.790 3.822 -0.032 1
1 1145 . 6 1 1 A 94 94 GLN C C 94 177.400 178.457 -1.057 1
1 1146 . 6 1 1 A 94 94 GLN CA C 94 60.000 58.637 1.363 1
1 1147 . 6 1 1 A 94 94 GLN CB C 94 30.300 28.008 2.292 1
1 1149 . 6 1 1 A 94 94 GLN N N 94 117.800 120.551 -2.751 1
1 1151 . 6 1 1 A 95 95 VAL H H 95 7.420 7.797 -0.377 1
1 1152 . 6 1 1 A 95 95 VAL HA H 95 3.760 3.613 0.147 1
1 1160 . 6 1 1 A 95 95 VAL C C 95 178.300 178.080 0.220 1
1 1161 . 6 1 1 A 95 95 VAL CA C 95 66.600 66.439 0.161 1
1 1162 . 6 1 1 A 95 95 VAL CB C 95 31.900 31.553 0.347 1
1 1165 . 6 1 1 A 95 95 VAL N N 95 121.500 120.030 1.470 1
1 1166 . 6 1 1 A 96 96 VAL H H 96 8.340 8.452 -0.112 1
1 1167 . 6 1 1 A 96 96 VAL HA H 96 3.810 3.150 0.660 1
1 1175 . 6 1 1 A 96 96 VAL C C 96 178.400 178.409 -0.009 1
1 1176 . 6 1 1 A 96 96 VAL CA C 96 66.100 66.272 -0.172 1
1 1177 . 6 1 1 A 96 96 VAL CB C 96 32.200 31.337 0.863 1
1 1180 . 6 1 1 A 96 96 VAL N N 96 120.000 119.718 0.282 1
1 1181 . 6 1 1 A 97 97 ALA H H 97 8.140 7.635 0.505 1
1 1182 . 6 1 1 A 97 97 ALA HA H 97 4.010 4.091 -0.081 1
1 1186 . 6 1 1 A 97 97 ALA C C 97 178.800 178.612 0.188 1
1 1187 . 6 1 1 A 97 97 ALA CA C 97 54.900 55.334 -0.434 1
1 1188 . 6 1 1 A 97 97 ALA CB C 97 19.900 19.273 0.627 1
1 1189 . 6 1 1 A 97 97 ALA N N 97 121.400 121.962 -0.562 1
1 1190 . 6 1 1 A 98 98 ASP H H 98 8.170 8.568 -0.398 1
1 1191 . 6 1 1 A 98 98 ASP HA H 98 4.320 4.274 0.046 1
1 1194 . 6 1 1 A 98 98 ASP C C 98 178.100 179.003 -0.903 1
1 1195 . 6 1 1 A 98 98 ASP CA C 98 57.100 57.814 -0.714 1
1 1196 . 6 1 1 A 98 98 ASP CB C 98 41.800 42.135 -0.335 1
1 1197 . 6 1 1 A 98 98 ASP N N 98 118.500 118.777 -0.277 1
1 1198 . 6 1 1 A 99 99 GLU H H 99 8.220 7.879 0.341 1
1 1199 . 6 1 1 A 99 99 GLU HA H 99 4.000 4.128 -0.128 1
1 1204 . 6 1 1 A 99 99 GLU C C 99 178.300 178.747 -0.447 1
1 1205 . 6 1 1 A 99 99 GLU CA C 99 58.300 59.182 -0.882 1
1 1206 . 6 1 1 A 99 99 GLU CB C 99 29.800 29.452 0.348 1
1 1208 . 6 1 1 A 99 99 GLU N N 99 116.600 119.667 -3.067 1
1 1209 . 6 1 1 A 100 100 HIS H H 100 7.980 7.504 0.476 1
1 1210 . 6 1 1 A 100 100 HIS HA H 100 4.600 4.381 0.219 1
1 1214 . 6 1 1 A 100 100 HIS C C 100 175.900 177.721 -1.821 1
1 1215 . 6 1 1 A 100 100 HIS CA C 100 57.500 59.187 -1.687 1
1 1216 . 6 1 1 A 100 100 HIS CB C 100 30.800 30.538 0.262 1
1 1218 . 6 1 1 A 100 100 HIS N N 100 114.000 117.770 -3.770 1
1 1219 . 6 1 1 A 101 101 LEU H H 101 7.920 8.118 -0.198 1
1 1220 . 6 1 1 A 101 101 LEU HA H 101 4.370 3.949 0.421 1
1 1230 . 6 1 1 A 101 101 LEU C C 101 177.700 176.977 0.723 1
1 1231 . 6 1 1 A 101 101 LEU CA C 101 55.900 56.178 -0.278 1
1 1232 . 6 1 1 A 101 101 LEU CB C 101 42.100 42.280 -0.180 1
1 1236 . 6 1 1 A 101 101 LEU N N 101 118.500 119.704 -1.204 1
1 1237 . 6 1 1 A 102 102 GLU H H 102 8.100 7.609 0.491 1
1 1238 . 6 1 1 A 102 102 GLU HA H 102 4.160 4.302 -0.142 1
1 1243 . 6 1 1 A 102 102 GLU C C 102 176.700 174.531 2.169 1
1 1244 . 6 1 1 A 102 102 GLU CA C 102 57.000 58.613 -1.613 1
1 1245 . 6 1 1 A 102 102 GLU CB C 102 29.900 28.446 1.454 1
1 1247 . 6 1 1 A 102 102 GLU N N 102 119.100 117.308 1.792 1
1 1248 . 6 1 1 A 103 103 HIS H H 103 8.010 8.719 -0.709 1
1 1249 . 6 1 1 A 103 103 HIS HA H 103 4.520 4.851 -0.331 1
1 1252 . 6 1 1 A 103 103 HIS CA C 103 56.100 54.745 1.355 1
1 1253 . 6 1 1 A 103 103 HIS CB C 103 29.700 28.524 1.176 1
1 1254 . 6 1 1 A 103 103 HIS N N 103 117.300 121.457 -4.157 1
1 1255 . 6 1 1 A 107 107 HIS HA H 107 4.560 4.656 -0.096 1
1 1258 . 6 1 1 A 107 107 HIS C C 107 173.900 174.265 -0.365 1
1 1259 . 6 1 1 A 107 107 HIS CA C 107 55.900 55.012 0.888 1
1 1260 . 6 1 1 A 107 107 HIS CB C 107 30.200 30.940 -0.740 1
1 4 . 7 1 1 A 2 2 ALA H H 2 8.450 8.407 0.043 1
1 5 . 7 1 1 A 2 2 ALA HA H 2 4.390 3.932 0.458 1
1 9 . 7 1 1 A 2 2 ALA C C 2 178.300 177.719 0.581 1
1 10 . 7 1 1 A 2 2 ALA CA C 2 52.500 52.773 -0.273 1
1 11 . 7 1 1 A 2 2 ALA CB C 2 19.200 17.556 1.644 1
1 12 . 7 1 1 A 2 2 ALA N N 2 125.100 125.141 -0.041 1
1 13 . 7 1 1 A 3 3 GLY H H 3 8.450 8.353 0.097 1
1 14 . 7 1 1 A 3 3 GLY HA2 H 3 4.030 4.119 -0.089 1
1 15 . 7 1 1 A 3 3 GLY HA3 H 3 4.030 4.119 -0.089 1
1 16 . 7 1 1 A 3 3 GLY C C 3 174.100 173.723 0.377 1
1 17 . 7 1 1 A 3 3 GLY CA C 3 45.200 45.533 -0.333 1
1 18 . 7 1 1 A 3 3 GLY N N 3 108.000 109.546 -1.546 1
1 19 . 7 1 1 A 4 4 GLN H H 4 8.550 7.822 0.728 1
1 20 . 7 1 1 A 4 4 GLN HA H 4 4.340 4.701 -0.361 1
1 27 . 7 1 1 A 4 4 GLN C C 4 176.700 174.981 1.719 1
1 28 . 7 1 1 A 4 4 GLN CA C 4 56.600 54.357 2.243 1
1 29 . 7 1 1 A 4 4 GLN CB C 4 29.300 30.565 -1.265 1
1 31 . 7 1 1 A 4 4 GLN N N 4 120.500 119.685 0.815 1
1 33 . 7 1 1 A 5 5 SER H H 5 8.540 8.635 -0.095 1
1 34 . 7 1 1 A 5 5 SER HA H 5 4.390 4.526 -0.136 1
1 38 . 7 1 1 A 5 5 SER C C 5 174.800 174.047 0.753 1
1 39 . 7 1 1 A 5 5 SER CA C 5 59.100 56.920 2.180 1
1 40 . 7 1 1 A 5 5 SER CB C 5 63.500 62.538 0.962 1
1 41 . 7 1 1 A 5 5 SER N N 5 117.100 117.220 -0.120 1
1 42 . 7 1 1 A 6 6 ASP H H 6 8.300 8.048 0.252 1
1 43 . 7 1 1 A 6 6 ASP HA H 6 4.540 4.525 0.015 1
1 46 . 7 1 1 A 6 6 ASP C C 6 177.300 178.661 -1.361 1
1 47 . 7 1 1 A 6 6 ASP CA C 6 55.100 56.142 -1.042 1
1 48 . 7 1 1 A 6 6 ASP CB C 6 40.800 40.791 0.009 1
1 49 . 7 1 1 A 6 6 ASP N N 6 122.700 126.834 -4.134 1
1 50 . 7 1 1 A 7 7 ARG H H 7 8.270 8.080 0.190 1
1 51 . 7 1 1 A 7 7 ARG HA H 7 4.150 4.117 0.033 1
1 58 . 7 1 1 A 7 7 ARG C C 7 177.600 178.995 -1.395 1
1 59 . 7 1 1 A 7 7 ARG CA C 7 58.000 59.781 -1.781 1
1 60 . 7 1 1 A 7 7 ARG CB C 7 30.100 29.694 0.406 1
1 63 . 7 1 1 A 7 7 ARG N N 7 122.100 121.154 0.946 1
1 64 . 7 1 1 A 8 8 LYS H H 8 8.130 7.961 0.169 1
1 65 . 7 1 1 A 8 8 LYS HA H 8 4.090 4.074 0.016 1
1 74 . 7 1 1 A 8 8 LYS C C 8 177.600 178.614 -1.014 1
1 75 . 7 1 1 A 8 8 LYS CA C 8 58.400 59.448 -1.048 1
1 76 . 7 1 1 A 8 8 LYS CB C 8 31.700 32.319 -0.619 1
1 80 . 7 1 1 A 8 8 LYS N N 8 120.900 120.000 0.900 1
1 81 . 7 1 1 A 9 9 ALA H H 9 8.050 8.118 -0.068 1
1 82 . 7 1 1 A 9 9 ALA HA H 9 3.950 4.094 -0.144 1
1 86 . 7 1 1 A 9 9 ALA C C 9 179.800 180.192 -0.392 1
1 87 . 7 1 1 A 9 9 ALA CA C 9 55.100 54.942 0.158 1
1 88 . 7 1 1 A 9 9 ALA CB C 9 18.100 17.945 0.155 1
1 89 . 7 1 1 A 9 9 ALA N N 9 121.600 120.929 0.671 1
1 90 . 7 1 1 A 10 10 ALA H H 10 7.910 7.878 0.032 1
1 91 . 7 1 1 A 10 10 ALA HA H 10 4.200 4.112 0.088 1
1 95 . 7 1 1 A 10 10 ALA C C 10 180.500 179.554 0.946 1
1 96 . 7 1 1 A 10 10 ALA CA C 10 54.600 54.801 -0.201 1
1 97 . 7 1 1 A 10 10 ALA CB C 10 18.100 18.341 -0.241 1
1 98 . 7 1 1 A 10 10 ALA N N 10 120.200 121.033 -0.833 1
1 99 . 7 1 1 A 11 11 LEU H H 11 8.080 8.093 -0.013 1
1 100 . 7 1 1 A 11 11 LEU HA H 11 4.120 4.135 -0.015 1
1 110 . 7 1 1 A 11 11 LEU C C 11 179.600 178.566 1.034 1
1 111 . 7 1 1 A 11 11 LEU CA C 11 57.800 57.731 0.069 1
1 112 . 7 1 1 A 11 11 LEU CB C 11 41.700 41.812 -0.112 1
1 115 . 7 1 1 A 11 11 LEU N N 11 120.900 120.789 0.111 1
1 116 . 7 1 1 A 12 12 LEU H H 12 8.480 8.260 0.220 1
1 117 . 7 1 1 A 12 12 LEU HA H 12 4.040 3.945 0.095 1
1 127 . 7 1 1 A 12 12 LEU C C 12 178.900 178.937 -0.037 1
1 128 . 7 1 1 A 12 12 LEU CA C 12 58.100 57.986 0.114 1
1 129 . 7 1 1 A 12 12 LEU CB C 12 40.100 40.618 -0.518 1
1 133 . 7 1 1 A 12 12 LEU N N 12 118.700 117.851 0.849 1
1 134 . 7 1 1 A 13 13 ASP H H 13 7.990 8.308 -0.318 1
1 135 . 7 1 1 A 13 13 ASP HA H 13 4.420 4.219 0.201 1
1 138 . 7 1 1 A 13 13 ASP C C 13 178.900 178.156 0.744 1
1 139 . 7 1 1 A 13 13 ASP CA C 13 57.500 57.832 -0.332 1
1 140 . 7 1 1 A 13 13 ASP CB C 13 40.500 41.977 -1.477 1
1 141 . 7 1 1 A 13 13 ASP N N 13 119.500 119.978 -0.478 1
1 142 . 7 1 1 A 14 14 GLN H H 14 7.620 7.938 -0.318 1
1 143 . 7 1 1 A 14 14 GLN HA H 14 4.230 4.087 0.143 1
1 150 . 7 1 1 A 14 14 GLN C C 14 178.400 177.932 0.468 1
1 151 . 7 1 1 A 14 14 GLN CA C 14 58.100 58.815 -0.715 1
1 152 . 7 1 1 A 14 14 GLN CB C 14 27.800 27.979 -0.179 1
1 154 . 7 1 1 A 14 14 GLN N N 14 118.900 117.476 1.424 1
1 156 . 7 1 1 A 15 15 VAL H H 15 8.480 7.770 0.710 1
1 157 . 7 1 1 A 15 15 VAL HA H 15 3.380 4.000 -0.620 1
1 165 . 7 1 1 A 15 15 VAL C C 15 177.600 178.141 -0.541 1
1 166 . 7 1 1 A 15 15 VAL CA C 15 66.600 63.300 3.300 1
1 167 . 7 1 1 A 15 15 VAL CB C 15 30.500 31.721 -1.221 1
1 170 . 7 1 1 A 15 15 VAL N N 15 121.300 116.341 4.959 1
1 171 . 7 1 1 A 16 16 ALA H H 16 8.080 8.057 0.023 1
1 172 . 7 1 1 A 16 16 ALA HA H 16 4.450 3.994 0.456 1
1 176 . 7 1 1 A 16 16 ALA C C 16 179.100 179.757 -0.657 1
1 177 . 7 1 1 A 16 16 ALA CA C 16 54.600 55.260 -0.660 1
1 178 . 7 1 1 A 16 16 ALA CB C 16 17.700 18.190 -0.490 1
1 179 . 7 1 1 A 16 16 ALA N N 16 121.400 124.205 -2.805 1
1 180 . 7 1 1 A 17 17 ARG H H 17 7.480 7.732 -0.252 1
1 181 . 7 1 1 A 17 17 ARG HA H 17 3.910 4.169 -0.259 1
1 187 . 7 1 1 A 17 17 ARG C C 17 179.700 179.040 0.660 1
1 188 . 7 1 1 A 17 17 ARG CA C 17 59.700 59.259 0.441 1
1 189 . 7 1 1 A 17 17 ARG CB C 17 30.400 29.879 0.521 1
1 191 . 7 1 1 A 17 17 ARG N N 17 116.900 119.376 -2.476 1
1 192 . 7 1 1 A 18 18 VAL H H 18 7.960 8.025 -0.065 1
1 193 . 7 1 1 A 18 18 VAL HA H 18 3.690 3.646 0.044 1
1 201 . 7 1 1 A 18 18 VAL C C 18 177.900 178.951 -1.051 1
1 202 . 7 1 1 A 18 18 VAL CA C 18 66.600 65.547 1.053 1
1 203 . 7 1 1 A 18 18 VAL CB C 18 31.300 31.744 -0.444 1
1 206 . 7 1 1 A 18 18 VAL N N 18 123.000 119.683 3.317 1
1 207 . 7 1 1 A 19 19 GLY H H 19 8.270 8.384 -0.114 1
1 208 . 7 1 1 A 19 19 GLY HA2 H 19 3.430 3.848 -0.418 1
1 209 . 7 1 1 A 19 19 GLY HA3 H 19 3.430 3.853 -0.423 1
1 210 . 7 1 1 A 19 19 GLY C C 19 174.400 176.102 -1.702 1
1 211 . 7 1 1 A 19 19 GLY CA C 19 48.500 46.852 1.648 1
1 212 . 7 1 1 A 19 19 GLY N N 19 105.400 107.652 -2.252 1
1 213 . 7 1 1 A 20 20 LYS H H 20 8.250 7.887 0.363 1
1 214 . 7 1 1 A 20 20 LYS HA H 20 3.710 4.011 -0.301 1
1 223 . 7 1 1 A 20 20 LYS C C 20 179.400 179.215 0.185 1
1 224 . 7 1 1 A 20 20 LYS CA C 20 59.300 59.718 -0.418 1
1 225 . 7 1 1 A 20 20 LYS CB C 20 32.600 32.267 0.333 1
1 229 . 7 1 1 A 20 20 LYS N N 20 118.700 121.982 -3.282 1
1 230 . 7 1 1 A 21 21 ALA H H 21 7.640 7.833 -0.193 1
1 231 . 7 1 1 A 21 21 ALA HA H 21 3.790 4.111 -0.321 1
1 235 . 7 1 1 A 21 21 ALA C C 21 177.900 178.842 -0.942 1
1 236 . 7 1 1 A 21 21 ALA CA C 21 55.200 54.642 0.558 1
1 237 . 7 1 1 A 21 21 ALA CB C 21 19.200 18.489 0.711 1
1 238 . 7 1 1 A 21 21 ALA N N 21 121.700 122.039 -0.339 1
1 239 . 7 1 1 A 22 22 LEU H H 22 7.330 8.292 -0.962 1
1 240 . 7 1 1 A 22 22 LEU HA H 22 4.140 4.471 -0.331 1
1 250 . 7 1 1 A 22 22 LEU C C 22 176.800 177.857 -1.057 1
1 251 . 7 1 1 A 22 22 LEU CA C 22 54.600 54.025 0.575 1
1 252 . 7 1 1 A 22 22 LEU CB C 22 42.900 42.403 0.497 1
1 256 . 7 1 1 A 22 22 LEU N N 22 114.200 119.071 -4.871 1
1 257 . 7 1 1 A 23 23 ALA H H 23 7.160 7.407 -0.247 1
1 258 . 7 1 1 A 23 23 ALA HA H 23 4.720 4.361 0.359 1
1 262 . 7 1 1 A 23 23 ALA C C 23 176.700 177.720 -1.020 1
1 263 . 7 1 1 A 23 23 ALA CA C 23 53.000 51.575 1.425 1
1 264 . 7 1 1 A 23 23 ALA CB C 23 18.200 18.567 -0.367 1
1 265 . 7 1 1 A 23 23 ALA N N 23 118.200 122.875 -4.675 1
1 266 . 7 1 1 A 24 24 ASN H H 24 7.440 8.251 -0.811 1
1 267 . 7 1 1 A 24 24 ASN HA H 24 4.730 4.733 -0.003 1
1 272 . 7 1 1 A 24 24 ASN C C 24 174.800 174.258 0.542 1
1 273 . 7 1 1 A 24 24 ASN CA C 24 53.500 55.418 -1.918 1
1 274 . 7 1 1 A 24 24 ASN CB C 24 41.700 37.366 4.334 1
1 275 . 7 1 1 A 24 24 ASN N N 24 116.800 114.039 2.761 1
1 277 . 7 1 1 A 25 25 GLY H H 25 9.370 8.550 0.820 1
1 278 . 7 1 1 A 25 25 GLY HA2 H 25 3.650 4.124 -0.474 1
1 279 . 7 1 1 A 25 25 GLY HA3 H 25 4.110 4.128 -0.018 1
1 280 . 7 1 1 A 25 25 GLY C C 25 175.300 174.411 0.889 1
1 281 . 7 1 1 A 25 25 GLY CA C 25 47.600 43.887 3.713 1
1 282 . 7 1 1 A 25 25 GLY N N 25 114.800 108.455 6.345 1
1 283 . 7 1 1 A 26 26 ARG H H 26 8.050 8.911 -0.861 1
1 284 . 7 1 1 A 26 26 ARG HA H 26 4.150 4.289 -0.139 1
1 289 . 7 1 1 A 26 26 ARG C C 26 179.300 177.324 1.976 1
1 290 . 7 1 1 A 26 26 ARG CA C 26 57.000 58.782 -1.782 1
1 291 . 7 1 1 A 26 26 ARG CB C 26 29.900 29.813 0.087 1
1 294 . 7 1 1 A 26 26 ARG N N 26 120.500 122.357 -1.857 1
1 295 . 7 1 1 A 27 27 ARG H H 27 7.930 8.185 -0.255 1
1 296 . 7 1 1 A 27 27 ARG HA H 27 3.710 4.144 -0.434 1
1 301 . 7 1 1 A 27 27 ARG C C 27 178.300 177.386 0.914 1
1 302 . 7 1 1 A 27 27 ARG CA C 27 61.000 58.051 2.949 1
1 303 . 7 1 1 A 27 27 ARG CB C 27 30.400 29.162 1.238 1
1 305 . 7 1 1 A 27 27 ARG N N 27 117.900 119.599 -1.699 1
1 306 . 7 1 1 A 28 28 LEU H H 28 7.640 7.730 -0.090 1
1 307 . 7 1 1 A 28 28 LEU HA H 28 3.950 4.030 -0.080 1
1 317 . 7 1 1 A 28 28 LEU C C 28 178.200 179.421 -1.221 1
1 318 . 7 1 1 A 28 28 LEU CA C 28 57.600 57.126 0.474 1
1 319 . 7 1 1 A 28 28 LEU CB C 28 41.900 41.180 0.720 1
1 323 . 7 1 1 A 28 28 LEU N N 28 117.600 120.713 -3.113 1
1 324 . 7 1 1 A 29 29 GLN H H 29 8.110 7.855 0.255 1
1 325 . 7 1 1 A 29 29 GLN HA H 29 3.880 4.107 -0.227 1
1 332 . 7 1 1 A 29 29 GLN C C 29 179.400 178.603 0.797 1
1 333 . 7 1 1 A 29 29 GLN CA C 29 59.100 58.482 0.618 1
1 334 . 7 1 1 A 29 29 GLN CB C 29 28.800 28.325 0.475 1
1 336 . 7 1 1 A 29 29 GLN N N 29 119.300 118.494 0.806 1
1 338 . 7 1 1 A 30 30 ILE H H 30 7.530 7.898 -0.368 1
1 339 . 7 1 1 A 30 30 ILE HA H 30 3.340 3.636 -0.296 1
1 349 . 7 1 1 A 30 30 ILE C C 30 176.700 178.117 -1.417 1
1 350 . 7 1 1 A 30 30 ILE CA C 30 65.900 65.264 0.636 1
1 351 . 7 1 1 A 30 30 ILE CB C 30 37.400 38.027 -0.627 1
1 355 . 7 1 1 A 30 30 ILE N N 30 118.600 120.939 -2.339 1
1 356 . 7 1 1 A 31 31 LEU H H 31 7.500 7.709 -0.209 1
1 357 . 7 1 1 A 31 31 LEU HA H 31 3.520 3.716 -0.196 1
1 367 . 7 1 1 A 31 31 LEU C C 31 177.300 178.445 -1.145 1
1 368 . 7 1 1 A 31 31 LEU CA C 31 58.100 57.848 0.252 1
1 369 . 7 1 1 A 31 31 LEU CB C 31 41.100 40.637 0.463 1
1 373 . 7 1 1 A 31 31 LEU N N 31 119.900 118.867 1.033 1
1 374 . 7 1 1 A 32 32 ASP H H 32 7.950 8.620 -0.670 1
1 375 . 7 1 1 A 32 32 ASP HA H 32 4.300 4.302 -0.002 1
1 378 . 7 1 1 A 32 32 ASP C C 32 178.300 178.449 -0.149 1
1 379 . 7 1 1 A 32 32 ASP CA C 32 57.400 57.845 -0.445 1
1 380 . 7 1 1 A 32 32 ASP CB C 32 42.400 42.033 0.367 1
1 381 . 7 1 1 A 32 32 ASP N N 32 116.900 119.494 -2.594 1
1 382 . 7 1 1 A 33 33 LEU H H 33 7.350 7.417 -0.067 1
1 383 . 7 1 1 A 33 33 LEU HA H 33 4.130 4.084 0.046 1
1 393 . 7 1 1 A 33 33 LEU C C 33 180.000 178.807 1.193 1
1 394 . 7 1 1 A 33 33 LEU CA C 33 57.600 57.819 -0.219 1
1 395 . 7 1 1 A 33 33 LEU CB C 33 42.300 41.603 0.697 1
1 399 . 7 1 1 A 33 33 LEU N N 33 118.600 120.232 -1.632 1
1 400 . 7 1 1 A 34 34 LEU H H 34 8.300 8.227 0.073 1
1 401 . 7 1 1 A 34 34 LEU HA H 34 4.490 4.335 0.155 1
1 411 . 7 1 1 A 34 34 LEU C C 34 178.900 179.627 -0.727 1
1 412 . 7 1 1 A 34 34 LEU CA C 34 55.800 57.613 -1.813 1
1 413 . 7 1 1 A 34 34 LEU CB C 34 41.300 40.366 0.934 1
1 417 . 7 1 1 A 34 34 LEU N N 34 117.800 118.468 -0.668 1
1 418 . 7 1 1 A 35 35 ALA H H 35 8.160 8.140 0.020 1
1 419 . 7 1 1 A 35 35 ALA HA H 35 4.050 4.104 -0.054 1
1 423 . 7 1 1 A 35 35 ALA C C 35 179.000 178.374 0.626 1
1 424 . 7 1 1 A 35 35 ALA CA C 35 54.900 54.438 0.462 1
1 425 . 7 1 1 A 35 35 ALA CB C 35 17.500 18.190 -0.690 1
1 426 . 7 1 1 A 35 35 ALA N N 35 123.900 121.761 2.139 1
1 427 . 7 1 1 A 36 36 GLN H H 36 7.600 7.747 -0.147 1
1 428 . 7 1 1 A 36 36 GLN HA H 36 4.340 4.413 -0.073 1
1 435 . 7 1 1 A 36 36 GLN C C 36 176.100 175.226 0.874 1
1 436 . 7 1 1 A 36 36 GLN CA C 36 55.800 55.905 -0.105 1
1 437 . 7 1 1 A 36 36 GLN CB C 36 29.000 29.563 -0.563 1
1 439 . 7 1 1 A 36 36 GLN N N 36 113.300 114.299 -0.999 1
1 441 . 7 1 1 A 37 37 GLY H H 37 7.550 7.162 0.388 1
1 442 . 7 1 1 A 37 37 GLY HA2 H 37 3.730 4.030 -0.300 1
1 443 . 7 1 1 A 37 37 GLY HA3 H 37 4.490 4.033 0.457 1
1 444 . 7 1 1 A 37 37 GLY C C 37 171.500 172.948 -1.448 1
1 445 . 7 1 1 A 37 37 GLY CA C 37 44.500 45.380 -0.880 1
1 446 . 7 1 1 A 37 37 GLY N N 37 108.400 107.779 0.621 1
1 447 . 7 1 1 A 38 38 GLU H H 38 8.120 8.440 -0.320 1
1 448 . 7 1 1 A 38 38 GLU HA H 38 4.820 4.574 0.246 1
1 453 . 7 1 1 A 38 38 GLU C C 38 177.000 176.218 0.782 1
1 454 . 7 1 1 A 38 38 GLU CA C 38 56.400 56.422 -0.022 1
1 455 . 7 1 1 A 38 38 GLU CB C 38 31.200 30.120 1.080 1
1 457 . 7 1 1 A 38 38 GLU N N 38 119.600 121.004 -1.404 1
1 458 . 7 1 1 A 39 39 ARG H H 39 8.580 8.489 0.091 1
1 459 . 7 1 1 A 39 39 ARG HA H 39 4.970 5.092 -0.122 1
1 467 . 7 1 1 A 39 39 ARG C C 39 174.800 175.559 -0.759 1
1 468 . 7 1 1 A 39 39 ARG CA C 39 53.900 54.071 -0.171 1
1 469 . 7 1 1 A 39 39 ARG CB C 39 36.400 34.691 1.709 1
1 472 . 7 1 1 A 39 39 ARG N N 39 121.500 121.402 0.098 1
1 474 . 7 1 1 A 40 40 ALA H H 40 8.910 8.624 0.286 1
1 475 . 7 1 1 A 40 40 ALA HA H 40 4.920 4.620 0.300 1
1 479 . 7 1 1 A 40 40 ALA C C 40 179.200 178.464 0.736 1
1 480 . 7 1 1 A 40 40 ALA CA C 40 51.100 51.556 -0.456 1
1 481 . 7 1 1 A 40 40 ALA CB C 40 19.200 19.522 -0.322 1
1 482 . 7 1 1 A 40 40 ALA N N 40 125.100 123.340 1.760 1
1 483 . 7 1 1 A 41 41 VAL H H 41 8.420 8.579 -0.159 1
1 484 . 7 1 1 A 41 41 VAL HA H 41 3.430 3.569 -0.139 1
1 492 . 7 1 1 A 41 41 VAL C C 41 176.800 177.224 -0.424 1
1 493 . 7 1 1 A 41 41 VAL CA C 41 67.600 66.856 0.744 1
1 494 . 7 1 1 A 41 41 VAL CB C 41 31.600 31.616 -0.016 1
1 497 . 7 1 1 A 41 41 VAL N N 41 120.900 119.989 0.911 1
1 498 . 7 1 1 A 42 42 GLU H H 42 9.640 8.477 1.163 1
1 499 . 7 1 1 A 42 42 GLU HA H 42 3.880 3.925 -0.045 1
1 504 . 7 1 1 A 42 42 GLU C C 42 178.300 178.459 -0.159 1
1 505 . 7 1 1 A 42 42 GLU CA C 42 60.600 59.516 1.084 1
1 506 . 7 1 1 A 42 42 GLU CB C 42 28.300 29.397 -1.097 1
1 508 . 7 1 1 A 42 42 GLU N N 42 119.000 119.292 -0.292 1
1 509 . 7 1 1 A 43 43 ALA H H 43 6.870 7.734 -0.864 1
1 510 . 7 1 1 A 43 43 ALA HA H 43 4.290 4.072 0.218 1
1 514 . 7 1 1 A 43 43 ALA C C 43 180.700 179.790 0.910 1
1 515 . 7 1 1 A 43 43 ALA CA C 43 54.100 55.237 -1.137 1
1 516 . 7 1 1 A 43 43 ALA CB C 43 19.100 18.146 0.954 1
1 517 . 7 1 1 A 43 43 ALA N N 43 120.500 121.972 -1.472 1
1 518 . 7 1 1 A 44 44 ILE H H 44 7.970 7.676 0.294 1
1 519 . 7 1 1 A 44 44 ILE HA H 44 3.470 3.564 -0.094 1
1 529 . 7 1 1 A 44 44 ILE C C 44 178.300 177.692 0.608 1
1 530 . 7 1 1 A 44 44 ILE CA C 44 64.700 65.560 -0.860 1
1 531 . 7 1 1 A 44 44 ILE CB C 44 38.100 38.253 -0.153 1
1 535 . 7 1 1 A 44 44 ILE N N 44 120.500 118.747 1.753 1
1 536 . 7 1 1 A 45 45 ALA H H 45 8.460 8.596 -0.136 1
1 537 . 7 1 1 A 45 45 ALA HA H 45 3.720 4.054 -0.334 1
1 541 . 7 1 1 A 45 45 ALA C C 45 178.500 179.863 -1.363 1
1 542 . 7 1 1 A 45 45 ALA CA C 45 56.200 55.110 1.090 1
1 543 . 7 1 1 A 45 45 ALA CB C 45 17.400 18.145 -0.745 1
1 544 . 7 1 1 A 45 45 ALA N N 45 124.500 121.874 2.626 1
1 545 . 7 1 1 A 46 46 THR H H 46 8.080 7.816 0.264 1
1 546 . 7 1 1 A 46 46 THR HA H 46 3.900 3.845 0.055 1
1 551 . 7 1 1 A 46 46 THR C C 46 177.200 176.497 0.703 1
1 552 . 7 1 1 A 46 46 THR CA C 46 66.400 66.555 -0.155 1
1 553 . 7 1 1 A 46 46 THR CB C 46 68.800 68.702 0.098 1
1 555 . 7 1 1 A 46 46 THR N N 46 112.400 114.130 -1.730 1
1 556 . 7 1 1 A 47 47 ALA H H 47 7.930 8.176 -0.246 1
1 557 . 7 1 1 A 47 47 ALA HA H 47 4.200 4.088 0.112 1
1 561 . 7 1 1 A 47 47 ALA C C 47 179.200 179.806 -0.606 1
1 562 . 7 1 1 A 47 47 ALA CA C 47 54.800 55.175 -0.375 1
1 563 . 7 1 1 A 47 47 ALA CB C 47 19.800 18.220 1.580 1
1 564 . 7 1 1 A 47 47 ALA N N 47 121.400 123.877 -2.477 1
1 565 . 7 1 1 A 48 48 THR H H 48 7.560 7.619 -0.059 1
1 566 . 7 1 1 A 48 48 THR HA H 48 4.390 4.376 0.014 1
1 571 . 7 1 1 A 48 48 THR C C 48 175.700 176.053 -0.353 1
1 572 . 7 1 1 A 48 48 THR CA C 48 61.800 62.766 -0.966 1
1 573 . 7 1 1 A 48 48 THR CB C 48 71.000 70.388 0.612 1
1 575 . 7 1 1 A 48 48 THR N N 48 103.500 107.142 -3.642 1
1 576 . 7 1 1 A 49 49 GLY H H 49 7.820 8.598 -0.778 1
1 577 . 7 1 1 A 49 49 GLY HA2 H 49 3.870 3.907 -0.037 1
1 578 . 7 1 1 A 49 49 GLY HA3 H 49 4.100 3.908 0.192 1
1 579 . 7 1 1 A 49 49 GLY C C 49 174.400 173.649 0.751 1
1 580 . 7 1 1 A 49 49 GLY CA C 49 46.300 46.243 0.057 1
1 581 . 7 1 1 A 49 49 GLY N N 49 111.100 112.227 -1.127 1
1 582 . 7 1 1 A 50 50 MET H H 50 7.930 7.896 0.034 1
1 583 . 7 1 1 A 50 50 MET HA H 50 4.540 4.971 -0.431 1
1 591 . 7 1 1 A 50 50 MET C C 50 174.800 174.624 0.176 1
1 592 . 7 1 1 A 50 50 MET CA C 50 55.100 54.317 0.783 1
1 593 . 7 1 1 A 50 50 MET CB C 50 37.200 36.982 0.218 1
1 596 . 7 1 1 A 50 50 MET N N 50 119.300 118.462 0.838 1
1 597 . 7 1 1 A 51 51 ASN H H 51 8.040 8.788 -0.748 1
1 598 . 7 1 1 A 51 51 ASN HA H 51 4.580 4.749 -0.169 1
1 601 . 7 1 1 A 51 51 ASN C C 51 176.100 176.532 -0.432 1
1 602 . 7 1 1 A 51 51 ASN CA C 51 52.800 53.390 -0.590 1
1 603 . 7 1 1 A 51 51 ASN CB C 51 41.100 40.506 0.594 1
1 604 . 7 1 1 A 51 51 ASN N N 51 118.000 119.928 -1.928 1
1 605 . 7 1 1 A 52 52 LEU H H 52 8.560 8.831 -0.271 1
1 606 . 7 1 1 A 52 52 LEU HA H 52 3.760 3.924 -0.164 1
1 616 . 7 1 1 A 52 52 LEU C C 52 179.600 178.569 1.031 1
1 617 . 7 1 1 A 52 52 LEU CA C 52 59.000 57.893 1.107 1
1 618 . 7 1 1 A 52 52 LEU CB C 52 41.800 41.660 0.140 1
1 622 . 7 1 1 A 52 52 LEU N N 52 120.600 125.888 -5.288 1
1 623 . 7 1 1 A 53 53 THR H H 53 8.230 8.049 0.181 1
1 624 . 7 1 1 A 53 53 THR HA H 53 3.880 3.958 -0.078 1
1 629 . 7 1 1 A 53 53 THR C C 53 176.900 177.008 -0.108 1
1 630 . 7 1 1 A 53 53 THR CA C 53 66.500 65.856 0.644 1
1 631 . 7 1 1 A 53 53 THR CB C 53 68.400 68.202 0.198 1
1 633 . 7 1 1 A 53 53 THR N N 53 115.800 114.306 1.494 1
1 634 . 7 1 1 A 54 54 THR H H 54 8.420 7.932 0.488 1
1 635 . 7 1 1 A 54 54 THR HA H 54 3.880 3.832 0.048 1
1 640 . 7 1 1 A 54 54 THR C C 54 177.300 176.184 1.116 1
1 641 . 7 1 1 A 54 54 THR CA C 54 66.600 66.592 0.008 1
1 642 . 7 1 1 A 54 54 THR CB C 54 66.600 68.563 -1.963 1
1 644 . 7 1 1 A 54 54 THR N N 54 122.300 117.256 5.044 1
1 645 . 7 1 1 A 55 55 ALA H H 55 8.860 8.538 0.322 1
1 646 . 7 1 1 A 55 55 ALA HA H 55 4.020 3.915 0.105 1
1 650 . 7 1 1 A 55 55 ALA C C 55 179.000 178.867 0.133 1
1 651 . 7 1 1 A 55 55 ALA CA C 55 56.100 55.246 0.854 1
1 652 . 7 1 1 A 55 55 ALA CB C 55 17.000 17.891 -0.891 1
1 653 . 7 1 1 A 55 55 ALA N N 55 125.600 123.574 2.026 1
1 654 . 7 1 1 A 56 56 SER H H 56 8.440 8.286 0.154 1
1 655 . 7 1 1 A 56 56 SER HA H 56 3.920 3.875 0.045 1
1 658 . 7 1 1 A 56 56 SER C C 56 176.400 176.288 0.112 1
1 659 . 7 1 1 A 56 56 SER CA C 56 62.600 61.562 1.038 1
1 660 . 7 1 1 A 56 56 SER CB C 56 62.700 62.644 0.056 1
1 661 . 7 1 1 A 56 56 SER N N 56 112.700 112.769 -0.069 1
1 662 . 7 1 1 A 57 57 ALA H H 57 8.090 8.158 -0.068 1
1 663 . 7 1 1 A 57 57 ALA HA H 57 4.130 3.994 0.136 1
1 667 . 7 1 1 A 57 57 ALA C C 57 181.200 179.935 1.265 1
1 668 . 7 1 1 A 57 57 ALA CA C 57 55.200 55.202 -0.002 1
1 669 . 7 1 1 A 57 57 ALA CB C 57 17.900 18.445 -0.545 1
1 670 . 7 1 1 A 57 57 ALA N N 57 124.000 123.455 0.545 1
1 671 . 7 1 1 A 58 58 ASN H H 58 7.970 7.891 0.079 1
1 672 . 7 1 1 A 58 58 ASN HA H 58 4.480 4.461 0.019 1
1 677 . 7 1 1 A 58 58 ASN C C 58 177.500 178.328 -0.828 1
1 678 . 7 1 1 A 58 58 ASN CA C 58 56.900 56.526 0.374 1
1 679 . 7 1 1 A 58 58 ASN CB C 58 39.800 37.734 2.066 1
1 680 . 7 1 1 A 58 58 ASN N N 58 117.600 117.497 0.103 1
1 682 . 7 1 1 A 59 59 LEU H H 59 8.530 8.424 0.106 1
1 683 . 7 1 1 A 59 59 LEU HA H 59 3.710 3.857 -0.147 1
1 693 . 7 1 1 A 59 59 LEU C C 59 178.400 179.471 -1.071 1
1 694 . 7 1 1 A 59 59 LEU CA C 59 58.600 57.597 1.003 1
1 695 . 7 1 1 A 59 59 LEU CB C 59 40.500 40.443 0.057 1
1 699 . 7 1 1 A 59 59 LEU N N 59 122.600 121.272 1.328 1
1 700 . 7 1 1 A 60 60 GLN H H 60 8.200 8.267 -0.067 1
1 701 . 7 1 1 A 60 60 GLN HA H 60 4.020 4.158 -0.138 1
1 708 . 7 1 1 A 60 60 GLN C C 60 178.700 178.731 -0.031 1
1 709 . 7 1 1 A 60 60 GLN CA C 60 58.800 58.788 0.012 1
1 710 . 7 1 1 A 60 60 GLN CB C 60 27.700 28.422 -0.722 1
1 712 . 7 1 1 A 60 60 GLN N N 60 118.900 118.114 0.786 1
1 714 . 7 1 1 A 61 61 ALA H H 61 7.580 7.549 0.031 1
1 715 . 7 1 1 A 61 61 ALA HA H 61 4.230 4.080 0.150 1
1 719 . 7 1 1 A 61 61 ALA C C 61 181.300 180.105 1.195 1
1 720 . 7 1 1 A 61 61 ALA CA C 61 55.100 55.067 0.033 1
1 721 . 7 1 1 A 61 61 ALA CB C 61 17.600 18.306 -0.706 1
1 722 . 7 1 1 A 61 61 ALA N N 61 122.200 122.732 -0.532 1
1 723 . 7 1 1 A 62 62 LEU H H 62 7.830 8.181 -0.351 1
1 724 . 7 1 1 A 62 62 LEU HA H 62 3.980 3.944 0.036 1
1 734 . 7 1 1 A 62 62 LEU C C 62 178.500 179.337 -0.837 1
1 735 . 7 1 1 A 62 62 LEU CA C 62 58.100 58.042 0.058 1
1 736 . 7 1 1 A 62 62 LEU CB C 62 43.300 41.323 1.977 1
1 739 . 7 1 1 A 62 62 LEU N N 62 119.000 118.677 0.323 1
1 740 . 7 1 1 A 63 63 LYS H H 63 8.580 8.184 0.396 1
1 741 . 7 1 1 A 63 63 LYS HA H 63 4.130 4.191 -0.061 1
1 750 . 7 1 1 A 63 63 LYS C C 63 180.500 179.292 1.208 1
1 751 . 7 1 1 A 63 63 LYS CA C 63 59.700 58.807 0.893 1
1 752 . 7 1 1 A 63 63 LYS CB C 63 32.600 32.013 0.587 1
1 756 . 7 1 1 A 63 63 LYS N N 63 123.400 120.576 2.824 1
1 757 . 7 1 1 A 64 64 SER H H 64 8.640 8.359 0.281 1
1 758 . 7 1 1 A 64 64 SER HA H 64 4.300 4.332 -0.032 1
1 761 . 7 1 1 A 64 64 SER C C 64 175.000 176.891 -1.891 1
1 762 . 7 1 1 A 64 64 SER CA C 64 61.400 62.328 -0.928 1
1 763 . 7 1 1 A 64 64 SER CB C 64 63.000 62.843 0.157 1
1 764 . 7 1 1 A 64 64 SER N N 64 117.700 117.693 0.007 1
1 765 . 7 1 1 A 65 65 GLY H H 65 7.280 7.747 -0.467 1
1 766 . 7 1 1 A 65 65 GLY HA2 H 65 3.240 3.937 -0.697 1
1 767 . 7 1 1 A 65 65 GLY HA3 H 65 3.980 3.937 0.043 1
1 768 . 7 1 1 A 65 65 GLY C C 65 171.300 174.712 -3.412 1
1 769 . 7 1 1 A 65 65 GLY CA C 65 45.100 45.513 -0.413 1
1 770 . 7 1 1 A 65 65 GLY N N 65 104.400 108.742 -4.342 1
1 771 . 7 1 1 A 66 66 GLY H H 66 7.730 7.490 0.240 1
1 772 . 7 1 1 A 66 66 GLY HA2 H 66 3.650 4.022 -0.372 1
1 773 . 7 1 1 A 66 66 GLY HA3 H 66 3.750 4.024 -0.274 1
1 774 . 7 1 1 A 66 66 GLY C C 66 173.700 175.147 -1.447 1
1 775 . 7 1 1 A 66 66 GLY CA C 66 45.400 45.757 -0.357 1
1 776 . 7 1 1 A 66 66 GLY N N 66 104.700 108.219 -3.519 1
1 777 . 7 1 1 A 67 67 LEU H H 67 7.520 8.270 -0.750 1
1 778 . 7 1 1 A 67 67 LEU HA H 67 4.310 4.200 0.110 1
1 788 . 7 1 1 A 67 67 LEU C C 67 177.700 176.919 0.781 1
1 789 . 7 1 1 A 67 67 LEU CA C 67 55.500 56.115 -0.615 1
1 790 . 7 1 1 A 67 67 LEU CB C 67 42.400 42.434 -0.034 1
1 794 . 7 1 1 A 67 67 LEU N N 67 110.600 118.818 -8.218 1
1 795 . 7 1 1 A 68 68 VAL H H 68 6.890 7.371 -0.481 1
1 796 . 7 1 1 A 68 68 VAL HA H 68 5.190 5.017 0.173 1
1 804 . 7 1 1 A 68 68 VAL C C 68 173.700 174.699 -0.999 1
1 805 . 7 1 1 A 68 68 VAL CA C 68 57.400 58.528 -1.128 1
1 806 . 7 1 1 A 68 68 VAL CB C 68 36.400 35.666 0.734 1
1 809 . 7 1 1 A 68 68 VAL N N 68 106.400 110.850 -4.450 1
1 810 . 7 1 1 A 69 69 GLU H H 69 8.880 8.986 -0.106 1
1 811 . 7 1 1 A 69 69 GLU HA H 69 4.660 4.895 -0.235 1
1 816 . 7 1 1 A 69 69 GLU C C 69 173.300 175.115 -1.815 1
1 817 . 7 1 1 A 69 69 GLU CA C 69 54.300 54.715 -0.415 1
1 818 . 7 1 1 A 69 69 GLU CB C 69 34.100 33.535 0.565 1
1 820 . 7 1 1 A 69 69 GLU N N 69 120.400 120.840 -0.440 1
1 821 . 7 1 1 A 70 70 ALA H H 70 8.730 8.792 -0.062 1
1 822 . 7 1 1 A 70 70 ALA HA H 70 4.990 5.038 -0.048 1
1 826 . 7 1 1 A 70 70 ALA C C 70 176.500 175.573 0.927 1
1 827 . 7 1 1 A 70 70 ALA CA C 70 50.000 49.908 0.092 1
1 828 . 7 1 1 A 70 70 ALA CB C 70 22.300 22.731 -0.431 1
1 829 . 7 1 1 A 70 70 ALA N N 70 122.800 121.873 0.927 1
1 830 . 7 1 1 A 71 71 ARG H H 71 8.670 8.953 -0.283 1
1 831 . 7 1 1 A 71 71 ARG HA H 71 4.630 4.931 -0.301 1
1 843 . 7 1 1 A 71 71 ARG C C 71 173.500 175.190 -1.690 1
1 844 . 7 1 1 A 71 71 ARG CA C 71 54.600 54.185 0.415 1
1 845 . 7 1 1 A 71 71 ARG CB C 71 33.600 32.311 1.289 1
1 849 . 7 1 1 A 71 71 ARG N N 71 120.100 120.093 0.007 1
1 851 . 7 1 1 A 72 72 ARG H H 72 8.780 8.700 0.080 1
1 852 . 7 1 1 A 72 72 ARG HA H 72 5.100 4.627 0.473 1
1 859 . 7 1 1 A 72 72 ARG C C 72 176.000 175.055 0.945 1
1 860 . 7 1 1 A 72 72 ARG CA C 72 54.900 55.883 -0.983 1
1 861 . 7 1 1 A 72 72 ARG CB C 72 32.500 30.243 2.257 1
1 864 . 7 1 1 A 72 72 ARG N N 72 123.600 124.072 -0.472 1
1 865 . 7 1 1 A 73 73 GLU H H 73 8.720 8.763 -0.043 1
1 866 . 7 1 1 A 73 73 GLU HA H 73 4.510 4.686 -0.176 1
1 871 . 7 1 1 A 73 73 GLU C C 73 175.900 176.560 -0.660 1
1 872 . 7 1 1 A 73 73 GLU CA C 73 55.700 55.243 0.457 1
1 873 . 7 1 1 A 73 73 GLU CB C 73 31.800 30.370 1.430 1
1 875 . 7 1 1 A 73 73 GLU N N 73 126.800 124.266 2.534 1
1 876 . 7 1 1 A 74 74 GLY H H 74 9.190 8.867 0.323 1
1 877 . 7 1 1 A 74 74 GLY HA2 H 74 3.700 3.887 -0.187 1
1 878 . 7 1 1 A 74 74 GLY HA3 H 74 4.170 3.898 0.272 1
1 879 . 7 1 1 A 74 74 GLY C C 74 175.400 175.000 0.400 1
1 880 . 7 1 1 A 74 74 GLY CA C 74 47.100 47.166 -0.066 1
1 881 . 7 1 1 A 74 74 GLY N N 74 118.500 116.550 1.950 1
1 882 . 7 1 1 A 75 75 THR H H 75 8.780 8.794 -0.014 1
1 883 . 7 1 1 A 75 75 THR HA H 75 4.290 4.370 -0.080 1
1 888 . 7 1 1 A 75 75 THR C C 75 174.600 174.254 0.346 1
1 889 . 7 1 1 A 75 75 THR CA C 75 62.000 63.344 -1.344 1
1 890 . 7 1 1 A 75 75 THR CB C 75 69.000 69.484 -0.484 1
1 892 . 7 1 1 A 75 75 THR N N 75 118.000 120.144 -2.144 1
1 893 . 7 1 1 A 76 76 ARG H H 76 8.030 7.453 0.577 1
1 894 . 7 1 1 A 76 76 ARG HA H 76 4.610 5.050 -0.440 1
1 901 . 7 1 1 A 76 76 ARG C C 76 174.800 174.677 0.123 1
1 902 . 7 1 1 A 76 76 ARG CA C 76 55.500 54.471 1.029 1
1 903 . 7 1 1 A 76 76 ARG CB C 76 32.700 33.150 -0.450 1
1 906 . 7 1 1 A 76 76 ARG N N 76 122.600 117.721 4.879 1
1 907 . 7 1 1 A 77 77 GLN H H 77 8.580 8.602 -0.022 1
1 908 . 7 1 1 A 77 77 GLN HA H 77 4.910 5.181 -0.271 1
1 915 . 7 1 1 A 77 77 GLN C C 77 173.900 174.544 -0.644 1
1 916 . 7 1 1 A 77 77 GLN CA C 77 54.700 54.441 0.259 1
1 917 . 7 1 1 A 77 77 GLN CB C 77 31.800 31.046 0.754 1
1 919 . 7 1 1 A 77 77 GLN N N 77 121.900 121.117 0.783 1
1 921 . 7 1 1 A 78 78 TYR H H 78 8.890 9.195 -0.305 1
1 922 . 7 1 1 A 78 78 TYR HA H 78 4.750 5.380 -0.630 1
1 929 . 7 1 1 A 78 78 TYR C C 78 175.600 174.537 1.063 1
1 930 . 7 1 1 A 78 78 TYR CA C 78 57.000 56.042 0.958 1
1 931 . 7 1 1 A 78 78 TYR CB C 78 41.400 40.839 0.561 1
1 936 . 7 1 1 A 78 78 TYR N N 78 121.800 122.725 -0.925 1
1 937 . 7 1 1 A 79 79 TYR H H 79 9.010 9.452 -0.442 1
1 938 . 7 1 1 A 79 79 TYR HA H 79 5.410 5.398 0.012 1
1 945 . 7 1 1 A 79 79 TYR C C 79 173.100 175.117 -2.017 1
1 946 . 7 1 1 A 79 79 TYR CA C 79 57.300 56.473 0.827 1
1 947 . 7 1 1 A 79 79 TYR CB C 79 43.300 41.681 1.619 1
1 952 . 7 1 1 A 79 79 TYR N N 79 122.500 121.290 1.210 1
1 953 . 7 1 1 A 80 80 ARG H H 80 8.720 9.204 -0.484 1
1 954 . 7 1 1 A 80 80 ARG HA H 80 5.120 5.059 0.061 1
1 962 . 7 1 1 A 80 80 ARG C C 80 175.500 174.898 0.602 1
1 963 . 7 1 1 A 80 80 ARG CA C 80 53.200 54.136 -0.936 1
1 964 . 7 1 1 A 80 80 ARG CB C 80 33.900 34.059 -0.159 1
1 967 . 7 1 1 A 80 80 ARG N N 80 114.500 120.563 -6.063 1
1 969 . 7 1 1 A 81 81 ILE H H 81 9.300 8.709 0.591 1
1 970 . 7 1 1 A 81 81 ILE HA H 81 4.150 4.206 -0.056 1
1 980 . 7 1 1 A 81 81 ILE C C 81 177.800 177.446 0.354 1
1 981 . 7 1 1 A 81 81 ILE CA C 81 62.300 61.957 0.343 1
1 982 . 7 1 1 A 81 81 ILE CB C 81 37.800 37.917 -0.117 1
1 986 . 7 1 1 A 81 81 ILE N N 81 122.100 121.665 0.435 1
1 987 . 7 1 1 A 82 82 ALA H H 82 7.930 8.651 -0.721 1
1 988 . 7 1 1 A 82 82 ALA HA H 82 3.930 4.053 -0.123 1
1 992 . 7 1 1 A 82 82 ALA C C 82 176.300 177.353 -1.053 1
1 993 . 7 1 1 A 82 82 ALA CA C 82 54.200 54.236 -0.036 1
1 994 . 7 1 1 A 82 82 ALA CB C 82 18.500 19.550 -1.050 1
1 995 . 7 1 1 A 82 82 ALA N N 82 127.200 126.878 0.322 1
1 996 . 7 1 1 A 83 83 GLY H H 83 6.980 7.238 -0.258 1
1 997 . 7 1 1 A 83 83 GLY HA2 H 83 4.090 4.057 0.033 1
1 998 . 7 1 1 A 83 83 GLY HA3 H 83 4.440 4.058 0.382 1
1 999 . 7 1 1 A 83 83 GLY C C 83 173.600 174.186 -0.586 1
1 1000 . 7 1 1 A 83 83 GLY CA C 83 45.200 45.724 -0.524 1
1 1001 . 7 1 1 A 83 83 GLY N N 83 101.800 103.403 -1.603 1
1 1002 . 7 1 1 A 84 84 GLU H H 84 8.930 8.841 0.089 1
1 1003 . 7 1 1 A 84 84 GLU HA H 84 4.120 4.179 -0.059 1
1 1008 . 7 1 1 A 84 84 GLU C C 84 178.300 178.779 -0.479 1
1 1009 . 7 1 1 A 84 84 GLU CA C 84 58.900 58.702 0.198 1
1 1010 . 7 1 1 A 84 84 GLU CB C 84 29.400 29.049 0.351 1
1 1012 . 7 1 1 A 84 84 GLU N N 84 120.300 118.525 1.775 1
1 1013 . 7 1 1 A 85 85 ASP H H 85 8.950 8.493 0.457 1
1 1014 . 7 1 1 A 85 85 ASP HA H 85 4.310 4.395 -0.085 1
1 1017 . 7 1 1 A 85 85 ASP C C 85 178.000 178.865 -0.865 1
1 1018 . 7 1 1 A 85 85 ASP CA C 85 57.100 56.984 0.116 1
1 1019 . 7 1 1 A 85 85 ASP CB C 85 38.900 40.103 -1.203 1
1 1020 . 7 1 1 A 85 85 ASP N N 85 119.400 120.335 -0.935 1
1 1021 . 7 1 1 A 86 86 VAL H H 86 7.620 8.061 -0.441 1
1 1022 . 7 1 1 A 86 86 VAL HA H 86 3.480 3.569 -0.089 1
1 1030 . 7 1 1 A 86 86 VAL C C 86 177.400 177.871 -0.471 1
1 1031 . 7 1 1 A 86 86 VAL CA C 86 66.800 66.346 0.454 1
1 1032 . 7 1 1 A 86 86 VAL CB C 86 31.300 31.563 -0.263 1
1 1035 . 7 1 1 A 86 86 VAL N N 86 121.600 120.594 1.006 1
1 1036 . 7 1 1 A 87 87 ALA H H 87 7.520 8.403 -0.883 1
1 1037 . 7 1 1 A 87 87 ALA HA H 87 4.110 4.024 0.086 1
1 1041 . 7 1 1 A 87 87 ALA C C 87 181.200 179.640 1.560 1
1 1042 . 7 1 1 A 87 87 ALA CA C 87 55.800 55.762 0.038 1
1 1043 . 7 1 1 A 87 87 ALA CB C 87 17.600 18.621 -1.021 1
1 1044 . 7 1 1 A 87 87 ALA N N 87 122.700 121.761 0.939 1
1 1045 . 7 1 1 A 88 88 ARG H H 88 8.380 8.209 0.171 1
1 1046 . 7 1 1 A 88 88 ARG HA H 88 4.090 4.219 -0.129 1
1 1054 . 7 1 1 A 88 88 ARG C C 88 179.100 178.623 0.477 1
1 1055 . 7 1 1 A 88 88 ARG CA C 88 59.600 57.627 1.973 1
1 1056 . 7 1 1 A 88 88 ARG CB C 88 30.500 30.578 -0.078 1
1 1059 . 7 1 1 A 88 88 ARG N N 88 119.200 117.917 1.283 1
1 1061 . 7 1 1 A 89 89 LEU H H 89 8.480 7.790 0.690 1
1 1062 . 7 1 1 A 89 89 LEU HA H 89 4.040 4.056 -0.016 1
1 1071 . 7 1 1 A 89 89 LEU C C 89 177.200 178.487 -1.287 1
1 1072 . 7 1 1 A 89 89 LEU CA C 89 58.300 57.847 0.453 1
1 1073 . 7 1 1 A 89 89 LEU CB C 89 41.300 41.843 -0.543 1
1 1076 . 7 1 1 A 89 89 LEU N N 89 123.300 122.481 0.819 1
1 1077 . 7 1 1 A 90 90 PHE H H 90 8.890 8.379 0.511 1
1 1078 . 7 1 1 A 90 90 PHE HA H 90 4.380 3.988 0.392 1
1 1086 . 7 1 1 A 90 90 PHE C C 90 177.500 178.045 -0.545 1
1 1087 . 7 1 1 A 90 90 PHE CA C 90 59.400 62.326 -2.926 1
1 1088 . 7 1 1 A 90 90 PHE CB C 90 38.600 38.790 -0.190 1
1 1094 . 7 1 1 A 90 90 PHE N N 90 119.400 119.374 0.026 1
1 1095 . 7 1 1 A 91 91 ALA H H 91 7.920 8.201 -0.281 1
1 1096 . 7 1 1 A 91 91 ALA HA H 91 3.940 3.941 -0.001 1
1 1100 . 7 1 1 A 91 91 ALA C C 91 180.200 179.786 0.414 1
1 1101 . 7 1 1 A 91 91 ALA CA C 91 55.100 55.099 0.001 1
1 1102 . 7 1 1 A 91 91 ALA CB C 91 18.000 17.780 0.220 1
1 1103 . 7 1 1 A 91 91 ALA N N 91 120.500 121.332 -0.832 1
1 1104 . 7 1 1 A 92 92 LEU H H 92 8.190 8.252 -0.062 1
1 1105 . 7 1 1 A 92 92 LEU HA H 92 4.300 4.012 0.288 1
1 1115 . 7 1 1 A 92 92 LEU C C 92 178.900 178.154 0.746 1
1 1116 . 7 1 1 A 92 92 LEU CA C 92 57.500 58.005 -0.505 1
1 1117 . 7 1 1 A 92 92 LEU CB C 92 42.100 41.669 0.431 1
1 1121 . 7 1 1 A 92 92 LEU N N 92 120.200 119.724 0.476 1
1 1122 . 7 1 1 A 93 93 VAL H H 93 8.890 8.012 0.878 1
1 1123 . 7 1 1 A 93 93 VAL HA H 93 3.810 3.724 0.086 1
1 1131 . 7 1 1 A 93 93 VAL C C 93 176.900 177.320 -0.420 1
1 1132 . 7 1 1 A 93 93 VAL CA C 93 66.000 64.811 1.189 1
1 1133 . 7 1 1 A 93 93 VAL CB C 93 31.200 31.427 -0.227 1
1 1136 . 7 1 1 A 93 93 VAL N N 93 117.100 118.423 -1.323 1
1 1137 . 7 1 1 A 94 94 GLN H H 94 6.920 7.571 -0.651 1
1 1138 . 7 1 1 A 94 94 GLN HA H 94 3.790 3.726 0.064 1
1 1145 . 7 1 1 A 94 94 GLN C C 94 177.400 178.229 -0.829 1
1 1146 . 7 1 1 A 94 94 GLN CA C 94 60.000 58.682 1.318 1
1 1147 . 7 1 1 A 94 94 GLN CB C 94 30.300 28.015 2.285 1
1 1149 . 7 1 1 A 94 94 GLN N N 94 117.800 120.666 -2.866 1
1 1151 . 7 1 1 A 95 95 VAL H H 95 7.420 7.697 -0.277 1
1 1152 . 7 1 1 A 95 95 VAL HA H 95 3.760 3.494 0.266 1
1 1160 . 7 1 1 A 95 95 VAL C C 95 178.300 177.856 0.444 1
1 1161 . 7 1 1 A 95 95 VAL CA C 95 66.600 66.280 0.320 1
1 1162 . 7 1 1 A 95 95 VAL CB C 95 31.900 31.417 0.483 1
1 1165 . 7 1 1 A 95 95 VAL N N 95 121.500 119.770 1.730 1
1 1166 . 7 1 1 A 96 96 VAL H H 96 8.340 8.056 0.284 1
1 1167 . 7 1 1 A 96 96 VAL HA H 96 3.810 3.051 0.759 1
1 1175 . 7 1 1 A 96 96 VAL C C 96 178.400 178.090 0.310 1
1 1176 . 7 1 1 A 96 96 VAL CA C 96 66.100 66.223 -0.123 1
1 1177 . 7 1 1 A 96 96 VAL CB C 96 32.200 31.362 0.838 1
1 1180 . 7 1 1 A 96 96 VAL N N 96 120.000 119.605 0.395 1
1 1181 . 7 1 1 A 97 97 ALA H H 97 8.140 7.892 0.248 1
1 1182 . 7 1 1 A 97 97 ALA HA H 97 4.010 3.951 0.059 1
1 1186 . 7 1 1 A 97 97 ALA C C 97 178.800 178.842 -0.042 1
1 1187 . 7 1 1 A 97 97 ALA CA C 97 54.900 55.252 -0.352 1
1 1188 . 7 1 1 A 97 97 ALA CB C 97 19.900 18.671 1.229 1
1 1189 . 7 1 1 A 97 97 ALA N N 97 121.400 121.902 -0.502 1
1 1190 . 7 1 1 A 98 98 ASP H H 98 8.170 8.531 -0.361 1
1 1191 . 7 1 1 A 98 98 ASP HA H 98 4.320 4.300 0.020 1
1 1194 . 7 1 1 A 98 98 ASP C C 98 178.100 178.885 -0.785 1
1 1195 . 7 1 1 A 98 98 ASP CA C 98 57.100 57.800 -0.700 1
1 1196 . 7 1 1 A 98 98 ASP CB C 98 41.800 42.162 -0.362 1
1 1197 . 7 1 1 A 98 98 ASP N N 98 118.500 118.443 0.057 1
1 1198 . 7 1 1 A 99 99 GLU H H 99 8.220 8.010 0.210 1
1 1199 . 7 1 1 A 99 99 GLU HA H 99 4.000 4.079 -0.079 1
1 1204 . 7 1 1 A 99 99 GLU C C 99 178.300 179.240 -0.940 1
1 1205 . 7 1 1 A 99 99 GLU CA C 99 58.300 59.327 -1.027 1
1 1206 . 7 1 1 A 99 99 GLU CB C 99 29.800 29.460 0.340 1
1 1208 . 7 1 1 A 99 99 GLU N N 99 116.600 119.471 -2.871 1
1 1209 . 7 1 1 A 100 100 HIS H H 100 7.980 7.367 0.613 1
1 1210 . 7 1 1 A 100 100 HIS HA H 100 4.600 4.360 0.240 1
1 1214 . 7 1 1 A 100 100 HIS C C 100 175.900 176.907 -1.007 1
1 1215 . 7 1 1 A 100 100 HIS CA C 100 57.500 58.773 -1.273 1
1 1216 . 7 1 1 A 100 100 HIS CB C 100 30.800 29.450 1.350 1
1 1218 . 7 1 1 A 100 100 HIS N N 100 114.000 117.979 -3.979 1
1 1219 . 7 1 1 A 101 101 LEU H H 101 7.920 7.935 -0.015 1
1 1220 . 7 1 1 A 101 101 LEU HA H 101 4.370 4.226 0.144 1
1 1230 . 7 1 1 A 101 101 LEU C C 101 177.700 177.022 0.678 1
1 1231 . 7 1 1 A 101 101 LEU CA C 101 55.900 56.492 -0.592 1
1 1232 . 7 1 1 A 101 101 LEU CB C 101 42.100 42.345 -0.245 1
1 1236 . 7 1 1 A 101 101 LEU N N 101 118.500 121.278 -2.778 1
1 1237 . 7 1 1 A 102 102 GLU H H 102 8.100 7.890 0.210 1
1 1238 . 7 1 1 A 102 102 GLU HA H 102 4.160 4.231 -0.071 1
1 1243 . 7 1 1 A 102 102 GLU C C 102 176.700 176.666 0.034 1
1 1244 . 7 1 1 A 102 102 GLU CA C 102 57.000 56.315 0.685 1
1 1245 . 7 1 1 A 102 102 GLU CB C 102 29.900 30.883 -0.983 1
1 1247 . 7 1 1 A 102 102 GLU N N 102 119.100 119.212 -0.112 1
1 1248 . 7 1 1 A 103 103 HIS H H 103 8.010 8.710 -0.700 1
1 1249 . 7 1 1 A 103 103 HIS HA H 103 4.520 4.663 -0.143 1
1 1252 . 7 1 1 A 103 103 HIS CA C 103 56.100 56.127 -0.027 1
1 1253 . 7 1 1 A 103 103 HIS CB C 103 29.700 29.425 0.275 1
1 1254 . 7 1 1 A 103 103 HIS N N 103 117.300 119.342 -2.042 1
1 1255 . 7 1 1 A 107 107 HIS HA H 107 4.560 4.785 -0.225 1
1 1258 . 7 1 1 A 107 107 HIS C C 107 173.900 174.187 -0.287 1
1 1259 . 7 1 1 A 107 107 HIS CA C 107 55.900 55.237 0.663 1
1 1260 . 7 1 1 A 107 107 HIS CB C 107 30.200 29.550 0.650 1
1 4 . 8 1 1 A 2 2 ALA H H 2 8.450 8.929 -0.479 1
1 5 . 8 1 1 A 2 2 ALA HA H 2 4.390 3.943 0.447 1
1 9 . 8 1 1 A 2 2 ALA C C 2 178.300 176.849 1.451 1
1 10 . 8 1 1 A 2 2 ALA CA C 2 52.500 54.842 -2.342 1
1 11 . 8 1 1 A 2 2 ALA CB C 2 19.200 17.840 1.360 1
1 12 . 8 1 1 A 2 2 ALA N N 2 125.100 127.041 -1.941 1
1 13 . 8 1 1 A 3 3 GLY H H 3 8.450 8.858 -0.408 1
1 14 . 8 1 1 A 3 3 GLY HA2 H 3 4.030 4.047 -0.017 1
1 15 . 8 1 1 A 3 3 GLY HA3 H 3 4.030 4.047 -0.017 1
1 16 . 8 1 1 A 3 3 GLY C C 3 174.100 173.453 0.647 1
1 17 . 8 1 1 A 3 3 GLY CA C 3 45.200 44.490 0.710 1
1 18 . 8 1 1 A 3 3 GLY N N 3 108.000 104.002 3.998 1
1 19 . 8 1 1 A 4 4 GLN H H 4 8.550 8.401 0.149 1
1 20 . 8 1 1 A 4 4 GLN HA H 4 4.340 4.311 0.029 1
1 27 . 8 1 1 A 4 4 GLN C C 4 176.700 175.255 1.445 1
1 28 . 8 1 1 A 4 4 GLN CA C 4 56.600 56.031 0.569 1
1 29 . 8 1 1 A 4 4 GLN CB C 4 29.300 28.884 0.416 1
1 31 . 8 1 1 A 4 4 GLN N N 4 120.500 121.131 -0.631 1
1 33 . 8 1 1 A 5 5 SER H H 5 8.540 8.668 -0.128 1
1 34 . 8 1 1 A 5 5 SER HA H 5 4.390 4.394 -0.004 1
1 38 . 8 1 1 A 5 5 SER C C 5 174.800 173.882 0.918 1
1 39 . 8 1 1 A 5 5 SER CA C 5 59.100 60.381 -1.281 1
1 40 . 8 1 1 A 5 5 SER CB C 5 63.500 63.369 0.131 1
1 41 . 8 1 1 A 5 5 SER N N 5 117.100 122.278 -5.178 1
1 42 . 8 1 1 A 6 6 ASP H H 6 8.300 8.983 -0.683 1
1 43 . 8 1 1 A 6 6 ASP HA H 6 4.540 4.491 0.049 1
1 46 . 8 1 1 A 6 6 ASP C C 6 177.300 178.021 -0.721 1
1 47 . 8 1 1 A 6 6 ASP CA C 6 55.100 56.151 -1.051 1
1 48 . 8 1 1 A 6 6 ASP CB C 6 40.800 40.408 0.392 1
1 49 . 8 1 1 A 6 6 ASP N N 6 122.700 126.593 -3.893 1
1 50 . 8 1 1 A 7 7 ARG H H 7 8.270 7.973 0.297 1
1 51 . 8 1 1 A 7 7 ARG HA H 7 4.150 4.031 0.119 1
1 58 . 8 1 1 A 7 7 ARG C C 7 177.600 178.494 -0.894 1
1 59 . 8 1 1 A 7 7 ARG CA C 7 58.000 58.916 -0.916 1
1 60 . 8 1 1 A 7 7 ARG CB C 7 30.100 29.703 0.397 1
1 63 . 8 1 1 A 7 7 ARG N N 7 122.100 120.828 1.272 1
1 64 . 8 1 1 A 8 8 LYS H H 8 8.130 8.078 0.052 1
1 65 . 8 1 1 A 8 8 LYS HA H 8 4.090 4.070 0.020 1
1 74 . 8 1 1 A 8 8 LYS C C 8 177.600 179.136 -1.536 1
1 75 . 8 1 1 A 8 8 LYS CA C 8 58.400 58.523 -0.123 1
1 76 . 8 1 1 A 8 8 LYS CB C 8 31.700 32.098 -0.398 1
1 80 . 8 1 1 A 8 8 LYS N N 8 120.900 119.222 1.678 1
1 81 . 8 1 1 A 9 9 ALA H H 9 8.050 8.157 -0.107 1
1 82 . 8 1 1 A 9 9 ALA HA H 9 3.950 4.054 -0.104 1
1 86 . 8 1 1 A 9 9 ALA C C 9 179.800 180.178 -0.378 1
1 87 . 8 1 1 A 9 9 ALA CA C 9 55.100 54.858 0.242 1
1 88 . 8 1 1 A 9 9 ALA CB C 9 18.100 18.183 -0.083 1
1 89 . 8 1 1 A 9 9 ALA N N 9 121.600 121.471 0.129 1
1 90 . 8 1 1 A 10 10 ALA H H 10 7.910 7.620 0.290 1
1 91 . 8 1 1 A 10 10 ALA HA H 10 4.200 4.086 0.114 1
1 95 . 8 1 1 A 10 10 ALA C C 10 180.500 180.162 0.338 1
1 96 . 8 1 1 A 10 10 ALA CA C 10 54.600 55.102 -0.502 1
1 97 . 8 1 1 A 10 10 ALA CB C 10 18.100 18.416 -0.316 1
1 98 . 8 1 1 A 10 10 ALA N N 10 120.200 120.388 -0.188 1
1 99 . 8 1 1 A 11 11 LEU H H 11 8.080 8.091 -0.011 1
1 100 . 8 1 1 A 11 11 LEU HA H 11 4.120 3.991 0.129 1
1 110 . 8 1 1 A 11 11 LEU C C 11 179.600 179.379 0.221 1
1 111 . 8 1 1 A 11 11 LEU CA C 11 57.800 57.687 0.113 1
1 112 . 8 1 1 A 11 11 LEU CB C 11 41.700 41.787 -0.087 1
1 115 . 8 1 1 A 11 11 LEU N N 11 120.900 119.355 1.545 1
1 116 . 8 1 1 A 12 12 LEU H H 12 8.480 8.295 0.185 1
1 117 . 8 1 1 A 12 12 LEU HA H 12 4.040 4.035 0.005 1
1 127 . 8 1 1 A 12 12 LEU C C 12 178.900 179.641 -0.741 1
1 128 . 8 1 1 A 12 12 LEU CA C 12 58.100 57.448 0.652 1
1 129 . 8 1 1 A 12 12 LEU CB C 12 40.100 40.695 -0.595 1
1 133 . 8 1 1 A 12 12 LEU N N 12 118.700 118.596 0.104 1
1 134 . 8 1 1 A 13 13 ASP H H 13 7.990 8.295 -0.305 1
1 135 . 8 1 1 A 13 13 ASP HA H 13 4.420 4.356 0.064 1
1 138 . 8 1 1 A 13 13 ASP C C 13 178.900 178.651 0.249 1
1 139 . 8 1 1 A 13 13 ASP CA C 13 57.500 57.435 0.065 1
1 140 . 8 1 1 A 13 13 ASP CB C 13 40.500 40.286 0.214 1
1 141 . 8 1 1 A 13 13 ASP N N 13 119.500 120.884 -1.384 1
1 142 . 8 1 1 A 14 14 GLN H H 14 7.620 7.925 -0.305 1
1 143 . 8 1 1 A 14 14 GLN HA H 14 4.230 4.087 0.143 1
1 150 . 8 1 1 A 14 14 GLN C C 14 178.400 177.921 0.479 1
1 151 . 8 1 1 A 14 14 GLN CA C 14 58.100 58.669 -0.569 1
1 152 . 8 1 1 A 14 14 GLN CB C 14 27.800 27.868 -0.068 1
1 154 . 8 1 1 A 14 14 GLN N N 14 118.900 117.813 1.087 1
1 156 . 8 1 1 A 15 15 VAL H H 15 8.480 7.960 0.520 1
1 157 . 8 1 1 A 15 15 VAL HA H 15 3.380 3.944 -0.564 1
1 165 . 8 1 1 A 15 15 VAL C C 15 177.600 178.021 -0.421 1
1 166 . 8 1 1 A 15 15 VAL CA C 15 66.600 63.882 2.718 1
1 167 . 8 1 1 A 15 15 VAL CB C 15 30.500 31.463 -0.963 1
1 170 . 8 1 1 A 15 15 VAL N N 15 121.300 116.585 4.715 1
1 171 . 8 1 1 A 16 16 ALA H H 16 8.080 7.891 0.189 1
1 172 . 8 1 1 A 16 16 ALA HA H 16 4.450 3.980 0.470 1
1 176 . 8 1 1 A 16 16 ALA C C 16 179.100 179.504 -0.404 1
1 177 . 8 1 1 A 16 16 ALA CA C 16 54.600 55.270 -0.670 1
1 178 . 8 1 1 A 16 16 ALA CB C 16 17.700 18.227 -0.527 1
1 179 . 8 1 1 A 16 16 ALA N N 16 121.400 124.159 -2.759 1
1 180 . 8 1 1 A 17 17 ARG H H 17 7.480 7.671 -0.191 1
1 181 . 8 1 1 A 17 17 ARG HA H 17 3.910 4.091 -0.181 1
1 187 . 8 1 1 A 17 17 ARG C C 17 179.700 178.711 0.989 1
1 188 . 8 1 1 A 17 17 ARG CA C 17 59.700 58.988 0.712 1
1 189 . 8 1 1 A 17 17 ARG CB C 17 30.400 29.860 0.540 1
1 191 . 8 1 1 A 17 17 ARG N N 17 116.900 119.054 -2.154 1
1 192 . 8 1 1 A 18 18 VAL H H 18 7.960 7.778 0.182 1
1 193 . 8 1 1 A 18 18 VAL HA H 18 3.690 3.589 0.101 1
1 201 . 8 1 1 A 18 18 VAL C C 18 177.900 177.892 0.008 1
1 202 . 8 1 1 A 18 18 VAL CA C 18 66.600 65.431 1.169 1
1 203 . 8 1 1 A 18 18 VAL CB C 18 31.300 31.834 -0.534 1
1 206 . 8 1 1 A 18 18 VAL N N 18 123.000 119.553 3.447 1
1 207 . 8 1 1 A 19 19 GLY H H 19 8.270 8.065 0.205 1
1 208 . 8 1 1 A 19 19 GLY HA2 H 19 3.430 3.745 -0.315 1
1 209 . 8 1 1 A 19 19 GLY HA3 H 19 3.430 3.750 -0.320 1
1 210 . 8 1 1 A 19 19 GLY C C 19 174.400 175.880 -1.480 1
1 211 . 8 1 1 A 19 19 GLY CA C 19 48.500 47.185 1.315 1
1 212 . 8 1 1 A 19 19 GLY N N 19 105.400 107.569 -2.169 1
1 213 . 8 1 1 A 20 20 LYS H H 20 8.250 8.254 -0.004 1
1 214 . 8 1 1 A 20 20 LYS HA H 20 3.710 4.029 -0.319 1
1 223 . 8 1 1 A 20 20 LYS C C 20 179.400 178.736 0.664 1
1 224 . 8 1 1 A 20 20 LYS CA C 20 59.300 59.702 -0.402 1
1 225 . 8 1 1 A 20 20 LYS CB C 20 32.600 32.090 0.510 1
1 229 . 8 1 1 A 20 20 LYS N N 20 118.700 121.821 -3.121 1
1 230 . 8 1 1 A 21 21 ALA H H 21 7.640 7.449 0.191 1
1 231 . 8 1 1 A 21 21 ALA HA H 21 3.790 4.106 -0.316 1
1 235 . 8 1 1 A 21 21 ALA C C 21 177.900 178.216 -0.316 1
1 236 . 8 1 1 A 21 21 ALA CA C 21 55.200 53.885 1.315 1
1 237 . 8 1 1 A 21 21 ALA CB C 21 19.200 18.269 0.931 1
1 238 . 8 1 1 A 21 21 ALA N N 21 121.700 121.397 0.303 1
1 239 . 8 1 1 A 22 22 LEU H H 22 7.330 7.346 -0.016 1
1 240 . 8 1 1 A 22 22 LEU HA H 22 4.140 4.428 -0.288 1
1 250 . 8 1 1 A 22 22 LEU C C 22 176.800 177.951 -1.151 1
1 251 . 8 1 1 A 22 22 LEU CA C 22 54.600 54.409 0.191 1
1 252 . 8 1 1 A 22 22 LEU CB C 22 42.900 41.249 1.651 1
1 256 . 8 1 1 A 22 22 LEU N N 22 114.200 115.903 -1.703 1
1 257 . 8 1 1 A 23 23 ALA H H 23 7.160 7.950 -0.790 1
1 258 . 8 1 1 A 23 23 ALA HA H 23 4.720 4.330 0.390 1
1 262 . 8 1 1 A 23 23 ALA C C 23 176.700 176.707 -0.007 1
1 263 . 8 1 1 A 23 23 ALA CA C 23 53.000 52.667 0.333 1
1 264 . 8 1 1 A 23 23 ALA CB C 23 18.200 19.522 -1.322 1
1 265 . 8 1 1 A 23 23 ALA N N 23 118.200 121.542 -3.342 1
1 266 . 8 1 1 A 24 24 ASN H H 24 7.440 7.635 -0.195 1
1 267 . 8 1 1 A 24 24 ASN HA H 24 4.730 5.015 -0.285 1
1 272 . 8 1 1 A 24 24 ASN C C 24 174.800 175.008 -0.208 1
1 273 . 8 1 1 A 24 24 ASN CA C 24 53.500 51.512 1.988 1
1 274 . 8 1 1 A 24 24 ASN CB C 24 41.700 41.577 0.123 1
1 275 . 8 1 1 A 24 24 ASN N N 24 116.800 112.937 3.863 1
1 277 . 8 1 1 A 25 25 GLY H H 25 9.370 8.994 0.376 1
1 278 . 8 1 1 A 25 25 GLY HA2 H 25 3.650 3.898 -0.248 1
1 279 . 8 1 1 A 25 25 GLY HA3 H 25 4.110 3.914 0.196 1
1 280 . 8 1 1 A 25 25 GLY C C 25 175.300 175.114 0.186 1
1 281 . 8 1 1 A 25 25 GLY CA C 25 47.600 46.673 0.927 1
1 282 . 8 1 1 A 25 25 GLY N N 25 114.800 108.454 6.346 1
1 283 . 8 1 1 A 26 26 ARG H H 26 8.050 8.005 0.045 1
1 284 . 8 1 1 A 26 26 ARG HA H 26 4.150 4.090 0.060 1
1 289 . 8 1 1 A 26 26 ARG C C 26 179.300 177.758 1.542 1
1 290 . 8 1 1 A 26 26 ARG CA C 26 57.000 58.903 -1.903 1
1 291 . 8 1 1 A 26 26 ARG CB C 26 29.900 29.730 0.170 1
1 294 . 8 1 1 A 26 26 ARG N N 26 120.500 121.790 -1.290 1
1 295 . 8 1 1 A 27 27 ARG H H 27 7.930 7.756 0.174 1
1 296 . 8 1 1 A 27 27 ARG HA H 27 3.710 4.117 -0.407 1
1 301 . 8 1 1 A 27 27 ARG C C 27 178.300 178.329 -0.029 1
1 302 . 8 1 1 A 27 27 ARG CA C 27 61.000 58.341 2.659 1
1 303 . 8 1 1 A 27 27 ARG CB C 27 30.400 30.180 0.220 1
1 305 . 8 1 1 A 27 27 ARG N N 27 117.900 118.724 -0.824 1
1 306 . 8 1 1 A 28 28 LEU H H 28 7.640 8.148 -0.508 1
1 307 . 8 1 1 A 28 28 LEU HA H 28 3.950 3.872 0.078 1
1 317 . 8 1 1 A 28 28 LEU C C 28 178.200 179.259 -1.059 1
1 318 . 8 1 1 A 28 28 LEU CA C 28 57.600 56.994 0.606 1
1 319 . 8 1 1 A 28 28 LEU CB C 28 41.900 41.004 0.896 1
1 323 . 8 1 1 A 28 28 LEU N N 28 117.600 118.723 -1.123 1
1 324 . 8 1 1 A 29 29 GLN H H 29 8.110 7.713 0.397 1
1 325 . 8 1 1 A 29 29 GLN HA H 29 3.880 4.204 -0.324 1
1 332 . 8 1 1 A 29 29 GLN C C 29 179.400 178.898 0.502 1
1 333 . 8 1 1 A 29 29 GLN CA C 29 59.100 58.799 0.301 1
1 334 . 8 1 1 A 29 29 GLN CB C 29 28.800 28.252 0.548 1
1 336 . 8 1 1 A 29 29 GLN N N 29 119.300 118.282 1.018 1
1 338 . 8 1 1 A 30 30 ILE H H 30 7.530 7.700 -0.170 1
1 339 . 8 1 1 A 30 30 ILE HA H 30 3.340 3.663 -0.323 1
1 349 . 8 1 1 A 30 30 ILE C C 30 176.700 178.491 -1.791 1
1 350 . 8 1 1 A 30 30 ILE CA C 30 65.900 65.093 0.807 1
1 351 . 8 1 1 A 30 30 ILE CB C 30 37.400 37.892 -0.492 1
1 355 . 8 1 1 A 30 30 ILE N N 30 118.600 120.515 -1.915 1
1 356 . 8 1 1 A 31 31 LEU H H 31 7.500 7.479 0.021 1
1 357 . 8 1 1 A 31 31 LEU HA H 31 3.520 3.801 -0.281 1
1 367 . 8 1 1 A 31 31 LEU C C 31 177.300 178.711 -1.411 1
1 368 . 8 1 1 A 31 31 LEU CA C 31 58.100 58.151 -0.051 1
1 369 . 8 1 1 A 31 31 LEU CB C 31 41.100 40.660 0.440 1
1 373 . 8 1 1 A 31 31 LEU N N 31 119.900 119.580 0.320 1
1 374 . 8 1 1 A 32 32 ASP H H 32 7.950 8.476 -0.526 1
1 375 . 8 1 1 A 32 32 ASP HA H 32 4.300 4.609 -0.309 1
1 378 . 8 1 1 A 32 32 ASP C C 32 178.300 178.460 -0.160 1
1 379 . 8 1 1 A 32 32 ASP CA C 32 57.400 57.670 -0.270 1
1 380 . 8 1 1 A 32 32 ASP CB C 32 42.400 42.356 0.044 1
1 381 . 8 1 1 A 32 32 ASP N N 32 116.900 119.594 -2.694 1
1 382 . 8 1 1 A 33 33 LEU H H 33 7.350 7.532 -0.182 1
1 383 . 8 1 1 A 33 33 LEU HA H 33 4.130 4.161 -0.031 1
1 393 . 8 1 1 A 33 33 LEU C C 33 180.000 178.838 1.162 1
1 394 . 8 1 1 A 33 33 LEU CA C 33 57.600 57.566 0.034 1
1 395 . 8 1 1 A 33 33 LEU CB C 33 42.300 41.931 0.369 1
1 399 . 8 1 1 A 33 33 LEU N N 33 118.600 120.042 -1.442 1
1 400 . 8 1 1 A 34 34 LEU H H 34 8.300 8.514 -0.214 1
1 401 . 8 1 1 A 34 34 LEU HA H 34 4.490 4.220 0.270 1
1 411 . 8 1 1 A 34 34 LEU C C 34 178.900 178.936 -0.036 1
1 412 . 8 1 1 A 34 34 LEU CA C 34 55.800 56.376 -0.576 1
1 413 . 8 1 1 A 34 34 LEU CB C 34 41.300 41.313 -0.013 1
1 417 . 8 1 1 A 34 34 LEU N N 34 117.800 118.577 -0.777 1
1 418 . 8 1 1 A 35 35 ALA H H 35 8.160 7.678 0.482 1
1 419 . 8 1 1 A 35 35 ALA HA H 35 4.050 4.257 -0.207 1
1 423 . 8 1 1 A 35 35 ALA C C 35 179.000 178.422 0.578 1
1 424 . 8 1 1 A 35 35 ALA CA C 35 54.900 54.302 0.598 1
1 425 . 8 1 1 A 35 35 ALA CB C 35 17.500 18.481 -0.981 1
1 426 . 8 1 1 A 35 35 ALA N N 35 123.900 121.873 2.027 1
1 427 . 8 1 1 A 36 36 GLN H H 36 7.600 7.628 -0.028 1
1 428 . 8 1 1 A 36 36 GLN HA H 36 4.340 4.328 0.012 1
1 435 . 8 1 1 A 36 36 GLN C C 36 176.100 176.253 -0.153 1
1 436 . 8 1 1 A 36 36 GLN CA C 36 55.800 56.352 -0.552 1
1 437 . 8 1 1 A 36 36 GLN CB C 36 29.000 29.164 -0.164 1
1 439 . 8 1 1 A 36 36 GLN N N 36 113.300 114.340 -1.040 1
1 441 . 8 1 1 A 37 37 GLY H H 37 7.550 7.569 -0.019 1
1 442 . 8 1 1 A 37 37 GLY HA2 H 37 3.730 4.164 -0.434 1
1 443 . 8 1 1 A 37 37 GLY HA3 H 37 4.490 4.166 0.324 1
1 444 . 8 1 1 A 37 37 GLY C C 37 171.500 172.406 -0.906 1
1 445 . 8 1 1 A 37 37 GLY CA C 37 44.500 45.245 -0.745 1
1 446 . 8 1 1 A 37 37 GLY N N 37 108.400 106.616 1.784 1
1 447 . 8 1 1 A 38 38 GLU H H 38 8.120 8.618 -0.498 1
1 448 . 8 1 1 A 38 38 GLU HA H 38 4.820 5.477 -0.657 1
1 453 . 8 1 1 A 38 38 GLU C C 38 177.000 174.965 2.035 1
1 454 . 8 1 1 A 38 38 GLU CA C 38 56.400 54.973 1.427 1
1 455 . 8 1 1 A 38 38 GLU CB C 38 31.200 32.895 -1.695 1
1 457 . 8 1 1 A 38 38 GLU N N 38 119.600 121.723 -2.123 1
1 458 . 8 1 1 A 39 39 ARG H H 39 8.580 8.788 -0.208 1
1 459 . 8 1 1 A 39 39 ARG HA H 39 4.970 5.159 -0.189 1
1 467 . 8 1 1 A 39 39 ARG C C 39 174.800 175.504 -0.704 1
1 468 . 8 1 1 A 39 39 ARG CA C 39 53.900 54.217 -0.317 1
1 469 . 8 1 1 A 39 39 ARG CB C 39 36.400 34.599 1.801 1
1 472 . 8 1 1 A 39 39 ARG N N 39 121.500 121.671 -0.171 1
1 474 . 8 1 1 A 40 40 ALA H H 40 8.910 8.808 0.102 1
1 475 . 8 1 1 A 40 40 ALA HA H 40 4.920 4.351 0.569 1
1 479 . 8 1 1 A 40 40 ALA C C 40 179.200 178.382 0.818 1
1 480 . 8 1 1 A 40 40 ALA CA C 40 51.100 51.859 -0.759 1
1 481 . 8 1 1 A 40 40 ALA CB C 40 19.200 19.209 -0.009 1
1 482 . 8 1 1 A 40 40 ALA N N 40 125.100 124.900 0.200 1
1 483 . 8 1 1 A 41 41 VAL H H 41 8.420 8.506 -0.086 1
1 484 . 8 1 1 A 41 41 VAL HA H 41 3.430 3.594 -0.164 1
1 492 . 8 1 1 A 41 41 VAL C C 41 176.800 177.230 -0.430 1
1 493 . 8 1 1 A 41 41 VAL CA C 41 67.600 66.525 1.075 1
1 494 . 8 1 1 A 41 41 VAL CB C 41 31.600 31.449 0.151 1
1 497 . 8 1 1 A 41 41 VAL N N 41 120.900 120.886 0.014 1
1 498 . 8 1 1 A 42 42 GLU H H 42 9.640 8.415 1.225 1
1 499 . 8 1 1 A 42 42 GLU HA H 42 3.880 3.927 -0.047 1
1 504 . 8 1 1 A 42 42 GLU C C 42 178.300 178.526 -0.226 1
1 505 . 8 1 1 A 42 42 GLU CA C 42 60.600 59.510 1.090 1
1 506 . 8 1 1 A 42 42 GLU CB C 42 28.300 29.294 -0.994 1
1 508 . 8 1 1 A 42 42 GLU N N 42 119.000 119.760 -0.760 1
1 509 . 8 1 1 A 43 43 ALA H H 43 6.870 7.594 -0.724 1
1 510 . 8 1 1 A 43 43 ALA HA H 43 4.290 4.062 0.228 1
1 514 . 8 1 1 A 43 43 ALA C C 43 180.700 179.735 0.965 1
1 515 . 8 1 1 A 43 43 ALA CA C 43 54.100 55.095 -0.995 1
1 516 . 8 1 1 A 43 43 ALA CB C 43 19.100 18.443 0.657 1
1 517 . 8 1 1 A 43 43 ALA N N 43 120.500 121.593 -1.093 1
1 518 . 8 1 1 A 44 44 ILE H H 44 7.970 8.074 -0.104 1
1 519 . 8 1 1 A 44 44 ILE HA H 44 3.470 3.653 -0.183 1
1 529 . 8 1 1 A 44 44 ILE C C 44 178.300 177.955 0.345 1
1 530 . 8 1 1 A 44 44 ILE CA C 44 64.700 65.391 -0.691 1
1 531 . 8 1 1 A 44 44 ILE CB C 44 38.100 37.715 0.385 1
1 535 . 8 1 1 A 44 44 ILE N N 44 120.500 118.522 1.978 1
1 536 . 8 1 1 A 45 45 ALA H H 45 8.460 8.320 0.140 1
1 537 . 8 1 1 A 45 45 ALA HA H 45 3.720 3.998 -0.278 1
1 541 . 8 1 1 A 45 45 ALA C C 45 178.500 179.758 -1.258 1
1 542 . 8 1 1 A 45 45 ALA CA C 45 56.200 55.270 0.930 1
1 543 . 8 1 1 A 45 45 ALA CB C 45 17.400 18.408 -1.008 1
1 544 . 8 1 1 A 45 45 ALA N N 45 124.500 122.053 2.447 1
1 545 . 8 1 1 A 46 46 THR H H 46 8.080 7.854 0.226 1
1 546 . 8 1 1 A 46 46 THR HA H 46 3.900 3.886 0.014 1
1 551 . 8 1 1 A 46 46 THR C C 46 177.200 176.614 0.586 1
1 552 . 8 1 1 A 46 46 THR CA C 46 66.400 66.642 -0.242 1
1 553 . 8 1 1 A 46 46 THR CB C 46 68.800 68.424 0.376 1
1 555 . 8 1 1 A 46 46 THR N N 46 112.400 114.704 -2.304 1
1 556 . 8 1 1 A 47 47 ALA H H 47 7.930 8.161 -0.231 1
1 557 . 8 1 1 A 47 47 ALA HA H 47 4.200 4.187 0.013 1
1 561 . 8 1 1 A 47 47 ALA C C 47 179.200 178.527 0.673 1
1 562 . 8 1 1 A 47 47 ALA CA C 47 54.800 54.834 -0.034 1
1 563 . 8 1 1 A 47 47 ALA CB C 47 19.800 18.173 1.627 1
1 564 . 8 1 1 A 47 47 ALA N N 47 121.400 123.980 -2.580 1
1 565 . 8 1 1 A 48 48 THR H H 48 7.560 7.330 0.230 1
1 566 . 8 1 1 A 48 48 THR HA H 48 4.390 4.488 -0.098 1
1 571 . 8 1 1 A 48 48 THR C C 48 175.700 175.044 0.656 1
1 572 . 8 1 1 A 48 48 THR CA C 48 61.800 61.993 -0.193 1
1 573 . 8 1 1 A 48 48 THR CB C 48 71.000 69.930 1.070 1
1 575 . 8 1 1 A 48 48 THR N N 48 103.500 106.691 -3.191 1
1 576 . 8 1 1 A 49 49 GLY H H 49 7.820 8.002 -0.182 1
1 577 . 8 1 1 A 49 49 GLY HA2 H 49 3.870 3.971 -0.101 1
1 578 . 8 1 1 A 49 49 GLY HA3 H 49 4.100 3.972 0.128 1
1 579 . 8 1 1 A 49 49 GLY C C 49 174.400 173.987 0.413 1
1 580 . 8 1 1 A 49 49 GLY CA C 49 46.300 46.417 -0.117 1
1 581 . 8 1 1 A 49 49 GLY N N 49 111.100 111.505 -0.405 1
1 582 . 8 1 1 A 50 50 MET H H 50 7.930 8.099 -0.169 1
1 583 . 8 1 1 A 50 50 MET HA H 50 4.540 4.956 -0.416 1
1 591 . 8 1 1 A 50 50 MET C C 50 174.800 174.697 0.103 1
1 592 . 8 1 1 A 50 50 MET CA C 50 55.100 54.371 0.729 1
1 593 . 8 1 1 A 50 50 MET CB C 50 37.200 37.328 -0.128 1
1 596 . 8 1 1 A 50 50 MET N N 50 119.300 118.241 1.059 1
1 597 . 8 1 1 A 51 51 ASN H H 51 8.040 8.747 -0.707 1
1 598 . 8 1 1 A 51 51 ASN HA H 51 4.580 4.937 -0.357 1
1 601 . 8 1 1 A 51 51 ASN C C 51 176.100 177.048 -0.948 1
1 602 . 8 1 1 A 51 51 ASN CA C 51 52.800 52.481 0.319 1
1 603 . 8 1 1 A 51 51 ASN CB C 51 41.100 39.288 1.812 1
1 604 . 8 1 1 A 51 51 ASN N N 51 118.000 118.438 -0.438 1
1 605 . 8 1 1 A 52 52 LEU H H 52 8.560 8.759 -0.199 1
1 606 . 8 1 1 A 52 52 LEU HA H 52 3.760 3.905 -0.145 1
1 616 . 8 1 1 A 52 52 LEU C C 52 179.600 179.024 0.576 1
1 617 . 8 1 1 A 52 52 LEU CA C 52 59.000 57.762 1.238 1
1 618 . 8 1 1 A 52 52 LEU CB C 52 41.800 41.289 0.511 1
1 622 . 8 1 1 A 52 52 LEU N N 52 120.600 124.042 -3.442 1
1 623 . 8 1 1 A 53 53 THR H H 53 8.230 8.077 0.153 1
1 624 . 8 1 1 A 53 53 THR HA H 53 3.880 4.030 -0.150 1
1 629 . 8 1 1 A 53 53 THR C C 53 176.900 176.946 -0.046 1
1 630 . 8 1 1 A 53 53 THR CA C 53 66.500 65.947 0.553 1
1 631 . 8 1 1 A 53 53 THR CB C 53 68.400 68.022 0.378 1
1 633 . 8 1 1 A 53 53 THR N N 53 115.800 111.023 4.777 1
1 634 . 8 1 1 A 54 54 THR H H 54 8.420 8.172 0.248 1
1 635 . 8 1 1 A 54 54 THR HA H 54 3.880 3.857 0.023 1
1 640 . 8 1 1 A 54 54 THR C C 54 177.300 176.349 0.951 1
1 641 . 8 1 1 A 54 54 THR CA C 54 66.600 66.712 -0.112 1
1 642 . 8 1 1 A 54 54 THR CB C 54 66.600 68.731 -2.131 1
1 644 . 8 1 1 A 54 54 THR N N 54 122.300 117.290 5.010 1
1 645 . 8 1 1 A 55 55 ALA H H 55 8.860 8.624 0.236 1
1 646 . 8 1 1 A 55 55 ALA HA H 55 4.020 3.910 0.110 1
1 650 . 8 1 1 A 55 55 ALA C C 55 179.000 178.969 0.031 1
1 651 . 8 1 1 A 55 55 ALA CA C 55 56.100 55.333 0.767 1
1 652 . 8 1 1 A 55 55 ALA CB C 55 17.000 17.936 -0.936 1
1 653 . 8 1 1 A 55 55 ALA N N 55 125.600 123.355 2.245 1
1 654 . 8 1 1 A 56 56 SER H H 56 8.440 8.312 0.128 1
1 655 . 8 1 1 A 56 56 SER HA H 56 3.920 3.886 0.034 1
1 658 . 8 1 1 A 56 56 SER C C 56 176.400 177.043 -0.643 1
1 659 . 8 1 1 A 56 56 SER CA C 56 62.600 61.309 1.291 1
1 660 . 8 1 1 A 56 56 SER CB C 56 62.700 62.961 -0.261 1
1 661 . 8 1 1 A 56 56 SER N N 56 112.700 112.825 -0.125 1
1 662 . 8 1 1 A 57 57 ALA H H 57 8.090 8.001 0.089 1
1 663 . 8 1 1 A 57 57 ALA HA H 57 4.130 3.970 0.160 1
1 667 . 8 1 1 A 57 57 ALA C C 57 181.200 179.541 1.659 1
1 668 . 8 1 1 A 57 57 ALA CA C 57 55.200 55.398 -0.198 1
1 669 . 8 1 1 A 57 57 ALA CB C 57 17.900 17.956 -0.056 1
1 670 . 8 1 1 A 57 57 ALA N N 57 124.000 123.132 0.868 1
1 671 . 8 1 1 A 58 58 ASN H H 58 7.970 7.965 0.005 1
1 672 . 8 1 1 A 58 58 ASN HA H 58 4.480 4.443 0.037 1
1 677 . 8 1 1 A 58 58 ASN C C 58 177.500 178.143 -0.643 1
1 678 . 8 1 1 A 58 58 ASN CA C 58 56.900 56.030 0.870 1
1 679 . 8 1 1 A 58 58 ASN CB C 58 39.800 37.719 2.081 1
1 680 . 8 1 1 A 58 58 ASN N N 58 117.600 117.270 0.330 1
1 682 . 8 1 1 A 59 59 LEU H H 59 8.530 8.773 -0.243 1
1 683 . 8 1 1 A 59 59 LEU HA H 59 3.710 3.787 -0.077 1
1 693 . 8 1 1 A 59 59 LEU C C 59 178.400 179.145 -0.745 1
1 694 . 8 1 1 A 59 59 LEU CA C 59 58.600 57.829 0.771 1
1 695 . 8 1 1 A 59 59 LEU CB C 59 40.500 40.510 -0.010 1
1 699 . 8 1 1 A 59 59 LEU N N 59 122.600 120.998 1.602 1
1 700 . 8 1 1 A 60 60 GLN H H 60 8.200 8.323 -0.123 1
1 701 . 8 1 1 A 60 60 GLN HA H 60 4.020 4.013 0.007 1
1 708 . 8 1 1 A 60 60 GLN C C 60 178.700 177.814 0.886 1
1 709 . 8 1 1 A 60 60 GLN CA C 60 58.800 59.001 -0.201 1
1 710 . 8 1 1 A 60 60 GLN CB C 60 27.700 28.587 -0.887 1
1 712 . 8 1 1 A 60 60 GLN N N 60 118.900 119.687 -0.787 1
1 714 . 8 1 1 A 61 61 ALA H H 61 7.580 7.695 -0.115 1
1 715 . 8 1 1 A 61 61 ALA HA H 61 4.230 4.091 0.139 1
1 719 . 8 1 1 A 61 61 ALA C C 61 181.300 180.141 1.159 1
1 720 . 8 1 1 A 61 61 ALA CA C 61 55.100 55.018 0.082 1
1 721 . 8 1 1 A 61 61 ALA CB C 61 17.600 18.069 -0.469 1
1 722 . 8 1 1 A 61 61 ALA N N 61 122.200 122.257 -0.057 1
1 723 . 8 1 1 A 62 62 LEU H H 62 7.830 7.986 -0.156 1
1 724 . 8 1 1 A 62 62 LEU HA H 62 3.980 3.988 -0.008 1
1 734 . 8 1 1 A 62 62 LEU C C 62 178.500 179.178 -0.678 1
1 735 . 8 1 1 A 62 62 LEU CA C 62 58.100 57.503 0.597 1
1 736 . 8 1 1 A 62 62 LEU CB C 62 43.300 40.898 2.402 1
1 739 . 8 1 1 A 62 62 LEU N N 62 119.000 118.500 0.500 1
1 740 . 8 1 1 A 63 63 LYS H H 63 8.580 8.168 0.412 1
1 741 . 8 1 1 A 63 63 LYS HA H 63 4.130 4.351 -0.221 1
1 750 . 8 1 1 A 63 63 LYS C C 63 180.500 178.540 1.960 1
1 751 . 8 1 1 A 63 63 LYS CA C 63 59.700 58.837 0.863 1
1 752 . 8 1 1 A 63 63 LYS CB C 63 32.600 32.156 0.444 1
1 756 . 8 1 1 A 63 63 LYS N N 63 123.400 121.625 1.775 1
1 757 . 8 1 1 A 64 64 SER H H 64 8.640 8.017 0.623 1
1 758 . 8 1 1 A 64 64 SER HA H 64 4.300 4.214 0.086 1
1 761 . 8 1 1 A 64 64 SER C C 64 175.000 177.021 -2.021 1
1 762 . 8 1 1 A 64 64 SER CA C 64 61.400 60.761 0.639 1
1 763 . 8 1 1 A 64 64 SER CB C 64 63.000 62.910 0.090 1
1 764 . 8 1 1 A 64 64 SER N N 64 117.700 114.645 3.055 1
1 765 . 8 1 1 A 65 65 GLY H H 65 7.280 7.928 -0.648 1
1 766 . 8 1 1 A 65 65 GLY HA2 H 65 3.240 3.897 -0.657 1
1 767 . 8 1 1 A 65 65 GLY HA3 H 65 3.980 3.902 0.078 1
1 768 . 8 1 1 A 65 65 GLY C C 65 171.300 174.580 -3.280 1
1 769 . 8 1 1 A 65 65 GLY CA C 65 45.100 45.756 -0.656 1
1 770 . 8 1 1 A 65 65 GLY N N 65 104.400 107.473 -3.073 1
1 771 . 8 1 1 A 66 66 GLY H H 66 7.730 7.631 0.099 1
1 772 . 8 1 1 A 66 66 GLY HA2 H 66 3.650 4.017 -0.367 1
1 773 . 8 1 1 A 66 66 GLY HA3 H 66 3.750 4.019 -0.269 1
1 774 . 8 1 1 A 66 66 GLY C C 66 173.700 174.986 -1.286 1
1 775 . 8 1 1 A 66 66 GLY CA C 66 45.400 46.168 -0.768 1
1 776 . 8 1 1 A 66 66 GLY N N 66 104.700 108.123 -3.423 1
1 777 . 8 1 1 A 67 67 LEU H H 67 7.520 8.390 -0.870 1
1 778 . 8 1 1 A 67 67 LEU HA H 67 4.310 4.264 0.046 1
1 788 . 8 1 1 A 67 67 LEU C C 67 177.700 176.942 0.758 1
1 789 . 8 1 1 A 67 67 LEU CA C 67 55.500 55.956 -0.456 1
1 790 . 8 1 1 A 67 67 LEU CB C 67 42.400 42.627 -0.227 1
1 794 . 8 1 1 A 67 67 LEU N N 67 110.600 118.256 -7.656 1
1 795 . 8 1 1 A 68 68 VAL H H 68 6.890 7.050 -0.160 1
1 796 . 8 1 1 A 68 68 VAL HA H 68 5.190 5.023 0.167 1
1 804 . 8 1 1 A 68 68 VAL C C 68 173.700 175.055 -1.355 1
1 805 . 8 1 1 A 68 68 VAL CA C 68 57.400 58.651 -1.251 1
1 806 . 8 1 1 A 68 68 VAL CB C 68 36.400 35.313 1.087 1
1 809 . 8 1 1 A 68 68 VAL N N 68 106.400 112.408 -6.008 1
1 810 . 8 1 1 A 69 69 GLU H H 69 8.880 9.313 -0.433 1
1 811 . 8 1 1 A 69 69 GLU HA H 69 4.660 5.146 -0.486 1
1 816 . 8 1 1 A 69 69 GLU C C 69 173.300 174.598 -1.298 1
1 817 . 8 1 1 A 69 69 GLU CA C 69 54.300 54.220 0.080 1
1 818 . 8 1 1 A 69 69 GLU CB C 69 34.100 33.244 0.856 1
1 820 . 8 1 1 A 69 69 GLU N N 69 120.400 121.003 -0.603 1
1 821 . 8 1 1 A 70 70 ALA H H 70 8.730 8.625 0.105 1
1 822 . 8 1 1 A 70 70 ALA HA H 70 4.990 4.897 0.093 1
1 826 . 8 1 1 A 70 70 ALA C C 70 176.500 175.003 1.497 1
1 827 . 8 1 1 A 70 70 ALA CA C 70 50.000 50.112 -0.112 1
1 828 . 8 1 1 A 70 70 ALA CB C 70 22.300 21.905 0.395 1
1 829 . 8 1 1 A 70 70 ALA N N 70 122.800 122.061 0.739 1
1 830 . 8 1 1 A 71 71 ARG H H 71 8.670 9.230 -0.560 1
1 831 . 8 1 1 A 71 71 ARG HA H 71 4.630 5.019 -0.389 1
1 843 . 8 1 1 A 71 71 ARG C C 71 173.500 174.624 -1.124 1
1 844 . 8 1 1 A 71 71 ARG CA C 71 54.600 54.231 0.369 1
1 845 . 8 1 1 A 71 71 ARG CB C 71 33.600 33.602 -0.002 1
1 849 . 8 1 1 A 71 71 ARG N N 71 120.100 123.144 -3.044 1
1 851 . 8 1 1 A 72 72 ARG H H 72 8.780 8.594 0.186 1
1 852 . 8 1 1 A 72 72 ARG HA H 72 5.100 4.643 0.457 1
1 859 . 8 1 1 A 72 72 ARG C C 72 176.000 175.024 0.976 1
1 860 . 8 1 1 A 72 72 ARG CA C 72 54.900 55.902 -1.002 1
1 861 . 8 1 1 A 72 72 ARG CB C 72 32.500 31.059 1.441 1
1 864 . 8 1 1 A 72 72 ARG N N 72 123.600 128.484 -4.884 1
1 865 . 8 1 1 A 73 73 GLU H H 73 8.720 8.870 -0.150 1
1 866 . 8 1 1 A 73 73 GLU HA H 73 4.510 4.744 -0.234 1
1 871 . 8 1 1 A 73 73 GLU C C 73 175.900 176.671 -0.771 1
1 872 . 8 1 1 A 73 73 GLU CA C 73 55.700 55.416 0.284 1
1 873 . 8 1 1 A 73 73 GLU CB C 73 31.800 31.379 0.421 1
1 875 . 8 1 1 A 73 73 GLU N N 73 126.800 127.318 -0.518 1
1 876 . 8 1 1 A 74 74 GLY H H 74 9.190 8.931 0.259 1
1 877 . 8 1 1 A 74 74 GLY HA2 H 74 3.700 3.888 -0.188 1
1 878 . 8 1 1 A 74 74 GLY HA3 H 74 4.170 3.909 0.261 1
1 879 . 8 1 1 A 74 74 GLY C C 74 175.400 174.882 0.518 1
1 880 . 8 1 1 A 74 74 GLY CA C 74 47.100 47.340 -0.240 1
1 881 . 8 1 1 A 74 74 GLY N N 74 118.500 116.716 1.784 1
1 882 . 8 1 1 A 75 75 THR H H 75 8.780 8.529 0.251 1
1 883 . 8 1 1 A 75 75 THR HA H 75 4.290 4.445 -0.155 1
1 888 . 8 1 1 A 75 75 THR C C 75 174.600 174.328 0.272 1
1 889 . 8 1 1 A 75 75 THR CA C 75 62.000 62.588 -0.588 1
1 890 . 8 1 1 A 75 75 THR CB C 75 69.000 69.947 -0.947 1
1 892 . 8 1 1 A 75 75 THR N N 75 118.000 120.349 -2.349 1
1 893 . 8 1 1 A 76 76 ARG H H 76 8.030 7.337 0.693 1
1 894 . 8 1 1 A 76 76 ARG HA H 76 4.610 4.850 -0.240 1
1 901 . 8 1 1 A 76 76 ARG C C 76 174.800 175.138 -0.338 1
1 902 . 8 1 1 A 76 76 ARG CA C 76 55.500 55.174 0.326 1
1 903 . 8 1 1 A 76 76 ARG CB C 76 32.700 32.346 0.354 1
1 906 . 8 1 1 A 76 76 ARG N N 76 122.600 119.341 3.259 1
1 907 . 8 1 1 A 77 77 GLN H H 77 8.580 8.571 0.009 1
1 908 . 8 1 1 A 77 77 GLN HA H 77 4.910 4.847 0.063 1
1 915 . 8 1 1 A 77 77 GLN C C 77 173.900 174.287 -0.387 1
1 916 . 8 1 1 A 77 77 GLN CA C 77 54.700 54.682 0.018 1
1 917 . 8 1 1 A 77 77 GLN CB C 77 31.800 29.706 2.094 1
1 919 . 8 1 1 A 77 77 GLN N N 77 121.900 121.279 0.621 1
1 921 . 8 1 1 A 78 78 TYR H H 78 8.890 9.563 -0.673 1
1 922 . 8 1 1 A 78 78 TYR HA H 78 4.750 5.174 -0.424 1
1 929 . 8 1 1 A 78 78 TYR C C 78 175.600 174.550 1.050 1
1 930 . 8 1 1 A 78 78 TYR CA C 78 57.000 56.334 0.666 1
1 931 . 8 1 1 A 78 78 TYR CB C 78 41.400 40.008 1.392 1
1 936 . 8 1 1 A 78 78 TYR N N 78 121.800 123.066 -1.266 1
1 937 . 8 1 1 A 79 79 TYR H H 79 9.010 9.750 -0.740 1
1 938 . 8 1 1 A 79 79 TYR HA H 79 5.410 5.469 -0.059 1
1 945 . 8 1 1 A 79 79 TYR C C 79 173.100 174.830 -1.730 1
1 946 . 8 1 1 A 79 79 TYR CA C 79 57.300 57.099 0.201 1
1 947 . 8 1 1 A 79 79 TYR CB C 79 43.300 41.193 2.107 1
1 952 . 8 1 1 A 79 79 TYR N N 79 122.500 122.787 -0.287 1
1 953 . 8 1 1 A 80 80 ARG H H 80 8.720 8.650 0.070 1
1 954 . 8 1 1 A 80 80 ARG HA H 80 5.120 4.880 0.240 1
1 962 . 8 1 1 A 80 80 ARG C C 80 175.500 174.783 0.717 1
1 963 . 8 1 1 A 80 80 ARG CA C 80 53.200 54.740 -1.540 1
1 964 . 8 1 1 A 80 80 ARG CB C 80 33.900 34.302 -0.402 1
1 967 . 8 1 1 A 80 80 ARG N N 80 114.500 122.345 -7.845 1
1 969 . 8 1 1 A 81 81 ILE H H 81 9.300 8.848 0.452 1
1 970 . 8 1 1 A 81 81 ILE HA H 81 4.150 4.108 0.042 1
1 980 . 8 1 1 A 81 81 ILE C C 81 177.800 177.576 0.224 1
1 981 . 8 1 1 A 81 81 ILE CA C 81 62.300 62.384 -0.084 1
1 982 . 8 1 1 A 81 81 ILE CB C 81 37.800 37.724 0.076 1
1 986 . 8 1 1 A 81 81 ILE N N 81 122.100 126.880 -4.780 1
1 987 . 8 1 1 A 82 82 ALA H H 82 7.930 8.409 -0.479 1
1 988 . 8 1 1 A 82 82 ALA HA H 82 3.930 4.130 -0.200 1
1 992 . 8 1 1 A 82 82 ALA C C 82 176.300 177.101 -0.801 1
1 993 . 8 1 1 A 82 82 ALA CA C 82 54.200 53.202 0.998 1
1 994 . 8 1 1 A 82 82 ALA CB C 82 18.500 19.349 -0.849 1
1 995 . 8 1 1 A 82 82 ALA N N 82 127.200 129.457 -2.257 1
1 996 . 8 1 1 A 83 83 GLY H H 83 6.980 7.409 -0.429 1
1 997 . 8 1 1 A 83 83 GLY HA2 H 83 4.090 4.043 0.047 1
1 998 . 8 1 1 A 83 83 GLY HA3 H 83 4.440 4.045 0.395 1
1 999 . 8 1 1 A 83 83 GLY C C 83 173.600 174.759 -1.159 1
1 1000 . 8 1 1 A 83 83 GLY CA C 83 45.200 45.817 -0.617 1
1 1001 . 8 1 1 A 83 83 GLY N N 83 101.800 104.285 -2.485 1
1 1002 . 8 1 1 A 84 84 GLU H H 84 8.930 8.918 0.012 1
1 1003 . 8 1 1 A 84 84 GLU HA H 84 4.120 3.988 0.132 1
1 1008 . 8 1 1 A 84 84 GLU C C 84 178.300 177.817 0.483 1
1 1009 . 8 1 1 A 84 84 GLU CA C 84 58.900 59.221 -0.321 1
1 1010 . 8 1 1 A 84 84 GLU CB C 84 29.400 29.263 0.137 1
1 1012 . 8 1 1 A 84 84 GLU N N 84 120.300 120.986 -0.686 1
1 1013 . 8 1 1 A 85 85 ASP H H 85 8.950 8.143 0.807 1
1 1014 . 8 1 1 A 85 85 ASP HA H 85 4.310 4.345 -0.035 1
1 1017 . 8 1 1 A 85 85 ASP C C 85 178.000 178.765 -0.765 1
1 1018 . 8 1 1 A 85 85 ASP CA C 85 57.100 57.440 -0.340 1
1 1019 . 8 1 1 A 85 85 ASP CB C 85 38.900 40.639 -1.739 1
1 1020 . 8 1 1 A 85 85 ASP N N 85 119.400 120.291 -0.891 1
1 1021 . 8 1 1 A 86 86 VAL H H 86 7.620 8.235 -0.615 1
1 1022 . 8 1 1 A 86 86 VAL HA H 86 3.480 3.567 -0.087 1
1 1030 . 8 1 1 A 86 86 VAL C C 86 177.400 178.035 -0.635 1
1 1031 . 8 1 1 A 86 86 VAL CA C 86 66.800 66.526 0.274 1
1 1032 . 8 1 1 A 86 86 VAL CB C 86 31.300 31.619 -0.319 1
1 1035 . 8 1 1 A 86 86 VAL N N 86 121.600 120.229 1.371 1
1 1036 . 8 1 1 A 87 87 ALA H H 87 7.520 7.800 -0.280 1
1 1037 . 8 1 1 A 87 87 ALA HA H 87 4.110 4.059 0.051 1
1 1041 . 8 1 1 A 87 87 ALA C C 87 181.200 179.726 1.474 1
1 1042 . 8 1 1 A 87 87 ALA CA C 87 55.800 55.778 0.022 1
1 1043 . 8 1 1 A 87 87 ALA CB C 87 17.600 18.178 -0.578 1
1 1044 . 8 1 1 A 87 87 ALA N N 87 122.700 122.349 0.351 1
1 1045 . 8 1 1 A 88 88 ARG H H 88 8.380 8.560 -0.180 1
1 1046 . 8 1 1 A 88 88 ARG HA H 88 4.090 4.034 0.056 1
1 1054 . 8 1 1 A 88 88 ARG C C 88 179.100 179.026 0.074 1
1 1055 . 8 1 1 A 88 88 ARG CA C 88 59.600 59.203 0.397 1
1 1056 . 8 1 1 A 88 88 ARG CB C 88 30.500 30.021 0.479 1
1 1059 . 8 1 1 A 88 88 ARG N N 88 119.200 118.573 0.627 1
1 1061 . 8 1 1 A 89 89 LEU H H 89 8.480 7.897 0.583 1
1 1062 . 8 1 1 A 89 89 LEU HA H 89 4.040 4.069 -0.029 1
1 1071 . 8 1 1 A 89 89 LEU C C 89 177.200 178.731 -1.531 1
1 1072 . 8 1 1 A 89 89 LEU CA C 89 58.300 57.937 0.363 1
1 1073 . 8 1 1 A 89 89 LEU CB C 89 41.300 41.930 -0.630 1
1 1076 . 8 1 1 A 89 89 LEU N N 89 123.300 121.410 1.890 1
1 1077 . 8 1 1 A 90 90 PHE H H 90 8.890 8.242 0.648 1
1 1078 . 8 1 1 A 90 90 PHE HA H 90 4.380 4.030 0.350 1
1 1086 . 8 1 1 A 90 90 PHE C C 90 177.500 178.054 -0.554 1
1 1087 . 8 1 1 A 90 90 PHE CA C 90 59.400 62.229 -2.829 1
1 1088 . 8 1 1 A 90 90 PHE CB C 90 38.600 38.965 -0.365 1
1 1094 . 8 1 1 A 90 90 PHE N N 90 119.400 119.355 0.045 1
1 1095 . 8 1 1 A 91 91 ALA H H 91 7.920 8.494 -0.574 1
1 1096 . 8 1 1 A 91 91 ALA HA H 91 3.940 3.869 0.071 1
1 1100 . 8 1 1 A 91 91 ALA C C 91 180.200 179.834 0.366 1
1 1101 . 8 1 1 A 91 91 ALA CA C 91 55.100 55.193 -0.093 1
1 1102 . 8 1 1 A 91 91 ALA CB C 91 18.000 17.855 0.145 1
1 1103 . 8 1 1 A 91 91 ALA N N 91 120.500 121.508 -1.008 1
1 1104 . 8 1 1 A 92 92 LEU H H 92 8.190 8.605 -0.415 1
1 1105 . 8 1 1 A 92 92 LEU HA H 92 4.300 4.083 0.217 1
1 1115 . 8 1 1 A 92 92 LEU C C 92 178.900 178.409 0.491 1
1 1116 . 8 1 1 A 92 92 LEU CA C 92 57.500 58.041 -0.541 1
1 1117 . 8 1 1 A 92 92 LEU CB C 92 42.100 41.794 0.306 1
1 1121 . 8 1 1 A 92 92 LEU N N 92 120.200 119.498 0.702 1
1 1122 . 8 1 1 A 93 93 VAL H H 93 8.890 8.032 0.858 1
1 1123 . 8 1 1 A 93 93 VAL HA H 93 3.810 3.723 0.087 1
1 1131 . 8 1 1 A 93 93 VAL C C 93 176.900 177.402 -0.502 1
1 1132 . 8 1 1 A 93 93 VAL CA C 93 66.000 65.020 0.980 1
1 1133 . 8 1 1 A 93 93 VAL CB C 93 31.200 31.066 0.134 1
1 1136 . 8 1 1 A 93 93 VAL N N 93 117.100 118.486 -1.386 1
1 1137 . 8 1 1 A 94 94 GLN H H 94 6.920 7.475 -0.555 1
1 1138 . 8 1 1 A 94 94 GLN HA H 94 3.790 3.854 -0.064 1
1 1145 . 8 1 1 A 94 94 GLN C C 94 177.400 178.464 -1.064 1
1 1146 . 8 1 1 A 94 94 GLN CA C 94 60.000 58.765 1.235 1
1 1147 . 8 1 1 A 94 94 GLN CB C 94 30.300 28.093 2.207 1
1 1149 . 8 1 1 A 94 94 GLN N N 94 117.800 120.530 -2.730 1
1 1151 . 8 1 1 A 95 95 VAL H H 95 7.420 7.833 -0.413 1
1 1152 . 8 1 1 A 95 95 VAL HA H 95 3.760 3.548 0.212 1
1 1160 . 8 1 1 A 95 95 VAL C C 95 178.300 178.032 0.268 1
1 1161 . 8 1 1 A 95 95 VAL CA C 95 66.600 66.477 0.123 1
1 1162 . 8 1 1 A 95 95 VAL CB C 95 31.900 31.728 0.172 1
1 1165 . 8 1 1 A 95 95 VAL N N 95 121.500 119.607 1.893 1
1 1166 . 8 1 1 A 96 96 VAL H H 96 8.340 8.290 0.050 1
1 1167 . 8 1 1 A 96 96 VAL HA H 96 3.810 3.599 0.211 1
1 1175 . 8 1 1 A 96 96 VAL C C 96 178.400 178.279 0.121 1
1 1176 . 8 1 1 A 96 96 VAL CA C 96 66.100 66.410 -0.310 1
1 1177 . 8 1 1 A 96 96 VAL CB C 96 32.200 31.520 0.680 1
1 1180 . 8 1 1 A 96 96 VAL N N 96 120.000 119.956 0.044 1
1 1181 . 8 1 1 A 97 97 ALA H H 97 8.140 8.115 0.025 1
1 1182 . 8 1 1 A 97 97 ALA HA H 97 4.010 3.981 0.029 1
1 1186 . 8 1 1 A 97 97 ALA C C 97 178.800 178.664 0.136 1
1 1187 . 8 1 1 A 97 97 ALA CA C 97 54.900 55.743 -0.843 1
1 1188 . 8 1 1 A 97 97 ALA CB C 97 19.900 18.001 1.899 1
1 1189 . 8 1 1 A 97 97 ALA N N 97 121.400 122.008 -0.608 1
1 1190 . 8 1 1 A 98 98 ASP H H 98 8.170 8.153 0.017 1
1 1191 . 8 1 1 A 98 98 ASP HA H 98 4.320 4.373 -0.053 1
1 1194 . 8 1 1 A 98 98 ASP C C 98 178.100 178.399 -0.299 1
1 1195 . 8 1 1 A 98 98 ASP CA C 98 57.100 57.807 -0.707 1
1 1196 . 8 1 1 A 98 98 ASP CB C 98 41.800 41.940 -0.140 1
1 1197 . 8 1 1 A 98 98 ASP N N 98 118.500 118.473 0.027 1
1 1198 . 8 1 1 A 99 99 GLU H H 99 8.220 8.195 0.025 1
1 1199 . 8 1 1 A 99 99 GLU HA H 99 4.000 4.236 -0.236 1
1 1204 . 8 1 1 A 99 99 GLU C C 99 178.300 177.562 0.738 1
1 1205 . 8 1 1 A 99 99 GLU CA C 99 58.300 58.285 0.015 1
1 1206 . 8 1 1 A 99 99 GLU CB C 99 29.800 29.593 0.207 1
1 1208 . 8 1 1 A 99 99 GLU N N 99 116.600 118.161 -1.561 1
1 1209 . 8 1 1 A 100 100 HIS H H 100 7.980 7.781 0.199 1
1 1210 . 8 1 1 A 100 100 HIS HA H 100 4.600 4.412 0.188 1
1 1214 . 8 1 1 A 100 100 HIS C C 100 175.900 176.136 -0.236 1
1 1215 . 8 1 1 A 100 100 HIS CA C 100 57.500 58.415 -0.915 1
1 1216 . 8 1 1 A 100 100 HIS CB C 100 30.800 31.178 -0.378 1
1 1218 . 8 1 1 A 100 100 HIS N N 100 114.000 118.571 -4.571 1
1 1219 . 8 1 1 A 101 101 LEU H H 101 7.920 7.612 0.308 1
1 1220 . 8 1 1 A 101 101 LEU HA H 101 4.370 4.547 -0.177 1
1 1230 . 8 1 1 A 101 101 LEU C C 101 177.700 176.658 1.042 1
1 1231 . 8 1 1 A 101 101 LEU CA C 101 55.900 54.574 1.326 1
1 1232 . 8 1 1 A 101 101 LEU CB C 101 42.100 41.899 0.201 1
1 1236 . 8 1 1 A 101 101 LEU N N 101 118.500 111.622 6.878 1
1 1237 . 8 1 1 A 102 102 GLU H H 102 8.100 7.635 0.465 1
1 1238 . 8 1 1 A 102 102 GLU HA H 102 4.160 4.219 -0.059 1
1 1243 . 8 1 1 A 102 102 GLU C C 102 176.700 176.006 0.694 1
1 1244 . 8 1 1 A 102 102 GLU CA C 102 57.000 57.102 -0.102 1
1 1245 . 8 1 1 A 102 102 GLU CB C 102 29.900 30.375 -0.475 1
1 1247 . 8 1 1 A 102 102 GLU N N 102 119.100 121.667 -2.567 1
1 1248 . 8 1 1 A 103 103 HIS H H 103 8.010 8.730 -0.720 1
1 1249 . 8 1 1 A 103 103 HIS HA H 103 4.520 4.811 -0.291 1
1 1252 . 8 1 1 A 103 103 HIS CA C 103 56.100 54.410 1.690 1
1 1253 . 8 1 1 A 103 103 HIS CB C 103 29.700 31.058 -1.358 1
1 1254 . 8 1 1 A 103 103 HIS N N 103 117.300 127.724 -10.424 1
1 1255 . 8 1 1 A 107 107 HIS HA H 107 4.560 4.611 -0.051 1
1 1258 . 8 1 1 A 107 107 HIS C C 107 173.900 172.512 1.388 1
1 1259 . 8 1 1 A 107 107 HIS CA C 107 55.900 53.945 1.955 1
1 1260 . 8 1 1 A 107 107 HIS CB C 107 30.200 30.539 -0.339 1
1 4 . 9 1 1 A 2 2 ALA H H 2 8.450 8.761 -0.311 1
1 5 . 9 1 1 A 2 2 ALA HA H 2 4.390 5.120 -0.730 1
1 9 . 9 1 1 A 2 2 ALA C C 2 178.300 176.749 1.551 1
1 10 . 9 1 1 A 2 2 ALA CA C 2 52.500 51.074 1.426 1
1 11 . 9 1 1 A 2 2 ALA CB C 2 19.200 23.817 -4.617 1
1 12 . 9 1 1 A 2 2 ALA N N 2 125.100 121.435 3.665 1
1 13 . 9 1 1 A 3 3 GLY H H 3 8.450 8.513 -0.063 1
1 14 . 9 1 1 A 3 3 GLY HA2 H 3 4.030 4.111 -0.081 1
1 15 . 9 1 1 A 3 3 GLY HA3 H 3 4.030 4.111 -0.081 1
1 16 . 9 1 1 A 3 3 GLY C C 3 174.100 173.810 0.290 1
1 17 . 9 1 1 A 3 3 GLY CA C 3 45.200 44.528 0.672 1
1 18 . 9 1 1 A 3 3 GLY N N 3 108.000 106.860 1.140 1
1 19 . 9 1 1 A 4 4 GLN H H 4 8.550 8.701 -0.151 1
1 20 . 9 1 1 A 4 4 GLN HA H 4 4.340 3.852 0.488 1
1 27 . 9 1 1 A 4 4 GLN C C 4 176.700 176.076 0.624 1
1 28 . 9 1 1 A 4 4 GLN CA C 4 56.600 56.526 0.074 1
1 29 . 9 1 1 A 4 4 GLN CB C 4 29.300 27.209 2.091 1
1 31 . 9 1 1 A 4 4 GLN N N 4 120.500 119.219 1.281 1
1 33 . 9 1 1 A 5 5 SER H H 5 8.540 8.136 0.404 1
1 34 . 9 1 1 A 5 5 SER HA H 5 4.390 4.424 -0.034 1
1 38 . 9 1 1 A 5 5 SER C C 5 174.800 175.351 -0.551 1
1 39 . 9 1 1 A 5 5 SER CA C 5 59.100 60.020 -0.920 1
1 40 . 9 1 1 A 5 5 SER CB C 5 63.500 62.927 0.573 1
1 41 . 9 1 1 A 5 5 SER N N 5 117.100 115.212 1.888 1
1 42 . 9 1 1 A 6 6 ASP H H 6 8.300 8.245 0.055 1
1 43 . 9 1 1 A 6 6 ASP HA H 6 4.540 4.364 0.176 1
1 46 . 9 1 1 A 6 6 ASP C C 6 177.300 179.165 -1.865 1
1 47 . 9 1 1 A 6 6 ASP CA C 6 55.100 57.034 -1.934 1
1 48 . 9 1 1 A 6 6 ASP CB C 6 40.800 40.077 0.723 1
1 49 . 9 1 1 A 6 6 ASP N N 6 122.700 123.153 -0.453 1
1 50 . 9 1 1 A 7 7 ARG H H 7 8.270 7.867 0.403 1
1 51 . 9 1 1 A 7 7 ARG HA H 7 4.150 4.130 0.020 1
1 58 . 9 1 1 A 7 7 ARG C C 7 177.600 179.284 -1.684 1
1 59 . 9 1 1 A 7 7 ARG CA C 7 58.000 58.937 -0.937 1
1 60 . 9 1 1 A 7 7 ARG CB C 7 30.100 29.580 0.520 1
1 63 . 9 1 1 A 7 7 ARG N N 7 122.100 120.221 1.879 1
1 64 . 9 1 1 A 8 8 LYS H H 8 8.130 7.739 0.391 1
1 65 . 9 1 1 A 8 8 LYS HA H 8 4.090 4.116 -0.026 1
1 74 . 9 1 1 A 8 8 LYS C C 8 177.600 178.850 -1.250 1
1 75 . 9 1 1 A 8 8 LYS CA C 8 58.400 58.512 -0.112 1
1 76 . 9 1 1 A 8 8 LYS CB C 8 31.700 31.771 -0.071 1
1 80 . 9 1 1 A 8 8 LYS N N 8 120.900 120.233 0.667 1
1 81 . 9 1 1 A 9 9 ALA H H 9 8.050 7.726 0.324 1
1 82 . 9 1 1 A 9 9 ALA HA H 9 3.950 4.202 -0.252 1
1 86 . 9 1 1 A 9 9 ALA C C 9 179.800 179.825 -0.025 1
1 87 . 9 1 1 A 9 9 ALA CA C 9 55.100 53.793 1.307 1
1 88 . 9 1 1 A 9 9 ALA CB C 9 18.100 18.462 -0.362 1
1 89 . 9 1 1 A 9 9 ALA N N 9 121.600 121.816 -0.216 1
1 90 . 9 1 1 A 10 10 ALA H H 10 7.910 7.551 0.359 1
1 91 . 9 1 1 A 10 10 ALA HA H 10 4.200 4.077 0.123 1
1 95 . 9 1 1 A 10 10 ALA C C 10 180.500 180.283 0.217 1
1 96 . 9 1 1 A 10 10 ALA CA C 10 54.600 54.861 -0.261 1
1 97 . 9 1 1 A 10 10 ALA CB C 10 18.100 18.461 -0.361 1
1 98 . 9 1 1 A 10 10 ALA N N 10 120.200 119.409 0.791 1
1 99 . 9 1 1 A 11 11 LEU H H 11 8.080 7.901 0.179 1
1 100 . 9 1 1 A 11 11 LEU HA H 11 4.120 4.046 0.074 1
1 110 . 9 1 1 A 11 11 LEU C C 11 179.600 179.770 -0.170 1
1 111 . 9 1 1 A 11 11 LEU CA C 11 57.800 57.622 0.178 1
1 112 . 9 1 1 A 11 11 LEU CB C 11 41.700 41.275 0.425 1
1 115 . 9 1 1 A 11 11 LEU N N 11 120.900 120.108 0.792 1
1 116 . 9 1 1 A 12 12 LEU H H 12 8.480 7.818 0.662 1
1 117 . 9 1 1 A 12 12 LEU HA H 12 4.040 4.039 0.001 1
1 127 . 9 1 1 A 12 12 LEU C C 12 178.900 178.928 -0.028 1
1 128 . 9 1 1 A 12 12 LEU CA C 12 58.100 58.002 0.098 1
1 129 . 9 1 1 A 12 12 LEU CB C 12 40.100 40.754 -0.654 1
1 133 . 9 1 1 A 12 12 LEU N N 12 118.700 120.309 -1.609 1
1 134 . 9 1 1 A 13 13 ASP H H 13 7.990 8.570 -0.580 1
1 135 . 9 1 1 A 13 13 ASP HA H 13 4.420 4.277 0.143 1
1 138 . 9 1 1 A 13 13 ASP C C 13 178.900 178.437 0.463 1
1 139 . 9 1 1 A 13 13 ASP CA C 13 57.500 57.824 -0.324 1
1 140 . 9 1 1 A 13 13 ASP CB C 13 40.500 41.352 -0.852 1
1 141 . 9 1 1 A 13 13 ASP N N 13 119.500 119.807 -0.307 1
1 142 . 9 1 1 A 14 14 GLN H H 14 7.620 7.637 -0.017 1
1 143 . 9 1 1 A 14 14 GLN HA H 14 4.230 4.139 0.091 1
1 150 . 9 1 1 A 14 14 GLN C C 14 178.400 178.479 -0.079 1
1 151 . 9 1 1 A 14 14 GLN CA C 14 58.100 58.409 -0.309 1
1 152 . 9 1 1 A 14 14 GLN CB C 14 27.800 28.601 -0.801 1
1 154 . 9 1 1 A 14 14 GLN N N 14 118.900 119.795 -0.895 1
1 156 . 9 1 1 A 15 15 VAL H H 15 8.480 7.966 0.514 1
1 157 . 9 1 1 A 15 15 VAL HA H 15 3.380 3.940 -0.560 1
1 165 . 9 1 1 A 15 15 VAL C C 15 177.600 178.077 -0.477 1
1 166 . 9 1 1 A 15 15 VAL CA C 15 66.600 64.385 2.215 1
1 167 . 9 1 1 A 15 15 VAL CB C 15 30.500 31.329 -0.829 1
1 170 . 9 1 1 A 15 15 VAL N N 15 121.300 118.799 2.501 1
1 171 . 9 1 1 A 16 16 ALA H H 16 8.080 7.978 0.102 1
1 172 . 9 1 1 A 16 16 ALA HA H 16 4.450 3.988 0.462 1
1 176 . 9 1 1 A 16 16 ALA C C 16 179.100 179.641 -0.541 1
1 177 . 9 1 1 A 16 16 ALA CA C 16 54.600 55.238 -0.638 1
1 178 . 9 1 1 A 16 16 ALA CB C 16 17.700 18.171 -0.471 1
1 179 . 9 1 1 A 16 16 ALA N N 16 121.400 124.114 -2.714 1
1 180 . 9 1 1 A 17 17 ARG H H 17 7.480 7.650 -0.170 1
1 181 . 9 1 1 A 17 17 ARG HA H 17 3.910 4.147 -0.237 1
1 187 . 9 1 1 A 17 17 ARG C C 17 179.700 179.396 0.304 1
1 188 . 9 1 1 A 17 17 ARG CA C 17 59.700 59.366 0.334 1
1 189 . 9 1 1 A 17 17 ARG CB C 17 30.400 29.993 0.407 1
1 191 . 9 1 1 A 17 17 ARG N N 17 116.900 119.369 -2.469 1
1 192 . 9 1 1 A 18 18 VAL H H 18 7.960 7.744 0.216 1
1 193 . 9 1 1 A 18 18 VAL HA H 18 3.690 3.670 0.020 1
1 201 . 9 1 1 A 18 18 VAL C C 18 177.900 178.017 -0.117 1
1 202 . 9 1 1 A 18 18 VAL CA C 18 66.600 65.910 0.690 1
1 203 . 9 1 1 A 18 18 VAL CB C 18 31.300 31.665 -0.365 1
1 206 . 9 1 1 A 18 18 VAL N N 18 123.000 119.391 3.609 1
1 207 . 9 1 1 A 19 19 GLY H H 19 8.270 8.349 -0.079 1
1 208 . 9 1 1 A 19 19 GLY HA2 H 19 3.430 3.769 -0.339 1
1 209 . 9 1 1 A 19 19 GLY HA3 H 19 3.430 3.777 -0.347 1
1 210 . 9 1 1 A 19 19 GLY C C 19 174.400 175.513 -1.113 1
1 211 . 9 1 1 A 19 19 GLY CA C 19 48.500 47.273 1.227 1
1 212 . 9 1 1 A 19 19 GLY N N 19 105.400 107.422 -2.022 1
1 213 . 9 1 1 A 20 20 LYS H H 20 8.250 8.443 -0.193 1
1 214 . 9 1 1 A 20 20 LYS HA H 20 3.710 4.028 -0.318 1
1 223 . 9 1 1 A 20 20 LYS C C 20 179.400 178.476 0.924 1
1 224 . 9 1 1 A 20 20 LYS CA C 20 59.300 58.851 0.449 1
1 225 . 9 1 1 A 20 20 LYS CB C 20 32.600 32.326 0.274 1
1 229 . 9 1 1 A 20 20 LYS N N 20 118.700 121.752 -3.052 1
1 230 . 9 1 1 A 21 21 ALA H H 21 7.640 7.640 0.000 1
1 231 . 9 1 1 A 21 21 ALA HA H 21 3.790 4.077 -0.287 1
1 235 . 9 1 1 A 21 21 ALA C C 21 177.900 180.466 -2.566 1
1 236 . 9 1 1 A 21 21 ALA CA C 21 55.200 54.751 0.449 1
1 237 . 9 1 1 A 21 21 ALA CB C 21 19.200 18.450 0.750 1
1 238 . 9 1 1 A 21 21 ALA N N 21 121.700 121.079 0.621 1
1 239 . 9 1 1 A 22 22 LEU H H 22 7.330 8.153 -0.823 1
1 240 . 9 1 1 A 22 22 LEU HA H 22 4.140 4.102 0.038 1
1 250 . 9 1 1 A 22 22 LEU C C 22 176.800 177.796 -0.996 1
1 251 . 9 1 1 A 22 22 LEU CA C 22 54.600 57.929 -3.329 1
1 252 . 9 1 1 A 22 22 LEU CB C 22 42.900 41.193 1.707 1
1 256 . 9 1 1 A 22 22 LEU N N 22 114.200 119.603 -5.403 1
1 257 . 9 1 1 A 23 23 ALA H H 23 7.160 8.301 -1.141 1
1 258 . 9 1 1 A 23 23 ALA HA H 23 4.720 4.254 0.466 1
1 262 . 9 1 1 A 23 23 ALA C C 23 176.700 177.463 -0.763 1
1 263 . 9 1 1 A 23 23 ALA CA C 23 53.000 52.825 0.175 1
1 264 . 9 1 1 A 23 23 ALA CB C 23 18.200 17.771 0.429 1
1 265 . 9 1 1 A 23 23 ALA N N 23 118.200 119.498 -1.298 1
1 266 . 9 1 1 A 24 24 ASN H H 24 7.440 7.468 -0.028 1
1 267 . 9 1 1 A 24 24 ASN HA H 24 4.730 4.782 -0.052 1
1 272 . 9 1 1 A 24 24 ASN C C 24 174.800 175.698 -0.898 1
1 273 . 9 1 1 A 24 24 ASN CA C 24 53.500 53.492 0.008 1
1 274 . 9 1 1 A 24 24 ASN CB C 24 41.700 39.289 2.411 1
1 275 . 9 1 1 A 24 24 ASN N N 24 116.800 116.567 0.233 1
1 277 . 9 1 1 A 25 25 GLY H H 25 9.370 7.517 1.853 1
1 278 . 9 1 1 A 25 25 GLY HA2 H 25 3.650 3.928 -0.278 1
1 279 . 9 1 1 A 25 25 GLY HA3 H 25 4.110 3.939 0.171 1
1 280 . 9 1 1 A 25 25 GLY C C 25 175.300 175.248 0.052 1
1 281 . 9 1 1 A 25 25 GLY CA C 25 47.600 47.200 0.400 1
1 282 . 9 1 1 A 25 25 GLY N N 25 114.800 107.707 7.093 1
1 283 . 9 1 1 A 26 26 ARG H H 26 8.050 8.322 -0.272 1
1 284 . 9 1 1 A 26 26 ARG HA H 26 4.150 4.094 0.056 1
1 289 . 9 1 1 A 26 26 ARG C C 26 179.300 177.717 1.583 1
1 290 . 9 1 1 A 26 26 ARG CA C 26 57.000 58.580 -1.580 1
1 291 . 9 1 1 A 26 26 ARG CB C 26 29.900 29.868 0.032 1
1 294 . 9 1 1 A 26 26 ARG N N 26 120.500 125.090 -4.590 1
1 295 . 9 1 1 A 27 27 ARG H H 27 7.930 7.957 -0.027 1
1 296 . 9 1 1 A 27 27 ARG HA H 27 3.710 4.208 -0.498 1
1 301 . 9 1 1 A 27 27 ARG C C 27 178.300 177.351 0.949 1
1 302 . 9 1 1 A 27 27 ARG CA C 27 61.000 57.393 3.607 1
1 303 . 9 1 1 A 27 27 ARG CB C 27 30.400 30.446 -0.046 1
1 305 . 9 1 1 A 27 27 ARG N N 27 117.900 118.523 -0.623 1
1 306 . 9 1 1 A 28 28 LEU H H 28 7.640 7.820 -0.180 1
1 307 . 9 1 1 A 28 28 LEU HA H 28 3.950 4.094 -0.144 1
1 317 . 9 1 1 A 28 28 LEU C C 28 178.200 178.809 -0.609 1
1 318 . 9 1 1 A 28 28 LEU CA C 28 57.600 56.652 0.948 1
1 319 . 9 1 1 A 28 28 LEU CB C 28 41.900 41.146 0.754 1
1 323 . 9 1 1 A 28 28 LEU N N 28 117.600 118.162 -0.562 1
1 324 . 9 1 1 A 29 29 GLN H H 29 8.110 8.197 -0.087 1
1 325 . 9 1 1 A 29 29 GLN HA H 29 3.880 4.142 -0.262 1
1 332 . 9 1 1 A 29 29 GLN C C 29 179.400 179.049 0.351 1
1 333 . 9 1 1 A 29 29 GLN CA C 29 59.100 58.649 0.451 1
1 334 . 9 1 1 A 29 29 GLN CB C 29 28.800 28.197 0.603 1
1 336 . 9 1 1 A 29 29 GLN N N 29 119.300 118.181 1.119 1
1 338 . 9 1 1 A 30 30 ILE H H 30 7.530 7.606 -0.076 1
1 339 . 9 1 1 A 30 30 ILE HA H 30 3.340 3.629 -0.289 1
1 349 . 9 1 1 A 30 30 ILE C C 30 176.700 178.396 -1.696 1
1 350 . 9 1 1 A 30 30 ILE CA C 30 65.900 65.340 0.560 1
1 351 . 9 1 1 A 30 30 ILE CB C 30 37.400 38.021 -0.621 1
1 355 . 9 1 1 A 30 30 ILE N N 30 118.600 120.712 -2.112 1
1 356 . 9 1 1 A 31 31 LEU H H 31 7.500 7.996 -0.496 1
1 357 . 9 1 1 A 31 31 LEU HA H 31 3.520 3.740 -0.220 1
1 367 . 9 1 1 A 31 31 LEU C C 31 177.300 178.687 -1.387 1
1 368 . 9 1 1 A 31 31 LEU CA C 31 58.100 57.873 0.227 1
1 369 . 9 1 1 A 31 31 LEU CB C 31 41.100 40.475 0.625 1
1 373 . 9 1 1 A 31 31 LEU N N 31 119.900 119.438 0.462 1
1 374 . 9 1 1 A 32 32 ASP H H 32 7.950 8.233 -0.283 1
1 375 . 9 1 1 A 32 32 ASP HA H 32 4.300 4.385 -0.085 1
1 378 . 9 1 1 A 32 32 ASP C C 32 178.300 178.228 0.072 1
1 379 . 9 1 1 A 32 32 ASP CA C 32 57.400 57.381 0.019 1
1 380 . 9 1 1 A 32 32 ASP CB C 32 42.400 42.068 0.332 1
1 381 . 9 1 1 A 32 32 ASP N N 32 116.900 119.514 -2.614 1
1 382 . 9 1 1 A 33 33 LEU H H 33 7.350 7.492 -0.142 1
1 383 . 9 1 1 A 33 33 LEU HA H 33 4.130 4.122 0.008 1
1 393 . 9 1 1 A 33 33 LEU C C 33 180.000 178.442 1.558 1
1 394 . 9 1 1 A 33 33 LEU CA C 33 57.600 57.075 0.525 1
1 395 . 9 1 1 A 33 33 LEU CB C 33 42.300 41.571 0.729 1
1 399 . 9 1 1 A 33 33 LEU N N 33 118.600 120.053 -1.453 1
1 400 . 9 1 1 A 34 34 LEU H H 34 8.300 7.826 0.474 1
1 401 . 9 1 1 A 34 34 LEU HA H 34 4.490 4.283 0.207 1
1 411 . 9 1 1 A 34 34 LEU C C 34 178.900 179.082 -0.182 1
1 412 . 9 1 1 A 34 34 LEU CA C 34 55.800 55.944 -0.144 1
1 413 . 9 1 1 A 34 34 LEU CB C 34 41.300 41.895 -0.595 1
1 417 . 9 1 1 A 34 34 LEU N N 34 117.800 117.905 -0.105 1
1 418 . 9 1 1 A 35 35 ALA H H 35 8.160 7.502 0.658 1
1 419 . 9 1 1 A 35 35 ALA HA H 35 4.050 4.049 0.001 1
1 423 . 9 1 1 A 35 35 ALA C C 35 179.000 178.486 0.514 1
1 424 . 9 1 1 A 35 35 ALA CA C 35 54.900 54.537 0.363 1
1 425 . 9 1 1 A 35 35 ALA CB C 35 17.500 18.417 -0.917 1
1 426 . 9 1 1 A 35 35 ALA N N 35 123.900 121.656 2.244 1
1 427 . 9 1 1 A 36 36 GLN H H 36 7.600 7.984 -0.384 1
1 428 . 9 1 1 A 36 36 GLN HA H 36 4.340 4.259 0.081 1
1 435 . 9 1 1 A 36 36 GLN C C 36 176.100 175.362 0.738 1
1 436 . 9 1 1 A 36 36 GLN CA C 36 55.800 55.180 0.620 1
1 437 . 9 1 1 A 36 36 GLN CB C 36 29.000 28.287 0.713 1
1 439 . 9 1 1 A 36 36 GLN N N 36 113.300 113.111 0.189 1
1 441 . 9 1 1 A 37 37 GLY H H 37 7.550 7.149 0.401 1
1 442 . 9 1 1 A 37 37 GLY HA2 H 37 3.730 4.066 -0.336 1
1 443 . 9 1 1 A 37 37 GLY HA3 H 37 4.490 4.068 0.422 1
1 444 . 9 1 1 A 37 37 GLY C C 37 171.500 172.986 -1.486 1
1 445 . 9 1 1 A 37 37 GLY CA C 37 44.500 43.993 0.507 1
1 446 . 9 1 1 A 37 37 GLY N N 37 108.400 107.749 0.651 1
1 447 . 9 1 1 A 38 38 GLU H H 38 8.120 8.469 -0.349 1
1 448 . 9 1 1 A 38 38 GLU HA H 38 4.820 4.546 0.274 1
1 453 . 9 1 1 A 38 38 GLU C C 38 177.000 175.604 1.396 1
1 454 . 9 1 1 A 38 38 GLU CA C 38 56.400 56.513 -0.113 1
1 455 . 9 1 1 A 38 38 GLU CB C 38 31.200 30.112 1.088 1
1 457 . 9 1 1 A 38 38 GLU N N 38 119.600 118.270 1.330 1
1 458 . 9 1 1 A 39 39 ARG H H 39 8.580 9.047 -0.467 1
1 459 . 9 1 1 A 39 39 ARG HA H 39 4.970 5.237 -0.267 1
1 467 . 9 1 1 A 39 39 ARG C C 39 174.800 175.671 -0.871 1
1 468 . 9 1 1 A 39 39 ARG CA C 39 53.900 54.123 -0.223 1
1 469 . 9 1 1 A 39 39 ARG CB C 39 36.400 33.999 2.401 1
1 472 . 9 1 1 A 39 39 ARG N N 39 121.500 123.373 -1.873 1
1 474 . 9 1 1 A 40 40 ALA H H 40 8.910 8.939 -0.029 1
1 475 . 9 1 1 A 40 40 ALA HA H 40 4.920 4.213 0.707 1
1 479 . 9 1 1 A 40 40 ALA C C 40 179.200 178.349 0.851 1
1 480 . 9 1 1 A 40 40 ALA CA C 40 51.100 51.946 -0.846 1
1 481 . 9 1 1 A 40 40 ALA CB C 40 19.200 19.075 0.125 1
1 482 . 9 1 1 A 40 40 ALA N N 40 125.100 128.301 -3.201 1
1 483 . 9 1 1 A 41 41 VAL H H 41 8.420 8.458 -0.038 1
1 484 . 9 1 1 A 41 41 VAL HA H 41 3.430 3.590 -0.160 1
1 492 . 9 1 1 A 41 41 VAL C C 41 176.800 177.132 -0.332 1
1 493 . 9 1 1 A 41 41 VAL CA C 41 67.600 66.852 0.748 1
1 494 . 9 1 1 A 41 41 VAL CB C 41 31.600 31.765 -0.165 1
1 497 . 9 1 1 A 41 41 VAL N N 41 120.900 121.001 -0.101 1
1 498 . 9 1 1 A 42 42 GLU H H 42 9.640 8.300 1.340 1
1 499 . 9 1 1 A 42 42 GLU HA H 42 3.880 3.979 -0.099 1
1 504 . 9 1 1 A 42 42 GLU C C 42 178.300 178.684 -0.384 1
1 505 . 9 1 1 A 42 42 GLU CA C 42 60.600 59.428 1.172 1
1 506 . 9 1 1 A 42 42 GLU CB C 42 28.300 29.655 -1.355 1
1 508 . 9 1 1 A 42 42 GLU N N 42 119.000 119.568 -0.568 1
1 509 . 9 1 1 A 43 43 ALA H H 43 6.870 7.645 -0.775 1
1 510 . 9 1 1 A 43 43 ALA HA H 43 4.290 4.102 0.188 1
1 514 . 9 1 1 A 43 43 ALA C C 43 180.700 179.597 1.103 1
1 515 . 9 1 1 A 43 43 ALA CA C 43 54.100 55.080 -0.980 1
1 516 . 9 1 1 A 43 43 ALA CB C 43 19.100 18.360 0.740 1
1 517 . 9 1 1 A 43 43 ALA N N 43 120.500 121.971 -1.471 1
1 518 . 9 1 1 A 44 44 ILE H H 44 7.970 8.064 -0.094 1
1 519 . 9 1 1 A 44 44 ILE HA H 44 3.470 3.623 -0.153 1
1 529 . 9 1 1 A 44 44 ILE C C 44 178.300 178.140 0.160 1
1 530 . 9 1 1 A 44 44 ILE CA C 44 64.700 65.553 -0.853 1
1 531 . 9 1 1 A 44 44 ILE CB C 44 38.100 37.912 0.188 1
1 535 . 9 1 1 A 44 44 ILE N N 44 120.500 118.902 1.598 1
1 536 . 9 1 1 A 45 45 ALA H H 45 8.460 8.393 0.067 1
1 537 . 9 1 1 A 45 45 ALA HA H 45 3.720 4.011 -0.291 1
1 541 . 9 1 1 A 45 45 ALA C C 45 178.500 179.606 -1.106 1
1 542 . 9 1 1 A 45 45 ALA CA C 45 56.200 55.308 0.892 1
1 543 . 9 1 1 A 45 45 ALA CB C 45 17.400 18.398 -0.998 1
1 544 . 9 1 1 A 45 45 ALA N N 45 124.500 122.165 2.335 1
1 545 . 9 1 1 A 46 46 THR H H 46 8.080 8.404 -0.324 1
1 546 . 9 1 1 A 46 46 THR HA H 46 3.900 3.828 0.072 1
1 551 . 9 1 1 A 46 46 THR C C 46 177.200 176.446 0.754 1
1 552 . 9 1 1 A 46 46 THR CA C 46 66.400 67.191 -0.791 1
1 553 . 9 1 1 A 46 46 THR CB C 46 68.800 68.776 0.024 1
1 555 . 9 1 1 A 46 46 THR N N 46 112.400 113.868 -1.468 1
1 556 . 9 1 1 A 47 47 ALA H H 47 7.930 8.264 -0.334 1
1 557 . 9 1 1 A 47 47 ALA HA H 47 4.200 4.141 0.059 1
1 561 . 9 1 1 A 47 47 ALA C C 47 179.200 179.572 -0.372 1
1 562 . 9 1 1 A 47 47 ALA CA C 47 54.800 55.340 -0.540 1
1 563 . 9 1 1 A 47 47 ALA CB C 47 19.800 18.265 1.535 1
1 564 . 9 1 1 A 47 47 ALA N N 47 121.400 123.694 -2.294 1
1 565 . 9 1 1 A 48 48 THR H H 48 7.560 7.575 -0.015 1
1 566 . 9 1 1 A 48 48 THR HA H 48 4.390 4.397 -0.007 1
1 571 . 9 1 1 A 48 48 THR C C 48 175.700 175.507 0.193 1
1 572 . 9 1 1 A 48 48 THR CA C 48 61.800 62.475 -0.675 1
1 573 . 9 1 1 A 48 48 THR CB C 48 71.000 70.164 0.836 1
1 575 . 9 1 1 A 48 48 THR N N 48 103.500 106.138 -2.638 1
1 576 . 9 1 1 A 49 49 GLY H H 49 7.820 8.104 -0.284 1
1 577 . 9 1 1 A 49 49 GLY HA2 H 49 3.870 3.954 -0.084 1
1 578 . 9 1 1 A 49 49 GLY HA3 H 49 4.100 3.956 0.144 1
1 579 . 9 1 1 A 49 49 GLY C C 49 174.400 174.260 0.140 1
1 580 . 9 1 1 A 49 49 GLY CA C 49 46.300 46.173 0.127 1
1 581 . 9 1 1 A 49 49 GLY N N 49 111.100 111.780 -0.680 1
1 582 . 9 1 1 A 50 50 MET H H 50 7.930 8.311 -0.381 1
1 583 . 9 1 1 A 50 50 MET HA H 50 4.540 4.836 -0.296 1
1 591 . 9 1 1 A 50 50 MET C C 50 174.800 174.883 -0.083 1
1 592 . 9 1 1 A 50 50 MET CA C 50 55.100 54.650 0.450 1
1 593 . 9 1 1 A 50 50 MET CB C 50 37.200 34.961 2.239 1
1 596 . 9 1 1 A 50 50 MET N N 50 119.300 118.892 0.408 1
1 597 . 9 1 1 A 51 51 ASN H H 51 8.040 8.316 -0.276 1
1 598 . 9 1 1 A 51 51 ASN HA H 51 4.580 4.851 -0.271 1
1 601 . 9 1 1 A 51 51 ASN C C 51 176.100 176.313 -0.213 1
1 602 . 9 1 1 A 51 51 ASN CA C 51 52.800 53.026 -0.226 1
1 603 . 9 1 1 A 51 51 ASN CB C 51 41.100 39.752 1.348 1
1 604 . 9 1 1 A 51 51 ASN N N 51 118.000 119.884 -1.884 1
1 605 . 9 1 1 A 52 52 LEU H H 52 8.560 8.799 -0.239 1
1 606 . 9 1 1 A 52 52 LEU HA H 52 3.760 3.906 -0.146 1
1 616 . 9 1 1 A 52 52 LEU C C 52 179.600 178.790 0.810 1
1 617 . 9 1 1 A 52 52 LEU CA C 52 59.000 57.735 1.265 1
1 618 . 9 1 1 A 52 52 LEU CB C 52 41.800 41.331 0.469 1
1 622 . 9 1 1 A 52 52 LEU N N 52 120.600 125.811 -5.211 1
1 623 . 9 1 1 A 53 53 THR H H 53 8.230 8.022 0.208 1
1 624 . 9 1 1 A 53 53 THR HA H 53 3.880 3.869 0.011 1
1 629 . 9 1 1 A 53 53 THR C C 53 176.900 176.836 0.064 1
1 630 . 9 1 1 A 53 53 THR CA C 53 66.500 66.663 -0.163 1
1 631 . 9 1 1 A 53 53 THR CB C 53 68.400 68.537 -0.137 1
1 633 . 9 1 1 A 53 53 THR N N 53 115.800 115.982 -0.182 1
1 634 . 9 1 1 A 54 54 THR H H 54 8.420 8.170 0.250 1
1 635 . 9 1 1 A 54 54 THR HA H 54 3.880 3.860 0.020 1
1 640 . 9 1 1 A 54 54 THR C C 54 177.300 176.340 0.960 1
1 641 . 9 1 1 A 54 54 THR CA C 54 66.600 66.366 0.234 1
1 642 . 9 1 1 A 54 54 THR CB C 54 66.600 68.792 -2.192 1
1 644 . 9 1 1 A 54 54 THR N N 54 122.300 116.824 5.476 1
1 645 . 9 1 1 A 55 55 ALA H H 55 8.860 8.340 0.520 1
1 646 . 9 1 1 A 55 55 ALA HA H 55 4.020 3.872 0.148 1
1 650 . 9 1 1 A 55 55 ALA C C 55 179.000 179.619 -0.619 1
1 651 . 9 1 1 A 55 55 ALA CA C 55 56.100 55.273 0.827 1
1 652 . 9 1 1 A 55 55 ALA CB C 55 17.000 17.713 -0.713 1
1 653 . 9 1 1 A 55 55 ALA N N 55 125.600 123.434 2.166 1
1 654 . 9 1 1 A 56 56 SER H H 56 8.440 8.193 0.247 1
1 655 . 9 1 1 A 56 56 SER HA H 56 3.920 3.938 -0.018 1
1 658 . 9 1 1 A 56 56 SER C C 56 176.400 177.141 -0.741 1
1 659 . 9 1 1 A 56 56 SER CA C 56 62.600 61.366 1.234 1
1 660 . 9 1 1 A 56 56 SER CB C 56 62.700 62.874 -0.174 1
1 661 . 9 1 1 A 56 56 SER N N 56 112.700 113.009 -0.309 1
1 662 . 9 1 1 A 57 57 ALA H H 57 8.090 8.046 0.044 1
1 663 . 9 1 1 A 57 57 ALA HA H 57 4.130 4.037 0.093 1
1 667 . 9 1 1 A 57 57 ALA C C 57 181.200 180.004 1.196 1
1 668 . 9 1 1 A 57 57 ALA CA C 57 55.200 55.221 -0.021 1
1 669 . 9 1 1 A 57 57 ALA CB C 57 17.900 18.184 -0.284 1
1 670 . 9 1 1 A 57 57 ALA N N 57 124.000 122.270 1.730 1
1 671 . 9 1 1 A 58 58 ASN H H 58 7.970 7.857 0.113 1
1 672 . 9 1 1 A 58 58 ASN HA H 58 4.480 4.507 -0.027 1
1 677 . 9 1 1 A 58 58 ASN C C 58 177.500 178.215 -0.715 1
1 678 . 9 1 1 A 58 58 ASN CA C 58 56.900 56.267 0.633 1
1 679 . 9 1 1 A 58 58 ASN CB C 58 39.800 38.134 1.666 1
1 680 . 9 1 1 A 58 58 ASN N N 58 117.600 117.155 0.445 1
1 682 . 9 1 1 A 59 59 LEU H H 59 8.530 8.487 0.043 1
1 683 . 9 1 1 A 59 59 LEU HA H 59 3.710 3.812 -0.102 1
1 693 . 9 1 1 A 59 59 LEU C C 59 178.400 179.082 -0.682 1
1 694 . 9 1 1 A 59 59 LEU CA C 59 58.600 57.669 0.931 1
1 695 . 9 1 1 A 59 59 LEU CB C 59 40.500 40.673 -0.173 1
1 699 . 9 1 1 A 59 59 LEU N N 59 122.600 121.448 1.152 1
1 700 . 9 1 1 A 60 60 GLN H H 60 8.200 8.284 -0.084 1
1 701 . 9 1 1 A 60 60 GLN HA H 60 4.020 4.152 -0.132 1
1 708 . 9 1 1 A 60 60 GLN C C 60 178.700 178.423 0.277 1
1 709 . 9 1 1 A 60 60 GLN CA C 60 58.800 58.885 -0.085 1
1 710 . 9 1 1 A 60 60 GLN CB C 60 27.700 28.159 -0.459 1
1 712 . 9 1 1 A 60 60 GLN N N 60 118.900 118.120 0.780 1
1 714 . 9 1 1 A 61 61 ALA H H 61 7.580 7.587 -0.007 1
1 715 . 9 1 1 A 61 61 ALA HA H 61 4.230 4.007 0.223 1
1 719 . 9 1 1 A 61 61 ALA C C 61 181.300 180.299 1.001 1
1 720 . 9 1 1 A 61 61 ALA CA C 61 55.100 54.968 0.132 1
1 721 . 9 1 1 A 61 61 ALA CB C 61 17.600 17.976 -0.376 1
1 722 . 9 1 1 A 61 61 ALA N N 61 122.200 122.944 -0.744 1
1 723 . 9 1 1 A 62 62 LEU H H 62 7.830 8.057 -0.227 1
1 724 . 9 1 1 A 62 62 LEU HA H 62 3.980 4.022 -0.042 1
1 734 . 9 1 1 A 62 62 LEU C C 62 178.500 179.058 -0.558 1
1 735 . 9 1 1 A 62 62 LEU CA C 62 58.100 57.471 0.629 1
1 736 . 9 1 1 A 62 62 LEU CB C 62 43.300 41.281 2.019 1
1 739 . 9 1 1 A 62 62 LEU N N 62 119.000 118.592 0.408 1
1 740 . 9 1 1 A 63 63 LYS H H 63 8.580 8.337 0.243 1
1 741 . 9 1 1 A 63 63 LYS HA H 63 4.130 4.085 0.045 1
1 750 . 9 1 1 A 63 63 LYS C C 63 180.500 178.692 1.808 1
1 751 . 9 1 1 A 63 63 LYS CA C 63 59.700 58.817 0.883 1
1 752 . 9 1 1 A 63 63 LYS CB C 63 32.600 32.096 0.504 1
1 756 . 9 1 1 A 63 63 LYS N N 63 123.400 122.038 1.362 1
1 757 . 9 1 1 A 64 64 SER H H 64 8.640 8.130 0.510 1
1 758 . 9 1 1 A 64 64 SER HA H 64 4.300 4.308 -0.008 1
1 761 . 9 1 1 A 64 64 SER C C 64 175.000 176.742 -1.742 1
1 762 . 9 1 1 A 64 64 SER CA C 64 61.400 60.561 0.839 1
1 763 . 9 1 1 A 64 64 SER CB C 64 63.000 62.877 0.123 1
1 764 . 9 1 1 A 64 64 SER N N 64 117.700 114.945 2.755 1
1 765 . 9 1 1 A 65 65 GLY H H 65 7.280 7.768 -0.488 1
1 766 . 9 1 1 A 65 65 GLY HA2 H 65 3.240 3.941 -0.701 1
1 767 . 9 1 1 A 65 65 GLY HA3 H 65 3.980 3.942 0.038 1
1 768 . 9 1 1 A 65 65 GLY C C 65 171.300 174.950 -3.650 1
1 769 . 9 1 1 A 65 65 GLY CA C 65 45.100 45.684 -0.584 1
1 770 . 9 1 1 A 65 65 GLY N N 65 104.400 107.122 -2.722 1
1 771 . 9 1 1 A 66 66 GLY H H 66 7.730 7.673 0.057 1
1 772 . 9 1 1 A 66 66 GLY HA2 H 66 3.650 4.035 -0.385 1
1 773 . 9 1 1 A 66 66 GLY HA3 H 66 3.750 4.038 -0.288 1
1 774 . 9 1 1 A 66 66 GLY C C 66 173.700 175.379 -1.679 1
1 775 . 9 1 1 A 66 66 GLY CA C 66 45.400 45.290 0.110 1
1 776 . 9 1 1 A 66 66 GLY N N 66 104.700 108.107 -3.407 1
1 777 . 9 1 1 A 67 67 LEU H H 67 7.520 8.108 -0.588 1
1 778 . 9 1 1 A 67 67 LEU HA H 67 4.310 4.199 0.111 1
1 788 . 9 1 1 A 67 67 LEU C C 67 177.700 176.873 0.827 1
1 789 . 9 1 1 A 67 67 LEU CA C 67 55.500 56.237 -0.737 1
1 790 . 9 1 1 A 67 67 LEU CB C 67 42.400 42.350 0.050 1
1 794 . 9 1 1 A 67 67 LEU N N 67 110.600 119.088 -8.488 1
1 795 . 9 1 1 A 68 68 VAL H H 68 6.890 7.358 -0.468 1
1 796 . 9 1 1 A 68 68 VAL HA H 68 5.190 5.261 -0.071 1
1 804 . 9 1 1 A 68 68 VAL C C 68 173.700 174.961 -1.261 1
1 805 . 9 1 1 A 68 68 VAL CA C 68 57.400 58.731 -1.331 1
1 806 . 9 1 1 A 68 68 VAL CB C 68 36.400 35.331 1.069 1
1 809 . 9 1 1 A 68 68 VAL N N 68 106.400 111.340 -4.940 1
1 810 . 9 1 1 A 69 69 GLU H H 69 8.880 9.194 -0.314 1
1 811 . 9 1 1 A 69 69 GLU HA H 69 4.660 4.897 -0.237 1
1 816 . 9 1 1 A 69 69 GLU C C 69 173.300 174.997 -1.697 1
1 817 . 9 1 1 A 69 69 GLU CA C 69 54.300 54.742 -0.442 1
1 818 . 9 1 1 A 69 69 GLU CB C 69 34.100 33.496 0.604 1
1 820 . 9 1 1 A 69 69 GLU N N 69 120.400 121.168 -0.768 1
1 821 . 9 1 1 A 70 70 ALA H H 70 8.730 8.692 0.038 1
1 822 . 9 1 1 A 70 70 ALA HA H 70 4.990 4.989 0.001 1
1 826 . 9 1 1 A 70 70 ALA C C 70 176.500 175.736 0.764 1
1 827 . 9 1 1 A 70 70 ALA CA C 70 50.000 50.070 -0.070 1
1 828 . 9 1 1 A 70 70 ALA CB C 70 22.300 21.601 0.699 1
1 829 . 9 1 1 A 70 70 ALA N N 70 122.800 121.501 1.299 1
1 830 . 9 1 1 A 71 71 ARG H H 71 8.670 8.874 -0.204 1
1 831 . 9 1 1 A 71 71 ARG HA H 71 4.630 4.888 -0.258 1
1 843 . 9 1 1 A 71 71 ARG C C 71 173.500 174.459 -0.959 1
1 844 . 9 1 1 A 71 71 ARG CA C 71 54.600 54.793 -0.193 1
1 845 . 9 1 1 A 71 71 ARG CB C 71 33.600 33.988 -0.388 1
1 849 . 9 1 1 A 71 71 ARG N N 71 120.100 122.093 -1.993 1
1 851 . 9 1 1 A 72 72 ARG H H 72 8.780 8.712 0.068 1
1 852 . 9 1 1 A 72 72 ARG HA H 72 5.100 5.157 -0.057 1
1 859 . 9 1 1 A 72 72 ARG C C 72 176.000 175.162 0.838 1
1 860 . 9 1 1 A 72 72 ARG CA C 72 54.900 55.690 -0.790 1
1 861 . 9 1 1 A 72 72 ARG CB C 72 32.500 32.220 0.280 1
1 864 . 9 1 1 A 72 72 ARG N N 72 123.600 126.044 -2.444 1
1 865 . 9 1 1 A 73 73 GLU H H 73 8.720 9.177 -0.457 1
1 866 . 9 1 1 A 73 73 GLU HA H 73 4.510 4.709 -0.199 1
1 871 . 9 1 1 A 73 73 GLU C C 73 175.900 176.602 -0.702 1
1 872 . 9 1 1 A 73 73 GLU CA C 73 55.700 55.759 -0.059 1
1 873 . 9 1 1 A 73 73 GLU CB C 73 31.800 32.260 -0.460 1
1 875 . 9 1 1 A 73 73 GLU N N 73 126.800 123.515 3.285 1
1 876 . 9 1 1 A 74 74 GLY H H 74 9.190 9.025 0.165 1
1 877 . 9 1 1 A 74 74 GLY HA2 H 74 3.700 3.889 -0.189 1
1 878 . 9 1 1 A 74 74 GLY HA3 H 74 4.170 3.918 0.252 1
1 879 . 9 1 1 A 74 74 GLY C C 74 175.400 174.848 0.552 1
1 880 . 9 1 1 A 74 74 GLY CA C 74 47.100 47.255 -0.155 1
1 881 . 9 1 1 A 74 74 GLY N N 74 118.500 116.658 1.842 1
1 882 . 9 1 1 A 75 75 THR H H 75 8.780 8.755 0.025 1
1 883 . 9 1 1 A 75 75 THR HA H 75 4.290 4.524 -0.234 1
1 888 . 9 1 1 A 75 75 THR C C 75 174.600 174.300 0.300 1
1 889 . 9 1 1 A 75 75 THR CA C 75 62.000 62.226 -0.226 1
1 890 . 9 1 1 A 75 75 THR CB C 75 69.000 70.373 -1.373 1
1 892 . 9 1 1 A 75 75 THR N N 75 118.000 120.344 -2.344 1
1 893 . 9 1 1 A 76 76 ARG H H 76 8.030 7.668 0.362 1
1 894 . 9 1 1 A 76 76 ARG HA H 76 4.610 4.682 -0.072 1
1 901 . 9 1 1 A 76 76 ARG C C 76 174.800 174.921 -0.121 1
1 902 . 9 1 1 A 76 76 ARG CA C 76 55.500 54.599 0.901 1
1 903 . 9 1 1 A 76 76 ARG CB C 76 32.700 31.730 0.970 1
1 906 . 9 1 1 A 76 76 ARG N N 76 122.600 122.004 0.596 1
1 907 . 9 1 1 A 77 77 GLN H H 77 8.580 8.466 0.114 1
1 908 . 9 1 1 A 77 77 GLN HA H 77 4.910 4.707 0.203 1
1 915 . 9 1 1 A 77 77 GLN C C 77 173.900 173.987 -0.087 1
1 916 . 9 1 1 A 77 77 GLN CA C 77 54.700 54.337 0.363 1
1 917 . 9 1 1 A 77 77 GLN CB C 77 31.800 29.476 2.324 1
1 919 . 9 1 1 A 77 77 GLN N N 77 121.900 122.200 -0.300 1
1 921 . 9 1 1 A 78 78 TYR H H 78 8.890 9.390 -0.500 1
1 922 . 9 1 1 A 78 78 TYR HA H 78 4.750 5.219 -0.469 1
1 929 . 9 1 1 A 78 78 TYR C C 78 175.600 174.578 1.022 1
1 930 . 9 1 1 A 78 78 TYR CA C 78 57.000 56.242 0.758 1
1 931 . 9 1 1 A 78 78 TYR CB C 78 41.400 40.788 0.612 1
1 936 . 9 1 1 A 78 78 TYR N N 78 121.800 126.968 -5.168 1
1 937 . 9 1 1 A 79 79 TYR H H 79 9.010 9.635 -0.625 1
1 938 . 9 1 1 A 79 79 TYR HA H 79 5.410 5.623 -0.213 1
1 945 . 9 1 1 A 79 79 TYR C C 79 173.100 175.229 -2.129 1
1 946 . 9 1 1 A 79 79 TYR CA C 79 57.300 57.047 0.253 1
1 947 . 9 1 1 A 79 79 TYR CB C 79 43.300 41.641 1.659 1
1 952 . 9 1 1 A 79 79 TYR N N 79 122.500 122.263 0.237 1
1 953 . 9 1 1 A 80 80 ARG H H 80 8.720 9.212 -0.492 1
1 954 . 9 1 1 A 80 80 ARG HA H 80 5.120 5.040 0.080 1
1 962 . 9 1 1 A 80 80 ARG C C 80 175.500 174.968 0.532 1
1 963 . 9 1 1 A 80 80 ARG CA C 80 53.200 54.284 -1.084 1
1 964 . 9 1 1 A 80 80 ARG CB C 80 33.900 34.068 -0.168 1
1 967 . 9 1 1 A 80 80 ARG N N 80 114.500 120.088 -5.588 1
1 969 . 9 1 1 A 81 81 ILE H H 81 9.300 8.697 0.603 1
1 970 . 9 1 1 A 81 81 ILE HA H 81 4.150 4.135 0.015 1
1 980 . 9 1 1 A 81 81 ILE C C 81 177.800 177.312 0.488 1
1 981 . 9 1 1 A 81 81 ILE CA C 81 62.300 61.939 0.361 1
1 982 . 9 1 1 A 81 81 ILE CB C 81 37.800 37.748 0.052 1
1 986 . 9 1 1 A 81 81 ILE N N 81 122.100 121.815 0.285 1
1 987 . 9 1 1 A 82 82 ALA H H 82 7.930 8.701 -0.771 1
1 988 . 9 1 1 A 82 82 ALA HA H 82 3.930 4.062 -0.132 1
1 992 . 9 1 1 A 82 82 ALA C C 82 176.300 177.226 -0.926 1
1 993 . 9 1 1 A 82 82 ALA CA C 82 54.200 55.287 -1.087 1
1 994 . 9 1 1 A 82 82 ALA CB C 82 18.500 19.240 -0.740 1
1 995 . 9 1 1 A 82 82 ALA N N 82 127.200 127.110 0.090 1
1 996 . 9 1 1 A 83 83 GLY H H 83 6.980 7.399 -0.419 1
1 997 . 9 1 1 A 83 83 GLY HA2 H 83 4.090 3.992 0.098 1
1 998 . 9 1 1 A 83 83 GLY HA3 H 83 4.440 3.994 0.446 1
1 999 . 9 1 1 A 83 83 GLY C C 83 173.600 175.143 -1.543 1
1 1000 . 9 1 1 A 83 83 GLY CA C 83 45.200 45.470 -0.270 1
1 1001 . 9 1 1 A 83 83 GLY N N 83 101.800 102.643 -0.843 1
1 1002 . 9 1 1 A 84 84 GLU H H 84 8.930 8.929 0.001 1
1 1003 . 9 1 1 A 84 84 GLU HA H 84 4.120 3.951 0.169 1
1 1008 . 9 1 1 A 84 84 GLU C C 84 178.300 177.829 0.471 1
1 1009 . 9 1 1 A 84 84 GLU CA C 84 58.900 59.049 -0.149 1
1 1010 . 9 1 1 A 84 84 GLU CB C 84 29.400 29.556 -0.156 1
1 1012 . 9 1 1 A 84 84 GLU N N 84 120.300 120.286 0.014 1
1 1013 . 9 1 1 A 85 85 ASP H H 85 8.950 8.168 0.782 1
1 1014 . 9 1 1 A 85 85 ASP HA H 85 4.310 4.412 -0.102 1
1 1017 . 9 1 1 A 85 85 ASP C C 85 178.000 178.534 -0.534 1
1 1018 . 9 1 1 A 85 85 ASP CA C 85 57.100 57.310 -0.210 1
1 1019 . 9 1 1 A 85 85 ASP CB C 85 38.900 40.633 -1.733 1
1 1020 . 9 1 1 A 85 85 ASP N N 85 119.400 120.560 -1.160 1
1 1021 . 9 1 1 A 86 86 VAL H H 86 7.620 7.846 -0.226 1
1 1022 . 9 1 1 A 86 86 VAL HA H 86 3.480 3.627 -0.147 1
1 1030 . 9 1 1 A 86 86 VAL C C 86 177.400 177.991 -0.591 1
1 1031 . 9 1 1 A 86 86 VAL CA C 86 66.800 66.394 0.406 1
1 1032 . 9 1 1 A 86 86 VAL CB C 86 31.300 31.524 -0.224 1
1 1035 . 9 1 1 A 86 86 VAL N N 86 121.600 120.802 0.798 1
1 1036 . 9 1 1 A 87 87 ALA H H 87 7.520 8.122 -0.602 1
1 1037 . 9 1 1 A 87 87 ALA HA H 87 4.110 4.028 0.082 1
1 1041 . 9 1 1 A 87 87 ALA C C 87 181.200 179.795 1.405 1
1 1042 . 9 1 1 A 87 87 ALA CA C 87 55.800 55.691 0.109 1
1 1043 . 9 1 1 A 87 87 ALA CB C 87 17.600 17.919 -0.319 1
1 1044 . 9 1 1 A 87 87 ALA N N 87 122.700 122.150 0.550 1
1 1045 . 9 1 1 A 88 88 ARG H H 88 8.380 8.375 0.005 1
1 1046 . 9 1 1 A 88 88 ARG HA H 88 4.090 4.059 0.031 1
1 1054 . 9 1 1 A 88 88 ARG C C 88 179.100 178.903 0.197 1
1 1055 . 9 1 1 A 88 88 ARG CA C 88 59.600 58.806 0.794 1
1 1056 . 9 1 1 A 88 88 ARG CB C 88 30.500 29.879 0.621 1
1 1059 . 9 1 1 A 88 88 ARG N N 88 119.200 118.219 0.981 1
1 1061 . 9 1 1 A 89 89 LEU H H 89 8.480 7.969 0.511 1
1 1062 . 9 1 1 A 89 89 LEU HA H 89 4.040 4.062 -0.022 1
1 1071 . 9 1 1 A 89 89 LEU C C 89 177.200 178.649 -1.449 1
1 1072 . 9 1 1 A 89 89 LEU CA C 89 58.300 58.025 0.275 1
1 1073 . 9 1 1 A 89 89 LEU CB C 89 41.300 41.980 -0.680 1
1 1076 . 9 1 1 A 89 89 LEU N N 89 123.300 121.940 1.360 1
1 1077 . 9 1 1 A 90 90 PHE H H 90 8.890 8.369 0.521 1
1 1078 . 9 1 1 A 90 90 PHE HA H 90 4.380 4.009 0.371 1
1 1086 . 9 1 1 A 90 90 PHE C C 90 177.500 177.903 -0.403 1
1 1087 . 9 1 1 A 90 90 PHE CA C 90 59.400 62.361 -2.961 1
1 1088 . 9 1 1 A 90 90 PHE CB C 90 38.600 38.837 -0.237 1
1 1094 . 9 1 1 A 90 90 PHE N N 90 119.400 119.497 -0.097 1
1 1095 . 9 1 1 A 91 91 ALA H H 91 7.920 8.563 -0.643 1
1 1096 . 9 1 1 A 91 91 ALA HA H 91 3.940 4.015 -0.075 1
1 1100 . 9 1 1 A 91 91 ALA C C 91 180.200 179.992 0.208 1
1 1101 . 9 1 1 A 91 91 ALA CA C 91 55.100 55.202 -0.102 1
1 1102 . 9 1 1 A 91 91 ALA CB C 91 18.000 18.288 -0.288 1
1 1103 . 9 1 1 A 91 91 ALA N N 91 120.500 121.433 -0.933 1
1 1104 . 9 1 1 A 92 92 LEU H H 92 8.190 8.434 -0.244 1
1 1105 . 9 1 1 A 92 92 LEU HA H 92 4.300 4.082 0.218 1
1 1115 . 9 1 1 A 92 92 LEU C C 92 178.900 178.341 0.559 1
1 1116 . 9 1 1 A 92 92 LEU CA C 92 57.500 57.949 -0.449 1
1 1117 . 9 1 1 A 92 92 LEU CB C 92 42.100 41.610 0.490 1
1 1121 . 9 1 1 A 92 92 LEU N N 92 120.200 119.574 0.626 1
1 1122 . 9 1 1 A 93 93 VAL H H 93 8.890 7.979 0.911 1
1 1123 . 9 1 1 A 93 93 VAL HA H 93 3.810 3.709 0.101 1
1 1131 . 9 1 1 A 93 93 VAL C C 93 176.900 177.378 -0.478 1
1 1132 . 9 1 1 A 93 93 VAL CA C 93 66.000 64.970 1.030 1
1 1133 . 9 1 1 A 93 93 VAL CB C 93 31.200 31.070 0.130 1
1 1136 . 9 1 1 A 93 93 VAL N N 93 117.100 118.469 -1.369 1
1 1137 . 9 1 1 A 94 94 GLN H H 94 6.920 7.505 -0.585 1
1 1138 . 9 1 1 A 94 94 GLN HA H 94 3.790 3.823 -0.033 1
1 1145 . 9 1 1 A 94 94 GLN C C 94 177.400 178.501 -1.101 1
1 1146 . 9 1 1 A 94 94 GLN CA C 94 60.000 58.655 1.345 1
1 1147 . 9 1 1 A 94 94 GLN CB C 94 30.300 28.004 2.296 1
1 1149 . 9 1 1 A 94 94 GLN N N 94 117.800 120.516 -2.716 1
1 1151 . 9 1 1 A 95 95 VAL H H 95 7.420 8.025 -0.605 1
1 1152 . 9 1 1 A 95 95 VAL HA H 95 3.760 3.613 0.147 1
1 1160 . 9 1 1 A 95 95 VAL C C 95 178.300 177.898 0.402 1
1 1161 . 9 1 1 A 95 95 VAL CA C 95 66.600 66.588 0.012 1
1 1162 . 9 1 1 A 95 95 VAL CB C 95 31.900 31.600 0.300 1
1 1165 . 9 1 1 A 95 95 VAL N N 95 121.500 120.086 1.414 1
1 1166 . 9 1 1 A 96 96 VAL H H 96 8.340 8.223 0.117 1
1 1167 . 9 1 1 A 96 96 VAL HA H 96 3.810 3.654 0.156 1
1 1175 . 9 1 1 A 96 96 VAL C C 96 178.400 178.287 0.113 1
1 1176 . 9 1 1 A 96 96 VAL CA C 96 66.100 66.609 -0.509 1
1 1177 . 9 1 1 A 96 96 VAL CB C 96 32.200 31.436 0.764 1
1 1180 . 9 1 1 A 96 96 VAL N N 96 120.000 119.743 0.257 1
1 1181 . 9 1 1 A 97 97 ALA H H 97 8.140 8.222 -0.082 1
1 1182 . 9 1 1 A 97 97 ALA HA H 97 4.010 3.987 0.023 1
1 1186 . 9 1 1 A 97 97 ALA C C 97 178.800 178.769 0.031 1
1 1187 . 9 1 1 A 97 97 ALA CA C 97 54.900 55.767 -0.867 1
1 1188 . 9 1 1 A 97 97 ALA CB C 97 19.900 18.198 1.702 1
1 1189 . 9 1 1 A 97 97 ALA N N 97 121.400 122.373 -0.973 1
1 1190 . 9 1 1 A 98 98 ASP H H 98 8.170 8.613 -0.443 1
1 1191 . 9 1 1 A 98 98 ASP HA H 98 4.320 4.401 -0.081 1
1 1194 . 9 1 1 A 98 98 ASP C C 98 178.100 178.557 -0.457 1
1 1195 . 9 1 1 A 98 98 ASP CA C 98 57.100 57.621 -0.521 1
1 1196 . 9 1 1 A 98 98 ASP CB C 98 41.800 42.298 -0.498 1
1 1197 . 9 1 1 A 98 98 ASP N N 98 118.500 118.464 0.036 1
1 1198 . 9 1 1 A 99 99 GLU H H 99 8.220 8.277 -0.057 1
1 1199 . 9 1 1 A 99 99 GLU HA H 99 4.000 3.971 0.029 1
1 1204 . 9 1 1 A 99 99 GLU C C 99 178.300 178.755 -0.455 1
1 1205 . 9 1 1 A 99 99 GLU CA C 99 58.300 58.980 -0.680 1
1 1206 . 9 1 1 A 99 99 GLU CB C 99 29.800 29.450 0.350 1
1 1208 . 9 1 1 A 99 99 GLU N N 99 116.600 118.855 -2.255 1
1 1209 . 9 1 1 A 100 100 HIS H H 100 7.980 7.589 0.391 1
1 1210 . 9 1 1 A 100 100 HIS HA H 100 4.600 4.403 0.197 1
1 1214 . 9 1 1 A 100 100 HIS C C 100 175.900 177.646 -1.746 1
1 1215 . 9 1 1 A 100 100 HIS CA C 100 57.500 59.166 -1.666 1
1 1216 . 9 1 1 A 100 100 HIS CB C 100 30.800 29.901 0.899 1
1 1218 . 9 1 1 A 100 100 HIS N N 100 114.000 118.773 -4.773 1
1 1219 . 9 1 1 A 101 101 LEU H H 101 7.920 8.118 -0.198 1
1 1220 . 9 1 1 A 101 101 LEU HA H 101 4.370 3.900 0.470 1
1 1230 . 9 1 1 A 101 101 LEU C C 101 177.700 177.328 0.372 1
1 1231 . 9 1 1 A 101 101 LEU CA C 101 55.900 57.176 -1.276 1
1 1232 . 9 1 1 A 101 101 LEU CB C 101 42.100 41.456 0.644 1
1 1236 . 9 1 1 A 101 101 LEU N N 101 118.500 120.315 -1.815 1
1 1237 . 9 1 1 A 102 102 GLU H H 102 8.100 7.951 0.149 1
1 1238 . 9 1 1 A 102 102 GLU HA H 102 4.160 4.373 -0.213 1
1 1243 . 9 1 1 A 102 102 GLU C C 102 176.700 176.622 0.078 1
1 1244 . 9 1 1 A 102 102 GLU CA C 102 57.000 58.098 -1.098 1
1 1245 . 9 1 1 A 102 102 GLU CB C 102 29.900 30.182 -0.282 1
1 1247 . 9 1 1 A 102 102 GLU N N 102 119.100 118.995 0.105 1
1 1248 . 9 1 1 A 103 103 HIS H H 103 8.010 7.173 0.837 1
1 1249 . 9 1 1 A 103 103 HIS HA H 103 4.520 4.591 -0.071 1
1 1252 . 9 1 1 A 103 103 HIS CA C 103 56.100 54.410 1.690 1
1 1253 . 9 1 1 A 103 103 HIS CB C 103 29.700 28.784 0.916 1
1 1254 . 9 1 1 A 103 103 HIS N N 103 117.300 119.743 -2.443 1
1 1255 . 9 1 1 A 107 107 HIS HA H 107 4.560 5.281 -0.721 1
1 1258 . 9 1 1 A 107 107 HIS C C 107 173.900 173.278 0.622 1
1 1259 . 9 1 1 A 107 107 HIS CA C 107 55.900 54.720 1.180 1
1 1260 . 9 1 1 A 107 107 HIS CB C 107 30.200 33.655 -3.455 1
1 4 . 10 1 1 A 2 2 ALA H H 2 8.450 7.801 0.649 1
1 5 . 10 1 1 A 2 2 ALA HA H 2 4.390 4.403 -0.013 1
1 9 . 10 1 1 A 2 2 ALA C C 2 178.300 177.552 0.748 1
1 10 . 10 1 1 A 2 2 ALA CA C 2 52.500 51.779 0.721 1
1 11 . 10 1 1 A 2 2 ALA CB C 2 19.200 20.345 -1.145 1
1 12 . 10 1 1 A 2 2 ALA N N 2 125.100 120.417 4.683 1
1 13 . 10 1 1 A 3 3 GLY H H 3 8.450 8.305 0.145 1
1 14 . 10 1 1 A 3 3 GLY HA2 H 3 4.030 4.228 -0.198 1
1 15 . 10 1 1 A 3 3 GLY HA3 H 3 4.030 4.229 -0.199 1
1 16 . 10 1 1 A 3 3 GLY C C 3 174.100 172.214 1.886 1
1 17 . 10 1 1 A 3 3 GLY CA C 3 45.200 44.575 0.625 1
1 18 . 10 1 1 A 3 3 GLY N N 3 108.000 107.297 0.703 1
1 19 . 10 1 1 A 4 4 GLN H H 4 8.550 8.374 0.176 1
1 20 . 10 1 1 A 4 4 GLN HA H 4 4.340 4.360 -0.020 1
1 27 . 10 1 1 A 4 4 GLN C C 4 176.700 176.452 0.248 1
1 28 . 10 1 1 A 4 4 GLN CA C 4 56.600 55.877 0.723 1
1 29 . 10 1 1 A 4 4 GLN CB C 4 29.300 28.518 0.782 1
1 31 . 10 1 1 A 4 4 GLN N N 4 120.500 120.840 -0.340 1
1 33 . 10 1 1 A 5 5 SER H H 5 8.540 8.434 0.106 1
1 34 . 10 1 1 A 5 5 SER HA H 5 4.390 4.715 -0.325 1
1 38 . 10 1 1 A 5 5 SER C C 5 174.800 175.234 -0.434 1
1 39 . 10 1 1 A 5 5 SER CA C 5 59.100 57.976 1.124 1
1 40 . 10 1 1 A 5 5 SER CB C 5 63.500 63.841 -0.341 1
1 41 . 10 1 1 A 5 5 SER N N 5 117.100 118.865 -1.765 1
1 42 . 10 1 1 A 6 6 ASP H H 6 8.300 8.222 0.078 1
1 43 . 10 1 1 A 6 6 ASP HA H 6 4.540 4.423 0.117 1
1 46 . 10 1 1 A 6 6 ASP C C 6 177.300 179.043 -1.743 1
1 47 . 10 1 1 A 6 6 ASP CA C 6 55.100 56.503 -1.403 1
1 48 . 10 1 1 A 6 6 ASP CB C 6 40.800 40.324 0.476 1
1 49 . 10 1 1 A 6 6 ASP N N 6 122.700 122.100 0.600 1
1 50 . 10 1 1 A 7 7 ARG H H 7 8.270 7.951 0.319 1
1 51 . 10 1 1 A 7 7 ARG HA H 7 4.150 4.063 0.087 1
1 58 . 10 1 1 A 7 7 ARG C C 7 177.600 178.370 -0.770 1
1 59 . 10 1 1 A 7 7 ARG CA C 7 58.000 59.158 -1.158 1
1 60 . 10 1 1 A 7 7 ARG CB C 7 30.100 29.957 0.143 1
1 63 . 10 1 1 A 7 7 ARG N N 7 122.100 120.932 1.168 1
1 64 . 10 1 1 A 8 8 LYS H H 8 8.130 7.992 0.138 1
1 65 . 10 1 1 A 8 8 LYS HA H 8 4.090 4.095 -0.005 1
1 74 . 10 1 1 A 8 8 LYS C C 8 177.600 178.629 -1.029 1
1 75 . 10 1 1 A 8 8 LYS CA C 8 58.400 59.307 -0.907 1
1 76 . 10 1 1 A 8 8 LYS CB C 8 31.700 32.192 -0.492 1
1 80 . 10 1 1 A 8 8 LYS N N 8 120.900 119.292 1.608 1
1 81 . 10 1 1 A 9 9 ALA H H 9 8.050 8.099 -0.049 1
1 82 . 10 1 1 A 9 9 ALA HA H 9 3.950 4.073 -0.123 1
1 86 . 10 1 1 A 9 9 ALA C C 9 179.800 180.097 -0.297 1
1 87 . 10 1 1 A 9 9 ALA CA C 9 55.100 54.875 0.225 1
1 88 . 10 1 1 A 9 9 ALA CB C 9 18.100 18.197 -0.097 1
1 89 . 10 1 1 A 9 9 ALA N N 9 121.600 121.356 0.244 1
1 90 . 10 1 1 A 10 10 ALA H H 10 7.910 7.880 0.030 1
1 91 . 10 1 1 A 10 10 ALA HA H 10 4.200 4.099 0.101 1
1 95 . 10 1 1 A 10 10 ALA C C 10 180.500 180.130 0.370 1
1 96 . 10 1 1 A 10 10 ALA CA C 10 54.600 55.176 -0.576 1
1 97 . 10 1 1 A 10 10 ALA CB C 10 18.100 17.760 0.340 1
1 98 . 10 1 1 A 10 10 ALA N N 10 120.200 120.610 -0.410 1
1 99 . 10 1 1 A 11 11 LEU H H 11 8.080 7.862 0.218 1
1 100 . 10 1 1 A 11 11 LEU HA H 11 4.120 4.023 0.097 1
1 110 . 10 1 1 A 11 11 LEU C C 11 179.600 179.326 0.274 1
1 111 . 10 1 1 A 11 11 LEU CA C 11 57.800 57.404 0.396 1
1 112 . 10 1 1 A 11 11 LEU CB C 11 41.700 41.217 0.483 1
1 115 . 10 1 1 A 11 11 LEU N N 11 120.900 118.782 2.118 1
1 116 . 10 1 1 A 12 12 LEU H H 12 8.480 8.239 0.241 1
1 117 . 10 1 1 A 12 12 LEU HA H 12 4.040 4.031 0.009 1
1 127 . 10 1 1 A 12 12 LEU C C 12 178.900 178.966 -0.066 1
1 128 . 10 1 1 A 12 12 LEU CA C 12 58.100 57.537 0.563 1
1 129 . 10 1 1 A 12 12 LEU CB C 12 40.100 40.806 -0.706 1
1 133 . 10 1 1 A 12 12 LEU N N 12 118.700 119.196 -0.496 1
1 134 . 10 1 1 A 13 13 ASP H H 13 7.990 7.990 0.000 1
1 135 . 10 1 1 A 13 13 ASP HA H 13 4.420 4.352 0.068 1
1 138 . 10 1 1 A 13 13 ASP C C 13 178.900 178.690 0.210 1
1 139 . 10 1 1 A 13 13 ASP CA C 13 57.500 57.135 0.365 1
1 140 . 10 1 1 A 13 13 ASP CB C 13 40.500 40.894 -0.394 1
1 141 . 10 1 1 A 13 13 ASP N N 13 119.500 119.700 -0.200 1
1 142 . 10 1 1 A 14 14 GLN H H 14 7.620 7.655 -0.035 1
1 143 . 10 1 1 A 14 14 GLN HA H 14 4.230 4.028 0.202 1
1 150 . 10 1 1 A 14 14 GLN C C 14 178.400 178.851 -0.451 1
1 151 . 10 1 1 A 14 14 GLN CA C 14 58.100 58.568 -0.468 1
1 152 . 10 1 1 A 14 14 GLN CB C 14 27.800 28.580 -0.780 1
1 154 . 10 1 1 A 14 14 GLN N N 14 118.900 118.440 0.460 1
1 156 . 10 1 1 A 15 15 VAL H H 15 8.480 8.276 0.204 1
1 157 . 10 1 1 A 15 15 VAL HA H 15 3.380 3.628 -0.248 1
1 165 . 10 1 1 A 15 15 VAL C C 15 177.600 178.238 -0.638 1
1 166 . 10 1 1 A 15 15 VAL CA C 15 66.600 66.284 0.316 1
1 167 . 10 1 1 A 15 15 VAL CB C 15 30.500 31.581 -1.081 1
1 170 . 10 1 1 A 15 15 VAL N N 15 121.300 119.926 1.374 1
1 171 . 10 1 1 A 16 16 ALA H H 16 8.080 8.240 -0.160 1
1 172 . 10 1 1 A 16 16 ALA HA H 16 4.450 3.912 0.538 1
1 176 . 10 1 1 A 16 16 ALA C C 16 179.100 179.185 -0.085 1
1 177 . 10 1 1 A 16 16 ALA CA C 16 54.600 55.388 -0.788 1
1 178 . 10 1 1 A 16 16 ALA CB C 16 17.700 18.126 -0.426 1
1 179 . 10 1 1 A 16 16 ALA N N 16 121.400 121.971 -0.571 1
1 180 . 10 1 1 A 17 17 ARG H H 17 7.480 8.044 -0.564 1
1 181 . 10 1 1 A 17 17 ARG HA H 17 3.910 4.063 -0.153 1
1 187 . 10 1 1 A 17 17 ARG C C 17 179.700 178.445 1.255 1
1 188 . 10 1 1 A 17 17 ARG CA C 17 59.700 59.532 0.168 1
1 189 . 10 1 1 A 17 17 ARG CB C 17 30.400 29.840 0.560 1
1 191 . 10 1 1 A 17 17 ARG N N 17 116.900 118.892 -1.992 1
1 192 . 10 1 1 A 18 18 VAL H H 18 7.960 7.664 0.296 1
1 193 . 10 1 1 A 18 18 VAL HA H 18 3.690 3.907 -0.217 1
1 201 . 10 1 1 A 18 18 VAL C C 18 177.900 178.747 -0.847 1
1 202 . 10 1 1 A 18 18 VAL CA C 18 66.600 65.954 0.646 1
1 203 . 10 1 1 A 18 18 VAL CB C 18 31.300 31.123 0.177 1
1 206 . 10 1 1 A 18 18 VAL N N 18 123.000 117.822 5.178 1
1 207 . 10 1 1 A 19 19 GLY H H 19 8.270 8.547 -0.277 1
1 208 . 10 1 1 A 19 19 GLY HA2 H 19 3.430 3.748 -0.318 1
1 209 . 10 1 1 A 19 19 GLY HA3 H 19 3.430 3.756 -0.326 1
1 210 . 10 1 1 A 19 19 GLY C C 19 174.400 175.639 -1.239 1
1 211 . 10 1 1 A 19 19 GLY CA C 19 48.500 47.407 1.093 1
1 212 . 10 1 1 A 19 19 GLY N N 19 105.400 108.609 -3.209 1
1 213 . 10 1 1 A 20 20 LYS H H 20 8.250 8.413 -0.163 1
1 214 . 10 1 1 A 20 20 LYS HA H 20 3.710 4.017 -0.307 1
1 223 . 10 1 1 A 20 20 LYS C C 20 179.400 179.334 0.066 1
1 224 . 10 1 1 A 20 20 LYS CA C 20 59.300 59.777 -0.477 1
1 225 . 10 1 1 A 20 20 LYS CB C 20 32.600 32.071 0.529 1
1 229 . 10 1 1 A 20 20 LYS N N 20 118.700 122.442 -3.742 1
1 230 . 10 1 1 A 21 21 ALA H H 21 7.640 7.758 -0.118 1
1 231 . 10 1 1 A 21 21 ALA HA H 21 3.790 4.116 -0.326 1
1 235 . 10 1 1 A 21 21 ALA C C 21 177.900 179.958 -2.058 1
1 236 . 10 1 1 A 21 21 ALA CA C 21 55.200 54.799 0.401 1
1 237 . 10 1 1 A 21 21 ALA CB C 21 19.200 18.526 0.674 1
1 238 . 10 1 1 A 21 21 ALA N N 21 121.700 121.315 0.385 1
1 239 . 10 1 1 A 22 22 LEU H H 22 7.330 7.814 -0.484 1
1 240 . 10 1 1 A 22 22 LEU HA H 22 4.140 4.147 -0.007 1
1 250 . 10 1 1 A 22 22 LEU C C 22 176.800 178.422 -1.622 1
1 251 . 10 1 1 A 22 22 LEU CA C 22 54.600 57.073 -2.473 1
1 252 . 10 1 1 A 22 22 LEU CB C 22 42.900 42.038 0.862 1
1 256 . 10 1 1 A 22 22 LEU N N 22 114.200 120.008 -5.808 1
1 257 . 10 1 1 A 23 23 ALA H H 23 7.160 7.245 -0.085 1
1 258 . 10 1 1 A 23 23 ALA HA H 23 4.720 4.316 0.404 1
1 262 . 10 1 1 A 23 23 ALA C C 23 176.700 177.542 -0.842 1
1 263 . 10 1 1 A 23 23 ALA CA C 23 53.000 52.705 0.295 1
1 264 . 10 1 1 A 23 23 ALA CB C 23 18.200 19.249 -1.049 1
1 265 . 10 1 1 A 23 23 ALA N N 23 118.200 120.565 -2.365 1
1 266 . 10 1 1 A 24 24 ASN H H 24 7.440 7.583 -0.143 1
1 267 . 10 1 1 A 24 24 ASN HA H 24 4.730 5.025 -0.295 1
1 272 . 10 1 1 A 24 24 ASN C C 24 174.800 175.991 -1.191 1
1 273 . 10 1 1 A 24 24 ASN CA C 24 53.500 52.493 1.007 1
1 274 . 10 1 1 A 24 24 ASN CB C 24 41.700 37.125 4.575 1
1 275 . 10 1 1 A 24 24 ASN N N 24 116.800 117.415 -0.615 1
1 277 . 10 1 1 A 25 25 GLY H H 25 9.370 8.629 0.741 1
1 278 . 10 1 1 A 25 25 GLY HA2 H 25 3.650 3.855 -0.205 1
1 279 . 10 1 1 A 25 25 GLY HA3 H 25 4.110 3.871 0.239 1
1 280 . 10 1 1 A 25 25 GLY C C 25 175.300 175.636 -0.336 1
1 281 . 10 1 1 A 25 25 GLY CA C 25 47.600 47.112 0.488 1
1 282 . 10 1 1 A 25 25 GLY N N 25 114.800 111.478 3.322 1
1 283 . 10 1 1 A 26 26 ARG H H 26 8.050 7.911 0.139 1
1 284 . 10 1 1 A 26 26 ARG HA H 26 4.150 4.069 0.081 1
1 289 . 10 1 1 A 26 26 ARG C C 26 179.300 177.521 1.779 1
1 290 . 10 1 1 A 26 26 ARG CA C 26 57.000 58.658 -1.658 1
1 291 . 10 1 1 A 26 26 ARG CB C 26 29.900 30.010 -0.110 1
1 294 . 10 1 1 A 26 26 ARG N N 26 120.500 121.772 -1.272 1
1 295 . 10 1 1 A 27 27 ARG H H 27 7.930 7.765 0.165 1
1 296 . 10 1 1 A 27 27 ARG HA H 27 3.710 4.268 -0.558 1
1 301 . 10 1 1 A 27 27 ARG C C 27 178.300 178.165 0.135 1
1 302 . 10 1 1 A 27 27 ARG CA C 27 61.000 56.840 4.160 1
1 303 . 10 1 1 A 27 27 ARG CB C 27 30.400 30.641 -0.241 1
1 305 . 10 1 1 A 27 27 ARG N N 27 117.900 118.042 -0.142 1
1 306 . 10 1 1 A 28 28 LEU H H 28 7.640 7.707 -0.067 1
1 307 . 10 1 1 A 28 28 LEU HA H 28 3.950 3.886 0.064 1
1 317 . 10 1 1 A 28 28 LEU C C 28 178.200 178.962 -0.762 1
1 318 . 10 1 1 A 28 28 LEU CA C 28 57.600 57.167 0.433 1
1 319 . 10 1 1 A 28 28 LEU CB C 28 41.900 41.096 0.804 1
1 323 . 10 1 1 A 28 28 LEU N N 28 117.600 118.603 -1.003 1
1 324 . 10 1 1 A 29 29 GLN H H 29 8.110 8.240 -0.130 1
1 325 . 10 1 1 A 29 29 GLN HA H 29 3.880 4.024 -0.144 1
1 332 . 10 1 1 A 29 29 GLN C C 29 179.400 177.983 1.417 1
1 333 . 10 1 1 A 29 29 GLN CA C 29 59.100 58.950 0.150 1
1 334 . 10 1 1 A 29 29 GLN CB C 29 28.800 28.135 0.665 1
1 336 . 10 1 1 A 29 29 GLN N N 29 119.300 119.603 -0.303 1
1 338 . 10 1 1 A 30 30 ILE H H 30 7.530 7.573 -0.043 1
1 339 . 10 1 1 A 30 30 ILE HA H 30 3.340 3.616 -0.276 1
1 349 . 10 1 1 A 30 30 ILE C C 30 176.700 178.684 -1.984 1
1 350 . 10 1 1 A 30 30 ILE CA C 30 65.900 64.976 0.924 1
1 351 . 10 1 1 A 30 30 ILE CB C 30 37.400 37.694 -0.294 1
1 355 . 10 1 1 A 30 30 ILE N N 30 118.600 120.731 -2.131 1
1 356 . 10 1 1 A 31 31 LEU H H 31 7.500 7.618 -0.118 1
1 357 . 10 1 1 A 31 31 LEU HA H 31 3.520 3.766 -0.246 1
1 367 . 10 1 1 A 31 31 LEU C C 31 177.300 178.629 -1.329 1
1 368 . 10 1 1 A 31 31 LEU CA C 31 58.100 58.005 0.095 1
1 369 . 10 1 1 A 31 31 LEU CB C 31 41.100 40.738 0.362 1
1 373 . 10 1 1 A 31 31 LEU N N 31 119.900 120.076 -0.176 1
1 374 . 10 1 1 A 32 32 ASP H H 32 7.950 8.218 -0.268 1
1 375 . 10 1 1 A 32 32 ASP HA H 32 4.300 4.434 -0.134 1
1 378 . 10 1 1 A 32 32 ASP C C 32 178.300 178.462 -0.162 1
1 379 . 10 1 1 A 32 32 ASP CA C 32 57.400 57.904 -0.504 1
1 380 . 10 1 1 A 32 32 ASP CB C 32 42.400 42.179 0.221 1
1 381 . 10 1 1 A 32 32 ASP N N 32 116.900 119.316 -2.416 1
1 382 . 10 1 1 A 33 33 LEU H H 33 7.350 7.639 -0.289 1
1 383 . 10 1 1 A 33 33 LEU HA H 33 4.130 4.106 0.024 1
1 393 . 10 1 1 A 33 33 LEU C C 33 180.000 179.056 0.944 1
1 394 . 10 1 1 A 33 33 LEU CA C 33 57.600 57.855 -0.255 1
1 395 . 10 1 1 A 33 33 LEU CB C 33 42.300 41.718 0.582 1
1 399 . 10 1 1 A 33 33 LEU N N 33 118.600 120.490 -1.890 1
1 400 . 10 1 1 A 34 34 LEU H H 34 8.300 8.301 -0.001 1
1 401 . 10 1 1 A 34 34 LEU HA H 34 4.490 4.382 0.108 1
1 411 . 10 1 1 A 34 34 LEU C C 34 178.900 179.605 -0.705 1
1 412 . 10 1 1 A 34 34 LEU CA C 34 55.800 57.320 -1.520 1
1 413 . 10 1 1 A 34 34 LEU CB C 34 41.300 41.384 -0.084 1
1 417 . 10 1 1 A 34 34 LEU N N 34 117.800 118.344 -0.544 1
1 418 . 10 1 1 A 35 35 ALA H H 35 8.160 8.139 0.021 1
1 419 . 10 1 1 A 35 35 ALA HA H 35 4.050 4.118 -0.068 1
1 423 . 10 1 1 A 35 35 ALA C C 35 179.000 178.947 0.053 1
1 424 . 10 1 1 A 35 35 ALA CA C 35 54.900 54.708 0.192 1
1 425 . 10 1 1 A 35 35 ALA CB C 35 17.500 18.183 -0.683 1
1 426 . 10 1 1 A 35 35 ALA N N 35 123.900 122.226 1.674 1
1 427 . 10 1 1 A 36 36 GLN H H 36 7.600 7.442 0.158 1
1 428 . 10 1 1 A 36 36 GLN HA H 36 4.340 4.404 -0.064 1
1 435 . 10 1 1 A 36 36 GLN C C 36 176.100 175.310 0.790 1
1 436 . 10 1 1 A 36 36 GLN CA C 36 55.800 55.973 -0.173 1
1 437 . 10 1 1 A 36 36 GLN CB C 36 29.000 29.172 -0.172 1
1 439 . 10 1 1 A 36 36 GLN N N 36 113.300 114.090 -0.790 1
1 441 . 10 1 1 A 37 37 GLY H H 37 7.550 7.049 0.501 1
1 442 . 10 1 1 A 37 37 GLY HA2 H 37 3.730 4.020 -0.290 1
1 443 . 10 1 1 A 37 37 GLY HA3 H 37 4.490 4.022 0.468 1
1 444 . 10 1 1 A 37 37 GLY C C 37 171.500 172.965 -1.465 1
1 445 . 10 1 1 A 37 37 GLY CA C 37 44.500 45.203 -0.703 1
1 446 . 10 1 1 A 37 37 GLY N N 37 108.400 107.610 0.790 1
1 447 . 10 1 1 A 38 38 GLU H H 38 8.120 8.421 -0.301 1
1 448 . 10 1 1 A 38 38 GLU HA H 38 4.820 4.507 0.313 1
1 453 . 10 1 1 A 38 38 GLU C C 38 177.000 175.716 1.284 1
1 454 . 10 1 1 A 38 38 GLU CA C 38 56.400 56.495 -0.095 1
1 455 . 10 1 1 A 38 38 GLU CB C 38 31.200 30.058 1.142 1
1 457 . 10 1 1 A 38 38 GLU N N 38 119.600 120.118 -0.518 1
1 458 . 10 1 1 A 39 39 ARG H H 39 8.580 8.465 0.115 1
1 459 . 10 1 1 A 39 39 ARG HA H 39 4.970 4.912 0.058 1
1 467 . 10 1 1 A 39 39 ARG C C 39 174.800 174.656 0.144 1
1 468 . 10 1 1 A 39 39 ARG CA C 39 53.900 54.905 -1.005 1
1 469 . 10 1 1 A 39 39 ARG CB C 39 36.400 34.227 2.173 1
1 472 . 10 1 1 A 39 39 ARG N N 39 121.500 122.222 -0.722 1
1 474 . 10 1 1 A 40 40 ALA H H 40 8.910 8.710 0.200 1
1 475 . 10 1 1 A 40 40 ALA HA H 40 4.920 4.413 0.507 1
1 479 . 10 1 1 A 40 40 ALA C C 40 179.200 178.336 0.864 1
1 480 . 10 1 1 A 40 40 ALA CA C 40 51.100 51.514 -0.414 1
1 481 . 10 1 1 A 40 40 ALA CB C 40 19.200 19.451 -0.251 1
1 482 . 10 1 1 A 40 40 ALA N N 40 125.100 127.047 -1.947 1
1 483 . 10 1 1 A 41 41 VAL H H 41 8.420 8.777 -0.357 1
1 484 . 10 1 1 A 41 41 VAL HA H 41 3.430 3.598 -0.168 1
1 492 . 10 1 1 A 41 41 VAL C C 41 176.800 177.121 -0.321 1
1 493 . 10 1 1 A 41 41 VAL CA C 41 67.600 66.951 0.649 1
1 494 . 10 1 1 A 41 41 VAL CB C 41 31.600 31.807 -0.207 1
1 497 . 10 1 1 A 41 41 VAL N N 41 120.900 120.611 0.289 1
1 498 . 10 1 1 A 42 42 GLU H H 42 9.640 8.299 1.341 1
1 499 . 10 1 1 A 42 42 GLU HA H 42 3.880 3.995 -0.115 1
1 504 . 10 1 1 A 42 42 GLU C C 42 178.300 178.885 -0.585 1
1 505 . 10 1 1 A 42 42 GLU CA C 42 60.600 59.410 1.190 1
1 506 . 10 1 1 A 42 42 GLU CB C 42 28.300 29.727 -1.427 1
1 508 . 10 1 1 A 42 42 GLU N N 42 119.000 119.706 -0.706 1
1 509 . 10 1 1 A 43 43 ALA H H 43 6.870 7.654 -0.784 1
1 510 . 10 1 1 A 43 43 ALA HA H 43 4.290 4.058 0.232 1
1 514 . 10 1 1 A 43 43 ALA C C 43 180.700 179.967 0.733 1
1 515 . 10 1 1 A 43 43 ALA CA C 43 54.100 54.956 -0.856 1
1 516 . 10 1 1 A 43 43 ALA CB C 43 19.100 18.516 0.584 1
1 517 . 10 1 1 A 43 43 ALA N N 43 120.500 121.852 -1.352 1
1 518 . 10 1 1 A 44 44 ILE H H 44 7.970 8.144 -0.174 1
1 519 . 10 1 1 A 44 44 ILE HA H 44 3.470 3.595 -0.125 1
1 529 . 10 1 1 A 44 44 ILE C C 44 178.300 177.686 0.614 1
1 530 . 10 1 1 A 44 44 ILE CA C 44 64.700 65.633 -0.933 1
1 531 . 10 1 1 A 44 44 ILE CB C 44 38.100 38.461 -0.361 1
1 535 . 10 1 1 A 44 44 ILE N N 44 120.500 119.695 0.805 1
1 536 . 10 1 1 A 45 45 ALA H H 45 8.460 8.768 -0.308 1
1 537 . 10 1 1 A 45 45 ALA HA H 45 3.720 4.138 -0.418 1
1 541 . 10 1 1 A 45 45 ALA C C 45 178.500 179.914 -1.414 1
1 542 . 10 1 1 A 45 45 ALA CA C 45 56.200 55.161 1.039 1
1 543 . 10 1 1 A 45 45 ALA CB C 45 17.400 18.169 -0.769 1
1 544 . 10 1 1 A 45 45 ALA N N 45 124.500 121.686 2.814 1
1 545 . 10 1 1 A 46 46 THR H H 46 8.080 7.991 0.089 1
1 546 . 10 1 1 A 46 46 THR HA H 46 3.900 3.839 0.061 1
1 551 . 10 1 1 A 46 46 THR C C 46 177.200 176.718 0.482 1
1 552 . 10 1 1 A 46 46 THR CA C 46 66.400 66.753 -0.353 1
1 553 . 10 1 1 A 46 46 THR CB C 46 68.800 68.847 -0.047 1
1 555 . 10 1 1 A 46 46 THR N N 46 112.400 114.623 -2.223 1
1 556 . 10 1 1 A 47 47 ALA H H 47 7.930 7.933 -0.003 1
1 557 . 10 1 1 A 47 47 ALA HA H 47 4.200 4.153 0.047 1
1 561 . 10 1 1 A 47 47 ALA C C 47 179.200 179.601 -0.401 1
1 562 . 10 1 1 A 47 47 ALA CA C 47 54.800 55.065 -0.265 1
1 563 . 10 1 1 A 47 47 ALA CB C 47 19.800 18.204 1.596 1
1 564 . 10 1 1 A 47 47 ALA N N 47 121.400 124.363 -2.963 1
1 565 . 10 1 1 A 48 48 THR H H 48 7.560 7.867 -0.307 1
1 566 . 10 1 1 A 48 48 THR HA H 48 4.390 4.337 0.053 1
1 571 . 10 1 1 A 48 48 THR C C 48 175.700 175.673 0.027 1
1 572 . 10 1 1 A 48 48 THR CA C 48 61.800 62.883 -1.083 1
1 573 . 10 1 1 A 48 48 THR CB C 48 71.000 70.388 0.612 1
1 575 . 10 1 1 A 48 48 THR N N 48 103.500 107.175 -3.675 1
1 576 . 10 1 1 A 49 49 GLY H H 49 7.820 8.255 -0.435 1
1 577 . 10 1 1 A 49 49 GLY HA2 H 49 3.870 3.951 -0.081 1
1 578 . 10 1 1 A 49 49 GLY HA3 H 49 4.100 3.952 0.148 1
1 579 . 10 1 1 A 49 49 GLY C C 49 174.400 174.022 0.378 1
1 580 . 10 1 1 A 49 49 GLY CA C 49 46.300 46.316 -0.016 1
1 581 . 10 1 1 A 49 49 GLY N N 49 111.100 112.341 -1.241 1
1 582 . 10 1 1 A 50 50 MET H H 50 7.930 8.098 -0.168 1
1 583 . 10 1 1 A 50 50 MET HA H 50 4.540 4.876 -0.336 1
1 591 . 10 1 1 A 50 50 MET C C 50 174.800 174.413 0.387 1
1 592 . 10 1 1 A 50 50 MET CA C 50 55.100 54.131 0.969 1
1 593 . 10 1 1 A 50 50 MET CB C 50 37.200 36.434 0.766 1
1 596 . 10 1 1 A 50 50 MET N N 50 119.300 118.453 0.847 1
1 597 . 10 1 1 A 51 51 ASN H H 51 8.040 8.770 -0.730 1
1 598 . 10 1 1 A 51 51 ASN HA H 51 4.580 5.048 -0.468 1
1 601 . 10 1 1 A 51 51 ASN C C 51 176.100 176.155 -0.055 1
1 602 . 10 1 1 A 51 51 ASN CA C 51 52.800 52.629 0.171 1
1 603 . 10 1 1 A 51 51 ASN CB C 51 41.100 40.302 0.798 1
1 604 . 10 1 1 A 51 51 ASN N N 51 118.000 120.008 -2.008 1
1 605 . 10 1 1 A 52 52 LEU H H 52 8.560 8.764 -0.204 1
1 606 . 10 1 1 A 52 52 LEU HA H 52 3.760 3.941 -0.181 1
1 616 . 10 1 1 A 52 52 LEU C C 52 179.600 178.382 1.218 1
1 617 . 10 1 1 A 52 52 LEU CA C 52 59.000 57.998 1.002 1
1 618 . 10 1 1 A 52 52 LEU CB C 52 41.800 41.508 0.292 1
1 622 . 10 1 1 A 52 52 LEU N N 52 120.600 125.644 -5.044 1
1 623 . 10 1 1 A 53 53 THR H H 53 8.230 8.017 0.213 1
1 624 . 10 1 1 A 53 53 THR HA H 53 3.880 3.866 0.014 1
1 629 . 10 1 1 A 53 53 THR C C 53 176.900 176.570 0.330 1
1 630 . 10 1 1 A 53 53 THR CA C 53 66.500 66.644 -0.144 1
1 631 . 10 1 1 A 53 53 THR CB C 53 68.400 68.308 0.092 1
1 633 . 10 1 1 A 53 53 THR N N 53 115.800 114.329 1.471 1
1 634 . 10 1 1 A 54 54 THR H H 54 8.420 8.184 0.236 1
1 635 . 10 1 1 A 54 54 THR HA H 54 3.880 3.882 -0.002 1
1 640 . 10 1 1 A 54 54 THR C C 54 177.300 176.451 0.849 1
1 641 . 10 1 1 A 54 54 THR CA C 54 66.600 66.545 0.055 1
1 642 . 10 1 1 A 54 54 THR CB C 54 66.600 68.788 -2.188 1
1 644 . 10 1 1 A 54 54 THR N N 54 122.300 117.204 5.096 1
1 645 . 10 1 1 A 55 55 ALA H H 55 8.860 8.581 0.279 1
1 646 . 10 1 1 A 55 55 ALA HA H 55 4.020 3.909 0.111 1
1 650 . 10 1 1 A 55 55 ALA C C 55 179.000 179.283 -0.283 1
1 651 . 10 1 1 A 55 55 ALA CA C 55 56.100 55.368 0.732 1
1 652 . 10 1 1 A 55 55 ALA CB C 55 17.000 18.136 -1.136 1
1 653 . 10 1 1 A 55 55 ALA N N 55 125.600 123.384 2.216 1
1 654 . 10 1 1 A 56 56 SER H H 56 8.440 8.303 0.137 1
1 655 . 10 1 1 A 56 56 SER HA H 56 3.920 3.970 -0.050 1
1 658 . 10 1 1 A 56 56 SER C C 56 176.400 177.036 -0.636 1
1 659 . 10 1 1 A 56 56 SER CA C 56 62.600 61.363 1.237 1
1 660 . 10 1 1 A 56 56 SER CB C 56 62.700 63.003 -0.303 1
1 661 . 10 1 1 A 56 56 SER N N 56 112.700 112.843 -0.143 1
1 662 . 10 1 1 A 57 57 ALA H H 57 8.090 8.259 -0.169 1
1 663 . 10 1 1 A 57 57 ALA HA H 57 4.130 4.016 0.114 1
1 667 . 10 1 1 A 57 57 ALA C C 57 181.200 179.600 1.600 1
1 668 . 10 1 1 A 57 57 ALA CA C 57 55.200 55.353 -0.153 1
1 669 . 10 1 1 A 57 57 ALA CB C 57 17.900 17.957 -0.057 1
1 670 . 10 1 1 A 57 57 ALA N N 57 124.000 123.411 0.589 1
1 671 . 10 1 1 A 58 58 ASN H H 58 7.970 7.993 -0.023 1
1 672 . 10 1 1 A 58 58 ASN HA H 58 4.480 4.478 0.002 1
1 677 . 10 1 1 A 58 58 ASN C C 58 177.500 178.210 -0.710 1
1 678 . 10 1 1 A 58 58 ASN CA C 58 56.900 56.233 0.667 1
1 679 . 10 1 1 A 58 58 ASN CB C 58 39.800 38.091 1.709 1
1 680 . 10 1 1 A 58 58 ASN N N 58 117.600 116.909 0.691 1
1 682 . 10 1 1 A 59 59 LEU H H 59 8.530 8.620 -0.090 1
1 683 . 10 1 1 A 59 59 LEU HA H 59 3.710 3.776 -0.066 1
1 693 . 10 1 1 A 59 59 LEU C C 59 178.400 179.106 -0.706 1
1 694 . 10 1 1 A 59 59 LEU CA C 59 58.600 57.636 0.964 1
1 695 . 10 1 1 A 59 59 LEU CB C 59 40.500 40.610 -0.110 1
1 699 . 10 1 1 A 59 59 LEU N N 59 122.600 121.596 1.004 1
1 700 . 10 1 1 A 60 60 GLN H H 60 8.200 8.465 -0.265 1
1 701 . 10 1 1 A 60 60 GLN HA H 60 4.020 4.012 0.008 1
1 708 . 10 1 1 A 60 60 GLN C C 60 178.700 177.874 0.826 1
1 709 . 10 1 1 A 60 60 GLN CA C 60 58.800 59.219 -0.419 1
1 710 . 10 1 1 A 60 60 GLN CB C 60 27.700 28.382 -0.682 1
1 712 . 10 1 1 A 60 60 GLN N N 60 118.900 118.868 0.032 1
1 714 . 10 1 1 A 61 61 ALA H H 61 7.580 7.612 -0.032 1
1 715 . 10 1 1 A 61 61 ALA HA H 61 4.230 4.213 0.017 1
1 719 . 10 1 1 A 61 61 ALA C C 61 181.300 180.054 1.246 1
1 720 . 10 1 1 A 61 61 ALA CA C 61 55.100 55.027 0.073 1
1 721 . 10 1 1 A 61 61 ALA CB C 61 17.600 18.180 -0.580 1
1 722 . 10 1 1 A 61 61 ALA N N 61 122.200 122.289 -0.089 1
1 723 . 10 1 1 A 62 62 LEU H H 62 7.830 7.950 -0.120 1
1 724 . 10 1 1 A 62 62 LEU HA H 62 3.980 3.999 -0.019 1
1 734 . 10 1 1 A 62 62 LEU C C 62 178.500 179.256 -0.756 1
1 735 . 10 1 1 A 62 62 LEU CA C 62 58.100 57.502 0.598 1
1 736 . 10 1 1 A 62 62 LEU CB C 62 43.300 41.091 2.209 1
1 739 . 10 1 1 A 62 62 LEU N N 62 119.000 118.572 0.428 1
1 740 . 10 1 1 A 63 63 LYS H H 63 8.580 8.256 0.324 1
1 741 . 10 1 1 A 63 63 LYS HA H 63 4.130 4.338 -0.208 1
1 750 . 10 1 1 A 63 63 LYS C C 63 180.500 179.230 1.270 1
1 751 . 10 1 1 A 63 63 LYS CA C 63 59.700 59.728 -0.028 1
1 752 . 10 1 1 A 63 63 LYS CB C 63 32.600 32.321 0.279 1
1 756 . 10 1 1 A 63 63 LYS N N 63 123.400 121.322 2.078 1
1 757 . 10 1 1 A 64 64 SER H H 64 8.640 8.539 0.101 1
1 758 . 10 1 1 A 64 64 SER HA H 64 4.300 4.183 0.117 1
1 761 . 10 1 1 A 64 64 SER C C 64 175.000 176.984 -1.984 1
1 762 . 10 1 1 A 64 64 SER CA C 64 61.400 60.948 0.452 1
1 763 . 10 1 1 A 64 64 SER CB C 64 63.000 62.466 0.534 1
1 764 . 10 1 1 A 64 64 SER N N 64 117.700 115.424 2.276 1
1 765 . 10 1 1 A 65 65 GLY H H 65 7.280 7.983 -0.703 1
1 766 . 10 1 1 A 65 65 GLY HA2 H 65 3.240 3.905 -0.665 1
1 767 . 10 1 1 A 65 65 GLY HA3 H 65 3.980 3.908 0.072 1
1 768 . 10 1 1 A 65 65 GLY C C 65 171.300 175.054 -3.754 1
1 769 . 10 1 1 A 65 65 GLY CA C 65 45.100 46.407 -1.307 1
1 770 . 10 1 1 A 65 65 GLY N N 65 104.400 109.028 -4.628 1
1 771 . 10 1 1 A 66 66 GLY H H 66 7.730 7.708 0.022 1
1 772 . 10 1 1 A 66 66 GLY HA2 H 66 3.650 4.043 -0.393 1
1 773 . 10 1 1 A 66 66 GLY HA3 H 66 3.750 4.046 -0.296 1
1 774 . 10 1 1 A 66 66 GLY C C 66 173.700 175.395 -1.695 1
1 775 . 10 1 1 A 66 66 GLY CA C 66 45.400 45.302 0.098 1
1 776 . 10 1 1 A 66 66 GLY N N 66 104.700 107.476 -2.776 1
1 777 . 10 1 1 A 67 67 LEU H H 67 7.520 8.251 -0.731 1
1 778 . 10 1 1 A 67 67 LEU HA H 67 4.310 4.234 0.076 1
1 788 . 10 1 1 A 67 67 LEU C C 67 177.700 177.112 0.588 1
1 789 . 10 1 1 A 67 67 LEU CA C 67 55.500 56.098 -0.598 1
1 790 . 10 1 1 A 67 67 LEU CB C 67 42.400 42.607 -0.207 1
1 794 . 10 1 1 A 67 67 LEU N N 67 110.600 118.702 -8.102 1
1 795 . 10 1 1 A 68 68 VAL H H 68 6.890 7.398 -0.508 1
1 796 . 10 1 1 A 68 68 VAL HA H 68 5.190 4.911 0.279 1
1 804 . 10 1 1 A 68 68 VAL C C 68 173.700 174.107 -0.407 1
1 805 . 10 1 1 A 68 68 VAL CA C 68 57.400 58.906 -1.506 1
1 806 . 10 1 1 A 68 68 VAL CB C 68 36.400 35.089 1.311 1
1 809 . 10 1 1 A 68 68 VAL N N 68 106.400 112.920 -6.520 1
1 810 . 10 1 1 A 69 69 GLU H H 69 8.880 9.458 -0.578 1
1 811 . 10 1 1 A 69 69 GLU HA H 69 4.660 4.909 -0.249 1
1 816 . 10 1 1 A 69 69 GLU C C 69 173.300 174.592 -1.292 1
1 817 . 10 1 1 A 69 69 GLU CA C 69 54.300 54.815 -0.515 1
1 818 . 10 1 1 A 69 69 GLU CB C 69 34.100 33.421 0.679 1
1 820 . 10 1 1 A 69 69 GLU N N 69 120.400 121.825 -1.425 1
1 821 . 10 1 1 A 70 70 ALA H H 70 8.730 8.792 -0.062 1
1 822 . 10 1 1 A 70 70 ALA HA H 70 4.990 4.746 0.244 1
1 826 . 10 1 1 A 70 70 ALA C C 70 176.500 174.964 1.536 1
1 827 . 10 1 1 A 70 70 ALA CA C 70 50.000 49.986 0.014 1
1 828 . 10 1 1 A 70 70 ALA CB C 70 22.300 20.343 1.957 1
1 829 . 10 1 1 A 70 70 ALA N N 70 122.800 123.221 -0.421 1
1 830 . 10 1 1 A 71 71 ARG H H 71 8.670 9.347 -0.677 1
1 831 . 10 1 1 A 71 71 ARG HA H 71 4.630 4.714 -0.084 1
1 843 . 10 1 1 A 71 71 ARG C C 71 173.500 174.825 -1.325 1
1 844 . 10 1 1 A 71 71 ARG CA C 71 54.600 54.719 -0.119 1
1 845 . 10 1 1 A 71 71 ARG CB C 71 33.600 31.792 1.808 1
1 849 . 10 1 1 A 71 71 ARG N N 71 120.100 125.126 -5.026 1
1 851 . 10 1 1 A 72 72 ARG H H 72 8.780 8.846 -0.066 1
1 852 . 10 1 1 A 72 72 ARG HA H 72 5.100 4.971 0.129 1
1 859 . 10 1 1 A 72 72 ARG C C 72 176.000 175.098 0.902 1
1 860 . 10 1 1 A 72 72 ARG CA C 72 54.900 55.738 -0.838 1
1 861 . 10 1 1 A 72 72 ARG CB C 72 32.500 30.945 1.555 1
1 864 . 10 1 1 A 72 72 ARG N N 72 123.600 128.653 -5.053 1
1 865 . 10 1 1 A 73 73 GLU H H 73 8.720 9.069 -0.349 1
1 866 . 10 1 1 A 73 73 GLU HA H 73 4.510 4.678 -0.168 1
1 871 . 10 1 1 A 73 73 GLU C C 73 175.900 176.658 -0.758 1
1 872 . 10 1 1 A 73 73 GLU CA C 73 55.700 55.329 0.371 1
1 873 . 10 1 1 A 73 73 GLU CB C 73 31.800 30.420 1.380 1
1 875 . 10 1 1 A 73 73 GLU N N 73 126.800 127.052 -0.252 1
1 876 . 10 1 1 A 74 74 GLY H H 74 9.190 8.885 0.305 1
1 877 . 10 1 1 A 74 74 GLY HA2 H 74 3.700 3.882 -0.182 1
1 878 . 10 1 1 A 74 74 GLY HA3 H 74 4.170 3.895 0.275 1
1 879 . 10 1 1 A 74 74 GLY C C 74 175.400 174.627 0.773 1
1 880 . 10 1 1 A 74 74 GLY CA C 74 47.100 47.232 -0.132 1
1 881 . 10 1 1 A 74 74 GLY N N 74 118.500 116.500 2.000 1
1 882 . 10 1 1 A 75 75 THR H H 75 8.780 8.668 0.112 1
1 883 . 10 1 1 A 75 75 THR HA H 75 4.290 4.382 -0.092 1
1 888 . 10 1 1 A 75 75 THR C C 75 174.600 174.004 0.596 1
1 889 . 10 1 1 A 75 75 THR CA C 75 62.000 62.415 -0.415 1
1 890 . 10 1 1 A 75 75 THR CB C 75 69.000 69.748 -0.748 1
1 892 . 10 1 1 A 75 75 THR N N 75 118.000 120.033 -2.033 1
1 893 . 10 1 1 A 76 76 ARG H H 76 8.030 7.570 0.460 1
1 894 . 10 1 1 A 76 76 ARG HA H 76 4.610 4.923 -0.313 1
1 901 . 10 1 1 A 76 76 ARG C C 76 174.800 174.820 -0.020 1
1 902 . 10 1 1 A 76 76 ARG CA C 76 55.500 54.636 0.864 1
1 903 . 10 1 1 A 76 76 ARG CB C 76 32.700 32.649 0.051 1
1 906 . 10 1 1 A 76 76 ARG N N 76 122.600 122.011 0.589 1
1 907 . 10 1 1 A 77 77 GLN H H 77 8.580 8.594 -0.014 1
1 908 . 10 1 1 A 77 77 GLN HA H 77 4.910 4.853 0.057 1
1 915 . 10 1 1 A 77 77 GLN C C 77 173.900 174.049 -0.149 1
1 916 . 10 1 1 A 77 77 GLN CA C 77 54.700 54.312 0.388 1
1 917 . 10 1 1 A 77 77 GLN CB C 77 31.800 30.087 1.713 1
1 919 . 10 1 1 A 77 77 GLN N N 77 121.900 122.613 -0.713 1
1 921 . 10 1 1 A 78 78 TYR H H 78 8.890 9.480 -0.590 1
1 922 . 10 1 1 A 78 78 TYR HA H 78 4.750 5.148 -0.398 1
1 929 . 10 1 1 A 78 78 TYR C C 78 175.600 174.672 0.928 1
1 930 . 10 1 1 A 78 78 TYR CA C 78 57.000 56.723 0.277 1
1 931 . 10 1 1 A 78 78 TYR CB C 78 41.400 41.007 0.393 1
1 936 . 10 1 1 A 78 78 TYR N N 78 121.800 126.913 -5.113 1
1 937 . 10 1 1 A 79 79 TYR H H 79 9.010 9.602 -0.592 1
1 938 . 10 1 1 A 79 79 TYR HA H 79 5.410 5.499 -0.089 1
1 945 . 10 1 1 A 79 79 TYR C C 79 173.100 174.651 -1.551 1
1 946 . 10 1 1 A 79 79 TYR CA C 79 57.300 56.395 0.905 1
1 947 . 10 1 1 A 79 79 TYR CB C 79 43.300 42.223 1.077 1
1 952 . 10 1 1 A 79 79 TYR N N 79 122.500 120.769 1.731 1
1 953 . 10 1 1 A 80 80 ARG H H 80 8.720 8.608 0.112 1
1 954 . 10 1 1 A 80 80 ARG HA H 80 5.120 4.787 0.333 1
1 962 . 10 1 1 A 80 80 ARG C C 80 175.500 174.820 0.680 1
1 963 . 10 1 1 A 80 80 ARG CA C 80 53.200 54.644 -1.444 1
1 964 . 10 1 1 A 80 80 ARG CB C 80 33.900 34.697 -0.797 1
1 967 . 10 1 1 A 80 80 ARG N N 80 114.500 122.502 -8.002 1
1 969 . 10 1 1 A 81 81 ILE H H 81 9.300 8.761 0.539 1
1 970 . 10 1 1 A 81 81 ILE HA H 81 4.150 4.119 0.031 1
1 980 . 10 1 1 A 81 81 ILE C C 81 177.800 177.148 0.652 1
1 981 . 10 1 1 A 81 81 ILE CA C 81 62.300 62.358 -0.058 1
1 982 . 10 1 1 A 81 81 ILE CB C 81 37.800 37.626 0.174 1
1 986 . 10 1 1 A 81 81 ILE N N 81 122.100 126.095 -3.995 1
1 987 . 10 1 1 A 82 82 ALA H H 82 7.930 8.746 -0.816 1
1 988 . 10 1 1 A 82 82 ALA HA H 82 3.930 4.097 -0.167 1
1 992 . 10 1 1 A 82 82 ALA C C 82 176.300 177.323 -1.023 1
1 993 . 10 1 1 A 82 82 ALA CA C 82 54.200 55.010 -0.810 1
1 994 . 10 1 1 A 82 82 ALA CB C 82 18.500 19.595 -1.095 1
1 995 . 10 1 1 A 82 82 ALA N N 82 127.200 129.463 -2.263 1
1 996 . 10 1 1 A 83 83 GLY H H 83 6.980 7.672 -0.692 1
1 997 . 10 1 1 A 83 83 GLY HA2 H 83 4.090 4.095 -0.005 1
1 998 . 10 1 1 A 83 83 GLY HA3 H 83 4.440 4.097 0.343 1
1 999 . 10 1 1 A 83 83 GLY C C 83 173.600 174.966 -1.366 1
1 1000 . 10 1 1 A 83 83 GLY CA C 83 45.200 44.813 0.387 1
1 1001 . 10 1 1 A 83 83 GLY N N 83 101.800 103.592 -1.792 1
1 1002 . 10 1 1 A 84 84 GLU H H 84 8.930 8.893 0.037 1
1 1003 . 10 1 1 A 84 84 GLU HA H 84 4.120 3.979 0.141 1
1 1008 . 10 1 1 A 84 84 GLU C C 84 178.300 177.831 0.469 1
1 1009 . 10 1 1 A 84 84 GLU CA C 84 58.900 59.072 -0.172 1
1 1010 . 10 1 1 A 84 84 GLU CB C 84 29.400 29.382 0.018 1
1 1012 . 10 1 1 A 84 84 GLU N N 84 120.300 121.243 -0.943 1
1 1013 . 10 1 1 A 85 85 ASP H H 85 8.950 8.492 0.458 1
1 1014 . 10 1 1 A 85 85 ASP HA H 85 4.310 4.370 -0.060 1
1 1017 . 10 1 1 A 85 85 ASP C C 85 178.000 178.673 -0.673 1
1 1018 . 10 1 1 A 85 85 ASP CA C 85 57.100 56.737 0.363 1
1 1019 . 10 1 1 A 85 85 ASP CB C 85 38.900 39.636 -0.736 1
1 1020 . 10 1 1 A 85 85 ASP N N 85 119.400 118.311 1.089 1
1 1021 . 10 1 1 A 86 86 VAL H H 86 7.620 8.213 -0.593 1
1 1022 . 10 1 1 A 86 86 VAL HA H 86 3.480 3.596 -0.116 1
1 1030 . 10 1 1 A 86 86 VAL C C 86 177.400 178.032 -0.632 1
1 1031 . 10 1 1 A 86 86 VAL CA C 86 66.800 66.518 0.282 1
1 1032 . 10 1 1 A 86 86 VAL CB C 86 31.300 31.639 -0.339 1
1 1035 . 10 1 1 A 86 86 VAL N N 86 121.600 121.693 -0.093 1
1 1036 . 10 1 1 A 87 87 ALA H H 87 7.520 8.281 -0.761 1
1 1037 . 10 1 1 A 87 87 ALA HA H 87 4.110 4.045 0.065 1
1 1041 . 10 1 1 A 87 87 ALA C C 87 181.200 179.809 1.391 1
1 1042 . 10 1 1 A 87 87 ALA CA C 87 55.800 55.747 0.053 1
1 1043 . 10 1 1 A 87 87 ALA CB C 87 17.600 18.288 -0.688 1
1 1044 . 10 1 1 A 87 87 ALA N N 87 122.700 122.204 0.496 1
1 1045 . 10 1 1 A 88 88 ARG H H 88 8.380 8.483 -0.103 1
1 1046 . 10 1 1 A 88 88 ARG HA H 88 4.090 4.062 0.028 1
1 1054 . 10 1 1 A 88 88 ARG C C 88 179.100 178.860 0.240 1
1 1055 . 10 1 1 A 88 88 ARG CA C 88 59.600 58.691 0.909 1
1 1056 . 10 1 1 A 88 88 ARG CB C 88 30.500 30.052 0.448 1
1 1059 . 10 1 1 A 88 88 ARG N N 88 119.200 118.001 1.199 1
1 1061 . 10 1 1 A 89 89 LEU H H 89 8.480 7.884 0.596 1
1 1062 . 10 1 1 A 89 89 LEU HA H 89 4.040 4.056 -0.016 1
1 1071 . 10 1 1 A 89 89 LEU C C 89 177.200 178.626 -1.426 1
1 1072 . 10 1 1 A 89 89 LEU CA C 89 58.300 58.128 0.172 1
1 1073 . 10 1 1 A 89 89 LEU CB C 89 41.300 41.950 -0.650 1
1 1076 . 10 1 1 A 89 89 LEU N N 89 123.300 122.144 1.156 1
1 1077 . 10 1 1 A 90 90 PHE H H 90 8.890 8.363 0.527 1
1 1078 . 10 1 1 A 90 90 PHE HA H 90 4.380 4.049 0.331 1
1 1086 . 10 1 1 A 90 90 PHE C C 90 177.500 178.074 -0.574 1
1 1087 . 10 1 1 A 90 90 PHE CA C 90 59.400 62.081 -2.681 1
1 1088 . 10 1 1 A 90 90 PHE CB C 90 38.600 39.223 -0.623 1
1 1094 . 10 1 1 A 90 90 PHE N N 90 119.400 119.639 -0.239 1
1 1095 . 10 1 1 A 91 91 ALA H H 91 7.920 8.403 -0.483 1
1 1096 . 10 1 1 A 91 91 ALA HA H 91 3.940 3.892 0.048 1
1 1100 . 10 1 1 A 91 91 ALA C C 91 180.200 179.845 0.355 1
1 1101 . 10 1 1 A 91 91 ALA CA C 91 55.100 55.219 -0.119 1
1 1102 . 10 1 1 A 91 91 ALA CB C 91 18.000 18.091 -0.091 1
1 1103 . 10 1 1 A 91 91 ALA N N 91 120.500 121.291 -0.791 1
1 1104 . 10 1 1 A 92 92 LEU H H 92 8.190 8.357 -0.167 1
1 1105 . 10 1 1 A 92 92 LEU HA H 92 4.300 4.021 0.279 1
1 1115 . 10 1 1 A 92 92 LEU C C 92 178.900 178.644 0.256 1
1 1116 . 10 1 1 A 92 92 LEU CA C 92 57.500 57.762 -0.262 1
1 1117 . 10 1 1 A 92 92 LEU CB C 92 42.100 41.595 0.505 1
1 1121 . 10 1 1 A 92 92 LEU N N 92 120.200 119.541 0.659 1
1 1122 . 10 1 1 A 93 93 VAL H H 93 8.890 8.143 0.747 1
1 1123 . 10 1 1 A 93 93 VAL HA H 93 3.810 3.483 0.327 1
1 1131 . 10 1 1 A 93 93 VAL C C 93 176.900 177.946 -1.046 1
1 1132 . 10 1 1 A 93 93 VAL CA C 93 66.000 66.524 -0.524 1
1 1133 . 10 1 1 A 93 93 VAL CB C 93 31.200 31.270 -0.070 1
1 1136 . 10 1 1 A 93 93 VAL N N 93 117.100 119.207 -2.107 1
1 1137 . 10 1 1 A 94 94 GLN H H 94 6.920 7.794 -0.874 1
1 1138 . 10 1 1 A 94 94 GLN HA H 94 3.790 3.745 0.045 1
1 1145 . 10 1 1 A 94 94 GLN C C 94 177.400 178.281 -0.881 1
1 1146 . 10 1 1 A 94 94 GLN CA C 94 60.000 59.082 0.918 1
1 1147 . 10 1 1 A 94 94 GLN CB C 94 30.300 27.998 2.302 1
1 1149 . 10 1 1 A 94 94 GLN N N 94 117.800 120.324 -2.524 1
1 1151 . 10 1 1 A 95 95 VAL H H 95 7.420 7.841 -0.421 1
1 1152 . 10 1 1 A 95 95 VAL HA H 95 3.760 3.554 0.206 1
1 1160 . 10 1 1 A 95 95 VAL C C 95 178.300 178.024 0.276 1
1 1161 . 10 1 1 A 95 95 VAL CA C 95 66.600 66.488 0.112 1
1 1162 . 10 1 1 A 95 95 VAL CB C 95 31.900 31.456 0.444 1
1 1165 . 10 1 1 A 95 95 VAL N N 95 121.500 119.459 2.041 1
1 1166 . 10 1 1 A 96 96 VAL H H 96 8.340 8.292 0.048 1
1 1167 . 10 1 1 A 96 96 VAL HA H 96 3.810 3.414 0.396 1
1 1175 . 10 1 1 A 96 96 VAL C C 96 178.400 178.023 0.377 1
1 1176 . 10 1 1 A 96 96 VAL CA C 96 66.100 66.328 -0.228 1
1 1177 . 10 1 1 A 96 96 VAL CB C 96 32.200 31.347 0.853 1
1 1180 . 10 1 1 A 96 96 VAL N N 96 120.000 120.043 -0.043 1
1 1181 . 10 1 1 A 97 97 ALA H H 97 8.140 8.212 -0.072 1
1 1182 . 10 1 1 A 97 97 ALA HA H 97 4.010 3.995 0.015 1
1 1186 . 10 1 1 A 97 97 ALA C C 97 178.800 178.598 0.202 1
1 1187 . 10 1 1 A 97 97 ALA CA C 97 54.900 55.776 -0.876 1
1 1188 . 10 1 1 A 97 97 ALA CB C 97 19.900 18.021 1.879 1
1 1189 . 10 1 1 A 97 97 ALA N N 97 121.400 121.959 -0.559 1
1 1190 . 10 1 1 A 98 98 ASP H H 98 8.170 8.326 -0.156 1
1 1191 . 10 1 1 A 98 98 ASP HA H 98 4.320 4.327 -0.007 1
1 1194 . 10 1 1 A 98 98 ASP C C 98 178.100 178.235 -0.135 1
1 1195 . 10 1 1 A 98 98 ASP CA C 98 57.100 57.650 -0.550 1
1 1196 . 10 1 1 A 98 98 ASP CB C 98 41.800 42.245 -0.445 1
1 1197 . 10 1 1 A 98 98 ASP N N 98 118.500 118.998 -0.498 1
1 1198 . 10 1 1 A 99 99 GLU H H 99 8.220 8.186 0.034 1
1 1199 . 10 1 1 A 99 99 GLU HA H 99 4.000 3.974 0.026 1
1 1204 . 10 1 1 A 99 99 GLU C C 99 178.300 179.114 -0.814 1
1 1205 . 10 1 1 A 99 99 GLU CA C 99 58.300 59.225 -0.925 1
1 1206 . 10 1 1 A 99 99 GLU CB C 99 29.800 29.355 0.445 1
1 1208 . 10 1 1 A 99 99 GLU N N 99 116.600 119.037 -2.437 1
1 1209 . 10 1 1 A 100 100 HIS H H 100 7.980 7.353 0.627 1
1 1210 . 10 1 1 A 100 100 HIS HA H 100 4.600 4.281 0.319 1
1 1214 . 10 1 1 A 100 100 HIS C C 100 175.900 177.750 -1.850 1
1 1215 . 10 1 1 A 100 100 HIS CA C 100 57.500 59.201 -1.701 1
1 1216 . 10 1 1 A 100 100 HIS CB C 100 30.800 29.532 1.268 1
1 1218 . 10 1 1 A 100 100 HIS N N 100 114.000 118.696 -4.696 1
1 1219 . 10 1 1 A 101 101 LEU H H 101 7.920 7.507 0.413 1
1 1220 . 10 1 1 A 101 101 LEU HA H 101 4.370 3.866 0.504 1
1 1230 . 10 1 1 A 101 101 LEU C C 101 177.700 177.395 0.305 1
1 1231 . 10 1 1 A 101 101 LEU CA C 101 55.900 57.318 -1.418 1
1 1232 . 10 1 1 A 101 101 LEU CB C 101 42.100 41.984 0.116 1
1 1236 . 10 1 1 A 101 101 LEU N N 101 118.500 119.830 -1.330 1
1 1237 . 10 1 1 A 102 102 GLU H H 102 8.100 7.210 0.890 1
1 1238 . 10 1 1 A 102 102 GLU HA H 102 4.160 4.591 -0.431 1
1 1243 . 10 1 1 A 102 102 GLU C C 102 176.700 176.261 0.439 1
1 1244 . 10 1 1 A 102 102 GLU CA C 102 57.000 54.818 2.182 1
1 1245 . 10 1 1 A 102 102 GLU CB C 102 29.900 27.747 2.153 1
1 1247 . 10 1 1 A 102 102 GLU N N 102 119.100 118.571 0.529 1
1 1248 . 10 1 1 A 103 103 HIS H H 103 8.010 7.840 0.170 1
1 1249 . 10 1 1 A 103 103 HIS HA H 103 4.520 4.371 0.149 1
1 1252 . 10 1 1 A 103 103 HIS CA C 103 56.100 59.236 -3.136 1
1 1253 . 10 1 1 A 103 103 HIS CB C 103 29.700 30.546 -0.846 1
1 1254 . 10 1 1 A 103 103 HIS N N 103 117.300 121.588 -4.288 1
1 1255 . 10 1 1 A 107 107 HIS HA H 107 4.560 4.548 0.012 1
1 1258 . 10 1 1 A 107 107 HIS C C 107 173.900 173.694 0.206 1
1 1259 . 10 1 1 A 107 107 HIS CA C 107 55.900 56.363 -0.463 1
1 1260 . 10 1 1 A 107 107 HIS CB C 107 30.200 29.838 0.362 1
1 4 . 11 1 1 A 2 2 ALA H H 2 8.450 8.873 -0.423 1
1 5 . 11 1 1 A 2 2 ALA HA H 2 4.390 4.280 0.110 1
1 9 . 11 1 1 A 2 2 ALA C C 2 178.300 179.028 -0.728 1
1 10 . 11 1 1 A 2 2 ALA CA C 2 52.500 54.933 -2.433 1
1 11 . 11 1 1 A 2 2 ALA CB C 2 19.200 18.982 0.218 1
1 12 . 11 1 1 A 2 2 ALA N N 2 125.100 128.581 -3.481 1
1 13 . 11 1 1 A 3 3 GLY H H 3 8.450 7.780 0.670 1
1 14 . 11 1 1 A 3 3 GLY HA2 H 3 4.030 4.097 -0.067 1
1 15 . 11 1 1 A 3 3 GLY HA3 H 3 4.030 4.097 -0.067 1
1 16 . 11 1 1 A 3 3 GLY C C 3 174.100 174.771 -0.671 1
1 17 . 11 1 1 A 3 3 GLY CA C 3 45.200 45.653 -0.453 1
1 18 . 11 1 1 A 3 3 GLY N N 3 108.000 104.167 3.833 1
1 19 . 11 1 1 A 4 4 GLN H H 4 8.550 8.165 0.385 1
1 20 . 11 1 1 A 4 4 GLN HA H 4 4.340 4.375 -0.035 1
1 27 . 11 1 1 A 4 4 GLN C C 4 176.700 176.457 0.243 1
1 28 . 11 1 1 A 4 4 GLN CA C 4 56.600 56.353 0.247 1
1 29 . 11 1 1 A 4 4 GLN CB C 4 29.300 27.987 1.313 1
1 31 . 11 1 1 A 4 4 GLN N N 4 120.500 119.393 1.107 1
1 33 . 11 1 1 A 5 5 SER H H 5 8.540 8.708 -0.168 1
1 34 . 11 1 1 A 5 5 SER HA H 5 4.390 4.218 0.172 1
1 38 . 11 1 1 A 5 5 SER C C 5 174.800 175.622 -0.822 1
1 39 . 11 1 1 A 5 5 SER CA C 5 59.100 61.655 -2.555 1
1 40 . 11 1 1 A 5 5 SER CB C 5 63.500 63.320 0.180 1
1 41 . 11 1 1 A 5 5 SER N N 5 117.100 119.568 -2.468 1
1 42 . 11 1 1 A 6 6 ASP H H 6 8.300 7.950 0.350 1
1 43 . 11 1 1 A 6 6 ASP HA H 6 4.540 4.631 -0.091 1
1 46 . 11 1 1 A 6 6 ASP C C 6 177.300 176.391 0.909 1
1 47 . 11 1 1 A 6 6 ASP CA C 6 55.100 52.744 2.356 1
1 48 . 11 1 1 A 6 6 ASP CB C 6 40.800 38.951 1.849 1
1 49 . 11 1 1 A 6 6 ASP N N 6 122.700 119.794 2.906 1
1 50 . 11 1 1 A 7 7 ARG H H 7 8.270 7.911 0.359 1
1 51 . 11 1 1 A 7 7 ARG HA H 7 4.150 3.947 0.203 1
1 58 . 11 1 1 A 7 7 ARG C C 7 177.600 178.598 -0.998 1
1 59 . 11 1 1 A 7 7 ARG CA C 7 58.000 59.151 -1.151 1
1 60 . 11 1 1 A 7 7 ARG CB C 7 30.100 29.907 0.193 1
1 63 . 11 1 1 A 7 7 ARG N N 7 122.100 125.297 -3.197 1
1 64 . 11 1 1 A 8 8 LYS H H 8 8.130 8.287 -0.157 1
1 65 . 11 1 1 A 8 8 LYS HA H 8 4.090 4.080 0.010 1
1 74 . 11 1 1 A 8 8 LYS C C 8 177.600 178.416 -0.816 1
1 75 . 11 1 1 A 8 8 LYS CA C 8 58.400 58.886 -0.486 1
1 76 . 11 1 1 A 8 8 LYS CB C 8 31.700 31.589 0.111 1
1 80 . 11 1 1 A 8 8 LYS N N 8 120.900 117.526 3.374 1
1 81 . 11 1 1 A 9 9 ALA H H 9 8.050 8.300 -0.250 1
1 82 . 11 1 1 A 9 9 ALA HA H 9 3.950 4.033 -0.083 1
1 86 . 11 1 1 A 9 9 ALA C C 9 179.800 179.868 -0.068 1
1 87 . 11 1 1 A 9 9 ALA CA C 9 55.100 54.752 0.348 1
1 88 . 11 1 1 A 9 9 ALA CB C 9 18.100 18.208 -0.108 1
1 89 . 11 1 1 A 9 9 ALA N N 9 121.600 122.444 -0.844 1
1 90 . 11 1 1 A 10 10 ALA H H 10 7.910 7.737 0.173 1
1 91 . 11 1 1 A 10 10 ALA HA H 10 4.200 4.077 0.123 1
1 95 . 11 1 1 A 10 10 ALA C C 10 180.500 180.181 0.319 1
1 96 . 11 1 1 A 10 10 ALA CA C 10 54.600 54.918 -0.318 1
1 97 . 11 1 1 A 10 10 ALA CB C 10 18.100 18.678 -0.578 1
1 98 . 11 1 1 A 10 10 ALA N N 10 120.200 120.100 0.100 1
1 99 . 11 1 1 A 11 11 LEU H H 11 8.080 7.638 0.442 1
1 100 . 11 1 1 A 11 11 LEU HA H 11 4.120 4.027 0.093 1
1 110 . 11 1 1 A 11 11 LEU C C 11 179.600 179.687 -0.087 1
1 111 . 11 1 1 A 11 11 LEU CA C 11 57.800 57.641 0.159 1
1 112 . 11 1 1 A 11 11 LEU CB C 11 41.700 41.599 0.101 1
1 115 . 11 1 1 A 11 11 LEU N N 11 120.900 119.603 1.297 1
1 116 . 11 1 1 A 12 12 LEU H H 12 8.480 8.933 -0.453 1
1 117 . 11 1 1 A 12 12 LEU HA H 12 4.040 4.104 -0.064 1
1 127 . 11 1 1 A 12 12 LEU C C 12 178.900 179.151 -0.251 1
1 128 . 11 1 1 A 12 12 LEU CA C 12 58.100 57.245 0.855 1
1 129 . 11 1 1 A 12 12 LEU CB C 12 40.100 41.169 -1.069 1
1 133 . 11 1 1 A 12 12 LEU N N 12 118.700 118.375 0.325 1
1 134 . 11 1 1 A 13 13 ASP H H 13 7.990 8.028 -0.038 1
1 135 . 11 1 1 A 13 13 ASP HA H 13 4.420 4.277 0.143 1
1 138 . 11 1 1 A 13 13 ASP C C 13 178.900 178.574 0.326 1
1 139 . 11 1 1 A 13 13 ASP CA C 13 57.500 57.969 -0.469 1
1 140 . 11 1 1 A 13 13 ASP CB C 13 40.500 41.396 -0.896 1
1 141 . 11 1 1 A 13 13 ASP N N 13 119.500 119.833 -0.333 1
1 142 . 11 1 1 A 14 14 GLN H H 14 7.620 7.571 0.049 1
1 143 . 11 1 1 A 14 14 GLN HA H 14 4.230 4.123 0.107 1
1 150 . 11 1 1 A 14 14 GLN C C 14 178.400 178.547 -0.147 1
1 151 . 11 1 1 A 14 14 GLN CA C 14 58.100 58.671 -0.571 1
1 152 . 11 1 1 A 14 14 GLN CB C 14 27.800 28.258 -0.458 1
1 154 . 11 1 1 A 14 14 GLN N N 14 118.900 120.062 -1.162 1
1 156 . 11 1 1 A 15 15 VAL H H 15 8.480 8.280 0.200 1
1 157 . 11 1 1 A 15 15 VAL HA H 15 3.380 3.603 -0.223 1
1 165 . 11 1 1 A 15 15 VAL C C 15 177.600 178.755 -1.155 1
1 166 . 11 1 1 A 15 15 VAL CA C 15 66.600 66.297 0.303 1
1 167 . 11 1 1 A 15 15 VAL CB C 15 30.500 31.637 -1.137 1
1 170 . 11 1 1 A 15 15 VAL N N 15 121.300 120.030 1.270 1
1 171 . 11 1 1 A 16 16 ALA H H 16 8.080 8.555 -0.475 1
1 172 . 11 1 1 A 16 16 ALA HA H 16 4.450 4.083 0.367 1
1 176 . 11 1 1 A 16 16 ALA C C 16 179.100 179.658 -0.558 1
1 177 . 11 1 1 A 16 16 ALA CA C 16 54.600 54.739 -0.139 1
1 178 . 11 1 1 A 16 16 ALA CB C 16 17.700 18.172 -0.472 1
1 179 . 11 1 1 A 16 16 ALA N N 16 121.400 121.273 0.127 1
1 180 . 11 1 1 A 17 17 ARG H H 17 7.480 7.439 0.041 1
1 181 . 11 1 1 A 17 17 ARG HA H 17 3.910 4.157 -0.247 1
1 187 . 11 1 1 A 17 17 ARG C C 17 179.700 178.797 0.903 1
1 188 . 11 1 1 A 17 17 ARG CA C 17 59.700 58.681 1.019 1
1 189 . 11 1 1 A 17 17 ARG CB C 17 30.400 30.000 0.400 1
1 191 . 11 1 1 A 17 17 ARG N N 17 116.900 118.991 -2.091 1
1 192 . 11 1 1 A 18 18 VAL H H 18 7.960 7.951 0.009 1
1 193 . 11 1 1 A 18 18 VAL HA H 18 3.690 3.694 -0.004 1
1 201 . 11 1 1 A 18 18 VAL C C 18 177.900 178.380 -0.480 1
1 202 . 11 1 1 A 18 18 VAL CA C 18 66.600 66.239 0.361 1
1 203 . 11 1 1 A 18 18 VAL CB C 18 31.300 31.686 -0.386 1
1 206 . 11 1 1 A 18 18 VAL N N 18 123.000 119.192 3.808 1
1 207 . 11 1 1 A 19 19 GLY H H 19 8.270 8.806 -0.536 1
1 208 . 11 1 1 A 19 19 GLY HA2 H 19 3.430 3.758 -0.328 1
1 209 . 11 1 1 A 19 19 GLY HA3 H 19 3.430 3.763 -0.333 1
1 210 . 11 1 1 A 19 19 GLY C C 19 174.400 175.566 -1.166 1
1 211 . 11 1 1 A 19 19 GLY CA C 19 48.500 47.289 1.211 1
1 212 . 11 1 1 A 19 19 GLY N N 19 105.400 107.333 -1.933 1
1 213 . 11 1 1 A 20 20 LYS H H 20 8.250 7.871 0.379 1
1 214 . 11 1 1 A 20 20 LYS HA H 20 3.710 4.072 -0.362 1
1 223 . 11 1 1 A 20 20 LYS C C 20 179.400 178.497 0.903 1
1 224 . 11 1 1 A 20 20 LYS CA C 20 59.300 58.684 0.616 1
1 225 . 11 1 1 A 20 20 LYS CB C 20 32.600 32.300 0.300 1
1 229 . 11 1 1 A 20 20 LYS N N 20 118.700 121.854 -3.154 1
1 230 . 11 1 1 A 21 21 ALA H H 21 7.640 7.586 0.054 1
1 231 . 11 1 1 A 21 21 ALA HA H 21 3.790 4.078 -0.288 1
1 235 . 11 1 1 A 21 21 ALA C C 21 177.900 178.851 -0.951 1
1 236 . 11 1 1 A 21 21 ALA CA C 21 55.200 54.649 0.551 1
1 237 . 11 1 1 A 21 21 ALA CB C 21 19.200 18.649 0.551 1
1 238 . 11 1 1 A 21 21 ALA N N 21 121.700 121.181 0.519 1
1 239 . 11 1 1 A 22 22 LEU H H 22 7.330 8.135 -0.805 1
1 240 . 11 1 1 A 22 22 LEU HA H 22 4.140 4.471 -0.331 1
1 250 . 11 1 1 A 22 22 LEU C C 22 176.800 177.858 -1.058 1
1 251 . 11 1 1 A 22 22 LEU CA C 22 54.600 54.023 0.577 1
1 252 . 11 1 1 A 22 22 LEU CB C 22 42.900 42.400 0.500 1
1 256 . 11 1 1 A 22 22 LEU N N 22 114.200 119.606 -5.406 1
1 257 . 11 1 1 A 23 23 ALA H H 23 7.160 7.704 -0.544 1
1 258 . 11 1 1 A 23 23 ALA HA H 23 4.720 4.334 0.386 1
1 262 . 11 1 1 A 23 23 ALA C C 23 176.700 177.479 -0.779 1
1 263 . 11 1 1 A 23 23 ALA CA C 23 53.000 51.509 1.491 1
1 264 . 11 1 1 A 23 23 ALA CB C 23 18.200 18.203 -0.003 1
1 265 . 11 1 1 A 23 23 ALA N N 23 118.200 122.951 -4.751 1
1 266 . 11 1 1 A 24 24 ASN H H 24 7.440 8.203 -0.763 1
1 267 . 11 1 1 A 24 24 ASN HA H 24 4.730 4.608 0.122 1
1 272 . 11 1 1 A 24 24 ASN C C 24 174.800 174.575 0.225 1
1 273 . 11 1 1 A 24 24 ASN CA C 24 53.500 55.320 -1.820 1
1 274 . 11 1 1 A 24 24 ASN CB C 24 41.700 37.232 4.468 1
1 275 . 11 1 1 A 24 24 ASN N N 24 116.800 113.531 3.269 1
1 277 . 11 1 1 A 25 25 GLY H H 25 9.370 8.588 0.782 1
1 278 . 11 1 1 A 25 25 GLY HA2 H 25 3.650 4.094 -0.444 1
1 279 . 11 1 1 A 25 25 GLY HA3 H 25 4.110 4.099 0.011 1
1 280 . 11 1 1 A 25 25 GLY C C 25 175.300 174.501 0.799 1
1 281 . 11 1 1 A 25 25 GLY CA C 25 47.600 44.705 2.895 1
1 282 . 11 1 1 A 25 25 GLY N N 25 114.800 108.497 6.303 1
1 283 . 11 1 1 A 26 26 ARG H H 26 8.050 8.873 -0.823 1
1 284 . 11 1 1 A 26 26 ARG HA H 26 4.150 4.158 -0.008 1
1 289 . 11 1 1 A 26 26 ARG C C 26 179.300 177.969 1.331 1
1 290 . 11 1 1 A 26 26 ARG CA C 26 57.000 58.236 -1.236 1
1 291 . 11 1 1 A 26 26 ARG CB C 26 29.900 29.712 0.188 1
1 294 . 11 1 1 A 26 26 ARG N N 26 120.500 123.937 -3.437 1
1 295 . 11 1 1 A 27 27 ARG H H 27 7.930 8.050 -0.120 1
1 296 . 11 1 1 A 27 27 ARG HA H 27 3.710 4.053 -0.343 1
1 301 . 11 1 1 A 27 27 ARG C C 27 178.300 178.614 -0.314 1
1 302 . 11 1 1 A 27 27 ARG CA C 27 61.000 58.516 2.484 1
1 303 . 11 1 1 A 27 27 ARG CB C 27 30.400 30.043 0.357 1
1 305 . 11 1 1 A 27 27 ARG N N 27 117.900 118.473 -0.573 1
1 306 . 11 1 1 A 28 28 LEU H H 28 7.640 8.174 -0.534 1
1 307 . 11 1 1 A 28 28 LEU HA H 28 3.950 4.093 -0.143 1
1 317 . 11 1 1 A 28 28 LEU C C 28 178.200 179.467 -1.267 1
1 318 . 11 1 1 A 28 28 LEU CA C 28 57.600 57.257 0.343 1
1 319 . 11 1 1 A 28 28 LEU CB C 28 41.900 41.201 0.699 1
1 323 . 11 1 1 A 28 28 LEU N N 28 117.600 119.503 -1.903 1
1 324 . 11 1 1 A 29 29 GLN H H 29 8.110 8.131 -0.021 1
1 325 . 11 1 1 A 29 29 GLN HA H 29 3.880 4.077 -0.197 1
1 332 . 11 1 1 A 29 29 GLN C C 29 179.400 178.970 0.430 1
1 333 . 11 1 1 A 29 29 GLN CA C 29 59.100 58.550 0.550 1
1 334 . 11 1 1 A 29 29 GLN CB C 29 28.800 28.287 0.513 1
1 336 . 11 1 1 A 29 29 GLN N N 29 119.300 119.091 0.209 1
1 338 . 11 1 1 A 30 30 ILE H H 30 7.530 7.848 -0.318 1
1 339 . 11 1 1 A 30 30 ILE HA H 30 3.340 3.598 -0.258 1
1 349 . 11 1 1 A 30 30 ILE C C 30 176.700 178.287 -1.587 1
1 350 . 11 1 1 A 30 30 ILE CA C 30 65.900 65.470 0.430 1
1 351 . 11 1 1 A 30 30 ILE CB C 30 37.400 37.962 -0.562 1
1 355 . 11 1 1 A 30 30 ILE N N 30 118.600 120.851 -2.251 1
1 356 . 11 1 1 A 31 31 LEU H H 31 7.500 7.957 -0.457 1
1 357 . 11 1 1 A 31 31 LEU HA H 31 3.520 3.733 -0.213 1
1 367 . 11 1 1 A 31 31 LEU C C 31 177.300 178.422 -1.122 1
1 368 . 11 1 1 A 31 31 LEU CA C 31 58.100 57.873 0.227 1
1 369 . 11 1 1 A 31 31 LEU CB C 31 41.100 40.733 0.367 1
1 373 . 11 1 1 A 31 31 LEU N N 31 119.900 119.151 0.749 1
1 374 . 11 1 1 A 32 32 ASP H H 32 7.950 8.312 -0.362 1
1 375 . 11 1 1 A 32 32 ASP HA H 32 4.300 4.292 0.008 1
1 378 . 11 1 1 A 32 32 ASP C C 32 178.300 178.212 0.088 1
1 379 . 11 1 1 A 32 32 ASP CA C 32 57.400 57.002 0.398 1
1 380 . 11 1 1 A 32 32 ASP CB C 32 42.400 42.069 0.331 1
1 381 . 11 1 1 A 32 32 ASP N N 32 116.900 119.194 -2.294 1
1 382 . 11 1 1 A 33 33 LEU H H 33 7.350 7.477 -0.127 1
1 383 . 11 1 1 A 33 33 LEU HA H 33 4.130 4.117 0.013 1
1 393 . 11 1 1 A 33 33 LEU C C 33 180.000 179.073 0.927 1
1 394 . 11 1 1 A 33 33 LEU CA C 33 57.600 57.009 0.591 1
1 395 . 11 1 1 A 33 33 LEU CB C 33 42.300 42.409 -0.109 1
1 399 . 11 1 1 A 33 33 LEU N N 33 118.600 120.056 -1.456 1
1 400 . 11 1 1 A 34 34 LEU H H 34 8.300 8.190 0.110 1
1 401 . 11 1 1 A 34 34 LEU HA H 34 4.490 4.310 0.180 1
1 411 . 11 1 1 A 34 34 LEU C C 34 178.900 179.631 -0.731 1
1 412 . 11 1 1 A 34 34 LEU CA C 34 55.800 57.401 -1.601 1
1 413 . 11 1 1 A 34 34 LEU CB C 34 41.300 41.286 0.014 1
1 417 . 11 1 1 A 34 34 LEU N N 34 117.800 118.850 -1.050 1
1 418 . 11 1 1 A 35 35 ALA H H 35 8.160 7.944 0.216 1
1 419 . 11 1 1 A 35 35 ALA HA H 35 4.050 4.059 -0.009 1
1 423 . 11 1 1 A 35 35 ALA C C 35 179.000 178.029 0.971 1
1 424 . 11 1 1 A 35 35 ALA CA C 35 54.900 54.433 0.467 1
1 425 . 11 1 1 A 35 35 ALA CB C 35 17.500 18.055 -0.555 1
1 426 . 11 1 1 A 35 35 ALA N N 35 123.900 121.862 2.038 1
1 427 . 11 1 1 A 36 36 GLN H H 36 7.600 7.892 -0.292 1
1 428 . 11 1 1 A 36 36 GLN HA H 36 4.340 4.307 0.033 1
1 435 . 11 1 1 A 36 36 GLN C C 36 176.100 175.421 0.679 1
1 436 . 11 1 1 A 36 36 GLN CA C 36 55.800 54.837 0.963 1
1 437 . 11 1 1 A 36 36 GLN CB C 36 29.000 27.910 1.090 1
1 439 . 11 1 1 A 36 36 GLN N N 36 113.300 113.127 0.173 1
1 441 . 11 1 1 A 37 37 GLY H H 37 7.550 7.017 0.533 1
1 442 . 11 1 1 A 37 37 GLY HA2 H 37 3.730 4.038 -0.308 1
1 443 . 11 1 1 A 37 37 GLY HA3 H 37 4.490 4.043 0.447 1
1 444 . 11 1 1 A 37 37 GLY C C 37 171.500 172.995 -1.495 1
1 445 . 11 1 1 A 37 37 GLY CA C 37 44.500 44.640 -0.140 1
1 446 . 11 1 1 A 37 37 GLY N N 37 108.400 108.583 -0.183 1
1 447 . 11 1 1 A 38 38 GLU H H 38 8.120 8.453 -0.333 1
1 448 . 11 1 1 A 38 38 GLU HA H 38 4.820 4.715 0.105 1
1 453 . 11 1 1 A 38 38 GLU C C 38 177.000 176.439 0.561 1
1 454 . 11 1 1 A 38 38 GLU CA C 38 56.400 56.553 -0.153 1
1 455 . 11 1 1 A 38 38 GLU CB C 38 31.200 29.991 1.209 1
1 457 . 11 1 1 A 38 38 GLU N N 38 119.600 119.685 -0.085 1
1 458 . 11 1 1 A 39 39 ARG H H 39 8.580 9.078 -0.498 1
1 459 . 11 1 1 A 39 39 ARG HA H 39 4.970 5.078 -0.108 1
1 467 . 11 1 1 A 39 39 ARG C C 39 174.800 175.619 -0.819 1
1 468 . 11 1 1 A 39 39 ARG CA C 39 53.900 54.241 -0.341 1
1 469 . 11 1 1 A 39 39 ARG CB C 39 36.400 33.891 2.509 1
1 472 . 11 1 1 A 39 39 ARG N N 39 121.500 123.821 -2.321 1
1 474 . 11 1 1 A 40 40 ALA H H 40 8.910 8.732 0.178 1
1 475 . 11 1 1 A 40 40 ALA HA H 40 4.920 4.214 0.706 1
1 479 . 11 1 1 A 40 40 ALA C C 40 179.200 178.263 0.937 1
1 480 . 11 1 1 A 40 40 ALA CA C 40 51.100 51.479 -0.379 1
1 481 . 11 1 1 A 40 40 ALA CB C 40 19.200 19.248 -0.048 1
1 482 . 11 1 1 A 40 40 ALA N N 40 125.100 124.953 0.147 1
1 483 . 11 1 1 A 41 41 VAL H H 41 8.420 8.364 0.056 1
1 484 . 11 1 1 A 41 41 VAL HA H 41 3.430 3.651 -0.221 1
1 492 . 11 1 1 A 41 41 VAL C C 41 176.800 177.197 -0.397 1
1 493 . 11 1 1 A 41 41 VAL CA C 41 67.600 67.022 0.578 1
1 494 . 11 1 1 A 41 41 VAL CB C 41 31.600 31.911 -0.311 1
1 497 . 11 1 1 A 41 41 VAL N N 41 120.900 120.544 0.356 1
1 498 . 11 1 1 A 42 42 GLU H H 42 9.640 8.194 1.446 1
1 499 . 11 1 1 A 42 42 GLU HA H 42 3.880 3.985 -0.105 1
1 504 . 11 1 1 A 42 42 GLU C C 42 178.300 179.006 -0.706 1
1 505 . 11 1 1 A 42 42 GLU CA C 42 60.600 59.463 1.137 1
1 506 . 11 1 1 A 42 42 GLU CB C 42 28.300 29.290 -0.990 1
1 508 . 11 1 1 A 42 42 GLU N N 42 119.000 119.996 -0.996 1
1 509 . 11 1 1 A 43 43 ALA H H 43 6.870 7.789 -0.919 1
1 510 . 11 1 1 A 43 43 ALA HA H 43 4.290 4.047 0.243 1
1 514 . 11 1 1 A 43 43 ALA C C 43 180.700 179.573 1.127 1
1 515 . 11 1 1 A 43 43 ALA CA C 43 54.100 54.982 -0.882 1
1 516 . 11 1 1 A 43 43 ALA CB C 43 19.100 18.118 0.982 1
1 517 . 11 1 1 A 43 43 ALA N N 43 120.500 122.133 -1.633 1
1 518 . 11 1 1 A 44 44 ILE H H 44 7.970 8.184 -0.214 1
1 519 . 11 1 1 A 44 44 ILE HA H 44 3.470 3.614 -0.144 1
1 529 . 11 1 1 A 44 44 ILE C C 44 178.300 177.935 0.365 1
1 530 . 11 1 1 A 44 44 ILE CA C 44 64.700 65.563 -0.863 1
1 531 . 11 1 1 A 44 44 ILE CB C 44 38.100 37.994 0.106 1
1 535 . 11 1 1 A 44 44 ILE N N 44 120.500 119.208 1.292 1
1 536 . 11 1 1 A 45 45 ALA H H 45 8.460 8.451 0.009 1
1 537 . 11 1 1 A 45 45 ALA HA H 45 3.720 4.304 -0.584 1
1 541 . 11 1 1 A 45 45 ALA C C 45 178.500 179.844 -1.344 1
1 542 . 11 1 1 A 45 45 ALA CA C 45 56.200 55.280 0.920 1
1 543 . 11 1 1 A 45 45 ALA CB C 45 17.400 18.544 -1.144 1
1 544 . 11 1 1 A 45 45 ALA N N 45 124.500 121.915 2.585 1
1 545 . 11 1 1 A 46 46 THR H H 46 8.080 8.051 0.029 1
1 546 . 11 1 1 A 46 46 THR HA H 46 3.900 3.835 0.065 1
1 551 . 11 1 1 A 46 46 THR C C 46 177.200 176.643 0.557 1
1 552 . 11 1 1 A 46 46 THR CA C 46 66.400 66.783 -0.383 1
1 553 . 11 1 1 A 46 46 THR CB C 46 68.800 68.875 -0.075 1
1 555 . 11 1 1 A 46 46 THR N N 46 112.400 114.761 -2.361 1
1 556 . 11 1 1 A 47 47 ALA H H 47 7.930 8.121 -0.191 1
1 557 . 11 1 1 A 47 47 ALA HA H 47 4.200 4.123 0.077 1
1 561 . 11 1 1 A 47 47 ALA C C 47 179.200 179.503 -0.303 1
1 562 . 11 1 1 A 47 47 ALA CA C 47 54.800 55.161 -0.361 1
1 563 . 11 1 1 A 47 47 ALA CB C 47 19.800 18.263 1.537 1
1 564 . 11 1 1 A 47 47 ALA N N 47 121.400 124.174 -2.774 1
1 565 . 11 1 1 A 48 48 THR H H 48 7.560 7.720 -0.160 1
1 566 . 11 1 1 A 48 48 THR HA H 48 4.390 4.377 0.013 1
1 571 . 11 1 1 A 48 48 THR C C 48 175.700 176.187 -0.487 1
1 572 . 11 1 1 A 48 48 THR CA C 48 61.800 62.816 -1.016 1
1 573 . 11 1 1 A 48 48 THR CB C 48 71.000 70.427 0.573 1
1 575 . 11 1 1 A 48 48 THR N N 48 103.500 106.964 -3.464 1
1 576 . 11 1 1 A 49 49 GLY H H 49 7.820 8.423 -0.603 1
1 577 . 11 1 1 A 49 49 GLY HA2 H 49 3.870 3.877 -0.007 1
1 578 . 11 1 1 A 49 49 GLY HA3 H 49 4.100 3.878 0.222 1
1 579 . 11 1 1 A 49 49 GLY C C 49 174.400 173.888 0.512 1
1 580 . 11 1 1 A 49 49 GLY CA C 49 46.300 45.661 0.639 1
1 581 . 11 1 1 A 49 49 GLY N N 49 111.100 112.414 -1.314 1
1 582 . 11 1 1 A 50 50 MET H H 50 7.930 7.623 0.307 1
1 583 . 11 1 1 A 50 50 MET HA H 50 4.540 4.678 -0.138 1
1 591 . 11 1 1 A 50 50 MET C C 50 174.800 175.136 -0.336 1
1 592 . 11 1 1 A 50 50 MET CA C 50 55.100 54.346 0.754 1
1 593 . 11 1 1 A 50 50 MET CB C 50 37.200 35.185 2.015 1
1 596 . 11 1 1 A 50 50 MET N N 50 119.300 120.601 -1.301 1
1 597 . 11 1 1 A 51 51 ASN H H 51 8.040 8.698 -0.658 1
1 598 . 11 1 1 A 51 51 ASN HA H 51 4.580 4.756 -0.176 1
1 601 . 11 1 1 A 51 51 ASN C C 51 176.100 176.349 -0.249 1
1 602 . 11 1 1 A 51 51 ASN CA C 51 52.800 52.957 -0.157 1
1 603 . 11 1 1 A 51 51 ASN CB C 51 41.100 39.646 1.454 1
1 604 . 11 1 1 A 51 51 ASN N N 51 118.000 123.649 -5.649 1
1 605 . 11 1 1 A 52 52 LEU H H 52 8.560 8.820 -0.260 1
1 606 . 11 1 1 A 52 52 LEU HA H 52 3.760 3.925 -0.165 1
1 616 . 11 1 1 A 52 52 LEU C C 52 179.600 178.639 0.961 1
1 617 . 11 1 1 A 52 52 LEU CA C 52 59.000 57.843 1.157 1
1 618 . 11 1 1 A 52 52 LEU CB C 52 41.800 41.297 0.503 1
1 622 . 11 1 1 A 52 52 LEU N N 52 120.600 125.665 -5.065 1
1 623 . 11 1 1 A 53 53 THR H H 53 8.230 7.990 0.240 1
1 624 . 11 1 1 A 53 53 THR HA H 53 3.880 3.923 -0.043 1
1 629 . 11 1 1 A 53 53 THR C C 53 176.900 176.863 0.037 1
1 630 . 11 1 1 A 53 53 THR CA C 53 66.500 66.719 -0.219 1
1 631 . 11 1 1 A 53 53 THR CB C 53 68.400 68.747 -0.347 1
1 633 . 11 1 1 A 53 53 THR N N 53 115.800 115.830 -0.030 1
1 634 . 11 1 1 A 54 54 THR H H 54 8.420 8.058 0.362 1
1 635 . 11 1 1 A 54 54 THR HA H 54 3.880 3.808 0.072 1
1 640 . 11 1 1 A 54 54 THR C C 54 177.300 176.238 1.062 1
1 641 . 11 1 1 A 54 54 THR CA C 54 66.600 67.081 -0.481 1
1 642 . 11 1 1 A 54 54 THR CB C 54 66.600 68.352 -1.752 1
1 644 . 11 1 1 A 54 54 THR N N 54 122.300 115.481 6.819 1
1 645 . 11 1 1 A 55 55 ALA H H 55 8.860 8.400 0.460 1
1 646 . 11 1 1 A 55 55 ALA HA H 55 4.020 3.959 0.061 1
1 650 . 11 1 1 A 55 55 ALA C C 55 179.000 179.620 -0.620 1
1 651 . 11 1 1 A 55 55 ALA CA C 55 56.100 55.334 0.766 1
1 652 . 11 1 1 A 55 55 ALA CB C 55 17.000 18.507 -1.507 1
1 653 . 11 1 1 A 55 55 ALA N N 55 125.600 123.606 1.994 1
1 654 . 11 1 1 A 56 56 SER H H 56 8.440 8.645 -0.205 1
1 655 . 11 1 1 A 56 56 SER HA H 56 3.920 4.042 -0.122 1
1 658 . 11 1 1 A 56 56 SER C C 56 176.400 176.152 0.248 1
1 659 . 11 1 1 A 56 56 SER CA C 56 62.600 61.495 1.105 1
1 660 . 11 1 1 A 56 56 SER CB C 56 62.700 62.703 -0.003 1
1 661 . 11 1 1 A 56 56 SER N N 56 112.700 113.404 -0.704 1
1 662 . 11 1 1 A 57 57 ALA H H 57 8.090 7.996 0.094 1
1 663 . 11 1 1 A 57 57 ALA HA H 57 4.130 4.006 0.124 1
1 667 . 11 1 1 A 57 57 ALA C C 57 181.200 179.836 1.364 1
1 668 . 11 1 1 A 57 57 ALA CA C 57 55.200 55.154 0.046 1
1 669 . 11 1 1 A 57 57 ALA CB C 57 17.900 18.636 -0.736 1
1 670 . 11 1 1 A 57 57 ALA N N 57 124.000 123.625 0.375 1
1 671 . 11 1 1 A 58 58 ASN H H 58 7.970 7.563 0.407 1
1 672 . 11 1 1 A 58 58 ASN HA H 58 4.480 4.581 -0.101 1
1 677 . 11 1 1 A 58 58 ASN C C 58 177.500 178.065 -0.565 1
1 678 . 11 1 1 A 58 58 ASN CA C 58 56.900 56.342 0.558 1
1 679 . 11 1 1 A 58 58 ASN CB C 58 39.800 38.615 1.185 1
1 680 . 11 1 1 A 58 58 ASN N N 58 117.600 116.732 0.868 1
1 682 . 11 1 1 A 59 59 LEU H H 59 8.530 8.773 -0.243 1
1 683 . 11 1 1 A 59 59 LEU HA H 59 3.710 3.678 0.032 1
1 693 . 11 1 1 A 59 59 LEU C C 59 178.400 178.946 -0.546 1
1 694 . 11 1 1 A 59 59 LEU CA C 59 58.600 57.722 0.878 1
1 695 . 11 1 1 A 59 59 LEU CB C 59 40.500 40.894 -0.394 1
1 699 . 11 1 1 A 59 59 LEU N N 59 122.600 121.517 1.083 1
1 700 . 11 1 1 A 60 60 GLN H H 60 8.200 8.628 -0.428 1
1 701 . 11 1 1 A 60 60 GLN HA H 60 4.020 3.979 0.041 1
1 708 . 11 1 1 A 60 60 GLN C C 60 178.700 177.798 0.902 1
1 709 . 11 1 1 A 60 60 GLN CA C 60 58.800 59.007 -0.207 1
1 710 . 11 1 1 A 60 60 GLN CB C 60 27.700 28.588 -0.888 1
1 712 . 11 1 1 A 60 60 GLN N N 60 118.900 118.401 0.499 1
1 714 . 11 1 1 A 61 61 ALA H H 61 7.580 7.742 -0.162 1
1 715 . 11 1 1 A 61 61 ALA HA H 61 4.230 4.107 0.123 1
1 719 . 11 1 1 A 61 61 ALA C C 61 181.300 180.159 1.141 1
1 720 . 11 1 1 A 61 61 ALA CA C 61 55.100 55.003 0.097 1
1 721 . 11 1 1 A 61 61 ALA CB C 61 17.600 18.007 -0.407 1
1 722 . 11 1 1 A 61 61 ALA N N 61 122.200 121.893 0.307 1
1 723 . 11 1 1 A 62 62 LEU H H 62 7.830 8.038 -0.208 1
1 724 . 11 1 1 A 62 62 LEU HA H 62 3.980 4.018 -0.038 1
1 734 . 11 1 1 A 62 62 LEU C C 62 178.500 179.122 -0.622 1
1 735 . 11 1 1 A 62 62 LEU CA C 62 58.100 57.456 0.644 1
1 736 . 11 1 1 A 62 62 LEU CB C 62 43.300 41.523 1.777 1
1 739 . 11 1 1 A 62 62 LEU N N 62 119.000 118.297 0.703 1
1 740 . 11 1 1 A 63 63 LYS H H 63 8.580 7.990 0.590 1
1 741 . 11 1 1 A 63 63 LYS HA H 63 4.130 4.130 0.000 1
1 750 . 11 1 1 A 63 63 LYS C C 63 180.500 179.434 1.066 1
1 751 . 11 1 1 A 63 63 LYS CA C 63 59.700 58.864 0.836 1
1 752 . 11 1 1 A 63 63 LYS CB C 63 32.600 32.157 0.443 1
1 756 . 11 1 1 A 63 63 LYS N N 63 123.400 121.895 1.505 1
1 757 . 11 1 1 A 64 64 SER H H 64 8.640 8.577 0.063 1
1 758 . 11 1 1 A 64 64 SER HA H 64 4.300 4.295 0.005 1
1 761 . 11 1 1 A 64 64 SER C C 64 175.000 177.238 -2.238 1
1 762 . 11 1 1 A 64 64 SER CA C 64 61.400 62.603 -1.203 1
1 763 . 11 1 1 A 64 64 SER CB C 64 63.000 62.706 0.294 1
1 764 . 11 1 1 A 64 64 SER N N 64 117.700 118.123 -0.423 1
1 765 . 11 1 1 A 65 65 GLY H H 65 7.280 7.997 -0.717 1
1 766 . 11 1 1 A 65 65 GLY HA2 H 65 3.240 3.863 -0.623 1
1 767 . 11 1 1 A 65 65 GLY HA3 H 65 3.980 3.864 0.116 1
1 768 . 11 1 1 A 65 65 GLY C C 65 171.300 175.133 -3.833 1
1 769 . 11 1 1 A 65 65 GLY CA C 65 45.100 46.176 -1.076 1
1 770 . 11 1 1 A 65 65 GLY N N 65 104.400 109.616 -5.216 1
1 771 . 11 1 1 A 66 66 GLY H H 66 7.730 7.655 0.075 1
1 772 . 11 1 1 A 66 66 GLY HA2 H 66 3.650 4.017 -0.367 1
1 773 . 11 1 1 A 66 66 GLY HA3 H 66 3.750 4.022 -0.272 1
1 774 . 11 1 1 A 66 66 GLY C C 66 173.700 174.885 -1.185 1
1 775 . 11 1 1 A 66 66 GLY CA C 66 45.400 45.829 -0.429 1
1 776 . 11 1 1 A 66 66 GLY N N 66 104.700 108.008 -3.308 1
1 777 . 11 1 1 A 67 67 LEU H H 67 7.520 7.838 -0.318 1
1 778 . 11 1 1 A 67 67 LEU HA H 67 4.310 4.442 -0.132 1
1 788 . 11 1 1 A 67 67 LEU C C 67 177.700 175.619 2.081 1
1 789 . 11 1 1 A 67 67 LEU CA C 67 55.500 55.038 0.462 1
1 790 . 11 1 1 A 67 67 LEU CB C 67 42.400 43.133 -0.733 1
1 794 . 11 1 1 A 67 67 LEU N N 67 110.600 117.899 -7.299 1
1 795 . 11 1 1 A 68 68 VAL H H 68 6.890 7.418 -0.528 1
1 796 . 11 1 1 A 68 68 VAL HA H 68 5.190 5.059 0.131 1
1 804 . 11 1 1 A 68 68 VAL C C 68 173.700 174.359 -0.659 1
1 805 . 11 1 1 A 68 68 VAL CA C 68 57.400 58.546 -1.146 1
1 806 . 11 1 1 A 68 68 VAL CB C 68 36.400 35.636 0.764 1
1 809 . 11 1 1 A 68 68 VAL N N 68 106.400 114.482 -8.082 1
1 810 . 11 1 1 A 69 69 GLU H H 69 8.880 8.885 -0.005 1
1 811 . 11 1 1 A 69 69 GLU HA H 69 4.660 5.063 -0.403 1
1 816 . 11 1 1 A 69 69 GLU C C 69 173.300 174.767 -1.467 1
1 817 . 11 1 1 A 69 69 GLU CA C 69 54.300 54.742 -0.442 1
1 818 . 11 1 1 A 69 69 GLU CB C 69 34.100 34.004 0.096 1
1 820 . 11 1 1 A 69 69 GLU N N 69 120.400 121.075 -0.675 1
1 821 . 11 1 1 A 70 70 ALA H H 70 8.730 8.880 -0.150 1
1 822 . 11 1 1 A 70 70 ALA HA H 70 4.990 5.536 -0.546 1
1 826 . 11 1 1 A 70 70 ALA C C 70 176.500 175.738 0.762 1
1 827 . 11 1 1 A 70 70 ALA CA C 70 50.000 49.973 0.027 1
1 828 . 11 1 1 A 70 70 ALA CB C 70 22.300 21.969 0.331 1
1 829 . 11 1 1 A 70 70 ALA N N 70 122.800 122.621 0.179 1
1 830 . 11 1 1 A 71 71 ARG H H 71 8.670 8.999 -0.329 1
1 831 . 11 1 1 A 71 71 ARG HA H 71 4.630 4.982 -0.352 1
1 843 . 11 1 1 A 71 71 ARG C C 71 173.500 174.887 -1.387 1
1 844 . 11 1 1 A 71 71 ARG CA C 71 54.600 54.238 0.362 1
1 845 . 11 1 1 A 71 71 ARG CB C 71 33.600 33.440 0.160 1
1 849 . 11 1 1 A 71 71 ARG N N 71 120.100 122.456 -2.356 1
1 851 . 11 1 1 A 72 72 ARG H H 72 8.780 8.682 0.098 1
1 852 . 11 1 1 A 72 72 ARG HA H 72 5.100 4.949 0.151 1
1 859 . 11 1 1 A 72 72 ARG C C 72 176.000 175.695 0.305 1
1 860 . 11 1 1 A 72 72 ARG CA C 72 54.900 55.485 -0.585 1
1 861 . 11 1 1 A 72 72 ARG CB C 72 32.500 31.191 1.309 1
1 864 . 11 1 1 A 72 72 ARG N N 72 123.600 121.939 1.661 1
1 865 . 11 1 1 A 73 73 GLU H H 73 8.720 8.908 -0.188 1
1 866 . 11 1 1 A 73 73 GLU HA H 73 4.510 4.611 -0.101 1
1 871 . 11 1 1 A 73 73 GLU C C 73 175.900 176.576 -0.676 1
1 872 . 11 1 1 A 73 73 GLU CA C 73 55.700 55.258 0.442 1
1 873 . 11 1 1 A 73 73 GLU CB C 73 31.800 31.455 0.345 1
1 875 . 11 1 1 A 73 73 GLU N N 73 126.800 123.131 3.669 1
1 876 . 11 1 1 A 74 74 GLY H H 74 9.190 8.952 0.238 1
1 877 . 11 1 1 A 74 74 GLY HA2 H 74 3.700 3.876 -0.176 1
1 878 . 11 1 1 A 74 74 GLY HA3 H 74 4.170 3.892 0.278 1
1 879 . 11 1 1 A 74 74 GLY C C 74 175.400 174.850 0.550 1
1 880 . 11 1 1 A 74 74 GLY CA C 74 47.100 47.297 -0.197 1
1 881 . 11 1 1 A 74 74 GLY N N 74 118.500 116.018 2.482 1
1 882 . 11 1 1 A 75 75 THR H H 75 8.780 8.512 0.268 1
1 883 . 11 1 1 A 75 75 THR HA H 75 4.290 4.447 -0.157 1
1 888 . 11 1 1 A 75 75 THR C C 75 174.600 174.126 0.474 1
1 889 . 11 1 1 A 75 75 THR CA C 75 62.000 62.253 -0.253 1
1 890 . 11 1 1 A 75 75 THR CB C 75 69.000 69.917 -0.917 1
1 892 . 11 1 1 A 75 75 THR N N 75 118.000 120.356 -2.356 1
1 893 . 11 1 1 A 76 76 ARG H H 76 8.030 7.718 0.312 1
1 894 . 11 1 1 A 76 76 ARG HA H 76 4.610 4.752 -0.142 1
1 901 . 11 1 1 A 76 76 ARG C C 76 174.800 174.897 -0.097 1
1 902 . 11 1 1 A 76 76 ARG CA C 76 55.500 54.710 0.790 1
1 903 . 11 1 1 A 76 76 ARG CB C 76 32.700 32.095 0.605 1
1 906 . 11 1 1 A 76 76 ARG N N 76 122.600 121.493 1.107 1
1 907 . 11 1 1 A 77 77 GLN H H 77 8.580 8.524 0.056 1
1 908 . 11 1 1 A 77 77 GLN HA H 77 4.910 4.842 0.068 1
1 915 . 11 1 1 A 77 77 GLN C C 77 173.900 173.645 0.255 1
1 916 . 11 1 1 A 77 77 GLN CA C 77 54.700 54.188 0.512 1
1 917 . 11 1 1 A 77 77 GLN CB C 77 31.800 30.523 1.277 1
1 919 . 11 1 1 A 77 77 GLN N N 77 121.900 122.310 -0.410 1
1 921 . 11 1 1 A 78 78 TYR H H 78 8.890 9.346 -0.456 1
1 922 . 11 1 1 A 78 78 TYR HA H 78 4.750 5.289 -0.539 1
1 929 . 11 1 1 A 78 78 TYR C C 78 175.600 174.397 1.203 1
1 930 . 11 1 1 A 78 78 TYR CA C 78 57.000 56.316 0.684 1
1 931 . 11 1 1 A 78 78 TYR CB C 78 41.400 39.974 1.426 1
1 936 . 11 1 1 A 78 78 TYR N N 78 121.800 127.085 -5.285 1
1 937 . 11 1 1 A 79 79 TYR H H 79 9.010 9.428 -0.418 1
1 938 . 11 1 1 A 79 79 TYR HA H 79 5.410 5.362 0.048 1
1 945 . 11 1 1 A 79 79 TYR C C 79 173.100 175.214 -2.114 1
1 946 . 11 1 1 A 79 79 TYR CA C 79 57.300 57.124 0.176 1
1 947 . 11 1 1 A 79 79 TYR CB C 79 43.300 41.160 2.140 1
1 952 . 11 1 1 A 79 79 TYR N N 79 122.500 123.327 -0.827 1
1 953 . 11 1 1 A 80 80 ARG H H 80 8.720 8.582 0.138 1
1 954 . 11 1 1 A 80 80 ARG HA H 80 5.120 4.722 0.398 1
1 962 . 11 1 1 A 80 80 ARG C C 80 175.500 174.690 0.810 1
1 963 . 11 1 1 A 80 80 ARG CA C 80 53.200 54.990 -1.790 1
1 964 . 11 1 1 A 80 80 ARG CB C 80 33.900 34.469 -0.569 1
1 967 . 11 1 1 A 80 80 ARG N N 80 114.500 121.815 -7.315 1
1 969 . 11 1 1 A 81 81 ILE H H 81 9.300 8.671 0.629 1
1 970 . 11 1 1 A 81 81 ILE HA H 81 4.150 4.099 0.051 1
1 980 . 11 1 1 A 81 81 ILE C C 81 177.800 177.264 0.536 1
1 981 . 11 1 1 A 81 81 ILE CA C 81 62.300 62.352 -0.052 1
1 982 . 11 1 1 A 81 81 ILE CB C 81 37.800 37.845 -0.045 1
1 986 . 11 1 1 A 81 81 ILE N N 81 122.100 125.110 -3.010 1
1 987 . 11 1 1 A 82 82 ALA H H 82 7.930 8.644 -0.714 1
1 988 . 11 1 1 A 82 82 ALA HA H 82 3.930 4.107 -0.177 1
1 992 . 11 1 1 A 82 82 ALA C C 82 176.300 177.118 -0.818 1
1 993 . 11 1 1 A 82 82 ALA CA C 82 54.200 55.153 -0.953 1
1 994 . 11 1 1 A 82 82 ALA CB C 82 18.500 19.584 -1.084 1
1 995 . 11 1 1 A 82 82 ALA N N 82 127.200 128.652 -1.452 1
1 996 . 11 1 1 A 83 83 GLY H H 83 6.980 7.612 -0.632 1
1 997 . 11 1 1 A 83 83 GLY HA2 H 83 4.090 4.067 0.023 1
1 998 . 11 1 1 A 83 83 GLY HA3 H 83 4.440 4.069 0.371 1
1 999 . 11 1 1 A 83 83 GLY C C 83 173.600 175.045 -1.445 1
1 1000 . 11 1 1 A 83 83 GLY CA C 83 45.200 45.088 0.112 1
1 1001 . 11 1 1 A 83 83 GLY N N 83 101.800 103.175 -1.375 1
1 1002 . 11 1 1 A 84 84 GLU H H 84 8.930 8.869 0.061 1
1 1003 . 11 1 1 A 84 84 GLU HA H 84 4.120 3.998 0.122 1
1 1008 . 11 1 1 A 84 84 GLU C C 84 178.300 177.846 0.454 1
1 1009 . 11 1 1 A 84 84 GLU CA C 84 58.900 59.351 -0.451 1
1 1010 . 11 1 1 A 84 84 GLU CB C 84 29.400 29.410 -0.010 1
1 1012 . 11 1 1 A 84 84 GLU N N 84 120.300 120.720 -0.420 1
1 1013 . 11 1 1 A 85 85 ASP H H 85 8.950 8.071 0.879 1
1 1014 . 11 1 1 A 85 85 ASP HA H 85 4.310 4.436 -0.126 1
1 1017 . 11 1 1 A 85 85 ASP C C 85 178.000 178.534 -0.534 1
1 1018 . 11 1 1 A 85 85 ASP CA C 85 57.100 56.862 0.238 1
1 1019 . 11 1 1 A 85 85 ASP CB C 85 38.900 40.610 -1.710 1
1 1020 . 11 1 1 A 85 85 ASP N N 85 119.400 118.872 0.528 1
1 1021 . 11 1 1 A 86 86 VAL H H 86 7.620 7.709 -0.089 1
1 1022 . 11 1 1 A 86 86 VAL HA H 86 3.480 3.642 -0.162 1
1 1030 . 11 1 1 A 86 86 VAL C C 86 177.400 177.937 -0.537 1
1 1031 . 11 1 1 A 86 86 VAL CA C 86 66.800 66.260 0.540 1
1 1032 . 11 1 1 A 86 86 VAL CB C 86 31.300 31.165 0.135 1
1 1035 . 11 1 1 A 86 86 VAL N N 86 121.600 121.184 0.416 1
1 1036 . 11 1 1 A 87 87 ALA H H 87 7.520 7.993 -0.473 1
1 1037 . 11 1 1 A 87 87 ALA HA H 87 4.110 4.023 0.087 1
1 1041 . 11 1 1 A 87 87 ALA C C 87 181.200 179.722 1.478 1
1 1042 . 11 1 1 A 87 87 ALA CA C 87 55.800 55.483 0.317 1
1 1043 . 11 1 1 A 87 87 ALA CB C 87 17.600 17.841 -0.241 1
1 1044 . 11 1 1 A 87 87 ALA N N 87 122.700 122.008 0.692 1
1 1045 . 11 1 1 A 88 88 ARG H H 88 8.380 8.055 0.325 1
1 1046 . 11 1 1 A 88 88 ARG HA H 88 4.090 4.059 0.031 1
1 1054 . 11 1 1 A 88 88 ARG C C 88 179.100 178.918 0.182 1
1 1055 . 11 1 1 A 88 88 ARG CA C 88 59.600 58.876 0.724 1
1 1056 . 11 1 1 A 88 88 ARG CB C 88 30.500 29.753 0.747 1
1 1059 . 11 1 1 A 88 88 ARG N N 88 119.200 117.753 1.447 1
1 1061 . 11 1 1 A 89 89 LEU H H 89 8.480 7.955 0.525 1
1 1062 . 11 1 1 A 89 89 LEU HA H 89 4.040 4.050 -0.010 1
1 1071 . 11 1 1 A 89 89 LEU C C 89 177.200 178.581 -1.381 1
1 1072 . 11 1 1 A 89 89 LEU CA C 89 58.300 57.907 0.393 1
1 1073 . 11 1 1 A 89 89 LEU CB C 89 41.300 41.902 -0.602 1
1 1076 . 11 1 1 A 89 89 LEU N N 89 123.300 121.884 1.416 1
1 1077 . 11 1 1 A 90 90 PHE H H 90 8.890 8.634 0.256 1
1 1078 . 11 1 1 A 90 90 PHE HA H 90 4.380 3.994 0.386 1
1 1086 . 11 1 1 A 90 90 PHE C C 90 177.500 177.780 -0.280 1
1 1087 . 11 1 1 A 90 90 PHE CA C 90 59.400 62.295 -2.895 1
1 1088 . 11 1 1 A 90 90 PHE CB C 90 38.600 39.030 -0.430 1
1 1094 . 11 1 1 A 90 90 PHE N N 90 119.400 119.375 0.025 1
1 1095 . 11 1 1 A 91 91 ALA H H 91 7.920 8.480 -0.560 1
1 1096 . 11 1 1 A 91 91 ALA HA H 91 3.940 3.963 -0.023 1
1 1100 . 11 1 1 A 91 91 ALA C C 91 180.200 179.818 0.382 1
1 1101 . 11 1 1 A 91 91 ALA CA C 91 55.100 55.307 -0.207 1
1 1102 . 11 1 1 A 91 91 ALA CB C 91 18.000 17.942 0.058 1
1 1103 . 11 1 1 A 91 91 ALA N N 91 120.500 121.322 -0.822 1
1 1104 . 11 1 1 A 92 92 LEU H H 92 8.190 8.522 -0.332 1
1 1105 . 11 1 1 A 92 92 LEU HA H 92 4.300 4.050 0.250 1
1 1115 . 11 1 1 A 92 92 LEU C C 92 178.900 178.302 0.598 1
1 1116 . 11 1 1 A 92 92 LEU CA C 92 57.500 57.961 -0.461 1
1 1117 . 11 1 1 A 92 92 LEU CB C 92 42.100 41.577 0.523 1
1 1121 . 11 1 1 A 92 92 LEU N N 92 120.200 119.441 0.759 1
1 1122 . 11 1 1 A 93 93 VAL H H 93 8.890 8.079 0.811 1
1 1123 . 11 1 1 A 93 93 VAL HA H 93 3.810 3.714 0.096 1
1 1131 . 11 1 1 A 93 93 VAL C C 93 176.900 177.286 -0.386 1
1 1132 . 11 1 1 A 93 93 VAL CA C 93 66.000 64.898 1.102 1
1 1133 . 11 1 1 A 93 93 VAL CB C 93 31.200 31.229 -0.029 1
1 1136 . 11 1 1 A 93 93 VAL N N 93 117.100 118.433 -1.333 1
1 1137 . 11 1 1 A 94 94 GLN H H 94 6.920 7.575 -0.655 1
1 1138 . 11 1 1 A 94 94 GLN HA H 94 3.790 3.796 -0.006 1
1 1145 . 11 1 1 A 94 94 GLN C C 94 177.400 178.457 -1.057 1
1 1146 . 11 1 1 A 94 94 GLN CA C 94 60.000 58.530 1.470 1
1 1147 . 11 1 1 A 94 94 GLN CB C 94 30.300 28.075 2.225 1
1 1149 . 11 1 1 A 94 94 GLN N N 94 117.800 120.647 -2.847 1
1 1151 . 11 1 1 A 95 95 VAL H H 95 7.420 8.000 -0.580 1
1 1152 . 11 1 1 A 95 95 VAL HA H 95 3.760 3.531 0.229 1
1 1160 . 11 1 1 A 95 95 VAL C C 95 178.300 178.000 0.300 1
1 1161 . 11 1 1 A 95 95 VAL CA C 95 66.600 66.403 0.197 1
1 1162 . 11 1 1 A 95 95 VAL CB C 95 31.900 31.453 0.447 1
1 1165 . 11 1 1 A 95 95 VAL N N 95 121.500 120.009 1.491 1
1 1166 . 11 1 1 A 96 96 VAL H H 96 8.340 8.113 0.227 1
1 1167 . 11 1 1 A 96 96 VAL HA H 96 3.810 3.517 0.293 1
1 1175 . 11 1 1 A 96 96 VAL C C 96 178.400 178.112 0.288 1
1 1176 . 11 1 1 A 96 96 VAL CA C 96 66.100 66.453 -0.353 1
1 1177 . 11 1 1 A 96 96 VAL CB C 96 32.200 31.382 0.818 1
1 1180 . 11 1 1 A 96 96 VAL N N 96 120.000 119.827 0.173 1
1 1181 . 11 1 1 A 97 97 ALA H H 97 8.140 7.767 0.373 1
1 1182 . 11 1 1 A 97 97 ALA HA H 97 4.010 3.931 0.079 1
1 1186 . 11 1 1 A 97 97 ALA C C 97 178.800 178.968 -0.168 1
1 1187 . 11 1 1 A 97 97 ALA CA C 97 54.900 55.349 -0.449 1
1 1188 . 11 1 1 A 97 97 ALA CB C 97 19.900 18.612 1.288 1
1 1189 . 11 1 1 A 97 97 ALA N N 97 121.400 121.988 -0.588 1
1 1190 . 11 1 1 A 98 98 ASP H H 98 8.170 8.738 -0.568 1
1 1191 . 11 1 1 A 98 98 ASP HA H 98 4.320 4.302 0.018 1
1 1194 . 11 1 1 A 98 98 ASP C C 98 178.100 178.189 -0.089 1
1 1195 . 11 1 1 A 98 98 ASP CA C 98 57.100 57.616 -0.516 1
1 1196 . 11 1 1 A 98 98 ASP CB C 98 41.800 41.986 -0.186 1
1 1197 . 11 1 1 A 98 98 ASP N N 98 118.500 118.521 -0.021 1
1 1198 . 11 1 1 A 99 99 GLU H H 99 8.220 8.234 -0.014 1
1 1199 . 11 1 1 A 99 99 GLU HA H 99 4.000 4.124 -0.124 1
1 1204 . 11 1 1 A 99 99 GLU C C 99 178.300 177.599 0.701 1
1 1205 . 11 1 1 A 99 99 GLU CA C 99 58.300 57.721 0.579 1
1 1206 . 11 1 1 A 99 99 GLU CB C 99 29.800 29.746 0.054 1
1 1208 . 11 1 1 A 99 99 GLU N N 99 116.600 118.325 -1.725 1
1 1209 . 11 1 1 A 100 100 HIS H H 100 7.980 7.335 0.645 1
1 1210 . 11 1 1 A 100 100 HIS HA H 100 4.600 4.314 0.286 1
1 1214 . 11 1 1 A 100 100 HIS C C 100 175.900 176.771 -0.871 1
1 1215 . 11 1 1 A 100 100 HIS CA C 100 57.500 58.532 -1.032 1
1 1216 . 11 1 1 A 100 100 HIS CB C 100 30.800 29.782 1.018 1
1 1218 . 11 1 1 A 100 100 HIS N N 100 114.000 116.521 -2.521 1
1 1219 . 11 1 1 A 101 101 LEU H H 101 7.920 7.329 0.591 1
1 1220 . 11 1 1 A 101 101 LEU HA H 101 4.370 3.999 0.371 1
1 1230 . 11 1 1 A 101 101 LEU C C 101 177.700 177.062 0.638 1
1 1231 . 11 1 1 A 101 101 LEU CA C 101 55.900 55.219 0.681 1
1 1232 . 11 1 1 A 101 101 LEU CB C 101 42.100 42.326 -0.226 1
1 1236 . 11 1 1 A 101 101 LEU N N 101 118.500 120.102 -1.602 1
1 1237 . 11 1 1 A 102 102 GLU H H 102 8.100 8.117 -0.017 1
1 1238 . 11 1 1 A 102 102 GLU HA H 102 4.160 3.984 0.176 1
1 1243 . 11 1 1 A 102 102 GLU C C 102 176.700 175.798 0.902 1
1 1244 . 11 1 1 A 102 102 GLU CA C 102 57.000 58.833 -1.833 1
1 1245 . 11 1 1 A 102 102 GLU CB C 102 29.900 29.062 0.838 1
1 1247 . 11 1 1 A 102 102 GLU N N 102 119.100 119.106 -0.006 1
1 1248 . 11 1 1 A 103 103 HIS H H 103 8.010 8.170 -0.160 1
1 1249 . 11 1 1 A 103 103 HIS HA H 103 4.520 4.600 -0.080 1
1 1252 . 11 1 1 A 103 103 HIS CA C 103 56.100 56.941 -0.841 1
1 1253 . 11 1 1 A 103 103 HIS CB C 103 29.700 31.893 -2.193 1
1 1254 . 11 1 1 A 103 103 HIS N N 103 117.300 117.754 -0.454 1
1 1255 . 11 1 1 A 107 107 HIS HA H 107 4.560 4.793 -0.233 1
1 1258 . 11 1 1 A 107 107 HIS C C 107 173.900 173.908 -0.008 1
1 1259 . 11 1 1 A 107 107 HIS CA C 107 55.900 54.956 0.944 1
1 1260 . 11 1 1 A 107 107 HIS CB C 107 30.200 29.031 1.169 1
1 4 . 12 1 1 A 2 2 ALA H H 2 8.450 8.775 -0.325 1
1 5 . 12 1 1 A 2 2 ALA HA H 2 4.390 4.602 -0.212 1
1 9 . 12 1 1 A 2 2 ALA C C 2 178.300 177.610 0.690 1
1 10 . 12 1 1 A 2 2 ALA CA C 2 52.500 51.463 1.037 1
1 11 . 12 1 1 A 2 2 ALA CB C 2 19.200 20.579 -1.379 1
1 12 . 12 1 1 A 2 2 ALA N N 2 125.100 124.086 1.014 1
1 13 . 12 1 1 A 3 3 GLY H H 3 8.450 8.593 -0.143 1
1 14 . 12 1 1 A 3 3 GLY HA2 H 3 4.030 3.827 0.203 1
1 15 . 12 1 1 A 3 3 GLY HA3 H 3 4.030 3.827 0.203 1
1 16 . 12 1 1 A 3 3 GLY C C 3 174.100 174.057 0.043 1
1 17 . 12 1 1 A 3 3 GLY CA C 3 45.200 47.062 -1.862 1
1 18 . 12 1 1 A 3 3 GLY N N 3 108.000 107.366 0.634 1
1 19 . 12 1 1 A 4 4 GLN H H 4 8.550 8.660 -0.110 1
1 20 . 12 1 1 A 4 4 GLN HA H 4 4.340 4.566 -0.226 1
1 27 . 12 1 1 A 4 4 GLN C C 4 176.700 175.758 0.942 1
1 28 . 12 1 1 A 4 4 GLN CA C 4 56.600 57.081 -0.481 1
1 29 . 12 1 1 A 4 4 GLN CB C 4 29.300 29.980 -0.680 1
1 31 . 12 1 1 A 4 4 GLN N N 4 120.500 120.897 -0.397 1
1 33 . 12 1 1 A 5 5 SER H H 5 8.540 8.145 0.395 1
1 34 . 12 1 1 A 5 5 SER HA H 5 4.390 4.133 0.257 1
1 38 . 12 1 1 A 5 5 SER C C 5 174.800 173.929 0.871 1
1 39 . 12 1 1 A 5 5 SER CA C 5 59.100 59.562 -0.462 1
1 40 . 12 1 1 A 5 5 SER CB C 5 63.500 61.438 2.062 1
1 41 . 12 1 1 A 5 5 SER N N 5 117.100 115.198 1.902 1
1 42 . 12 1 1 A 6 6 ASP H H 6 8.300 8.427 -0.127 1
1 43 . 12 1 1 A 6 6 ASP HA H 6 4.540 4.553 -0.013 1
1 46 . 12 1 1 A 6 6 ASP C C 6 177.300 176.108 1.192 1
1 47 . 12 1 1 A 6 6 ASP CA C 6 55.100 54.919 0.181 1
1 48 . 12 1 1 A 6 6 ASP CB C 6 40.800 39.704 1.096 1
1 49 . 12 1 1 A 6 6 ASP N N 6 122.700 119.358 3.342 1
1 50 . 12 1 1 A 7 7 ARG H H 7 8.270 8.648 -0.378 1
1 51 . 12 1 1 A 7 7 ARG HA H 7 4.150 4.177 -0.027 1
1 58 . 12 1 1 A 7 7 ARG C C 7 177.600 178.913 -1.313 1
1 59 . 12 1 1 A 7 7 ARG CA C 7 58.000 57.952 0.048 1
1 60 . 12 1 1 A 7 7 ARG CB C 7 30.100 29.571 0.529 1
1 63 . 12 1 1 A 7 7 ARG N N 7 122.100 125.319 -3.219 1
1 64 . 12 1 1 A 8 8 LYS H H 8 8.130 8.116 0.014 1
1 65 . 12 1 1 A 8 8 LYS HA H 8 4.090 4.087 0.003 1
1 74 . 12 1 1 A 8 8 LYS C C 8 177.600 178.910 -1.310 1
1 75 . 12 1 1 A 8 8 LYS CA C 8 58.400 58.563 -0.163 1
1 76 . 12 1 1 A 8 8 LYS CB C 8 31.700 31.761 -0.061 1
1 80 . 12 1 1 A 8 8 LYS N N 8 120.900 119.983 0.917 1
1 81 . 12 1 1 A 9 9 ALA H H 9 8.050 7.646 0.404 1
1 82 . 12 1 1 A 9 9 ALA HA H 9 3.950 4.096 -0.146 1
1 86 . 12 1 1 A 9 9 ALA C C 9 179.800 180.379 -0.579 1
1 87 . 12 1 1 A 9 9 ALA CA C 9 55.100 54.934 0.166 1
1 88 . 12 1 1 A 9 9 ALA CB C 9 18.100 18.136 -0.036 1
1 89 . 12 1 1 A 9 9 ALA N N 9 121.600 122.040 -0.440 1
1 90 . 12 1 1 A 10 10 ALA H H 10 7.910 7.783 0.127 1
1 91 . 12 1 1 A 10 10 ALA HA H 10 4.200 4.121 0.079 1
1 95 . 12 1 1 A 10 10 ALA C C 10 180.500 180.163 0.337 1
1 96 . 12 1 1 A 10 10 ALA CA C 10 54.600 54.991 -0.391 1
1 97 . 12 1 1 A 10 10 ALA CB C 10 18.100 18.430 -0.330 1
1 98 . 12 1 1 A 10 10 ALA N N 10 120.200 120.690 -0.490 1
1 99 . 12 1 1 A 11 11 LEU H H 11 8.080 8.097 -0.017 1
1 100 . 12 1 1 A 11 11 LEU HA H 11 4.120 4.022 0.098 1
1 110 . 12 1 1 A 11 11 LEU C C 11 179.600 179.596 0.004 1
1 111 . 12 1 1 A 11 11 LEU CA C 11 57.800 57.664 0.136 1
1 112 . 12 1 1 A 11 11 LEU CB C 11 41.700 41.677 0.023 1
1 115 . 12 1 1 A 11 11 LEU N N 11 120.900 119.806 1.094 1
1 116 . 12 1 1 A 12 12 LEU H H 12 8.480 8.360 0.120 1
1 117 . 12 1 1 A 12 12 LEU HA H 12 4.040 3.946 0.094 1
1 127 . 12 1 1 A 12 12 LEU C C 12 178.900 179.130 -0.230 1
1 128 . 12 1 1 A 12 12 LEU CA C 12 58.100 57.923 0.177 1
1 129 . 12 1 1 A 12 12 LEU CB C 12 40.100 40.598 -0.498 1
1 133 . 12 1 1 A 12 12 LEU N N 12 118.700 118.900 -0.200 1
1 134 . 12 1 1 A 13 13 ASP H H 13 7.990 8.170 -0.180 1
1 135 . 12 1 1 A 13 13 ASP HA H 13 4.420 4.272 0.148 1
1 138 . 12 1 1 A 13 13 ASP C C 13 178.900 178.450 0.450 1
1 139 . 12 1 1 A 13 13 ASP CA C 13 57.500 57.987 -0.487 1
1 140 . 12 1 1 A 13 13 ASP CB C 13 40.500 41.097 -0.597 1
1 141 . 12 1 1 A 13 13 ASP N N 13 119.500 119.980 -0.480 1
1 142 . 12 1 1 A 14 14 GLN H H 14 7.620 7.652 -0.032 1
1 143 . 12 1 1 A 14 14 GLN HA H 14 4.230 4.065 0.165 1
1 150 . 12 1 1 A 14 14 GLN C C 14 178.400 178.949 -0.549 1
1 151 . 12 1 1 A 14 14 GLN CA C 14 58.100 58.548 -0.448 1
1 152 . 12 1 1 A 14 14 GLN CB C 14 27.800 28.585 -0.785 1
1 154 . 12 1 1 A 14 14 GLN N N 14 118.900 117.878 1.022 1
1 156 . 12 1 1 A 15 15 VAL H H 15 8.480 8.474 0.006 1
1 157 . 12 1 1 A 15 15 VAL HA H 15 3.380 3.626 -0.246 1
1 165 . 12 1 1 A 15 15 VAL C C 15 177.600 178.472 -0.872 1
1 166 . 12 1 1 A 15 15 VAL CA C 15 66.600 66.291 0.309 1
1 167 . 12 1 1 A 15 15 VAL CB C 15 30.500 31.660 -1.160 1
1 170 . 12 1 1 A 15 15 VAL N N 15 121.300 120.560 0.740 1
1 171 . 12 1 1 A 16 16 ALA H H 16 8.080 8.215 -0.135 1
1 172 . 12 1 1 A 16 16 ALA HA H 16 4.450 4.043 0.407 1
1 176 . 12 1 1 A 16 16 ALA C C 16 179.100 179.274 -0.174 1
1 177 . 12 1 1 A 16 16 ALA CA C 16 54.600 55.042 -0.442 1
1 178 . 12 1 1 A 16 16 ALA CB C 16 17.700 18.039 -0.339 1
1 179 . 12 1 1 A 16 16 ALA N N 16 121.400 121.849 -0.449 1
1 180 . 12 1 1 A 17 17 ARG H H 17 7.480 8.199 -0.719 1
1 181 . 12 1 1 A 17 17 ARG HA H 17 3.910 4.059 -0.149 1
1 187 . 12 1 1 A 17 17 ARG C C 17 179.700 178.931 0.769 1
1 188 . 12 1 1 A 17 17 ARG CA C 17 59.700 59.552 0.148 1
1 189 . 12 1 1 A 17 17 ARG CB C 17 30.400 29.869 0.531 1
1 191 . 12 1 1 A 17 17 ARG N N 17 116.900 119.020 -2.120 1
1 192 . 12 1 1 A 18 18 VAL H H 18 7.960 7.978 -0.018 1
1 193 . 12 1 1 A 18 18 VAL HA H 18 3.690 3.700 -0.010 1
1 201 . 12 1 1 A 18 18 VAL C C 18 177.900 177.920 -0.020 1
1 202 . 12 1 1 A 18 18 VAL CA C 18 66.600 66.068 0.532 1
1 203 . 12 1 1 A 18 18 VAL CB C 18 31.300 31.494 -0.194 1
1 206 . 12 1 1 A 18 18 VAL N N 18 123.000 119.141 3.859 1
1 207 . 12 1 1 A 19 19 GLY H H 19 8.270 8.437 -0.167 1
1 208 . 12 1 1 A 19 19 GLY HA2 H 19 3.430 3.780 -0.350 1
1 209 . 12 1 1 A 19 19 GLY HA3 H 19 3.430 3.788 -0.358 1
1 210 . 12 1 1 A 19 19 GLY C C 19 174.400 176.005 -1.605 1
1 211 . 12 1 1 A 19 19 GLY CA C 19 48.500 47.221 1.279 1
1 212 . 12 1 1 A 19 19 GLY N N 19 105.400 107.751 -2.351 1
1 213 . 12 1 1 A 20 20 LYS H H 20 8.250 8.660 -0.410 1
1 214 . 12 1 1 A 20 20 LYS HA H 20 3.710 4.085 -0.375 1
1 223 . 12 1 1 A 20 20 LYS C C 20 179.400 178.776 0.624 1
1 224 . 12 1 1 A 20 20 LYS CA C 20 59.300 58.651 0.649 1
1 225 . 12 1 1 A 20 20 LYS CB C 20 32.600 31.687 0.913 1
1 229 . 12 1 1 A 20 20 LYS N N 20 118.700 120.907 -2.207 1
1 230 . 12 1 1 A 21 21 ALA H H 21 7.640 7.661 -0.021 1
1 231 . 12 1 1 A 21 21 ALA HA H 21 3.790 4.098 -0.308 1
1 235 . 12 1 1 A 21 21 ALA C C 21 177.900 180.252 -2.352 1
1 236 . 12 1 1 A 21 21 ALA CA C 21 55.200 54.680 0.520 1
1 237 . 12 1 1 A 21 21 ALA CB C 21 19.200 18.462 0.738 1
1 238 . 12 1 1 A 21 21 ALA N N 21 121.700 122.182 -0.482 1
1 239 . 12 1 1 A 22 22 LEU H H 22 7.330 8.246 -0.916 1
1 240 . 12 1 1 A 22 22 LEU HA H 22 4.140 4.096 0.044 1
1 250 . 12 1 1 A 22 22 LEU C C 22 176.800 178.393 -1.593 1
1 251 . 12 1 1 A 22 22 LEU CA C 22 54.600 57.636 -3.036 1
1 252 . 12 1 1 A 22 22 LEU CB C 22 42.900 41.758 1.142 1
1 256 . 12 1 1 A 22 22 LEU N N 22 114.200 119.924 -5.724 1
1 257 . 12 1 1 A 23 23 ALA H H 23 7.160 7.969 -0.809 1
1 258 . 12 1 1 A 23 23 ALA HA H 23 4.720 4.323 0.397 1
1 262 . 12 1 1 A 23 23 ALA C C 23 176.700 178.181 -1.481 1
1 263 . 12 1 1 A 23 23 ALA CA C 23 53.000 53.381 -0.381 1
1 264 . 12 1 1 A 23 23 ALA CB C 23 18.200 18.136 0.064 1
1 265 . 12 1 1 A 23 23 ALA N N 23 118.200 121.298 -3.098 1
1 266 . 12 1 1 A 24 24 ASN H H 24 7.440 7.847 -0.407 1
1 267 . 12 1 1 A 24 24 ASN HA H 24 4.730 4.659 0.071 1
1 272 . 12 1 1 A 24 24 ASN C C 24 174.800 176.489 -1.689 1
1 273 . 12 1 1 A 24 24 ASN CA C 24 53.500 53.789 -0.289 1
1 274 . 12 1 1 A 24 24 ASN CB C 24 41.700 38.990 2.710 1
1 275 . 12 1 1 A 24 24 ASN N N 24 116.800 115.657 1.143 1
1 277 . 12 1 1 A 25 25 GLY H H 25 9.370 7.402 1.968 1
1 278 . 12 1 1 A 25 25 GLY HA2 H 25 3.650 3.988 -0.338 1
1 279 . 12 1 1 A 25 25 GLY HA3 H 25 4.110 4.008 0.102 1
1 280 . 12 1 1 A 25 25 GLY C C 25 175.300 175.920 -0.620 1
1 281 . 12 1 1 A 25 25 GLY CA C 25 47.600 45.878 1.722 1
1 282 . 12 1 1 A 25 25 GLY N N 25 114.800 107.915 6.885 1
1 283 . 12 1 1 A 26 26 ARG H H 26 8.050 8.646 -0.596 1
1 284 . 12 1 1 A 26 26 ARG HA H 26 4.150 4.007 0.143 1
1 289 . 12 1 1 A 26 26 ARG C C 26 179.300 178.337 0.963 1
1 290 . 12 1 1 A 26 26 ARG CA C 26 57.000 59.181 -2.181 1
1 291 . 12 1 1 A 26 26 ARG CB C 26 29.900 30.051 -0.151 1
1 294 . 12 1 1 A 26 26 ARG N N 26 120.500 121.006 -0.506 1
1 295 . 12 1 1 A 27 27 ARG H H 27 7.930 7.967 -0.037 1
1 296 . 12 1 1 A 27 27 ARG HA H 27 3.710 4.190 -0.480 1
1 301 . 12 1 1 A 27 27 ARG C C 27 178.300 177.692 0.608 1
1 302 . 12 1 1 A 27 27 ARG CA C 27 61.000 57.791 3.209 1
1 303 . 12 1 1 A 27 27 ARG CB C 27 30.400 30.301 0.099 1
1 305 . 12 1 1 A 27 27 ARG N N 27 117.900 117.842 0.058 1
1 306 . 12 1 1 A 28 28 LEU H H 28 7.640 7.665 -0.025 1
1 307 . 12 1 1 A 28 28 LEU HA H 28 3.950 4.003 -0.053 1
1 317 . 12 1 1 A 28 28 LEU C C 28 178.200 179.384 -1.184 1
1 318 . 12 1 1 A 28 28 LEU CA C 28 57.600 57.138 0.462 1
1 319 . 12 1 1 A 28 28 LEU CB C 28 41.900 41.149 0.751 1
1 323 . 12 1 1 A 28 28 LEU N N 28 117.600 118.346 -0.746 1
1 324 . 12 1 1 A 29 29 GLN H H 29 8.110 7.850 0.260 1
1 325 . 12 1 1 A 29 29 GLN HA H 29 3.880 4.131 -0.251 1
1 332 . 12 1 1 A 29 29 GLN C C 29 179.400 179.056 0.344 1
1 333 . 12 1 1 A 29 29 GLN CA C 29 59.100 58.680 0.420 1
1 334 . 12 1 1 A 29 29 GLN CB C 29 28.800 28.209 0.591 1
1 336 . 12 1 1 A 29 29 GLN N N 29 119.300 118.465 0.835 1
1 338 . 12 1 1 A 30 30 ILE H H 30 7.530 7.587 -0.057 1
1 339 . 12 1 1 A 30 30 ILE HA H 30 3.340 3.623 -0.283 1
1 349 . 12 1 1 A 30 30 ILE C C 30 176.700 178.447 -1.747 1
1 350 . 12 1 1 A 30 30 ILE CA C 30 65.900 65.045 0.855 1
1 351 . 12 1 1 A 30 30 ILE CB C 30 37.400 37.854 -0.454 1
1 355 . 12 1 1 A 30 30 ILE N N 30 118.600 120.558 -1.958 1
1 356 . 12 1 1 A 31 31 LEU H H 31 7.500 7.567 -0.067 1
1 357 . 12 1 1 A 31 31 LEU HA H 31 3.520 3.716 -0.196 1
1 367 . 12 1 1 A 31 31 LEU C C 31 177.300 178.349 -1.049 1
1 368 . 12 1 1 A 31 31 LEU CA C 31 58.100 57.941 0.159 1
1 369 . 12 1 1 A 31 31 LEU CB C 31 41.100 40.566 0.534 1
1 373 . 12 1 1 A 31 31 LEU N N 31 119.900 119.467 0.433 1
1 374 . 12 1 1 A 32 32 ASP H H 32 7.950 8.156 -0.206 1
1 375 . 12 1 1 A 32 32 ASP HA H 32 4.300 4.487 -0.187 1
1 378 . 12 1 1 A 32 32 ASP C C 32 178.300 178.371 -0.071 1
1 379 . 12 1 1 A 32 32 ASP CA C 32 57.400 56.861 0.539 1
1 380 . 12 1 1 A 32 32 ASP CB C 32 42.400 41.705 0.695 1
1 381 . 12 1 1 A 32 32 ASP N N 32 116.900 119.031 -2.131 1
1 382 . 12 1 1 A 33 33 LEU H H 33 7.350 7.513 -0.163 1
1 383 . 12 1 1 A 33 33 LEU HA H 33 4.130 4.151 -0.021 1
1 393 . 12 1 1 A 33 33 LEU C C 33 180.000 178.852 1.148 1
1 394 . 12 1 1 A 33 33 LEU CA C 33 57.600 57.154 0.446 1
1 395 . 12 1 1 A 33 33 LEU CB C 33 42.300 42.449 -0.149 1
1 399 . 12 1 1 A 33 33 LEU N N 33 118.600 120.244 -1.644 1
1 400 . 12 1 1 A 34 34 LEU H H 34 8.300 8.416 -0.116 1
1 401 . 12 1 1 A 34 34 LEU HA H 34 4.490 4.170 0.320 1
1 411 . 12 1 1 A 34 34 LEU C C 34 178.900 179.145 -0.245 1
1 412 . 12 1 1 A 34 34 LEU CA C 34 55.800 56.432 -0.632 1
1 413 . 12 1 1 A 34 34 LEU CB C 34 41.300 41.393 -0.093 1
1 417 . 12 1 1 A 34 34 LEU N N 34 117.800 118.740 -0.940 1
1 418 . 12 1 1 A 35 35 ALA H H 35 8.160 7.555 0.605 1
1 419 . 12 1 1 A 35 35 ALA HA H 35 4.050 4.138 -0.088 1
1 423 . 12 1 1 A 35 35 ALA C C 35 179.000 178.796 0.204 1
1 424 . 12 1 1 A 35 35 ALA CA C 35 54.900 54.503 0.397 1
1 425 . 12 1 1 A 35 35 ALA CB C 35 17.500 18.499 -0.999 1
1 426 . 12 1 1 A 35 35 ALA N N 35 123.900 121.796 2.104 1
1 427 . 12 1 1 A 36 36 GLN H H 36 7.600 7.590 0.010 1
1 428 . 12 1 1 A 36 36 GLN HA H 36 4.340 4.223 0.117 1
1 435 . 12 1 1 A 36 36 GLN C C 36 176.100 176.086 0.014 1
1 436 . 12 1 1 A 36 36 GLN CA C 36 55.800 56.605 -0.805 1
1 437 . 12 1 1 A 36 36 GLN CB C 36 29.000 29.311 -0.311 1
1 439 . 12 1 1 A 36 36 GLN N N 36 113.300 114.068 -0.768 1
1 441 . 12 1 1 A 37 37 GLY H H 37 7.550 7.129 0.421 1
1 442 . 12 1 1 A 37 37 GLY HA2 H 37 3.730 4.149 -0.419 1
1 443 . 12 1 1 A 37 37 GLY HA3 H 37 4.490 4.151 0.339 1
1 444 . 12 1 1 A 37 37 GLY C C 37 171.500 172.172 -0.672 1
1 445 . 12 1 1 A 37 37 GLY CA C 37 44.500 45.536 -1.036 1
1 446 . 12 1 1 A 37 37 GLY N N 37 108.400 105.519 2.881 1
1 447 . 12 1 1 A 38 38 GLU H H 38 8.120 8.640 -0.520 1
1 448 . 12 1 1 A 38 38 GLU HA H 38 4.820 5.419 -0.599 1
1 453 . 12 1 1 A 38 38 GLU C C 38 177.000 175.807 1.193 1
1 454 . 12 1 1 A 38 38 GLU CA C 38 56.400 55.605 0.795 1
1 455 . 12 1 1 A 38 38 GLU CB C 38 31.200 31.150 0.050 1
1 457 . 12 1 1 A 38 38 GLU N N 38 119.600 121.205 -1.605 1
1 458 . 12 1 1 A 39 39 ARG H H 39 8.580 9.055 -0.475 1
1 459 . 12 1 1 A 39 39 ARG HA H 39 4.970 5.039 -0.069 1
1 467 . 12 1 1 A 39 39 ARG C C 39 174.800 175.686 -0.886 1
1 468 . 12 1 1 A 39 39 ARG CA C 39 53.900 54.404 -0.504 1
1 469 . 12 1 1 A 39 39 ARG CB C 39 36.400 33.499 2.901 1
1 472 . 12 1 1 A 39 39 ARG N N 39 121.500 124.515 -3.015 1
1 474 . 12 1 1 A 40 40 ALA H H 40 8.910 8.916 -0.006 1
1 475 . 12 1 1 A 40 40 ALA HA H 40 4.920 4.225 0.695 1
1 479 . 12 1 1 A 40 40 ALA C C 40 179.200 178.334 0.866 1
1 480 . 12 1 1 A 40 40 ALA CA C 40 51.100 51.840 -0.740 1
1 481 . 12 1 1 A 40 40 ALA CB C 40 19.200 18.979 0.221 1
1 482 . 12 1 1 A 40 40 ALA N N 40 125.100 125.399 -0.299 1
1 483 . 12 1 1 A 41 41 VAL H H 41 8.420 8.424 -0.004 1
1 484 . 12 1 1 A 41 41 VAL HA H 41 3.430 3.596 -0.166 1
1 492 . 12 1 1 A 41 41 VAL C C 41 176.800 177.208 -0.408 1
1 493 . 12 1 1 A 41 41 VAL CA C 41 67.600 66.846 0.754 1
1 494 . 12 1 1 A 41 41 VAL CB C 41 31.600 31.764 -0.164 1
1 497 . 12 1 1 A 41 41 VAL N N 41 120.900 120.972 -0.072 1
1 498 . 12 1 1 A 42 42 GLU H H 42 9.640 8.088 1.552 1
1 499 . 12 1 1 A 42 42 GLU HA H 42 3.880 3.981 -0.101 1
1 504 . 12 1 1 A 42 42 GLU C C 42 178.300 179.021 -0.721 1
1 505 . 12 1 1 A 42 42 GLU CA C 42 60.600 59.451 1.149 1
1 506 . 12 1 1 A 42 42 GLU CB C 42 28.300 29.276 -0.976 1
1 508 . 12 1 1 A 42 42 GLU N N 42 119.000 119.756 -0.756 1
1 509 . 12 1 1 A 43 43 ALA H H 43 6.870 7.797 -0.927 1
1 510 . 12 1 1 A 43 43 ALA HA H 43 4.290 4.076 0.214 1
1 514 . 12 1 1 A 43 43 ALA C C 43 180.700 179.593 1.107 1
1 515 . 12 1 1 A 43 43 ALA CA C 43 54.100 55.066 -0.966 1
1 516 . 12 1 1 A 43 43 ALA CB C 43 19.100 18.338 0.762 1
1 517 . 12 1 1 A 43 43 ALA N N 43 120.500 122.325 -1.825 1
1 518 . 12 1 1 A 44 44 ILE H H 44 7.970 8.078 -0.108 1
1 519 . 12 1 1 A 44 44 ILE HA H 44 3.470 3.631 -0.161 1
1 529 . 12 1 1 A 44 44 ILE C C 44 178.300 177.940 0.360 1
1 530 . 12 1 1 A 44 44 ILE CA C 44 64.700 65.483 -0.783 1
1 531 . 12 1 1 A 44 44 ILE CB C 44 38.100 37.996 0.104 1
1 535 . 12 1 1 A 44 44 ILE N N 44 120.500 118.653 1.847 1
1 536 . 12 1 1 A 45 45 ALA H H 45 8.460 8.180 0.280 1
1 537 . 12 1 1 A 45 45 ALA HA H 45 3.720 4.026 -0.306 1
1 541 . 12 1 1 A 45 45 ALA C C 45 178.500 179.734 -1.234 1
1 542 . 12 1 1 A 45 45 ALA CA C 45 56.200 55.262 0.938 1
1 543 . 12 1 1 A 45 45 ALA CB C 45 17.400 18.413 -1.013 1
1 544 . 12 1 1 A 45 45 ALA N N 45 124.500 122.171 2.329 1
1 545 . 12 1 1 A 46 46 THR H H 46 8.080 8.182 -0.102 1
1 546 . 12 1 1 A 46 46 THR HA H 46 3.900 3.860 0.040 1
1 551 . 12 1 1 A 46 46 THR C C 46 177.200 176.555 0.645 1
1 552 . 12 1 1 A 46 46 THR CA C 46 66.400 66.732 -0.332 1
1 553 . 12 1 1 A 46 46 THR CB C 46 68.800 68.687 0.113 1
1 555 . 12 1 1 A 46 46 THR N N 46 112.400 114.481 -2.081 1
1 556 . 12 1 1 A 47 47 ALA H H 47 7.930 8.306 -0.376 1
1 557 . 12 1 1 A 47 47 ALA HA H 47 4.200 4.112 0.088 1
1 561 . 12 1 1 A 47 47 ALA C C 47 179.200 179.713 -0.513 1
1 562 . 12 1 1 A 47 47 ALA CA C 47 54.800 55.205 -0.405 1
1 563 . 12 1 1 A 47 47 ALA CB C 47 19.800 18.360 1.440 1
1 564 . 12 1 1 A 47 47 ALA N N 47 121.400 123.974 -2.574 1
1 565 . 12 1 1 A 48 48 THR H H 48 7.560 7.596 -0.036 1
1 566 . 12 1 1 A 48 48 THR HA H 48 4.390 4.382 0.008 1
1 571 . 12 1 1 A 48 48 THR C C 48 175.700 175.819 -0.119 1
1 572 . 12 1 1 A 48 48 THR CA C 48 61.800 62.868 -1.068 1
1 573 . 12 1 1 A 48 48 THR CB C 48 71.000 70.425 0.575 1
1 575 . 12 1 1 A 48 48 THR N N 48 103.500 106.733 -3.233 1
1 576 . 12 1 1 A 49 49 GLY H H 49 7.820 8.410 -0.590 1
1 577 . 12 1 1 A 49 49 GLY HA2 H 49 3.870 3.951 -0.081 1
1 578 . 12 1 1 A 49 49 GLY HA3 H 49 4.100 3.953 0.147 1
1 579 . 12 1 1 A 49 49 GLY C C 49 174.400 173.815 0.585 1
1 580 . 12 1 1 A 49 49 GLY CA C 49 46.300 46.422 -0.122 1
1 581 . 12 1 1 A 49 49 GLY N N 49 111.100 112.480 -1.380 1
1 582 . 12 1 1 A 50 50 MET H H 50 7.930 8.002 -0.072 1
1 583 . 12 1 1 A 50 50 MET HA H 50 4.540 4.961 -0.421 1
1 591 . 12 1 1 A 50 50 MET C C 50 174.800 174.923 -0.123 1
1 592 . 12 1 1 A 50 50 MET CA C 50 55.100 54.240 0.860 1
1 593 . 12 1 1 A 50 50 MET CB C 50 37.200 37.557 -0.357 1
1 596 . 12 1 1 A 50 50 MET N N 50 119.300 118.181 1.119 1
1 597 . 12 1 1 A 51 51 ASN H H 51 8.040 8.588 -0.548 1
1 598 . 12 1 1 A 51 51 ASN HA H 51 4.580 5.004 -0.424 1
1 601 . 12 1 1 A 51 51 ASN C C 51 176.100 176.487 -0.387 1
1 602 . 12 1 1 A 51 51 ASN CA C 51 52.800 51.599 1.201 1
1 603 . 12 1 1 A 51 51 ASN CB C 51 41.100 39.235 1.865 1
1 604 . 12 1 1 A 51 51 ASN N N 51 118.000 118.688 -0.688 1
1 605 . 12 1 1 A 52 52 LEU H H 52 8.560 8.765 -0.205 1
1 606 . 12 1 1 A 52 52 LEU HA H 52 3.760 3.910 -0.150 1
1 616 . 12 1 1 A 52 52 LEU C C 52 179.600 179.142 0.458 1
1 617 . 12 1 1 A 52 52 LEU CA C 52 59.000 57.831 1.169 1
1 618 . 12 1 1 A 52 52 LEU CB C 52 41.800 41.414 0.386 1
1 622 . 12 1 1 A 52 52 LEU N N 52 120.600 120.605 -0.005 1
1 623 . 12 1 1 A 53 53 THR H H 53 8.230 8.131 0.099 1
1 624 . 12 1 1 A 53 53 THR HA H 53 3.880 4.032 -0.152 1
1 629 . 12 1 1 A 53 53 THR C C 53 176.900 177.478 -0.578 1
1 630 . 12 1 1 A 53 53 THR CA C 53 66.500 65.957 0.543 1
1 631 . 12 1 1 A 53 53 THR CB C 53 68.400 67.867 0.533 1
1 633 . 12 1 1 A 53 53 THR N N 53 115.800 110.935 4.865 1
1 634 . 12 1 1 A 54 54 THR H H 54 8.420 8.293 0.127 1
1 635 . 12 1 1 A 54 54 THR HA H 54 3.880 3.849 0.031 1
1 640 . 12 1 1 A 54 54 THR C C 54 177.300 176.171 1.129 1
1 641 . 12 1 1 A 54 54 THR CA C 54 66.600 66.343 0.257 1
1 642 . 12 1 1 A 54 54 THR CB C 54 66.600 68.610 -2.010 1
1 644 . 12 1 1 A 54 54 THR N N 54 122.300 117.161 5.139 1
1 645 . 12 1 1 A 55 55 ALA H H 55 8.860 8.516 0.344 1
1 646 . 12 1 1 A 55 55 ALA HA H 55 4.020 3.938 0.082 1
1 650 . 12 1 1 A 55 55 ALA C C 55 179.000 179.671 -0.671 1
1 651 . 12 1 1 A 55 55 ALA CA C 55 56.100 55.395 0.705 1
1 652 . 12 1 1 A 55 55 ALA CB C 55 17.000 18.261 -1.261 1
1 653 . 12 1 1 A 55 55 ALA N N 55 125.600 123.642 1.958 1
1 654 . 12 1 1 A 56 56 SER H H 56 8.440 8.602 -0.162 1
1 655 . 12 1 1 A 56 56 SER HA H 56 3.920 4.066 -0.146 1
1 658 . 12 1 1 A 56 56 SER C C 56 176.400 177.152 -0.752 1
1 659 . 12 1 1 A 56 56 SER CA C 56 62.600 61.426 1.174 1
1 660 . 12 1 1 A 56 56 SER CB C 56 62.700 62.258 0.442 1
1 661 . 12 1 1 A 56 56 SER N N 56 112.700 113.061 -0.361 1
1 662 . 12 1 1 A 57 57 ALA H H 57 8.090 7.916 0.174 1
1 663 . 12 1 1 A 57 57 ALA HA H 57 4.130 3.947 0.183 1
1 667 . 12 1 1 A 57 57 ALA C C 57 181.200 179.617 1.583 1
1 668 . 12 1 1 A 57 57 ALA CA C 57 55.200 55.290 -0.090 1
1 669 . 12 1 1 A 57 57 ALA CB C 57 17.900 17.862 0.038 1
1 670 . 12 1 1 A 57 57 ALA N N 57 124.000 124.629 -0.629 1
1 671 . 12 1 1 A 58 58 ASN H H 58 7.970 8.191 -0.221 1
1 672 . 12 1 1 A 58 58 ASN HA H 58 4.480 4.457 0.023 1
1 677 . 12 1 1 A 58 58 ASN C C 58 177.500 178.160 -0.660 1
1 678 . 12 1 1 A 58 58 ASN CA C 58 56.900 56.068 0.832 1
1 679 . 12 1 1 A 58 58 ASN CB C 58 39.800 37.895 1.905 1
1 680 . 12 1 1 A 58 58 ASN N N 58 117.600 117.150 0.450 1
1 682 . 12 1 1 A 59 59 LEU H H 59 8.530 8.723 -0.193 1
1 683 . 12 1 1 A 59 59 LEU HA H 59 3.710 3.785 -0.075 1
1 693 . 12 1 1 A 59 59 LEU C C 59 178.400 178.974 -0.574 1
1 694 . 12 1 1 A 59 59 LEU CA C 59 58.600 57.771 0.829 1
1 695 . 12 1 1 A 59 59 LEU CB C 59 40.500 41.133 -0.633 1
1 699 . 12 1 1 A 59 59 LEU N N 59 122.600 121.559 1.041 1
1 700 . 12 1 1 A 60 60 GLN H H 60 8.200 8.407 -0.207 1
1 701 . 12 1 1 A 60 60 GLN HA H 60 4.020 3.929 0.091 1
1 708 . 12 1 1 A 60 60 GLN C C 60 178.700 177.711 0.989 1
1 709 . 12 1 1 A 60 60 GLN CA C 60 58.800 59.089 -0.289 1
1 710 . 12 1 1 A 60 60 GLN CB C 60 27.700 28.642 -0.942 1
1 712 . 12 1 1 A 60 60 GLN N N 60 118.900 118.842 0.058 1
1 714 . 12 1 1 A 61 61 ALA H H 61 7.580 7.791 -0.211 1
1 715 . 12 1 1 A 61 61 ALA HA H 61 4.230 4.101 0.129 1
1 719 . 12 1 1 A 61 61 ALA C C 61 181.300 179.980 1.320 1
1 720 . 12 1 1 A 61 61 ALA CA C 61 55.100 54.998 0.102 1
1 721 . 12 1 1 A 61 61 ALA CB C 61 17.600 18.141 -0.541 1
1 722 . 12 1 1 A 61 61 ALA N N 61 122.200 122.243 -0.043 1
1 723 . 12 1 1 A 62 62 LEU H H 62 7.830 8.109 -0.279 1
1 724 . 12 1 1 A 62 62 LEU HA H 62 3.980 3.978 0.002 1
1 734 . 12 1 1 A 62 62 LEU C C 62 178.500 178.858 -0.358 1
1 735 . 12 1 1 A 62 62 LEU CA C 62 58.100 57.532 0.568 1
1 736 . 12 1 1 A 62 62 LEU CB C 62 43.300 41.434 1.866 1
1 739 . 12 1 1 A 62 62 LEU N N 62 119.000 119.069 -0.069 1
1 740 . 12 1 1 A 63 63 LYS H H 63 8.580 7.947 0.633 1
1 741 . 12 1 1 A 63 63 LYS HA H 63 4.130 4.142 -0.012 1
1 750 . 12 1 1 A 63 63 LYS C C 63 180.500 179.358 1.142 1
1 751 . 12 1 1 A 63 63 LYS CA C 63 59.700 58.636 1.064 1
1 752 . 12 1 1 A 63 63 LYS CB C 63 32.600 31.791 0.809 1
1 756 . 12 1 1 A 63 63 LYS N N 63 123.400 121.673 1.727 1
1 757 . 12 1 1 A 64 64 SER H H 64 8.640 8.349 0.291 1
1 758 . 12 1 1 A 64 64 SER HA H 64 4.300 4.214 0.086 1
1 761 . 12 1 1 A 64 64 SER C C 64 175.000 177.098 -2.098 1
1 762 . 12 1 1 A 64 64 SER CA C 64 61.400 62.946 -1.546 1
1 763 . 12 1 1 A 64 64 SER CB C 64 63.000 62.467 0.533 1
1 764 . 12 1 1 A 64 64 SER N N 64 117.700 117.958 -0.258 1
1 765 . 12 1 1 A 65 65 GLY H H 65 7.280 8.061 -0.781 1
1 766 . 12 1 1 A 65 65 GLY HA2 H 65 3.240 3.836 -0.596 1
1 767 . 12 1 1 A 65 65 GLY HA3 H 65 3.980 3.836 0.144 1
1 768 . 12 1 1 A 65 65 GLY C C 65 171.300 174.830 -3.530 1
1 769 . 12 1 1 A 65 65 GLY CA C 65 45.100 46.152 -1.052 1
1 770 . 12 1 1 A 65 65 GLY N N 65 104.400 109.165 -4.765 1
1 771 . 12 1 1 A 66 66 GLY H H 66 7.730 7.652 0.078 1
1 772 . 12 1 1 A 66 66 GLY HA2 H 66 3.650 3.985 -0.335 1
1 773 . 12 1 1 A 66 66 GLY HA3 H 66 3.750 3.991 -0.241 1
1 774 . 12 1 1 A 66 66 GLY C C 66 173.700 175.133 -1.433 1
1 775 . 12 1 1 A 66 66 GLY CA C 66 45.400 46.630 -1.230 1
1 776 . 12 1 1 A 66 66 GLY N N 66 104.700 108.277 -3.577 1
1 777 . 12 1 1 A 67 67 LEU H H 67 7.520 7.790 -0.270 1
1 778 . 12 1 1 A 67 67 LEU HA H 67 4.310 4.671 -0.361 1
1 788 . 12 1 1 A 67 67 LEU C C 67 177.700 175.617 2.083 1
1 789 . 12 1 1 A 67 67 LEU CA C 67 55.500 54.328 1.172 1
1 790 . 12 1 1 A 67 67 LEU CB C 67 42.400 43.471 -1.071 1
1 794 . 12 1 1 A 67 67 LEU N N 67 110.600 118.180 -7.580 1
1 795 . 12 1 1 A 68 68 VAL H H 68 6.890 7.491 -0.601 1
1 796 . 12 1 1 A 68 68 VAL HA H 68 5.190 4.971 0.219 1
1 804 . 12 1 1 A 68 68 VAL C C 68 173.700 174.308 -0.608 1
1 805 . 12 1 1 A 68 68 VAL CA C 68 57.400 58.580 -1.180 1
1 806 . 12 1 1 A 68 68 VAL CB C 68 36.400 35.835 0.565 1
1 809 . 12 1 1 A 68 68 VAL N N 68 106.400 115.423 -9.023 1
1 810 . 12 1 1 A 69 69 GLU H H 69 8.880 9.236 -0.356 1
1 811 . 12 1 1 A 69 69 GLU HA H 69 4.660 4.941 -0.281 1
1 816 . 12 1 1 A 69 69 GLU C C 69 173.300 174.680 -1.380 1
1 817 . 12 1 1 A 69 69 GLU CA C 69 54.300 54.703 -0.403 1
1 818 . 12 1 1 A 69 69 GLU CB C 69 34.100 33.393 0.707 1
1 820 . 12 1 1 A 69 69 GLU N N 69 120.400 122.077 -1.677 1
1 821 . 12 1 1 A 70 70 ALA H H 70 8.730 8.763 -0.033 1
1 822 . 12 1 1 A 70 70 ALA HA H 70 4.990 4.930 0.060 1
1 826 . 12 1 1 A 70 70 ALA C C 70 176.500 174.765 1.735 1
1 827 . 12 1 1 A 70 70 ALA CA C 70 50.000 49.704 0.296 1
1 828 . 12 1 1 A 70 70 ALA CB C 70 22.300 21.213 1.087 1
1 829 . 12 1 1 A 70 70 ALA N N 70 122.800 121.652 1.148 1
1 830 . 12 1 1 A 71 71 ARG H H 71 8.670 9.428 -0.758 1
1 831 . 12 1 1 A 71 71 ARG HA H 71 4.630 4.783 -0.153 1
1 843 . 12 1 1 A 71 71 ARG C C 71 173.500 175.251 -1.751 1
1 844 . 12 1 1 A 71 71 ARG CA C 71 54.600 54.587 0.013 1
1 845 . 12 1 1 A 71 71 ARG CB C 71 33.600 32.091 1.509 1
1 849 . 12 1 1 A 71 71 ARG N N 71 120.100 123.715 -3.615 1
1 851 . 12 1 1 A 72 72 ARG H H 72 8.780 8.597 0.183 1
1 852 . 12 1 1 A 72 72 ARG HA H 72 5.100 4.896 0.204 1
1 859 . 12 1 1 A 72 72 ARG C C 72 176.000 175.333 0.667 1
1 860 . 12 1 1 A 72 72 ARG CA C 72 54.900 55.749 -0.849 1
1 861 . 12 1 1 A 72 72 ARG CB C 72 32.500 30.922 1.578 1
1 864 . 12 1 1 A 72 72 ARG N N 72 123.600 125.312 -1.712 1
1 865 . 12 1 1 A 73 73 GLU H H 73 8.720 9.282 -0.562 1
1 866 . 12 1 1 A 73 73 GLU HA H 73 4.510 4.666 -0.156 1
1 871 . 12 1 1 A 73 73 GLU C C 73 175.900 176.690 -0.790 1
1 872 . 12 1 1 A 73 73 GLU CA C 73 55.700 55.398 0.302 1
1 873 . 12 1 1 A 73 73 GLU CB C 73 31.800 31.502 0.298 1
1 875 . 12 1 1 A 73 73 GLU N N 73 126.800 123.049 3.751 1
1 876 . 12 1 1 A 74 74 GLY H H 74 9.190 9.034 0.156 1
1 877 . 12 1 1 A 74 74 GLY HA2 H 74 3.700 3.879 -0.179 1
1 878 . 12 1 1 A 74 74 GLY HA3 H 74 4.170 3.890 0.280 1
1 879 . 12 1 1 A 74 74 GLY C C 74 175.400 174.761 0.639 1
1 880 . 12 1 1 A 74 74 GLY CA C 74 47.100 47.262 -0.162 1
1 881 . 12 1 1 A 74 74 GLY N N 74 118.500 117.612 0.888 1
1 882 . 12 1 1 A 75 75 THR H H 75 8.780 8.664 0.116 1
1 883 . 12 1 1 A 75 75 THR HA H 75 4.290 4.500 -0.210 1
1 888 . 12 1 1 A 75 75 THR C C 75 174.600 174.292 0.308 1
1 889 . 12 1 1 A 75 75 THR CA C 75 62.000 61.463 0.537 1
1 890 . 12 1 1 A 75 75 THR CB C 75 69.000 69.767 -0.767 1
1 892 . 12 1 1 A 75 75 THR N N 75 118.000 120.009 -2.009 1
1 893 . 12 1 1 A 76 76 ARG H H 76 8.030 7.650 0.380 1
1 894 . 12 1 1 A 76 76 ARG HA H 76 4.610 4.921 -0.311 1
1 901 . 12 1 1 A 76 76 ARG C C 76 174.800 175.033 -0.233 1
1 902 . 12 1 1 A 76 76 ARG CA C 76 55.500 54.537 0.963 1
1 903 . 12 1 1 A 76 76 ARG CB C 76 32.700 32.786 -0.086 1
1 906 . 12 1 1 A 76 76 ARG N N 76 122.600 122.062 0.538 1
1 907 . 12 1 1 A 77 77 GLN H H 77 8.580 8.653 -0.073 1
1 908 . 12 1 1 A 77 77 GLN HA H 77 4.910 5.054 -0.144 1
1 915 . 12 1 1 A 77 77 GLN C C 77 173.900 174.424 -0.524 1
1 916 . 12 1 1 A 77 77 GLN CA C 77 54.700 54.438 0.262 1
1 917 . 12 1 1 A 77 77 GLN CB C 77 31.800 31.049 0.751 1
1 919 . 12 1 1 A 77 77 GLN N N 77 121.900 121.330 0.570 1
1 921 . 12 1 1 A 78 78 TYR H H 78 8.890 9.587 -0.697 1
1 922 . 12 1 1 A 78 78 TYR HA H 78 4.750 5.539 -0.789 1
1 929 . 12 1 1 A 78 78 TYR C C 78 175.600 174.691 0.909 1
1 930 . 12 1 1 A 78 78 TYR CA C 78 57.000 56.617 0.383 1
1 931 . 12 1 1 A 78 78 TYR CB C 78 41.400 39.557 1.843 1
1 936 . 12 1 1 A 78 78 TYR N N 78 121.800 123.769 -1.969 1
1 937 . 12 1 1 A 79 79 TYR H H 79 9.010 9.624 -0.614 1
1 938 . 12 1 1 A 79 79 TYR HA H 79 5.410 5.333 0.077 1
1 945 . 12 1 1 A 79 79 TYR C C 79 173.100 175.420 -2.320 1
1 946 . 12 1 1 A 79 79 TYR CA C 79 57.300 57.201 0.099 1
1 947 . 12 1 1 A 79 79 TYR CB C 79 43.300 41.265 2.035 1
1 952 . 12 1 1 A 79 79 TYR N N 79 122.500 123.461 -0.961 1
1 953 . 12 1 1 A 80 80 ARG H H 80 8.720 9.131 -0.411 1
1 954 . 12 1 1 A 80 80 ARG HA H 80 5.120 5.059 0.061 1
1 962 . 12 1 1 A 80 80 ARG C C 80 175.500 175.007 0.493 1
1 963 . 12 1 1 A 80 80 ARG CA C 80 53.200 54.352 -1.152 1
1 964 . 12 1 1 A 80 80 ARG CB C 80 33.900 33.816 0.084 1
1 967 . 12 1 1 A 80 80 ARG N N 80 114.500 119.777 -5.277 1
1 969 . 12 1 1 A 81 81 ILE H H 81 9.300 8.695 0.605 1
1 970 . 12 1 1 A 81 81 ILE HA H 81 4.150 4.172 -0.022 1
1 980 . 12 1 1 A 81 81 ILE C C 81 177.800 177.096 0.704 1
1 981 . 12 1 1 A 81 81 ILE CA C 81 62.300 62.126 0.174 1
1 982 . 12 1 1 A 81 81 ILE CB C 81 37.800 37.751 0.049 1
1 986 . 12 1 1 A 81 81 ILE N N 81 122.100 121.438 0.662 1
1 987 . 12 1 1 A 82 82 ALA H H 82 7.930 8.483 -0.553 1
1 988 . 12 1 1 A 82 82 ALA HA H 82 3.930 4.103 -0.173 1
1 992 . 12 1 1 A 82 82 ALA C C 82 176.300 177.248 -0.948 1
1 993 . 12 1 1 A 82 82 ALA CA C 82 54.200 55.169 -0.969 1
1 994 . 12 1 1 A 82 82 ALA CB C 82 18.500 19.616 -1.116 1
1 995 . 12 1 1 A 82 82 ALA N N 82 127.200 128.554 -1.354 1
1 996 . 12 1 1 A 83 83 GLY H H 83 6.980 7.610 -0.630 1
1 997 . 12 1 1 A 83 83 GLY HA2 H 83 4.090 4.050 0.040 1
1 998 . 12 1 1 A 83 83 GLY HA3 H 83 4.440 4.052 0.388 1
1 999 . 12 1 1 A 83 83 GLY C C 83 173.600 175.036 -1.436 1
1 1000 . 12 1 1 A 83 83 GLY CA C 83 45.200 45.145 0.055 1
1 1001 . 12 1 1 A 83 83 GLY N N 83 101.800 103.030 -1.230 1
1 1002 . 12 1 1 A 84 84 GLU H H 84 8.930 8.892 0.038 1
1 1003 . 12 1 1 A 84 84 GLU HA H 84 4.120 4.001 0.119 1
1 1008 . 12 1 1 A 84 84 GLU C C 84 178.300 177.706 0.594 1
1 1009 . 12 1 1 A 84 84 GLU CA C 84 58.900 59.232 -0.332 1
1 1010 . 12 1 1 A 84 84 GLU CB C 84 29.400 29.319 0.081 1
1 1012 . 12 1 1 A 84 84 GLU N N 84 120.300 120.627 -0.327 1
1 1013 . 12 1 1 A 85 85 ASP H H 85 8.950 8.105 0.845 1
1 1014 . 12 1 1 A 85 85 ASP HA H 85 4.310 4.459 -0.149 1
1 1017 . 12 1 1 A 85 85 ASP C C 85 178.000 178.545 -0.545 1
1 1018 . 12 1 1 A 85 85 ASP CA C 85 57.100 56.935 0.165 1
1 1019 . 12 1 1 A 85 85 ASP CB C 85 38.900 40.782 -1.882 1
1 1020 . 12 1 1 A 85 85 ASP N N 85 119.400 118.854 0.546 1
1 1021 . 12 1 1 A 86 86 VAL H H 86 7.620 7.317 0.303 1
1 1022 . 12 1 1 A 86 86 VAL HA H 86 3.480 3.676 -0.196 1
1 1030 . 12 1 1 A 86 86 VAL C C 86 177.400 177.898 -0.498 1
1 1031 . 12 1 1 A 86 86 VAL CA C 86 66.800 66.389 0.411 1
1 1032 . 12 1 1 A 86 86 VAL CB C 86 31.300 31.435 -0.135 1
1 1035 . 12 1 1 A 86 86 VAL N N 86 121.600 121.386 0.214 1
1 1036 . 12 1 1 A 87 87 ALA H H 87 7.520 8.121 -0.601 1
1 1037 . 12 1 1 A 87 87 ALA HA H 87 4.110 4.033 0.077 1
1 1041 . 12 1 1 A 87 87 ALA C C 87 181.200 179.805 1.395 1
1 1042 . 12 1 1 A 87 87 ALA CA C 87 55.800 55.754 0.046 1
1 1043 . 12 1 1 A 87 87 ALA CB C 87 17.600 18.299 -0.699 1
1 1044 . 12 1 1 A 87 87 ALA N N 87 122.700 122.125 0.575 1
1 1045 . 12 1 1 A 88 88 ARG H H 88 8.380 8.616 -0.236 1
1 1046 . 12 1 1 A 88 88 ARG HA H 88 4.090 4.046 0.044 1
1 1054 . 12 1 1 A 88 88 ARG C C 88 179.100 178.793 0.307 1
1 1055 . 12 1 1 A 88 88 ARG CA C 88 59.600 58.806 0.794 1
1 1056 . 12 1 1 A 88 88 ARG CB C 88 30.500 29.835 0.665 1
1 1059 . 12 1 1 A 88 88 ARG N N 88 119.200 118.377 0.823 1
1 1061 . 12 1 1 A 89 89 LEU H H 89 8.480 7.718 0.762 1
1 1062 . 12 1 1 A 89 89 LEU HA H 89 4.040 4.051 -0.011 1
1 1071 . 12 1 1 A 89 89 LEU C C 89 177.200 178.529 -1.329 1
1 1072 . 12 1 1 A 89 89 LEU CA C 89 58.300 58.043 0.257 1
1 1073 . 12 1 1 A 89 89 LEU CB C 89 41.300 42.020 -0.720 1
1 1076 . 12 1 1 A 89 89 LEU N N 89 123.300 121.964 1.336 1
1 1077 . 12 1 1 A 90 90 PHE H H 90 8.890 8.491 0.399 1
1 1078 . 12 1 1 A 90 90 PHE HA H 90 4.380 4.034 0.346 1
1 1086 . 12 1 1 A 90 90 PHE C C 90 177.500 177.839 -0.339 1
1 1087 . 12 1 1 A 90 90 PHE CA C 90 59.400 62.109 -2.709 1
1 1088 . 12 1 1 A 90 90 PHE CB C 90 38.600 39.011 -0.411 1
1 1094 . 12 1 1 A 90 90 PHE N N 90 119.400 119.511 -0.111 1
1 1095 . 12 1 1 A 91 91 ALA H H 91 7.920 8.459 -0.539 1
1 1096 . 12 1 1 A 91 91 ALA HA H 91 3.940 3.977 -0.037 1
1 1100 . 12 1 1 A 91 91 ALA C C 91 180.200 179.821 0.379 1
1 1101 . 12 1 1 A 91 91 ALA CA C 91 55.100 55.340 -0.240 1
1 1102 . 12 1 1 A 91 91 ALA CB C 91 18.000 18.076 -0.076 1
1 1103 . 12 1 1 A 91 91 ALA N N 91 120.500 121.338 -0.838 1
1 1104 . 12 1 1 A 92 92 LEU H H 92 8.190 8.537 -0.347 1
1 1105 . 12 1 1 A 92 92 LEU HA H 92 4.300 4.044 0.256 1
1 1115 . 12 1 1 A 92 92 LEU C C 92 178.900 178.263 0.637 1
1 1116 . 12 1 1 A 92 92 LEU CA C 92 57.500 57.991 -0.491 1
1 1117 . 12 1 1 A 92 92 LEU CB C 92 42.100 41.591 0.509 1
1 1121 . 12 1 1 A 92 92 LEU N N 92 120.200 119.543 0.657 1
1 1122 . 12 1 1 A 93 93 VAL H H 93 8.890 8.030 0.860 1
1 1123 . 12 1 1 A 93 93 VAL HA H 93 3.810 3.833 -0.023 1
1 1131 . 12 1 1 A 93 93 VAL C C 93 176.900 177.862 -0.962 1
1 1132 . 12 1 1 A 93 93 VAL CA C 93 66.000 65.437 0.563 1
1 1133 . 12 1 1 A 93 93 VAL CB C 93 31.200 31.221 -0.021 1
1 1136 . 12 1 1 A 93 93 VAL N N 93 117.100 115.658 1.442 1
1 1137 . 12 1 1 A 94 94 GLN H H 94 6.920 7.595 -0.675 1
1 1138 . 12 1 1 A 94 94 GLN HA H 94 3.790 3.857 -0.067 1
1 1145 . 12 1 1 A 94 94 GLN C C 94 177.400 178.482 -1.082 1
1 1146 . 12 1 1 A 94 94 GLN CA C 94 60.000 58.615 1.385 1
1 1147 . 12 1 1 A 94 94 GLN CB C 94 30.300 28.171 2.129 1
1 1149 . 12 1 1 A 94 94 GLN N N 94 117.800 121.235 -3.435 1
1 1151 . 12 1 1 A 95 95 VAL H H 95 7.420 7.863 -0.443 1
1 1152 . 12 1 1 A 95 95 VAL HA H 95 3.760 3.576 0.184 1
1 1160 . 12 1 1 A 95 95 VAL C C 95 178.300 178.478 -0.178 1
1 1161 . 12 1 1 A 95 95 VAL CA C 95 66.600 66.133 0.467 1
1 1162 . 12 1 1 A 95 95 VAL CB C 95 31.900 31.522 0.378 1
1 1165 . 12 1 1 A 95 95 VAL N N 95 121.500 120.062 1.438 1
1 1166 . 12 1 1 A 96 96 VAL H H 96 8.340 8.275 0.065 1
1 1167 . 12 1 1 A 96 96 VAL HA H 96 3.810 3.616 0.194 1
1 1175 . 12 1 1 A 96 96 VAL C C 96 178.400 178.468 -0.068 1
1 1176 . 12 1 1 A 96 96 VAL CA C 96 66.100 66.516 -0.416 1
1 1177 . 12 1 1 A 96 96 VAL CB C 96 32.200 31.440 0.760 1
1 1180 . 12 1 1 A 96 96 VAL N N 96 120.000 120.843 -0.843 1
1 1181 . 12 1 1 A 97 97 ALA H H 97 8.140 8.181 -0.041 1
1 1182 . 12 1 1 A 97 97 ALA HA H 97 4.010 4.231 -0.221 1
1 1186 . 12 1 1 A 97 97 ALA C C 97 178.800 178.790 0.010 1
1 1187 . 12 1 1 A 97 97 ALA CA C 97 54.900 54.446 0.454 1
1 1188 . 12 1 1 A 97 97 ALA CB C 97 19.900 18.267 1.633 1
1 1189 . 12 1 1 A 97 97 ALA N N 97 121.400 121.304 0.096 1
1 1190 . 12 1 1 A 98 98 ASP H H 98 8.170 7.585 0.585 1
1 1191 . 12 1 1 A 98 98 ASP HA H 98 4.320 4.530 -0.210 1
1 1194 . 12 1 1 A 98 98 ASP C C 98 178.100 178.292 -0.192 1
1 1195 . 12 1 1 A 98 98 ASP CA C 98 57.100 56.378 0.722 1
1 1196 . 12 1 1 A 98 98 ASP CB C 98 41.800 41.658 0.142 1
1 1197 . 12 1 1 A 98 98 ASP N N 98 118.500 118.738 -0.238 1
1 1198 . 12 1 1 A 99 99 GLU H H 99 8.220 8.474 -0.254 1
1 1199 . 12 1 1 A 99 99 GLU HA H 99 4.000 4.239 -0.239 1
1 1204 . 12 1 1 A 99 99 GLU C C 99 178.300 179.196 -0.896 1
1 1205 . 12 1 1 A 99 99 GLU CA C 99 58.300 58.886 -0.586 1
1 1206 . 12 1 1 A 99 99 GLU CB C 99 29.800 30.021 -0.221 1
1 1208 . 12 1 1 A 99 99 GLU N N 99 116.600 117.985 -1.385 1
1 1209 . 12 1 1 A 100 100 HIS H H 100 7.980 7.832 0.148 1
1 1210 . 12 1 1 A 100 100 HIS HA H 100 4.600 4.259 0.341 1
1 1214 . 12 1 1 A 100 100 HIS C C 100 175.900 177.102 -1.202 1
1 1215 . 12 1 1 A 100 100 HIS CA C 100 57.500 58.807 -1.307 1
1 1216 . 12 1 1 A 100 100 HIS CB C 100 30.800 30.306 0.494 1
1 1218 . 12 1 1 A 100 100 HIS N N 100 114.000 120.332 -6.332 1
1 1219 . 12 1 1 A 101 101 LEU H H 101 7.920 7.743 0.177 1
1 1220 . 12 1 1 A 101 101 LEU HA H 101 4.370 4.187 0.183 1
1 1230 . 12 1 1 A 101 101 LEU C C 101 177.700 176.440 1.260 1
1 1231 . 12 1 1 A 101 101 LEU CA C 101 55.900 56.346 -0.446 1
1 1232 . 12 1 1 A 101 101 LEU CB C 101 42.100 43.079 -0.979 1
1 1236 . 12 1 1 A 101 101 LEU N N 101 118.500 119.083 -0.583 1
1 1237 . 12 1 1 A 102 102 GLU H H 102 8.100 8.028 0.072 1
1 1238 . 12 1 1 A 102 102 GLU HA H 102 4.160 4.464 -0.304 1
1 1243 . 12 1 1 A 102 102 GLU C C 102 176.700 175.701 0.999 1
1 1244 . 12 1 1 A 102 102 GLU CA C 102 57.000 57.297 -0.297 1
1 1245 . 12 1 1 A 102 102 GLU CB C 102 29.900 28.765 1.135 1
1 1247 . 12 1 1 A 102 102 GLU N N 102 119.100 118.602 0.498 1
1 1248 . 12 1 1 A 103 103 HIS H H 103 8.010 8.693 -0.683 1
1 1249 . 12 1 1 A 103 103 HIS HA H 103 4.520 4.533 -0.013 1
1 1252 . 12 1 1 A 103 103 HIS CA C 103 56.100 55.660 0.440 1
1 1253 . 12 1 1 A 103 103 HIS CB C 103 29.700 29.690 0.010 1
1 1254 . 12 1 1 A 103 103 HIS N N 103 117.300 125.898 -8.598 1
1 1255 . 12 1 1 A 107 107 HIS HA H 107 4.560 4.563 -0.003 1
1 1258 . 12 1 1 A 107 107 HIS C C 107 173.900 174.413 -0.513 1
1 1259 . 12 1 1 A 107 107 HIS CA C 107 55.900 55.766 0.134 1
1 1260 . 12 1 1 A 107 107 HIS CB C 107 30.200 31.433 -1.233 1
1 4 . 13 1 1 A 2 2 ALA H H 2 8.450 8.820 -0.370 1
1 5 . 13 1 1 A 2 2 ALA HA H 2 4.390 5.273 -0.883 1
1 9 . 13 1 1 A 2 2 ALA C C 2 178.300 176.085 2.215 1
1 10 . 13 1 1 A 2 2 ALA CA C 2 52.500 51.109 1.391 1
1 11 . 13 1 1 A 2 2 ALA CB C 2 19.200 22.810 -3.610 1
1 12 . 13 1 1 A 2 2 ALA N N 2 125.100 128.107 -3.007 1
1 13 . 13 1 1 A 3 3 GLY H H 3 8.450 8.317 0.133 1
1 14 . 13 1 1 A 3 3 GLY HA2 H 3 4.030 4.251 -0.221 1
1 15 . 13 1 1 A 3 3 GLY HA3 H 3 4.030 4.251 -0.221 1
1 16 . 13 1 1 A 3 3 GLY C C 3 174.100 174.104 -0.004 1
1 17 . 13 1 1 A 3 3 GLY CA C 3 45.200 45.077 0.123 1
1 18 . 13 1 1 A 3 3 GLY N N 3 108.000 108.876 -0.876 1
1 19 . 13 1 1 A 4 4 GLN H H 4 8.550 8.874 -0.324 1
1 20 . 13 1 1 A 4 4 GLN HA H 4 4.340 3.861 0.479 1
1 27 . 13 1 1 A 4 4 GLN C C 4 176.700 174.525 2.175 1
1 28 . 13 1 1 A 4 4 GLN CA C 4 56.600 58.490 -1.890 1
1 29 . 13 1 1 A 4 4 GLN CB C 4 29.300 26.596 2.704 1
1 31 . 13 1 1 A 4 4 GLN N N 4 120.500 122.466 -1.966 1
1 33 . 13 1 1 A 5 5 SER H H 5 8.540 8.304 0.236 1
1 34 . 13 1 1 A 5 5 SER HA H 5 4.390 4.606 -0.216 1
1 38 . 13 1 1 A 5 5 SER C C 5 174.800 173.103 1.697 1
1 39 . 13 1 1 A 5 5 SER CA C 5 59.100 56.921 2.179 1
1 40 . 13 1 1 A 5 5 SER CB C 5 63.500 63.168 0.332 1
1 41 . 13 1 1 A 5 5 SER N N 5 117.100 115.497 1.603 1
1 42 . 13 1 1 A 6 6 ASP H H 6 8.300 9.151 -0.851 1
1 43 . 13 1 1 A 6 6 ASP HA H 6 4.540 4.763 -0.223 1
1 46 . 13 1 1 A 6 6 ASP C C 6 177.300 175.826 1.474 1
1 47 . 13 1 1 A 6 6 ASP CA C 6 55.100 53.171 1.929 1
1 48 . 13 1 1 A 6 6 ASP CB C 6 40.800 38.942 1.858 1
1 49 . 13 1 1 A 6 6 ASP N N 6 122.700 127.908 -5.208 1
1 50 . 13 1 1 A 7 7 ARG H H 7 8.270 8.127 0.143 1
1 51 . 13 1 1 A 7 7 ARG HA H 7 4.150 4.058 0.092 1
1 58 . 13 1 1 A 7 7 ARG C C 7 177.600 178.415 -0.815 1
1 59 . 13 1 1 A 7 7 ARG CA C 7 58.000 59.692 -1.692 1
1 60 . 13 1 1 A 7 7 ARG CB C 7 30.100 30.046 0.054 1
1 63 . 13 1 1 A 7 7 ARG N N 7 122.100 124.668 -2.568 1
1 64 . 13 1 1 A 8 8 LYS H H 8 8.130 8.241 -0.111 1
1 65 . 13 1 1 A 8 8 LYS HA H 8 4.090 4.040 0.050 1
1 74 . 13 1 1 A 8 8 LYS C C 8 177.600 178.882 -1.282 1
1 75 . 13 1 1 A 8 8 LYS CA C 8 58.400 59.082 -0.682 1
1 76 . 13 1 1 A 8 8 LYS CB C 8 31.700 32.153 -0.453 1
1 80 . 13 1 1 A 8 8 LYS N N 8 120.900 119.027 1.873 1
1 81 . 13 1 1 A 9 9 ALA H H 9 8.050 7.930 0.120 1
1 82 . 13 1 1 A 9 9 ALA HA H 9 3.950 4.130 -0.180 1
1 86 . 13 1 1 A 9 9 ALA C C 9 179.800 180.182 -0.382 1
1 87 . 13 1 1 A 9 9 ALA CA C 9 55.100 54.922 0.178 1
1 88 . 13 1 1 A 9 9 ALA CB C 9 18.100 18.142 -0.042 1
1 89 . 13 1 1 A 9 9 ALA N N 9 121.600 121.820 -0.220 1
1 90 . 13 1 1 A 10 10 ALA H H 10 7.910 7.836 0.074 1
1 91 . 13 1 1 A 10 10 ALA HA H 10 4.200 4.107 0.093 1
1 95 . 13 1 1 A 10 10 ALA C C 10 180.500 180.433 0.067 1
1 96 . 13 1 1 A 10 10 ALA CA C 10 54.600 55.087 -0.487 1
1 97 . 13 1 1 A 10 10 ALA CB C 10 18.100 18.448 -0.348 1
1 98 . 13 1 1 A 10 10 ALA N N 10 120.200 120.735 -0.535 1
1 99 . 13 1 1 A 11 11 LEU H H 11 8.080 8.121 -0.041 1
1 100 . 13 1 1 A 11 11 LEU HA H 11 4.120 4.029 0.091 1
1 110 . 13 1 1 A 11 11 LEU C C 11 179.600 179.582 0.018 1
1 111 . 13 1 1 A 11 11 LEU CA C 11 57.800 57.581 0.219 1
1 112 . 13 1 1 A 11 11 LEU CB C 11 41.700 41.152 0.548 1
1 115 . 13 1 1 A 11 11 LEU N N 11 120.900 120.079 0.821 1
1 116 . 13 1 1 A 12 12 LEU H H 12 8.480 8.377 0.103 1
1 117 . 13 1 1 A 12 12 LEU HA H 12 4.040 3.938 0.102 1
1 127 . 13 1 1 A 12 12 LEU C C 12 178.900 178.932 -0.032 1
1 128 . 13 1 1 A 12 12 LEU CA C 12 58.100 58.036 0.064 1
1 129 . 13 1 1 A 12 12 LEU CB C 12 40.100 41.140 -1.040 1
1 133 . 13 1 1 A 12 12 LEU N N 12 118.700 119.420 -0.720 1
1 134 . 13 1 1 A 13 13 ASP H H 13 7.990 8.298 -0.308 1
1 135 . 13 1 1 A 13 13 ASP HA H 13 4.420 4.393 0.027 1
1 138 . 13 1 1 A 13 13 ASP C C 13 178.900 178.660 0.240 1
1 139 . 13 1 1 A 13 13 ASP CA C 13 57.500 57.391 0.109 1
1 140 . 13 1 1 A 13 13 ASP CB C 13 40.500 41.021 -0.521 1
1 141 . 13 1 1 A 13 13 ASP N N 13 119.500 119.715 -0.215 1
1 142 . 13 1 1 A 14 14 GLN H H 14 7.620 7.648 -0.028 1
1 143 . 13 1 1 A 14 14 GLN HA H 14 4.230 4.051 0.179 1
1 150 . 13 1 1 A 14 14 GLN C C 14 178.400 178.747 -0.347 1
1 151 . 13 1 1 A 14 14 GLN CA C 14 58.100 58.512 -0.412 1
1 152 . 13 1 1 A 14 14 GLN CB C 14 27.800 28.516 -0.716 1
1 154 . 13 1 1 A 14 14 GLN N N 14 118.900 118.502 0.398 1
1 156 . 13 1 1 A 15 15 VAL H H 15 8.480 8.305 0.175 1
1 157 . 13 1 1 A 15 15 VAL HA H 15 3.380 3.666 -0.286 1
1 165 . 13 1 1 A 15 15 VAL C C 15 177.600 178.301 -0.701 1
1 166 . 13 1 1 A 15 15 VAL CA C 15 66.600 66.282 0.318 1
1 167 . 13 1 1 A 15 15 VAL CB C 15 30.500 31.503 -1.003 1
1 170 . 13 1 1 A 15 15 VAL N N 15 121.300 120.259 1.041 1
1 171 . 13 1 1 A 16 16 ALA H H 16 8.080 8.371 -0.291 1
1 172 . 13 1 1 A 16 16 ALA HA H 16 4.450 3.882 0.568 1
1 176 . 13 1 1 A 16 16 ALA C C 16 179.100 179.295 -0.195 1
1 177 . 13 1 1 A 16 16 ALA CA C 16 54.600 55.484 -0.884 1
1 178 . 13 1 1 A 16 16 ALA CB C 16 17.700 18.350 -0.650 1
1 179 . 13 1 1 A 16 16 ALA N N 16 121.400 121.869 -0.469 1
1 180 . 13 1 1 A 17 17 ARG H H 17 7.480 7.785 -0.305 1
1 181 . 13 1 1 A 17 17 ARG HA H 17 3.910 4.107 -0.197 1
1 187 . 13 1 1 A 17 17 ARG C C 17 179.700 178.942 0.758 1
1 188 . 13 1 1 A 17 17 ARG CA C 17 59.700 58.961 0.739 1
1 189 . 13 1 1 A 17 17 ARG CB C 17 30.400 29.749 0.651 1
1 191 . 13 1 1 A 17 17 ARG N N 17 116.900 119.236 -2.336 1
1 192 . 13 1 1 A 18 18 VAL H H 18 7.960 7.670 0.290 1
1 193 . 13 1 1 A 18 18 VAL HA H 18 3.690 3.702 -0.012 1
1 201 . 13 1 1 A 18 18 VAL C C 18 177.900 178.118 -0.218 1
1 202 . 13 1 1 A 18 18 VAL CA C 18 66.600 66.170 0.430 1
1 203 . 13 1 1 A 18 18 VAL CB C 18 31.300 31.547 -0.247 1
1 206 . 13 1 1 A 18 18 VAL N N 18 123.000 119.247 3.753 1
1 207 . 13 1 1 A 19 19 GLY H H 19 8.270 8.530 -0.260 1
1 208 . 13 1 1 A 19 19 GLY HA2 H 19 3.430 3.748 -0.318 1
1 209 . 13 1 1 A 19 19 GLY HA3 H 19 3.430 3.756 -0.326 1
1 210 . 13 1 1 A 19 19 GLY C C 19 174.400 175.440 -1.040 1
1 211 . 13 1 1 A 19 19 GLY CA C 19 48.500 47.251 1.249 1
1 212 . 13 1 1 A 19 19 GLY N N 19 105.400 107.327 -1.927 1
1 213 . 13 1 1 A 20 20 LYS H H 20 8.250 8.610 -0.360 1
1 214 . 13 1 1 A 20 20 LYS HA H 20 3.710 4.013 -0.303 1
1 223 . 13 1 1 A 20 20 LYS C C 20 179.400 179.456 -0.056 1
1 224 . 13 1 1 A 20 20 LYS CA C 20 59.300 59.761 -0.461 1
1 225 . 13 1 1 A 20 20 LYS CB C 20 32.600 32.307 0.293 1
1 229 . 13 1 1 A 20 20 LYS N N 20 118.700 122.022 -3.322 1
1 230 . 13 1 1 A 21 21 ALA H H 21 7.640 7.768 -0.128 1
1 231 . 13 1 1 A 21 21 ALA HA H 21 3.790 4.129 -0.339 1
1 235 . 13 1 1 A 21 21 ALA C C 21 177.900 180.143 -2.243 1
1 236 . 13 1 1 A 21 21 ALA CA C 21 55.200 54.709 0.491 1
1 237 . 13 1 1 A 21 21 ALA CB C 21 19.200 18.290 0.910 1
1 238 . 13 1 1 A 21 21 ALA N N 21 121.700 122.704 -1.004 1
1 239 . 13 1 1 A 22 22 LEU H H 22 7.330 8.060 -0.730 1
1 240 . 13 1 1 A 22 22 LEU HA H 22 4.140 4.157 -0.017 1
1 250 . 13 1 1 A 22 22 LEU C C 22 176.800 177.931 -1.131 1
1 251 . 13 1 1 A 22 22 LEU CA C 22 54.600 57.298 -2.698 1
1 252 . 13 1 1 A 22 22 LEU CB C 22 42.900 41.661 1.239 1
1 256 . 13 1 1 A 22 22 LEU N N 22 114.200 120.316 -6.116 1
1 257 . 13 1 1 A 23 23 ALA H H 23 7.160 7.538 -0.378 1
1 258 . 13 1 1 A 23 23 ALA HA H 23 4.720 4.654 0.066 1
1 262 . 13 1 1 A 23 23 ALA C C 23 176.700 177.511 -0.811 1
1 263 . 13 1 1 A 23 23 ALA CA C 23 53.000 51.686 1.314 1
1 264 . 13 1 1 A 23 23 ALA CB C 23 18.200 18.958 -0.758 1
1 265 . 13 1 1 A 23 23 ALA N N 23 118.200 120.856 -2.656 1
1 266 . 13 1 1 A 24 24 ASN H H 24 7.440 7.996 -0.556 1
1 267 . 13 1 1 A 24 24 ASN HA H 24 4.730 4.767 -0.037 1
1 272 . 13 1 1 A 24 24 ASN C C 24 174.800 176.038 -1.238 1
1 273 . 13 1 1 A 24 24 ASN CA C 24 53.500 53.329 0.171 1
1 274 . 13 1 1 A 24 24 ASN CB C 24 41.700 39.067 2.633 1
1 275 . 13 1 1 A 24 24 ASN N N 24 116.800 117.047 -0.247 1
1 277 . 13 1 1 A 25 25 GLY H H 25 9.370 8.382 0.988 1
1 278 . 13 1 1 A 25 25 GLY HA2 H 25 3.650 3.859 -0.209 1
1 279 . 13 1 1 A 25 25 GLY HA3 H 25 4.110 3.869 0.241 1
1 280 . 13 1 1 A 25 25 GLY C C 25 175.300 175.214 0.086 1
1 281 . 13 1 1 A 25 25 GLY CA C 25 47.600 47.342 0.258 1
1 282 . 13 1 1 A 25 25 GLY N N 25 114.800 108.583 6.217 1
1 283 . 13 1 1 A 26 26 ARG H H 26 8.050 8.522 -0.472 1
1 284 . 13 1 1 A 26 26 ARG HA H 26 4.150 4.051 0.099 1
1 289 . 13 1 1 A 26 26 ARG C C 26 179.300 178.385 0.915 1
1 290 . 13 1 1 A 26 26 ARG CA C 26 57.000 58.920 -1.920 1
1 291 . 13 1 1 A 26 26 ARG CB C 26 29.900 29.782 0.118 1
1 294 . 13 1 1 A 26 26 ARG N N 26 120.500 126.140 -5.640 1
1 295 . 13 1 1 A 27 27 ARG H H 27 7.930 7.625 0.305 1
1 296 . 13 1 1 A 27 27 ARG HA H 27 3.710 4.140 -0.430 1
1 301 . 13 1 1 A 27 27 ARG C C 27 178.300 177.790 0.510 1
1 302 . 13 1 1 A 27 27 ARG CA C 27 61.000 58.127 2.873 1
1 303 . 13 1 1 A 27 27 ARG CB C 27 30.400 30.059 0.341 1
1 305 . 13 1 1 A 27 27 ARG N N 27 117.900 118.348 -0.448 1
1 306 . 13 1 1 A 28 28 LEU H H 28 7.640 7.898 -0.258 1
1 307 . 13 1 1 A 28 28 LEU HA H 28 3.950 4.064 -0.114 1
1 317 . 13 1 1 A 28 28 LEU C C 28 178.200 179.102 -0.902 1
1 318 . 13 1 1 A 28 28 LEU CA C 28 57.600 57.068 0.532 1
1 319 . 13 1 1 A 28 28 LEU CB C 28 41.900 41.146 0.754 1
1 323 . 13 1 1 A 28 28 LEU N N 28 117.600 118.026 -0.426 1
1 324 . 13 1 1 A 29 29 GLN H H 29 8.110 8.165 -0.055 1
1 325 . 13 1 1 A 29 29 GLN HA H 29 3.880 4.014 -0.134 1
1 332 . 13 1 1 A 29 29 GLN C C 29 179.400 178.227 1.173 1
1 333 . 13 1 1 A 29 29 GLN CA C 29 59.100 58.977 0.123 1
1 334 . 13 1 1 A 29 29 GLN CB C 29 28.800 28.103 0.697 1
1 336 . 13 1 1 A 29 29 GLN N N 29 119.300 119.323 -0.023 1
1 338 . 13 1 1 A 30 30 ILE H H 30 7.530 7.605 -0.075 1
1 339 . 13 1 1 A 30 30 ILE HA H 30 3.340 3.626 -0.286 1
1 349 . 13 1 1 A 30 30 ILE C C 30 176.700 178.406 -1.706 1
1 350 . 13 1 1 A 30 30 ILE CA C 30 65.900 65.177 0.723 1
1 351 . 13 1 1 A 30 30 ILE CB C 30 37.400 37.909 -0.509 1
1 355 . 13 1 1 A 30 30 ILE N N 30 118.600 120.873 -2.273 1
1 356 . 13 1 1 A 31 31 LEU H H 31 7.500 7.664 -0.164 1
1 357 . 13 1 1 A 31 31 LEU HA H 31 3.520 3.739 -0.219 1
1 367 . 13 1 1 A 31 31 LEU C C 31 177.300 178.531 -1.231 1
1 368 . 13 1 1 A 31 31 LEU CA C 31 58.100 57.893 0.207 1
1 369 . 13 1 1 A 31 31 LEU CB C 31 41.100 40.111 0.989 1
1 373 . 13 1 1 A 31 31 LEU N N 31 119.900 119.633 0.267 1
1 374 . 13 1 1 A 32 32 ASP H H 32 7.950 8.400 -0.450 1
1 375 . 13 1 1 A 32 32 ASP HA H 32 4.300 4.593 -0.293 1
1 378 . 13 1 1 A 32 32 ASP C C 32 178.300 178.381 -0.081 1
1 379 . 13 1 1 A 32 32 ASP CA C 32 57.400 57.900 -0.500 1
1 380 . 13 1 1 A 32 32 ASP CB C 32 42.400 42.171 0.229 1
1 381 . 13 1 1 A 32 32 ASP N N 32 116.900 120.039 -3.139 1
1 382 . 13 1 1 A 33 33 LEU H H 33 7.350 7.461 -0.111 1
1 383 . 13 1 1 A 33 33 LEU HA H 33 4.130 4.149 -0.019 1
1 393 . 13 1 1 A 33 33 LEU C C 33 180.000 179.001 0.999 1
1 394 . 13 1 1 A 33 33 LEU CA C 33 57.600 57.581 0.019 1
1 395 . 13 1 1 A 33 33 LEU CB C 33 42.300 41.806 0.494 1
1 399 . 13 1 1 A 33 33 LEU N N 33 118.600 120.323 -1.723 1
1 400 . 13 1 1 A 34 34 LEU H H 34 8.300 8.415 -0.115 1
1 401 . 13 1 1 A 34 34 LEU HA H 34 4.490 4.409 0.081 1
1 411 . 13 1 1 A 34 34 LEU C C 34 178.900 179.097 -0.197 1
1 412 . 13 1 1 A 34 34 LEU CA C 34 55.800 57.156 -1.356 1
1 413 . 13 1 1 A 34 34 LEU CB C 34 41.300 41.167 0.133 1
1 417 . 13 1 1 A 34 34 LEU N N 34 117.800 118.603 -0.803 1
1 418 . 13 1 1 A 35 35 ALA H H 35 8.160 7.962 0.198 1
1 419 . 13 1 1 A 35 35 ALA HA H 35 4.050 4.185 -0.135 1
1 423 . 13 1 1 A 35 35 ALA C C 35 179.000 179.796 -0.796 1
1 424 . 13 1 1 A 35 35 ALA CA C 35 54.900 54.709 0.191 1
1 425 . 13 1 1 A 35 35 ALA CB C 35 17.500 18.422 -0.922 1
1 426 . 13 1 1 A 35 35 ALA N N 35 123.900 122.173 1.727 1
1 427 . 13 1 1 A 36 36 GLN H H 36 7.600 7.624 -0.024 1
1 428 . 13 1 1 A 36 36 GLN HA H 36 4.340 4.204 0.136 1
1 435 . 13 1 1 A 36 36 GLN C C 36 176.100 175.862 0.238 1
1 436 . 13 1 1 A 36 36 GLN CA C 36 55.800 57.248 -1.448 1
1 437 . 13 1 1 A 36 36 GLN CB C 36 29.000 29.970 -0.970 1
1 439 . 13 1 1 A 36 36 GLN N N 36 113.300 116.986 -3.686 1
1 441 . 13 1 1 A 37 37 GLY H H 37 7.550 6.844 0.706 1
1 442 . 13 1 1 A 37 37 GLY HA2 H 37 3.730 4.099 -0.369 1
1 443 . 13 1 1 A 37 37 GLY HA3 H 37 4.490 4.101 0.389 1
1 444 . 13 1 1 A 37 37 GLY C C 37 171.500 172.174 -0.674 1
1 445 . 13 1 1 A 37 37 GLY CA C 37 44.500 45.330 -0.830 1
1 446 . 13 1 1 A 37 37 GLY N N 37 108.400 106.796 1.604 1
1 447 . 13 1 1 A 38 38 GLU H H 38 8.120 8.538 -0.418 1
1 448 . 13 1 1 A 38 38 GLU HA H 38 4.820 4.834 -0.014 1
1 453 . 13 1 1 A 38 38 GLU C C 38 177.000 176.181 0.819 1
1 454 . 13 1 1 A 38 38 GLU CA C 38 56.400 56.236 0.164 1
1 455 . 13 1 1 A 38 38 GLU CB C 38 31.200 30.532 0.668 1
1 457 . 13 1 1 A 38 38 GLU N N 38 119.600 117.072 2.528 1
1 458 . 13 1 1 A 39 39 ARG H H 39 8.580 8.693 -0.113 1
1 459 . 13 1 1 A 39 39 ARG HA H 39 4.970 5.090 -0.120 1
1 467 . 13 1 1 A 39 39 ARG C C 39 174.800 175.568 -0.768 1
1 468 . 13 1 1 A 39 39 ARG CA C 39 53.900 54.073 -0.173 1
1 469 . 13 1 1 A 39 39 ARG CB C 39 36.400 34.439 1.961 1
1 472 . 13 1 1 A 39 39 ARG N N 39 121.500 121.540 -0.040 1
1 474 . 13 1 1 A 40 40 ALA H H 40 8.910 8.794 0.116 1
1 475 . 13 1 1 A 40 40 ALA HA H 40 4.920 4.158 0.762 1
1 479 . 13 1 1 A 40 40 ALA C C 40 179.200 178.369 0.831 1
1 480 . 13 1 1 A 40 40 ALA CA C 40 51.100 51.850 -0.750 1
1 481 . 13 1 1 A 40 40 ALA CB C 40 19.200 19.067 0.133 1
1 482 . 13 1 1 A 40 40 ALA N N 40 125.100 123.395 1.705 1
1 483 . 13 1 1 A 41 41 VAL H H 41 8.420 8.432 -0.012 1
1 484 . 13 1 1 A 41 41 VAL HA H 41 3.430 3.579 -0.149 1
1 492 . 13 1 1 A 41 41 VAL C C 41 176.800 177.483 -0.683 1
1 493 . 13 1 1 A 41 41 VAL CA C 41 67.600 66.655 0.945 1
1 494 . 13 1 1 A 41 41 VAL CB C 41 31.600 31.595 0.005 1
1 497 . 13 1 1 A 41 41 VAL N N 41 120.900 121.092 -0.192 1
1 498 . 13 1 1 A 42 42 GLU H H 42 9.640 8.348 1.292 1
1 499 . 13 1 1 A 42 42 GLU HA H 42 3.880 3.898 -0.018 1
1 504 . 13 1 1 A 42 42 GLU C C 42 178.300 178.526 -0.226 1
1 505 . 13 1 1 A 42 42 GLU CA C 42 60.600 59.635 0.965 1
1 506 . 13 1 1 A 42 42 GLU CB C 42 28.300 29.412 -1.112 1
1 508 . 13 1 1 A 42 42 GLU N N 42 119.000 119.980 -0.980 1
1 509 . 13 1 1 A 43 43 ALA H H 43 6.870 7.617 -0.747 1
1 510 . 13 1 1 A 43 43 ALA HA H 43 4.290 4.062 0.228 1
1 514 . 13 1 1 A 43 43 ALA C C 43 180.700 179.768 0.932 1
1 515 . 13 1 1 A 43 43 ALA CA C 43 54.100 54.949 -0.849 1
1 516 . 13 1 1 A 43 43 ALA CB C 43 19.100 18.116 0.984 1
1 517 . 13 1 1 A 43 43 ALA N N 43 120.500 121.509 -1.009 1
1 518 . 13 1 1 A 44 44 ILE H H 44 7.970 7.865 0.105 1
1 519 . 13 1 1 A 44 44 ILE HA H 44 3.470 3.575 -0.105 1
1 529 . 13 1 1 A 44 44 ILE C C 44 178.300 177.934 0.366 1
1 530 . 13 1 1 A 44 44 ILE CA C 44 64.700 65.582 -0.882 1
1 531 . 13 1 1 A 44 44 ILE CB C 44 38.100 38.090 0.010 1
1 535 . 13 1 1 A 44 44 ILE N N 44 120.500 119.322 1.178 1
1 536 . 13 1 1 A 45 45 ALA H H 45 8.460 8.472 -0.012 1
1 537 . 13 1 1 A 45 45 ALA HA H 45 3.720 4.005 -0.285 1
1 541 . 13 1 1 A 45 45 ALA C C 45 178.500 179.700 -1.200 1
1 542 . 13 1 1 A 45 45 ALA CA C 45 56.200 55.356 0.844 1
1 543 . 13 1 1 A 45 45 ALA CB C 45 17.400 18.427 -1.027 1
1 544 . 13 1 1 A 45 45 ALA N N 45 124.500 122.099 2.401 1
1 545 . 13 1 1 A 46 46 THR H H 46 8.080 8.165 -0.085 1
1 546 . 13 1 1 A 46 46 THR HA H 46 3.900 3.872 0.028 1
1 551 . 13 1 1 A 46 46 THR C C 46 177.200 176.733 0.467 1
1 552 . 13 1 1 A 46 46 THR CA C 46 66.400 66.984 -0.584 1
1 553 . 13 1 1 A 46 46 THR CB C 46 68.800 68.770 0.030 1
1 555 . 13 1 1 A 46 46 THR N N 46 112.400 114.157 -1.757 1
1 556 . 13 1 1 A 47 47 ALA H H 47 7.930 7.990 -0.060 1
1 557 . 13 1 1 A 47 47 ALA HA H 47 4.200 4.183 0.017 1
1 561 . 13 1 1 A 47 47 ALA C C 47 179.200 179.016 0.184 1
1 562 . 13 1 1 A 47 47 ALA CA C 47 54.800 55.005 -0.205 1
1 563 . 13 1 1 A 47 47 ALA CB C 47 19.800 18.126 1.674 1
1 564 . 13 1 1 A 47 47 ALA N N 47 121.400 124.078 -2.678 1
1 565 . 13 1 1 A 48 48 THR H H 48 7.560 7.484 0.076 1
1 566 . 13 1 1 A 48 48 THR HA H 48 4.390 4.456 -0.066 1
1 571 . 13 1 1 A 48 48 THR C C 48 175.700 175.518 0.182 1
1 572 . 13 1 1 A 48 48 THR CA C 48 61.800 62.416 -0.616 1
1 573 . 13 1 1 A 48 48 THR CB C 48 71.000 70.488 0.512 1
1 575 . 13 1 1 A 48 48 THR N N 48 103.500 106.838 -3.338 1
1 576 . 13 1 1 A 49 49 GLY H H 49 7.820 8.335 -0.515 1
1 577 . 13 1 1 A 49 49 GLY HA2 H 49 3.870 3.944 -0.074 1
1 578 . 13 1 1 A 49 49 GLY HA3 H 49 4.100 3.945 0.155 1
1 579 . 13 1 1 A 49 49 GLY C C 49 174.400 173.817 0.583 1
1 580 . 13 1 1 A 49 49 GLY CA C 49 46.300 46.401 -0.101 1
1 581 . 13 1 1 A 49 49 GLY N N 49 111.100 112.462 -1.362 1
1 582 . 13 1 1 A 50 50 MET H H 50 7.930 8.162 -0.232 1
1 583 . 13 1 1 A 50 50 MET HA H 50 4.540 4.966 -0.426 1
1 591 . 13 1 1 A 50 50 MET C C 50 174.800 175.030 -0.230 1
1 592 . 13 1 1 A 50 50 MET CA C 50 55.100 54.226 0.874 1
1 593 . 13 1 1 A 50 50 MET CB C 50 37.200 37.186 0.014 1
1 596 . 13 1 1 A 50 50 MET N N 50 119.300 118.390 0.910 1
1 597 . 13 1 1 A 51 51 ASN H H 51 8.040 8.867 -0.827 1
1 598 . 13 1 1 A 51 51 ASN HA H 51 4.580 4.802 -0.222 1
1 601 . 13 1 1 A 51 51 ASN C C 51 176.100 177.295 -1.195 1
1 602 . 13 1 1 A 51 51 ASN CA C 51 52.800 53.339 -0.539 1
1 603 . 13 1 1 A 51 51 ASN CB C 51 41.100 39.264 1.836 1
1 604 . 13 1 1 A 51 51 ASN N N 51 118.000 119.149 -1.149 1
1 605 . 13 1 1 A 52 52 LEU H H 52 8.560 8.755 -0.195 1
1 606 . 13 1 1 A 52 52 LEU HA H 52 3.760 3.934 -0.174 1
1 616 . 13 1 1 A 52 52 LEU C C 52 179.600 178.798 0.802 1
1 617 . 13 1 1 A 52 52 LEU CA C 52 59.000 57.833 1.167 1
1 618 . 13 1 1 A 52 52 LEU CB C 52 41.800 41.445 0.355 1
1 622 . 13 1 1 A 52 52 LEU N N 52 120.600 124.024 -3.424 1
1 623 . 13 1 1 A 53 53 THR H H 53 8.230 8.084 0.146 1
1 624 . 13 1 1 A 53 53 THR HA H 53 3.880 4.036 -0.156 1
1 629 . 13 1 1 A 53 53 THR C C 53 176.900 176.974 -0.074 1
1 630 . 13 1 1 A 53 53 THR CA C 53 66.500 65.973 0.527 1
1 631 . 13 1 1 A 53 53 THR CB C 53 68.400 68.065 0.335 1
1 633 . 13 1 1 A 53 53 THR N N 53 115.800 110.628 5.172 1
1 634 . 13 1 1 A 54 54 THR H H 54 8.420 8.158 0.262 1
1 635 . 13 1 1 A 54 54 THR HA H 54 3.880 3.858 0.022 1
1 640 . 13 1 1 A 54 54 THR C C 54 177.300 176.416 0.884 1
1 641 . 13 1 1 A 54 54 THR CA C 54 66.600 66.712 -0.112 1
1 642 . 13 1 1 A 54 54 THR CB C 54 66.600 68.759 -2.159 1
1 644 . 13 1 1 A 54 54 THR N N 54 122.300 117.223 5.077 1
1 645 . 13 1 1 A 55 55 ALA H H 55 8.860 8.807 0.053 1
1 646 . 13 1 1 A 55 55 ALA HA H 55 4.020 3.886 0.134 1
1 650 . 13 1 1 A 55 55 ALA C C 55 179.000 178.972 0.028 1
1 651 . 13 1 1 A 55 55 ALA CA C 55 56.100 55.340 0.760 1
1 652 . 13 1 1 A 55 55 ALA CB C 55 17.000 17.823 -0.823 1
1 653 . 13 1 1 A 55 55 ALA N N 55 125.600 123.175 2.425 1
1 654 . 13 1 1 A 56 56 SER H H 56 8.440 8.184 0.256 1
1 655 . 13 1 1 A 56 56 SER HA H 56 3.920 3.947 -0.027 1
1 658 . 13 1 1 A 56 56 SER C C 56 176.400 176.302 0.098 1
1 659 . 13 1 1 A 56 56 SER CA C 56 62.600 61.543 1.057 1
1 660 . 13 1 1 A 56 56 SER CB C 56 62.700 62.723 -0.023 1
1 661 . 13 1 1 A 56 56 SER N N 56 112.700 112.750 -0.050 1
1 662 . 13 1 1 A 57 57 ALA H H 57 8.090 7.828 0.262 1
1 663 . 13 1 1 A 57 57 ALA HA H 57 4.130 3.997 0.133 1
1 667 . 13 1 1 A 57 57 ALA C C 57 181.200 179.528 1.672 1
1 668 . 13 1 1 A 57 57 ALA CA C 57 55.200 55.287 -0.087 1
1 669 . 13 1 1 A 57 57 ALA CB C 57 17.900 18.074 -0.174 1
1 670 . 13 1 1 A 57 57 ALA N N 57 124.000 123.476 0.524 1
1 671 . 13 1 1 A 58 58 ASN H H 58 7.970 8.208 -0.238 1
1 672 . 13 1 1 A 58 58 ASN HA H 58 4.480 4.464 0.016 1
1 677 . 13 1 1 A 58 58 ASN C C 58 177.500 178.183 -0.683 1
1 678 . 13 1 1 A 58 58 ASN CA C 58 56.900 56.642 0.258 1
1 679 . 13 1 1 A 58 58 ASN CB C 58 39.800 37.654 2.146 1
1 680 . 13 1 1 A 58 58 ASN N N 58 117.600 117.513 0.087 1
1 682 . 13 1 1 A 59 59 LEU H H 59 8.530 8.610 -0.080 1
1 683 . 13 1 1 A 59 59 LEU HA H 59 3.710 3.884 -0.174 1
1 693 . 13 1 1 A 59 59 LEU C C 59 178.400 179.009 -0.609 1
1 694 . 13 1 1 A 59 59 LEU CA C 59 58.600 57.582 1.018 1
1 695 . 13 1 1 A 59 59 LEU CB C 59 40.500 40.591 -0.091 1
1 699 . 13 1 1 A 59 59 LEU N N 59 122.600 121.014 1.586 1
1 700 . 13 1 1 A 60 60 GLN H H 60 8.200 8.337 -0.137 1
1 701 . 13 1 1 A 60 60 GLN HA H 60 4.020 3.995 0.025 1
1 708 . 13 1 1 A 60 60 GLN C C 60 178.700 177.947 0.753 1
1 709 . 13 1 1 A 60 60 GLN CA C 60 58.800 59.103 -0.303 1
1 710 . 13 1 1 A 60 60 GLN CB C 60 27.700 28.554 -0.854 1
1 712 . 13 1 1 A 60 60 GLN N N 60 118.900 119.450 -0.550 1
1 714 . 13 1 1 A 61 61 ALA H H 61 7.580 7.622 -0.042 1
1 715 . 13 1 1 A 61 61 ALA HA H 61 4.230 4.019 0.211 1
1 719 . 13 1 1 A 61 61 ALA C C 61 181.300 180.140 1.160 1
1 720 . 13 1 1 A 61 61 ALA CA C 61 55.100 55.163 -0.063 1
1 721 . 13 1 1 A 61 61 ALA CB C 61 17.600 18.545 -0.945 1
1 722 . 13 1 1 A 61 61 ALA N N 61 122.200 122.420 -0.220 1
1 723 . 13 1 1 A 62 62 LEU H H 62 7.830 7.942 -0.112 1
1 724 . 13 1 1 A 62 62 LEU HA H 62 3.980 3.973 0.007 1
1 734 . 13 1 1 A 62 62 LEU C C 62 178.500 179.224 -0.724 1
1 735 . 13 1 1 A 62 62 LEU CA C 62 58.100 57.536 0.564 1
1 736 . 13 1 1 A 62 62 LEU CB C 62 43.300 41.448 1.852 1
1 739 . 13 1 1 A 62 62 LEU N N 62 119.000 118.026 0.974 1
1 740 . 13 1 1 A 63 63 LYS H H 63 8.580 8.327 0.253 1
1 741 . 13 1 1 A 63 63 LYS HA H 63 4.130 4.147 -0.017 1
1 750 . 13 1 1 A 63 63 LYS C C 63 180.500 178.975 1.525 1
1 751 . 13 1 1 A 63 63 LYS CA C 63 59.700 58.855 0.845 1
1 752 . 13 1 1 A 63 63 LYS CB C 63 32.600 32.057 0.543 1
1 756 . 13 1 1 A 63 63 LYS N N 63 123.400 121.926 1.474 1
1 757 . 13 1 1 A 64 64 SER H H 64 8.640 8.186 0.454 1
1 758 . 13 1 1 A 64 64 SER HA H 64 4.300 4.297 0.003 1
1 761 . 13 1 1 A 64 64 SER C C 64 175.000 176.831 -1.831 1
1 762 . 13 1 1 A 64 64 SER CA C 64 61.400 61.958 -0.558 1
1 763 . 13 1 1 A 64 64 SER CB C 64 63.000 63.196 -0.196 1
1 764 . 13 1 1 A 64 64 SER N N 64 117.700 117.479 0.221 1
1 765 . 13 1 1 A 65 65 GLY H H 65 7.280 7.623 -0.343 1
1 766 . 13 1 1 A 65 65 GLY HA2 H 65 3.240 3.932 -0.692 1
1 767 . 13 1 1 A 65 65 GLY HA3 H 65 3.980 3.932 0.048 1
1 768 . 13 1 1 A 65 65 GLY C C 65 171.300 174.714 -3.414 1
1 769 . 13 1 1 A 65 65 GLY CA C 65 45.100 45.580 -0.480 1
1 770 . 13 1 1 A 65 65 GLY N N 65 104.400 109.229 -4.829 1
1 771 . 13 1 1 A 66 66 GLY H H 66 7.730 7.631 0.099 1
1 772 . 13 1 1 A 66 66 GLY HA2 H 66 3.650 4.016 -0.366 1
1 773 . 13 1 1 A 66 66 GLY HA3 H 66 3.750 4.017 -0.267 1
1 774 . 13 1 1 A 66 66 GLY C C 66 173.700 175.104 -1.404 1
1 775 . 13 1 1 A 66 66 GLY CA C 66 45.400 45.676 -0.276 1
1 776 . 13 1 1 A 66 66 GLY N N 66 104.700 108.166 -3.466 1
1 777 . 13 1 1 A 67 67 LEU H H 67 7.520 7.991 -0.471 1
1 778 . 13 1 1 A 67 67 LEU HA H 67 4.310 4.232 0.078 1
1 788 . 13 1 1 A 67 67 LEU C C 67 177.700 176.938 0.762 1
1 789 . 13 1 1 A 67 67 LEU CA C 67 55.500 56.189 -0.689 1
1 790 . 13 1 1 A 67 67 LEU CB C 67 42.400 42.454 -0.054 1
1 794 . 13 1 1 A 67 67 LEU N N 67 110.600 118.802 -8.202 1
1 795 . 13 1 1 A 68 68 VAL H H 68 6.890 7.378 -0.488 1
1 796 . 13 1 1 A 68 68 VAL HA H 68 5.190 5.021 0.169 1
1 804 . 13 1 1 A 68 68 VAL C C 68 173.700 174.134 -0.434 1
1 805 . 13 1 1 A 68 68 VAL CA C 68 57.400 58.838 -1.438 1
1 806 . 13 1 1 A 68 68 VAL CB C 68 36.400 35.151 1.249 1
1 809 . 13 1 1 A 68 68 VAL N N 68 106.400 112.208 -5.808 1
1 810 . 13 1 1 A 69 69 GLU H H 69 8.880 9.003 -0.123 1
1 811 . 13 1 1 A 69 69 GLU HA H 69 4.660 4.999 -0.339 1
1 816 . 13 1 1 A 69 69 GLU C C 69 173.300 174.512 -1.212 1
1 817 . 13 1 1 A 69 69 GLU CA C 69 54.300 54.687 -0.387 1
1 818 . 13 1 1 A 69 69 GLU CB C 69 34.100 33.910 0.190 1
1 820 . 13 1 1 A 69 69 GLU N N 69 120.400 121.166 -0.766 1
1 821 . 13 1 1 A 70 70 ALA H H 70 8.730 8.793 -0.063 1
1 822 . 13 1 1 A 70 70 ALA HA H 70 4.990 5.032 -0.042 1
1 826 . 13 1 1 A 70 70 ALA C C 70 176.500 175.457 1.043 1
1 827 . 13 1 1 A 70 70 ALA CA C 70 50.000 49.867 0.133 1
1 828 . 13 1 1 A 70 70 ALA CB C 70 22.300 21.194 1.106 1
1 829 . 13 1 1 A 70 70 ALA N N 70 122.800 122.872 -0.072 1
1 830 . 13 1 1 A 71 71 ARG H H 71 8.670 9.149 -0.479 1
1 831 . 13 1 1 A 71 71 ARG HA H 71 4.630 4.682 -0.052 1
1 843 . 13 1 1 A 71 71 ARG C C 71 173.500 174.671 -1.171 1
1 844 . 13 1 1 A 71 71 ARG CA C 71 54.600 55.385 -0.785 1
1 845 . 13 1 1 A 71 71 ARG CB C 71 33.600 31.262 2.338 1
1 849 . 13 1 1 A 71 71 ARG N N 71 120.100 123.360 -3.260 1
1 851 . 13 1 1 A 72 72 ARG H H 72 8.780 8.806 -0.026 1
1 852 . 13 1 1 A 72 72 ARG HA H 72 5.100 4.558 0.542 1
1 859 . 13 1 1 A 72 72 ARG C C 72 176.000 174.933 1.067 1
1 860 . 13 1 1 A 72 72 ARG CA C 72 54.900 55.652 -0.752 1
1 861 . 13 1 1 A 72 72 ARG CB C 72 32.500 30.445 2.055 1
1 864 . 13 1 1 A 72 72 ARG N N 72 123.600 125.092 -1.492 1
1 865 . 13 1 1 A 73 73 GLU H H 73 8.720 8.717 0.003 1
1 866 . 13 1 1 A 73 73 GLU HA H 73 4.510 4.677 -0.167 1
1 871 . 13 1 1 A 73 73 GLU C C 73 175.900 176.761 -0.861 1
1 872 . 13 1 1 A 73 73 GLU CA C 73 55.700 55.474 0.226 1
1 873 . 13 1 1 A 73 73 GLU CB C 73 31.800 30.513 1.287 1
1 875 . 13 1 1 A 73 73 GLU N N 73 126.800 127.467 -0.667 1
1 876 . 13 1 1 A 74 74 GLY H H 74 9.190 8.892 0.298 1
1 877 . 13 1 1 A 74 74 GLY HA2 H 74 3.700 3.890 -0.190 1
1 878 . 13 1 1 A 74 74 GLY HA3 H 74 4.170 3.913 0.257 1
1 879 . 13 1 1 A 74 74 GLY C C 74 175.400 174.826 0.574 1
1 880 . 13 1 1 A 74 74 GLY CA C 74 47.100 47.152 -0.052 1
1 881 . 13 1 1 A 74 74 GLY N N 74 118.500 115.544 2.956 1
1 882 . 13 1 1 A 75 75 THR H H 75 8.780 8.529 0.251 1
1 883 . 13 1 1 A 75 75 THR HA H 75 4.290 4.437 -0.147 1
1 888 . 13 1 1 A 75 75 THR C C 75 174.600 173.669 0.931 1
1 889 . 13 1 1 A 75 75 THR CA C 75 62.000 61.780 0.220 1
1 890 . 13 1 1 A 75 75 THR CB C 75 69.000 69.168 -0.168 1
1 892 . 13 1 1 A 75 75 THR N N 75 118.000 120.366 -2.366 1
1 893 . 13 1 1 A 76 76 ARG H H 76 8.030 7.662 0.368 1
1 894 . 13 1 1 A 76 76 ARG HA H 76 4.610 4.824 -0.214 1
1 901 . 13 1 1 A 76 76 ARG C C 76 174.800 174.866 -0.066 1
1 902 . 13 1 1 A 76 76 ARG CA C 76 55.500 54.456 1.044 1
1 903 . 13 1 1 A 76 76 ARG CB C 76 32.700 33.287 -0.587 1
1 906 . 13 1 1 A 76 76 ARG N N 76 122.600 120.667 1.933 1
1 907 . 13 1 1 A 77 77 GLN H H 77 8.580 8.566 0.014 1
1 908 . 13 1 1 A 77 77 GLN HA H 77 4.910 4.877 0.033 1
1 915 . 13 1 1 A 77 77 GLN C C 77 173.900 174.600 -0.700 1
1 916 . 13 1 1 A 77 77 GLN CA C 77 54.700 54.778 -0.078 1
1 917 . 13 1 1 A 77 77 GLN CB C 77 31.800 30.175 1.625 1
1 919 . 13 1 1 A 77 77 GLN N N 77 121.900 120.952 0.948 1
1 921 . 13 1 1 A 78 78 TYR H H 78 8.890 9.076 -0.186 1
1 922 . 13 1 1 A 78 78 TYR HA H 78 4.750 5.397 -0.647 1
1 929 . 13 1 1 A 78 78 TYR C C 78 175.600 174.526 1.074 1
1 930 . 13 1 1 A 78 78 TYR CA C 78 57.000 56.464 0.536 1
1 931 . 13 1 1 A 78 78 TYR CB C 78 41.400 39.936 1.464 1
1 936 . 13 1 1 A 78 78 TYR N N 78 121.800 122.790 -0.990 1
1 937 . 13 1 1 A 79 79 TYR H H 79 9.010 9.143 -0.133 1
1 938 . 13 1 1 A 79 79 TYR HA H 79 5.410 5.353 0.057 1
1 945 . 13 1 1 A 79 79 TYR C C 79 173.100 175.175 -2.075 1
1 946 . 13 1 1 A 79 79 TYR CA C 79 57.300 57.401 -0.101 1
1 947 . 13 1 1 A 79 79 TYR CB C 79 43.300 41.279 2.021 1
1 952 . 13 1 1 A 79 79 TYR N N 79 122.500 123.381 -0.881 1
1 953 . 13 1 1 A 80 80 ARG H H 80 8.720 8.602 0.118 1
1 954 . 13 1 1 A 80 80 ARG HA H 80 5.120 4.693 0.427 1
1 962 . 13 1 1 A 80 80 ARG C C 80 175.500 174.717 0.783 1
1 963 . 13 1 1 A 80 80 ARG CA C 80 53.200 55.084 -1.884 1
1 964 . 13 1 1 A 80 80 ARG CB C 80 33.900 34.009 -0.109 1
1 967 . 13 1 1 A 80 80 ARG N N 80 114.500 121.462 -6.962 1
1 969 . 13 1 1 A 81 81 ILE H H 81 9.300 8.593 0.707 1
1 970 . 13 1 1 A 81 81 ILE HA H 81 4.150 4.137 0.013 1
1 980 . 13 1 1 A 81 81 ILE C C 81 177.800 177.570 0.230 1
1 981 . 13 1 1 A 81 81 ILE CA C 81 62.300 62.301 -0.001 1
1 982 . 13 1 1 A 81 81 ILE CB C 81 37.800 37.810 -0.010 1
1 986 . 13 1 1 A 81 81 ILE N N 81 122.100 124.228 -2.128 1
1 987 . 13 1 1 A 82 82 ALA H H 82 7.930 8.825 -0.895 1
1 988 . 13 1 1 A 82 82 ALA HA H 82 3.930 4.037 -0.107 1
1 992 . 13 1 1 A 82 82 ALA C C 82 176.300 177.220 -0.920 1
1 993 . 13 1 1 A 82 82 ALA CA C 82 54.200 55.364 -1.164 1
1 994 . 13 1 1 A 82 82 ALA CB C 82 18.500 19.181 -0.681 1
1 995 . 13 1 1 A 82 82 ALA N N 82 127.200 128.195 -0.995 1
1 996 . 13 1 1 A 83 83 GLY H H 83 6.980 7.623 -0.643 1
1 997 . 13 1 1 A 83 83 GLY HA2 H 83 4.090 4.061 0.029 1
1 998 . 13 1 1 A 83 83 GLY HA3 H 83 4.440 4.063 0.377 1
1 999 . 13 1 1 A 83 83 GLY C C 83 173.600 175.137 -1.537 1
1 1000 . 13 1 1 A 83 83 GLY CA C 83 45.200 44.830 0.370 1
1 1001 . 13 1 1 A 83 83 GLY N N 83 101.800 102.920 -1.120 1
1 1002 . 13 1 1 A 84 84 GLU H H 84 8.930 8.880 0.050 1
1 1003 . 13 1 1 A 84 84 GLU HA H 84 4.120 3.978 0.142 1
1 1008 . 13 1 1 A 84 84 GLU C C 84 178.300 177.418 0.882 1
1 1009 . 13 1 1 A 84 84 GLU CA C 84 58.900 59.247 -0.347 1
1 1010 . 13 1 1 A 84 84 GLU CB C 84 29.400 29.289 0.111 1
1 1012 . 13 1 1 A 84 84 GLU N N 84 120.300 120.467 -0.167 1
1 1013 . 13 1 1 A 85 85 ASP H H 85 8.950 8.203 0.747 1
1 1014 . 13 1 1 A 85 85 ASP HA H 85 4.310 4.352 -0.042 1
1 1017 . 13 1 1 A 85 85 ASP C C 85 178.000 178.829 -0.829 1
1 1018 . 13 1 1 A 85 85 ASP CA C 85 57.100 57.692 -0.592 1
1 1019 . 13 1 1 A 85 85 ASP CB C 85 38.900 41.707 -2.807 1
1 1020 . 13 1 1 A 85 85 ASP N N 85 119.400 120.463 -1.063 1
1 1021 . 13 1 1 A 86 86 VAL H H 86 7.620 8.087 -0.467 1
1 1022 . 13 1 1 A 86 86 VAL HA H 86 3.480 3.569 -0.089 1
1 1030 . 13 1 1 A 86 86 VAL C C 86 177.400 177.989 -0.589 1
1 1031 . 13 1 1 A 86 86 VAL CA C 86 66.800 66.442 0.358 1
1 1032 . 13 1 1 A 86 86 VAL CB C 86 31.300 31.574 -0.274 1
1 1035 . 13 1 1 A 86 86 VAL N N 86 121.600 119.076 2.524 1
1 1036 . 13 1 1 A 87 87 ALA H H 87 7.520 8.250 -0.730 1
1 1037 . 13 1 1 A 87 87 ALA HA H 87 4.110 4.025 0.085 1
1 1041 . 13 1 1 A 87 87 ALA C C 87 181.200 179.901 1.299 1
1 1042 . 13 1 1 A 87 87 ALA CA C 87 55.800 55.273 0.527 1
1 1043 . 13 1 1 A 87 87 ALA CB C 87 17.600 18.139 -0.539 1
1 1044 . 13 1 1 A 87 87 ALA N N 87 122.700 121.653 1.047 1
1 1045 . 13 1 1 A 88 88 ARG H H 88 8.380 8.131 0.249 1
1 1046 . 13 1 1 A 88 88 ARG HA H 88 4.090 4.058 0.032 1
1 1054 . 13 1 1 A 88 88 ARG C C 88 179.100 178.963 0.137 1
1 1055 . 13 1 1 A 88 88 ARG CA C 88 59.600 59.048 0.552 1
1 1056 . 13 1 1 A 88 88 ARG CB C 88 30.500 29.823 0.677 1
1 1059 . 13 1 1 A 88 88 ARG N N 88 119.200 117.055 2.145 1
1 1061 . 13 1 1 A 89 89 LEU H H 89 8.480 7.647 0.833 1
1 1062 . 13 1 1 A 89 89 LEU HA H 89 4.040 4.057 -0.017 1
1 1071 . 13 1 1 A 89 89 LEU C C 89 177.200 178.596 -1.396 1
1 1072 . 13 1 1 A 89 89 LEU CA C 89 58.300 57.884 0.416 1
1 1073 . 13 1 1 A 89 89 LEU CB C 89 41.300 41.938 -0.638 1
1 1076 . 13 1 1 A 89 89 LEU N N 89 123.300 121.695 1.605 1
1 1077 . 13 1 1 A 90 90 PHE H H 90 8.890 8.532 0.358 1
1 1078 . 13 1 1 A 90 90 PHE HA H 90 4.380 3.999 0.381 1
1 1086 . 13 1 1 A 90 90 PHE C C 90 177.500 177.992 -0.492 1
1 1087 . 13 1 1 A 90 90 PHE CA C 90 59.400 62.089 -2.689 1
1 1088 . 13 1 1 A 90 90 PHE CB C 90 38.600 39.048 -0.448 1
1 1094 . 13 1 1 A 90 90 PHE N N 90 119.400 119.390 0.010 1
1 1095 . 13 1 1 A 91 91 ALA H H 91 7.920 8.333 -0.413 1
1 1096 . 13 1 1 A 91 91 ALA HA H 91 3.940 3.928 0.012 1
1 1100 . 13 1 1 A 91 91 ALA C C 91 180.200 179.862 0.338 1
1 1101 . 13 1 1 A 91 91 ALA CA C 91 55.100 55.274 -0.174 1
1 1102 . 13 1 1 A 91 91 ALA CB C 91 18.000 17.833 0.167 1
1 1103 . 13 1 1 A 91 91 ALA N N 91 120.500 121.341 -0.841 1
1 1104 . 13 1 1 A 92 92 LEU H H 92 8.190 8.321 -0.131 1
1 1105 . 13 1 1 A 92 92 LEU HA H 92 4.300 4.041 0.259 1
1 1115 . 13 1 1 A 92 92 LEU C C 92 178.900 178.282 0.618 1
1 1116 . 13 1 1 A 92 92 LEU CA C 92 57.500 58.003 -0.503 1
1 1117 . 13 1 1 A 92 92 LEU CB C 92 42.100 41.609 0.491 1
1 1121 . 13 1 1 A 92 92 LEU N N 92 120.200 119.451 0.749 1
1 1122 . 13 1 1 A 93 93 VAL H H 93 8.890 7.910 0.980 1
1 1123 . 13 1 1 A 93 93 VAL HA H 93 3.810 3.852 -0.042 1
1 1131 . 13 1 1 A 93 93 VAL C C 93 176.900 177.891 -0.991 1
1 1132 . 13 1 1 A 93 93 VAL CA C 93 66.000 65.490 0.510 1
1 1133 . 13 1 1 A 93 93 VAL CB C 93 31.200 31.247 -0.047 1
1 1136 . 13 1 1 A 93 93 VAL N N 93 117.100 115.607 1.493 1
1 1137 . 13 1 1 A 94 94 GLN H H 94 6.920 7.519 -0.599 1
1 1138 . 13 1 1 A 94 94 GLN HA H 94 3.790 3.811 -0.021 1
1 1145 . 13 1 1 A 94 94 GLN C C 94 177.400 178.322 -0.922 1
1 1146 . 13 1 1 A 94 94 GLN CA C 94 60.000 58.506 1.494 1
1 1147 . 13 1 1 A 94 94 GLN CB C 94 30.300 28.287 2.013 1
1 1149 . 13 1 1 A 94 94 GLN N N 94 117.800 121.227 -3.427 1
1 1151 . 13 1 1 A 95 95 VAL H H 95 7.420 7.914 -0.494 1
1 1152 . 13 1 1 A 95 95 VAL HA H 95 3.760 3.571 0.189 1
1 1160 . 13 1 1 A 95 95 VAL C C 95 178.300 177.983 0.317 1
1 1161 . 13 1 1 A 95 95 VAL CA C 95 66.600 66.360 0.240 1
1 1162 . 13 1 1 A 95 95 VAL CB C 95 31.900 31.524 0.376 1
1 1165 . 13 1 1 A 95 95 VAL N N 95 121.500 119.937 1.563 1
1 1166 . 13 1 1 A 96 96 VAL H H 96 8.340 8.137 0.203 1
1 1167 . 13 1 1 A 96 96 VAL HA H 96 3.810 3.743 0.067 1
1 1175 . 13 1 1 A 96 96 VAL C C 96 178.400 177.300 1.100 1
1 1176 . 13 1 1 A 96 96 VAL CA C 96 66.100 64.962 1.138 1
1 1177 . 13 1 1 A 96 96 VAL CB C 96 32.200 31.162 1.038 1
1 1180 . 13 1 1 A 96 96 VAL N N 96 120.000 120.077 -0.077 1
1 1181 . 13 1 1 A 97 97 ALA H H 97 8.140 7.846 0.294 1
1 1182 . 13 1 1 A 97 97 ALA HA H 97 4.010 3.864 0.146 1
1 1186 . 13 1 1 A 97 97 ALA C C 97 178.800 178.367 0.433 1
1 1187 . 13 1 1 A 97 97 ALA CA C 97 54.900 55.522 -0.622 1
1 1188 . 13 1 1 A 97 97 ALA CB C 97 19.900 18.037 1.863 1
1 1189 . 13 1 1 A 97 97 ALA N N 97 121.400 123.752 -2.352 1
1 1190 . 13 1 1 A 98 98 ASP H H 98 8.170 8.397 -0.227 1
1 1191 . 13 1 1 A 98 98 ASP HA H 98 4.320 4.221 0.099 1
1 1194 . 13 1 1 A 98 98 ASP C C 98 178.100 178.035 0.065 1
1 1195 . 13 1 1 A 98 98 ASP CA C 98 57.100 57.857 -0.757 1
1 1196 . 13 1 1 A 98 98 ASP CB C 98 41.800 41.905 -0.105 1
1 1197 . 13 1 1 A 98 98 ASP N N 98 118.500 118.328 0.172 1
1 1198 . 13 1 1 A 99 99 GLU H H 99 8.220 8.806 -0.586 1
1 1199 . 13 1 1 A 99 99 GLU HA H 99 4.000 4.085 -0.085 1
1 1204 . 13 1 1 A 99 99 GLU C C 99 178.300 177.491 0.809 1
1 1205 . 13 1 1 A 99 99 GLU CA C 99 58.300 58.894 -0.594 1
1 1206 . 13 1 1 A 99 99 GLU CB C 99 29.800 29.132 0.668 1
1 1208 . 13 1 1 A 99 99 GLU N N 99 116.600 117.160 -0.560 1
1 1209 . 13 1 1 A 100 100 HIS H H 100 7.980 7.803 0.177 1
1 1210 . 13 1 1 A 100 100 HIS HA H 100 4.600 4.644 -0.044 1
1 1214 . 13 1 1 A 100 100 HIS C C 100 175.900 176.932 -1.032 1
1 1215 . 13 1 1 A 100 100 HIS CA C 100 57.500 56.920 0.580 1
1 1216 . 13 1 1 A 100 100 HIS CB C 100 30.800 30.112 0.688 1
1 1218 . 13 1 1 A 100 100 HIS N N 100 114.000 117.099 -3.099 1
1 1219 . 13 1 1 A 101 101 LEU H H 101 7.920 7.767 0.153 1
1 1220 . 13 1 1 A 101 101 LEU HA H 101 4.370 4.068 0.302 1
1 1230 . 13 1 1 A 101 101 LEU C C 101 177.700 176.529 1.171 1
1 1231 . 13 1 1 A 101 101 LEU CA C 101 55.900 57.297 -1.397 1
1 1232 . 13 1 1 A 101 101 LEU CB C 101 42.100 42.270 -0.170 1
1 1236 . 13 1 1 A 101 101 LEU N N 101 118.500 121.557 -3.057 1
1 1237 . 13 1 1 A 102 102 GLU H H 102 8.100 7.536 0.564 1
1 1238 . 13 1 1 A 102 102 GLU HA H 102 4.160 4.404 -0.244 1
1 1243 . 13 1 1 A 102 102 GLU C C 102 176.700 175.996 0.704 1
1 1244 . 13 1 1 A 102 102 GLU CA C 102 57.000 55.282 1.718 1
1 1245 . 13 1 1 A 102 102 GLU CB C 102 29.900 30.821 -0.921 1
1 1247 . 13 1 1 A 102 102 GLU N N 102 119.100 115.360 3.740 1
1 1248 . 13 1 1 A 103 103 HIS H H 103 8.010 8.570 -0.560 1
1 1249 . 13 1 1 A 103 103 HIS HA H 103 4.520 4.882 -0.362 1
1 1252 . 13 1 1 A 103 103 HIS CA C 103 56.100 55.068 1.032 1
1 1253 . 13 1 1 A 103 103 HIS CB C 103 29.700 31.467 -1.767 1
1 1254 . 13 1 1 A 103 103 HIS N N 103 117.300 122.500 -5.200 1
1 1255 . 13 1 1 A 107 107 HIS HA H 107 4.560 4.833 -0.273 1
1 1258 . 13 1 1 A 107 107 HIS C C 107 173.900 174.350 -0.450 1
1 1259 . 13 1 1 A 107 107 HIS CA C 107 55.900 55.736 0.164 1
1 1260 . 13 1 1 A 107 107 HIS CB C 107 30.200 31.776 -1.576 1
1 4 . 14 1 1 A 2 2 ALA H H 2 8.450 8.595 -0.145 1
1 5 . 14 1 1 A 2 2 ALA HA H 2 4.390 4.953 -0.563 1
1 9 . 14 1 1 A 2 2 ALA C C 2 178.300 176.254 2.046 1
1 10 . 14 1 1 A 2 2 ALA CA C 2 52.500 51.389 1.111 1
1 11 . 14 1 1 A 2 2 ALA CB C 2 19.200 20.731 -1.531 1
1 12 . 14 1 1 A 2 2 ALA N N 2 125.100 125.799 -0.699 1
1 13 . 14 1 1 A 3 3 GLY H H 3 8.450 9.068 -0.618 1
1 14 . 14 1 1 A 3 3 GLY HA2 H 3 4.030 3.910 0.120 1
1 15 . 14 1 1 A 3 3 GLY HA3 H 3 4.030 3.910 0.120 1
1 16 . 14 1 1 A 3 3 GLY C C 3 174.100 173.728 0.372 1
1 17 . 14 1 1 A 3 3 GLY CA C 3 45.200 47.152 -1.952 1
1 18 . 14 1 1 A 3 3 GLY N N 3 108.000 111.436 -3.436 1
1 19 . 14 1 1 A 4 4 GLN H H 4 8.550 8.313 0.237 1
1 20 . 14 1 1 A 4 4 GLN HA H 4 4.340 4.093 0.247 1
1 27 . 14 1 1 A 4 4 GLN C C 4 176.700 176.110 0.590 1
1 28 . 14 1 1 A 4 4 GLN CA C 4 56.600 56.922 -0.322 1
1 29 . 14 1 1 A 4 4 GLN CB C 4 29.300 28.813 0.487 1
1 31 . 14 1 1 A 4 4 GLN N N 4 120.500 123.334 -2.834 1
1 33 . 14 1 1 A 5 5 SER H H 5 8.540 8.670 -0.130 1
1 34 . 14 1 1 A 5 5 SER HA H 5 4.390 4.451 -0.061 1
1 38 . 14 1 1 A 5 5 SER C C 5 174.800 172.886 1.914 1
1 39 . 14 1 1 A 5 5 SER CA C 5 59.100 58.243 0.857 1
1 40 . 14 1 1 A 5 5 SER CB C 5 63.500 62.798 0.702 1
1 41 . 14 1 1 A 5 5 SER N N 5 117.100 117.201 -0.101 1
1 42 . 14 1 1 A 6 6 ASP H H 6 8.300 8.491 -0.191 1
1 43 . 14 1 1 A 6 6 ASP HA H 6 4.540 5.137 -0.597 1
1 46 . 14 1 1 A 6 6 ASP C C 6 177.300 175.902 1.398 1
1 47 . 14 1 1 A 6 6 ASP CA C 6 55.100 52.948 2.152 1
1 48 . 14 1 1 A 6 6 ASP CB C 6 40.800 41.753 -0.953 1
1 49 . 14 1 1 A 6 6 ASP N N 6 122.700 121.126 1.574 1
1 50 . 14 1 1 A 7 7 ARG H H 7 8.270 8.817 -0.547 1
1 51 . 14 1 1 A 7 7 ARG HA H 7 4.150 4.050 0.100 1
1 58 . 14 1 1 A 7 7 ARG C C 7 177.600 177.471 0.129 1
1 59 . 14 1 1 A 7 7 ARG CA C 7 58.000 58.758 -0.758 1
1 60 . 14 1 1 A 7 7 ARG CB C 7 30.100 29.813 0.287 1
1 63 . 14 1 1 A 7 7 ARG N N 7 122.100 123.805 -1.705 1
1 64 . 14 1 1 A 8 8 LYS H H 8 8.130 7.851 0.279 1
1 65 . 14 1 1 A 8 8 LYS HA H 8 4.090 4.122 -0.032 1
1 74 . 14 1 1 A 8 8 LYS C C 8 177.600 179.098 -1.498 1
1 75 . 14 1 1 A 8 8 LYS CA C 8 58.400 58.496 -0.096 1
1 76 . 14 1 1 A 8 8 LYS CB C 8 31.700 31.751 -0.051 1
1 80 . 14 1 1 A 8 8 LYS N N 8 120.900 119.272 1.628 1
1 81 . 14 1 1 A 9 9 ALA H H 9 8.050 8.197 -0.147 1
1 82 . 14 1 1 A 9 9 ALA HA H 9 3.950 4.062 -0.112 1
1 86 . 14 1 1 A 9 9 ALA C C 9 179.800 180.252 -0.452 1
1 87 . 14 1 1 A 9 9 ALA CA C 9 55.100 54.907 0.193 1
1 88 . 14 1 1 A 9 9 ALA CB C 9 18.100 18.103 -0.003 1
1 89 . 14 1 1 A 9 9 ALA N N 9 121.600 121.619 -0.019 1
1 90 . 14 1 1 A 10 10 ALA H H 10 7.910 7.521 0.389 1
1 91 . 14 1 1 A 10 10 ALA HA H 10 4.200 4.085 0.115 1
1 95 . 14 1 1 A 10 10 ALA C C 10 180.500 179.412 1.088 1
1 96 . 14 1 1 A 10 10 ALA CA C 10 54.600 55.020 -0.420 1
1 97 . 14 1 1 A 10 10 ALA CB C 10 18.100 18.625 -0.525 1
1 98 . 14 1 1 A 10 10 ALA N N 10 120.200 120.582 -0.382 1
1 99 . 14 1 1 A 11 11 LEU H H 11 8.080 7.632 0.448 1
1 100 . 14 1 1 A 11 11 LEU HA H 11 4.120 4.154 -0.034 1
1 110 . 14 1 1 A 11 11 LEU C C 11 179.600 179.233 0.367 1
1 111 . 14 1 1 A 11 11 LEU CA C 11 57.800 57.150 0.650 1
1 112 . 14 1 1 A 11 11 LEU CB C 11 41.700 41.946 -0.246 1
1 115 . 14 1 1 A 11 11 LEU N N 11 120.900 119.783 1.117 1
1 116 . 14 1 1 A 12 12 LEU H H 12 8.480 8.358 0.122 1
1 117 . 14 1 1 A 12 12 LEU HA H 12 4.040 4.014 0.026 1
1 127 . 14 1 1 A 12 12 LEU C C 12 178.900 178.743 0.157 1
1 128 . 14 1 1 A 12 12 LEU CA C 12 58.100 58.194 -0.094 1
1 129 . 14 1 1 A 12 12 LEU CB C 12 40.100 40.822 -0.722 1
1 133 . 14 1 1 A 12 12 LEU N N 12 118.700 118.410 0.290 1
1 134 . 14 1 1 A 13 13 ASP H H 13 7.990 8.499 -0.509 1
1 135 . 14 1 1 A 13 13 ASP HA H 13 4.420 4.279 0.141 1
1 138 . 14 1 1 A 13 13 ASP C C 13 178.900 178.397 0.503 1
1 139 . 14 1 1 A 13 13 ASP CA C 13 57.500 57.729 -0.229 1
1 140 . 14 1 1 A 13 13 ASP CB C 13 40.500 41.202 -0.702 1
1 141 . 14 1 1 A 13 13 ASP N N 13 119.500 119.735 -0.235 1
1 142 . 14 1 1 A 14 14 GLN H H 14 7.620 7.592 0.028 1
1 143 . 14 1 1 A 14 14 GLN HA H 14 4.230 4.027 0.203 1
1 150 . 14 1 1 A 14 14 GLN C C 14 178.400 178.195 0.205 1
1 151 . 14 1 1 A 14 14 GLN CA C 14 58.100 58.567 -0.467 1
1 152 . 14 1 1 A 14 14 GLN CB C 14 27.800 28.762 -0.962 1
1 154 . 14 1 1 A 14 14 GLN N N 14 118.900 119.459 -0.559 1
1 156 . 14 1 1 A 15 15 VAL H H 15 8.480 7.806 0.674 1
1 157 . 14 1 1 A 15 15 VAL HA H 15 3.380 4.048 -0.668 1
1 165 . 14 1 1 A 15 15 VAL C C 15 177.600 178.103 -0.503 1
1 166 . 14 1 1 A 15 15 VAL CA C 15 66.600 63.640 2.960 1
1 167 . 14 1 1 A 15 15 VAL CB C 15 30.500 31.607 -1.107 1
1 170 . 14 1 1 A 15 15 VAL N N 15 121.300 118.418 2.882 1
1 171 . 14 1 1 A 16 16 ALA H H 16 8.080 8.231 -0.151 1
1 172 . 14 1 1 A 16 16 ALA HA H 16 4.450 4.045 0.405 1
1 176 . 14 1 1 A 16 16 ALA C C 16 179.100 179.792 -0.692 1
1 177 . 14 1 1 A 16 16 ALA CA C 16 54.600 55.241 -0.641 1
1 178 . 14 1 1 A 16 16 ALA CB C 16 17.700 18.117 -0.417 1
1 179 . 14 1 1 A 16 16 ALA N N 16 121.400 124.287 -2.887 1
1 180 . 14 1 1 A 17 17 ARG H H 17 7.480 8.292 -0.812 1
1 181 . 14 1 1 A 17 17 ARG HA H 17 3.910 4.112 -0.202 1
1 187 . 14 1 1 A 17 17 ARG C C 17 179.700 178.867 0.833 1
1 188 . 14 1 1 A 17 17 ARG CA C 17 59.700 58.927 0.773 1
1 189 . 14 1 1 A 17 17 ARG CB C 17 30.400 29.884 0.516 1
1 191 . 14 1 1 A 17 17 ARG N N 17 116.900 119.201 -2.301 1
1 192 . 14 1 1 A 18 18 VAL H H 18 7.960 7.829 0.131 1
1 193 . 14 1 1 A 18 18 VAL HA H 18 3.690 3.940 -0.250 1
1 201 . 14 1 1 A 18 18 VAL C C 18 177.900 178.532 -0.632 1
1 202 . 14 1 1 A 18 18 VAL CA C 18 66.600 66.002 0.598 1
1 203 . 14 1 1 A 18 18 VAL CB C 18 31.300 31.666 -0.366 1
1 206 . 14 1 1 A 18 18 VAL N N 18 123.000 119.611 3.389 1
1 207 . 14 1 1 A 19 19 GLY H H 19 8.270 8.141 0.129 1
1 208 . 14 1 1 A 19 19 GLY HA2 H 19 3.430 3.833 -0.403 1
1 209 . 14 1 1 A 19 19 GLY HA3 H 19 3.430 3.842 -0.412 1
1 210 . 14 1 1 A 19 19 GLY C C 19 174.400 175.621 -1.221 1
1 211 . 14 1 1 A 19 19 GLY CA C 19 48.500 46.989 1.511 1
1 212 . 14 1 1 A 19 19 GLY N N 19 105.400 107.419 -2.019 1
1 213 . 14 1 1 A 20 20 LYS H H 20 8.250 8.050 0.200 1
1 214 . 14 1 1 A 20 20 LYS HA H 20 3.710 4.197 -0.487 1
1 223 . 14 1 1 A 20 20 LYS C C 20 179.400 178.383 1.017 1
1 224 . 14 1 1 A 20 20 LYS CA C 20 59.300 58.319 0.981 1
1 225 . 14 1 1 A 20 20 LYS CB C 20 32.600 32.074 0.526 1
1 229 . 14 1 1 A 20 20 LYS N N 20 118.700 121.527 -2.827 1
1 230 . 14 1 1 A 21 21 ALA H H 21 7.640 7.679 -0.039 1
1 231 . 14 1 1 A 21 21 ALA HA H 21 3.790 4.187 -0.397 1
1 235 . 14 1 1 A 21 21 ALA C C 21 177.900 180.500 -2.600 1
1 236 . 14 1 1 A 21 21 ALA CA C 21 55.200 53.963 1.237 1
1 237 . 14 1 1 A 21 21 ALA CB C 21 19.200 18.543 0.657 1
1 238 . 14 1 1 A 21 21 ALA N N 21 121.700 121.517 0.183 1
1 239 . 14 1 1 A 22 22 LEU H H 22 7.330 8.374 -1.044 1
1 240 . 14 1 1 A 22 22 LEU HA H 22 4.140 4.134 0.006 1
1 250 . 14 1 1 A 22 22 LEU C C 22 176.800 178.537 -1.737 1
1 251 . 14 1 1 A 22 22 LEU CA C 22 54.600 57.620 -3.020 1
1 252 . 14 1 1 A 22 22 LEU CB C 22 42.900 41.521 1.379 1
1 256 . 14 1 1 A 22 22 LEU N N 22 114.200 120.829 -6.629 1
1 257 . 14 1 1 A 23 23 ALA H H 23 7.160 8.187 -1.027 1
1 258 . 14 1 1 A 23 23 ALA HA H 23 4.720 4.287 0.433 1
1 262 . 14 1 1 A 23 23 ALA C C 23 176.700 177.754 -1.054 1
1 263 . 14 1 1 A 23 23 ALA CA C 23 53.000 52.847 0.153 1
1 264 . 14 1 1 A 23 23 ALA CB C 23 18.200 17.934 0.266 1
1 265 . 14 1 1 A 23 23 ALA N N 23 118.200 120.404 -2.204 1
1 266 . 14 1 1 A 24 24 ASN H H 24 7.440 7.835 -0.395 1
1 267 . 14 1 1 A 24 24 ASN HA H 24 4.730 4.763 -0.033 1
1 272 . 14 1 1 A 24 24 ASN C C 24 174.800 175.605 -0.805 1
1 273 . 14 1 1 A 24 24 ASN CA C 24 53.500 53.700 -0.200 1
1 274 . 14 1 1 A 24 24 ASN CB C 24 41.700 39.281 2.419 1
1 275 . 14 1 1 A 24 24 ASN N N 24 116.800 117.567 -0.767 1
1 277 . 14 1 1 A 25 25 GLY H H 25 9.370 7.867 1.503 1
1 278 . 14 1 1 A 25 25 GLY HA2 H 25 3.650 3.999 -0.349 1
1 279 . 14 1 1 A 25 25 GLY HA3 H 25 4.110 4.015 0.095 1
1 280 . 14 1 1 A 25 25 GLY C C 25 175.300 175.854 -0.554 1
1 281 . 14 1 1 A 25 25 GLY CA C 25 47.600 45.781 1.819 1
1 282 . 14 1 1 A 25 25 GLY N N 25 114.800 107.683 7.117 1
1 283 . 14 1 1 A 26 26 ARG H H 26 8.050 8.215 -0.165 1
1 284 . 14 1 1 A 26 26 ARG HA H 26 4.150 4.046 0.104 1
1 289 . 14 1 1 A 26 26 ARG C C 26 179.300 178.432 0.868 1
1 290 . 14 1 1 A 26 26 ARG CA C 26 57.000 59.226 -2.226 1
1 291 . 14 1 1 A 26 26 ARG CB C 26 29.900 29.912 -0.012 1
1 294 . 14 1 1 A 26 26 ARG N N 26 120.500 121.135 -0.635 1
1 295 . 14 1 1 A 27 27 ARG H H 27 7.930 7.951 -0.021 1
1 296 . 14 1 1 A 27 27 ARG HA H 27 3.710 4.180 -0.470 1
1 301 . 14 1 1 A 27 27 ARG C C 27 178.300 177.668 0.632 1
1 302 . 14 1 1 A 27 27 ARG CA C 27 61.000 58.067 2.933 1
1 303 . 14 1 1 A 27 27 ARG CB C 27 30.400 30.112 0.288 1
1 305 . 14 1 1 A 27 27 ARG N N 27 117.900 118.512 -0.612 1
1 306 . 14 1 1 A 28 28 LEU H H 28 7.640 7.645 -0.005 1
1 307 . 14 1 1 A 28 28 LEU HA H 28 3.950 4.021 -0.071 1
1 317 . 14 1 1 A 28 28 LEU C C 28 178.200 179.446 -1.246 1
1 318 . 14 1 1 A 28 28 LEU CA C 28 57.600 57.263 0.337 1
1 319 . 14 1 1 A 28 28 LEU CB C 28 41.900 41.157 0.743 1
1 323 . 14 1 1 A 28 28 LEU N N 28 117.600 118.070 -0.470 1
1 324 . 14 1 1 A 29 29 GLN H H 29 8.110 7.852 0.258 1
1 325 . 14 1 1 A 29 29 GLN HA H 29 3.880 4.112 -0.232 1
1 332 . 14 1 1 A 29 29 GLN C C 29 179.400 178.775 0.625 1
1 333 . 14 1 1 A 29 29 GLN CA C 29 59.100 58.538 0.562 1
1 334 . 14 1 1 A 29 29 GLN CB C 29 28.800 28.320 0.480 1
1 336 . 14 1 1 A 29 29 GLN N N 29 119.300 118.943 0.357 1
1 338 . 14 1 1 A 30 30 ILE H H 30 7.530 7.921 -0.391 1
1 339 . 14 1 1 A 30 30 ILE HA H 30 3.340 3.650 -0.310 1
1 349 . 14 1 1 A 30 30 ILE C C 30 176.700 178.406 -1.706 1
1 350 . 14 1 1 A 30 30 ILE CA C 30 65.900 65.133 0.767 1
1 351 . 14 1 1 A 30 30 ILE CB C 30 37.400 37.944 -0.544 1
1 355 . 14 1 1 A 30 30 ILE N N 30 118.600 120.930 -2.330 1
1 356 . 14 1 1 A 31 31 LEU H H 31 7.500 7.670 -0.170 1
1 357 . 14 1 1 A 31 31 LEU HA H 31 3.520 3.745 -0.225 1
1 367 . 14 1 1 A 31 31 LEU C C 31 177.300 178.492 -1.192 1
1 368 . 14 1 1 A 31 31 LEU CA C 31 58.100 57.857 0.243 1
1 369 . 14 1 1 A 31 31 LEU CB C 31 41.100 40.617 0.483 1
1 373 . 14 1 1 A 31 31 LEU N N 31 119.900 119.462 0.438 1
1 374 . 14 1 1 A 32 32 ASP H H 32 7.950 8.196 -0.246 1
1 375 . 14 1 1 A 32 32 ASP HA H 32 4.300 4.291 0.009 1
1 378 . 14 1 1 A 32 32 ASP C C 32 178.300 178.289 0.011 1
1 379 . 14 1 1 A 32 32 ASP CA C 32 57.400 57.674 -0.274 1
1 380 . 14 1 1 A 32 32 ASP CB C 32 42.400 42.264 0.136 1
1 381 . 14 1 1 A 32 32 ASP N N 32 116.900 119.745 -2.845 1
1 382 . 14 1 1 A 33 33 LEU H H 33 7.350 7.358 -0.008 1
1 383 . 14 1 1 A 33 33 LEU HA H 33 4.130 4.114 0.016 1
1 393 . 14 1 1 A 33 33 LEU C C 33 180.000 178.726 1.274 1
1 394 . 14 1 1 A 33 33 LEU CA C 33 57.600 57.648 -0.048 1
1 395 . 14 1 1 A 33 33 LEU CB C 33 42.300 41.682 0.618 1
1 399 . 14 1 1 A 33 33 LEU N N 33 118.600 120.299 -1.699 1
1 400 . 14 1 1 A 34 34 LEU H H 34 8.300 8.171 0.129 1
1 401 . 14 1 1 A 34 34 LEU HA H 34 4.490 4.209 0.281 1
1 411 . 14 1 1 A 34 34 LEU C C 34 178.900 178.820 0.080 1
1 412 . 14 1 1 A 34 34 LEU CA C 34 55.800 55.851 -0.051 1
1 413 . 14 1 1 A 34 34 LEU CB C 34 41.300 41.394 -0.094 1
1 417 . 14 1 1 A 34 34 LEU N N 34 117.800 118.387 -0.587 1
1 418 . 14 1 1 A 35 35 ALA H H 35 8.160 7.462 0.698 1
1 419 . 14 1 1 A 35 35 ALA HA H 35 4.050 4.112 -0.062 1
1 423 . 14 1 1 A 35 35 ALA C C 35 179.000 178.147 0.853 1
1 424 . 14 1 1 A 35 35 ALA CA C 35 54.900 54.103 0.797 1
1 425 . 14 1 1 A 35 35 ALA CB C 35 17.500 18.185 -0.685 1
1 426 . 14 1 1 A 35 35 ALA N N 35 123.900 121.830 2.070 1
1 427 . 14 1 1 A 36 36 GLN H H 36 7.600 7.521 0.079 1
1 428 . 14 1 1 A 36 36 GLN HA H 36 4.340 4.269 0.071 1
1 435 . 14 1 1 A 36 36 GLN C C 36 176.100 175.306 0.794 1
1 436 . 14 1 1 A 36 36 GLN CA C 36 55.800 55.005 0.795 1
1 437 . 14 1 1 A 36 36 GLN CB C 36 29.000 28.469 0.531 1
1 439 . 14 1 1 A 36 36 GLN N N 36 113.300 114.247 -0.947 1
1 441 . 14 1 1 A 37 37 GLY H H 37 7.550 7.377 0.173 1
1 442 . 14 1 1 A 37 37 GLY HA2 H 37 3.730 4.156 -0.426 1
1 443 . 14 1 1 A 37 37 GLY HA3 H 37 4.490 4.162 0.328 1
1 444 . 14 1 1 A 37 37 GLY C C 37 171.500 171.927 -0.427 1
1 445 . 14 1 1 A 37 37 GLY CA C 37 44.500 45.458 -0.958 1
1 446 . 14 1 1 A 37 37 GLY N N 37 108.400 107.676 0.724 1
1 447 . 14 1 1 A 38 38 GLU H H 38 8.120 8.807 -0.687 1
1 448 . 14 1 1 A 38 38 GLU HA H 38 4.820 5.380 -0.560 1
1 453 . 14 1 1 A 38 38 GLU C C 38 177.000 174.990 2.010 1
1 454 . 14 1 1 A 38 38 GLU CA C 38 56.400 54.720 1.680 1
1 455 . 14 1 1 A 38 38 GLU CB C 38 31.200 33.112 -1.912 1
1 457 . 14 1 1 A 38 38 GLU N N 38 119.600 121.284 -1.684 1
1 458 . 14 1 1 A 39 39 ARG H H 39 8.580 8.908 -0.328 1
1 459 . 14 1 1 A 39 39 ARG HA H 39 4.970 5.074 -0.104 1
1 467 . 14 1 1 A 39 39 ARG C C 39 174.800 175.448 -0.648 1
1 468 . 14 1 1 A 39 39 ARG CA C 39 53.900 54.065 -0.165 1
1 469 . 14 1 1 A 39 39 ARG CB C 39 36.400 34.343 2.057 1
1 472 . 14 1 1 A 39 39 ARG N N 39 121.500 122.576 -1.076 1
1 474 . 14 1 1 A 40 40 ALA H H 40 8.910 8.558 0.352 1
1 475 . 14 1 1 A 40 40 ALA HA H 40 4.920 4.518 0.402 1
1 479 . 14 1 1 A 40 40 ALA C C 40 179.200 178.337 0.863 1
1 480 . 14 1 1 A 40 40 ALA CA C 40 51.100 51.833 -0.733 1
1 481 . 14 1 1 A 40 40 ALA CB C 40 19.200 18.831 0.369 1
1 482 . 14 1 1 A 40 40 ALA N N 40 125.100 124.672 0.428 1
1 483 . 14 1 1 A 41 41 VAL H H 41 8.420 8.886 -0.466 1
1 484 . 14 1 1 A 41 41 VAL HA H 41 3.430 3.580 -0.150 1
1 492 . 14 1 1 A 41 41 VAL C C 41 176.800 177.155 -0.355 1
1 493 . 14 1 1 A 41 41 VAL CA C 41 67.600 66.676 0.924 1
1 494 . 14 1 1 A 41 41 VAL CB C 41 31.600 31.760 -0.160 1
1 497 . 14 1 1 A 41 41 VAL N N 41 120.900 121.168 -0.268 1
1 498 . 14 1 1 A 42 42 GLU H H 42 9.640 8.446 1.194 1
1 499 . 14 1 1 A 42 42 GLU HA H 42 3.880 3.976 -0.096 1
1 504 . 14 1 1 A 42 42 GLU C C 42 178.300 179.046 -0.746 1
1 505 . 14 1 1 A 42 42 GLU CA C 42 60.600 59.439 1.161 1
1 506 . 14 1 1 A 42 42 GLU CB C 42 28.300 29.423 -1.123 1
1 508 . 14 1 1 A 42 42 GLU N N 42 119.000 119.441 -0.441 1
1 509 . 14 1 1 A 43 43 ALA H H 43 6.870 7.505 -0.635 1
1 510 . 14 1 1 A 43 43 ALA HA H 43 4.290 4.025 0.265 1
1 514 . 14 1 1 A 43 43 ALA C C 43 180.700 179.907 0.793 1
1 515 . 14 1 1 A 43 43 ALA CA C 43 54.100 54.793 -0.693 1
1 516 . 14 1 1 A 43 43 ALA CB C 43 19.100 18.224 0.876 1
1 517 . 14 1 1 A 43 43 ALA N N 43 120.500 121.790 -1.290 1
1 518 . 14 1 1 A 44 44 ILE H H 44 7.970 8.176 -0.206 1
1 519 . 14 1 1 A 44 44 ILE HA H 44 3.470 3.623 -0.153 1
1 529 . 14 1 1 A 44 44 ILE C C 44 178.300 178.008 0.292 1
1 530 . 14 1 1 A 44 44 ILE CA C 44 64.700 65.437 -0.737 1
1 531 . 14 1 1 A 44 44 ILE CB C 44 38.100 37.718 0.382 1
1 535 . 14 1 1 A 44 44 ILE N N 44 120.500 119.591 0.909 1
1 536 . 14 1 1 A 45 45 ALA H H 45 8.460 8.411 0.049 1
1 537 . 14 1 1 A 45 45 ALA HA H 45 3.720 4.007 -0.287 1
1 541 . 14 1 1 A 45 45 ALA C C 45 178.500 179.948 -1.448 1
1 542 . 14 1 1 A 45 45 ALA CA C 45 56.200 55.306 0.894 1
1 543 . 14 1 1 A 45 45 ALA CB C 45 17.400 18.556 -1.156 1
1 544 . 14 1 1 A 45 45 ALA N N 45 124.500 122.591 1.909 1
1 545 . 14 1 1 A 46 46 THR H H 46 8.080 7.955 0.125 1
1 546 . 14 1 1 A 46 46 THR HA H 46 3.900 3.875 0.025 1
1 551 . 14 1 1 A 46 46 THR C C 46 177.200 176.374 0.826 1
1 552 . 14 1 1 A 46 46 THR CA C 46 66.400 66.587 -0.187 1
1 553 . 14 1 1 A 46 46 THR CB C 46 68.800 68.322 0.478 1
1 555 . 14 1 1 A 46 46 THR N N 46 112.400 112.985 -0.585 1
1 556 . 14 1 1 A 47 47 ALA H H 47 7.930 8.083 -0.153 1
1 557 . 14 1 1 A 47 47 ALA HA H 47 4.200 4.162 0.038 1
1 561 . 14 1 1 A 47 47 ALA C C 47 179.200 178.868 0.332 1
1 562 . 14 1 1 A 47 47 ALA CA C 47 54.800 55.137 -0.337 1
1 563 . 14 1 1 A 47 47 ALA CB C 47 19.800 18.267 1.533 1
1 564 . 14 1 1 A 47 47 ALA N N 47 121.400 123.788 -2.388 1
1 565 . 14 1 1 A 48 48 THR H H 48 7.560 7.504 0.056 1
1 566 . 14 1 1 A 48 48 THR HA H 48 4.390 4.474 -0.084 1
1 571 . 14 1 1 A 48 48 THR C C 48 175.700 175.536 0.164 1
1 572 . 14 1 1 A 48 48 THR CA C 48 61.800 62.203 -0.403 1
1 573 . 14 1 1 A 48 48 THR CB C 48 71.000 70.384 0.616 1
1 575 . 14 1 1 A 48 48 THR N N 48 103.500 106.649 -3.149 1
1 576 . 14 1 1 A 49 49 GLY H H 49 7.820 8.223 -0.403 1
1 577 . 14 1 1 A 49 49 GLY HA2 H 49 3.870 3.927 -0.057 1
1 578 . 14 1 1 A 49 49 GLY HA3 H 49 4.100 3.929 0.171 1
1 579 . 14 1 1 A 49 49 GLY C C 49 174.400 173.942 0.458 1
1 580 . 14 1 1 A 49 49 GLY CA C 49 46.300 46.313 -0.013 1
1 581 . 14 1 1 A 49 49 GLY N N 49 111.100 112.378 -1.278 1
1 582 . 14 1 1 A 50 50 MET H H 50 7.930 8.200 -0.270 1
1 583 . 14 1 1 A 50 50 MET HA H 50 4.540 4.902 -0.362 1
1 591 . 14 1 1 A 50 50 MET C C 50 174.800 175.141 -0.341 1
1 592 . 14 1 1 A 50 50 MET CA C 50 55.100 54.250 0.850 1
1 593 . 14 1 1 A 50 50 MET CB C 50 37.200 36.564 0.636 1
1 596 . 14 1 1 A 50 50 MET N N 50 119.300 118.808 0.492 1
1 597 . 14 1 1 A 51 51 ASN H H 51 8.040 8.783 -0.743 1
1 598 . 14 1 1 A 51 51 ASN HA H 51 4.580 4.923 -0.343 1
1 601 . 14 1 1 A 51 51 ASN C C 51 176.100 177.003 -0.903 1
1 602 . 14 1 1 A 51 51 ASN CA C 51 52.800 52.297 0.503 1
1 603 . 14 1 1 A 51 51 ASN CB C 51 41.100 39.473 1.627 1
1 604 . 14 1 1 A 51 51 ASN N N 51 118.000 118.551 -0.551 1
1 605 . 14 1 1 A 52 52 LEU H H 52 8.560 8.839 -0.279 1
1 606 . 14 1 1 A 52 52 LEU HA H 52 3.760 3.941 -0.181 1
1 616 . 14 1 1 A 52 52 LEU C C 52 179.600 178.700 0.900 1
1 617 . 14 1 1 A 52 52 LEU CA C 52 59.000 57.788 1.212 1
1 618 . 14 1 1 A 52 52 LEU CB C 52 41.800 41.364 0.436 1
1 622 . 14 1 1 A 52 52 LEU N N 52 120.600 123.799 -3.199 1
1 623 . 14 1 1 A 53 53 THR H H 53 8.230 8.169 0.061 1
1 624 . 14 1 1 A 53 53 THR HA H 53 3.880 4.029 -0.149 1
1 629 . 14 1 1 A 53 53 THR C C 53 176.900 177.091 -0.191 1
1 630 . 14 1 1 A 53 53 THR CA C 53 66.500 65.532 0.968 1
1 631 . 14 1 1 A 53 53 THR CB C 53 68.400 67.853 0.547 1
1 633 . 14 1 1 A 53 53 THR N N 53 115.800 111.027 4.773 1
1 634 . 14 1 1 A 54 54 THR H H 54 8.420 8.057 0.363 1
1 635 . 14 1 1 A 54 54 THR HA H 54 3.880 3.808 0.072 1
1 640 . 14 1 1 A 54 54 THR C C 54 177.300 176.316 0.984 1
1 641 . 14 1 1 A 54 54 THR CA C 54 66.600 67.212 -0.612 1
1 642 . 14 1 1 A 54 54 THR CB C 54 66.600 68.311 -1.711 1
1 644 . 14 1 1 A 54 54 THR N N 54 122.300 117.355 4.945 1
1 645 . 14 1 1 A 55 55 ALA H H 55 8.860 8.515 0.345 1
1 646 . 14 1 1 A 55 55 ALA HA H 55 4.020 4.008 0.012 1
1 650 . 14 1 1 A 55 55 ALA C C 55 179.000 179.087 -0.087 1
1 651 . 14 1 1 A 55 55 ALA CA C 55 56.100 55.307 0.793 1
1 652 . 14 1 1 A 55 55 ALA CB C 55 17.000 18.136 -1.136 1
1 653 . 14 1 1 A 55 55 ALA N N 55 125.600 123.649 1.951 1
1 654 . 14 1 1 A 56 56 SER H H 56 8.440 8.343 0.097 1
1 655 . 14 1 1 A 56 56 SER HA H 56 3.920 3.919 0.001 1
1 658 . 14 1 1 A 56 56 SER C C 56 176.400 177.089 -0.689 1
1 659 . 14 1 1 A 56 56 SER CA C 56 62.600 61.350 1.250 1
1 660 . 14 1 1 A 56 56 SER CB C 56 62.700 62.943 -0.243 1
1 661 . 14 1 1 A 56 56 SER N N 56 112.700 112.717 -0.017 1
1 662 . 14 1 1 A 57 57 ALA H H 57 8.090 7.976 0.114 1
1 663 . 14 1 1 A 57 57 ALA HA H 57 4.130 3.954 0.176 1
1 667 . 14 1 1 A 57 57 ALA C C 57 181.200 179.783 1.417 1
1 668 . 14 1 1 A 57 57 ALA CA C 57 55.200 55.352 -0.152 1
1 669 . 14 1 1 A 57 57 ALA CB C 57 17.900 17.799 0.101 1
1 670 . 14 1 1 A 57 57 ALA N N 57 124.000 122.920 1.080 1
1 671 . 14 1 1 A 58 58 ASN H H 58 7.970 7.782 0.188 1
1 672 . 14 1 1 A 58 58 ASN HA H 58 4.480 4.527 -0.047 1
1 677 . 14 1 1 A 58 58 ASN C C 58 177.500 178.379 -0.879 1
1 678 . 14 1 1 A 58 58 ASN CA C 58 56.900 56.353 0.547 1
1 679 . 14 1 1 A 58 58 ASN CB C 58 39.800 38.560 1.240 1
1 680 . 14 1 1 A 58 58 ASN N N 58 117.600 117.069 0.531 1
1 682 . 14 1 1 A 59 59 LEU H H 59 8.530 8.546 -0.016 1
1 683 . 14 1 1 A 59 59 LEU HA H 59 3.710 3.806 -0.096 1
1 693 . 14 1 1 A 59 59 LEU C C 59 178.400 179.002 -0.602 1
1 694 . 14 1 1 A 59 59 LEU CA C 59 58.600 57.508 1.092 1
1 695 . 14 1 1 A 59 59 LEU CB C 59 40.500 40.417 0.083 1
1 699 . 14 1 1 A 59 59 LEU N N 59 122.600 121.258 1.342 1
1 700 . 14 1 1 A 60 60 GLN H H 60 8.200 8.225 -0.025 1
1 701 . 14 1 1 A 60 60 GLN HA H 60 4.020 3.979 0.041 1
1 708 . 14 1 1 A 60 60 GLN C C 60 178.700 177.683 1.017 1
1 709 . 14 1 1 A 60 60 GLN CA C 60 58.800 59.218 -0.418 1
1 710 . 14 1 1 A 60 60 GLN CB C 60 27.700 28.891 -1.191 1
1 712 . 14 1 1 A 60 60 GLN N N 60 118.900 120.117 -1.217 1
1 714 . 14 1 1 A 61 61 ALA H H 61 7.580 7.685 -0.105 1
1 715 . 14 1 1 A 61 61 ALA HA H 61 4.230 4.097 0.133 1
1 719 . 14 1 1 A 61 61 ALA C C 61 181.300 179.971 1.329 1
1 720 . 14 1 1 A 61 61 ALA CA C 61 55.100 54.961 0.139 1
1 721 . 14 1 1 A 61 61 ALA CB C 61 17.600 18.267 -0.667 1
1 722 . 14 1 1 A 61 61 ALA N N 61 122.200 122.155 0.045 1
1 723 . 14 1 1 A 62 62 LEU H H 62 7.830 8.421 -0.591 1
1 724 . 14 1 1 A 62 62 LEU HA H 62 3.980 4.117 -0.137 1
1 734 . 14 1 1 A 62 62 LEU C C 62 178.500 179.083 -0.583 1
1 735 . 14 1 1 A 62 62 LEU CA C 62 58.100 55.999 2.101 1
1 736 . 14 1 1 A 62 62 LEU CB C 62 43.300 41.465 1.835 1
1 739 . 14 1 1 A 62 62 LEU N N 62 119.000 119.078 -0.078 1
1 740 . 14 1 1 A 63 63 LYS H H 63 8.580 7.871 0.709 1
1 741 . 14 1 1 A 63 63 LYS HA H 63 4.130 4.123 0.007 1
1 750 . 14 1 1 A 63 63 LYS C C 63 180.500 179.018 1.482 1
1 751 . 14 1 1 A 63 63 LYS CA C 63 59.700 59.241 0.459 1
1 752 . 14 1 1 A 63 63 LYS CB C 63 32.600 32.557 0.043 1
1 756 . 14 1 1 A 63 63 LYS N N 63 123.400 120.905 2.495 1
1 757 . 14 1 1 A 64 64 SER H H 64 8.640 8.310 0.330 1
1 758 . 14 1 1 A 64 64 SER HA H 64 4.300 4.233 0.067 1
1 761 . 14 1 1 A 64 64 SER C C 64 175.000 175.669 -0.669 1
1 762 . 14 1 1 A 64 64 SER CA C 64 61.400 62.468 -1.068 1
1 763 . 14 1 1 A 64 64 SER CB C 64 63.000 62.575 0.425 1
1 764 . 14 1 1 A 64 64 SER N N 64 117.700 114.593 3.107 1
1 765 . 14 1 1 A 65 65 GLY H H 65 7.280 8.000 -0.720 1
1 766 . 14 1 1 A 65 65 GLY HA2 H 65 3.240 4.137 -0.897 1
1 767 . 14 1 1 A 65 65 GLY HA3 H 65 3.980 4.139 -0.159 1
1 768 . 14 1 1 A 65 65 GLY C C 65 171.300 174.964 -3.664 1
1 769 . 14 1 1 A 65 65 GLY CA C 65 45.100 45.580 -0.480 1
1 770 . 14 1 1 A 65 65 GLY N N 65 104.400 107.295 -2.895 1
1 771 . 14 1 1 A 66 66 GLY H H 66 7.730 7.649 0.081 1
1 772 . 14 1 1 A 66 66 GLY HA2 H 66 3.650 4.005 -0.355 1
1 773 . 14 1 1 A 66 66 GLY HA3 H 66 3.750 4.010 -0.260 1
1 774 . 14 1 1 A 66 66 GLY C C 66 173.700 174.147 -0.447 1
1 775 . 14 1 1 A 66 66 GLY CA C 66 45.400 45.325 0.075 1
1 776 . 14 1 1 A 66 66 GLY N N 66 104.700 107.872 -3.172 1
1 777 . 14 1 1 A 67 67 LEU H H 67 7.520 7.551 -0.031 1
1 778 . 14 1 1 A 67 67 LEU HA H 67 4.310 3.838 0.472 1
1 788 . 14 1 1 A 67 67 LEU C C 67 177.700 175.026 2.674 1
1 789 . 14 1 1 A 67 67 LEU CA C 67 55.500 56.368 -0.868 1
1 790 . 14 1 1 A 67 67 LEU CB C 67 42.400 39.672 2.728 1
1 794 . 14 1 1 A 67 67 LEU N N 67 110.600 117.093 -6.493 1
1 795 . 14 1 1 A 68 68 VAL H H 68 6.890 7.425 -0.535 1
1 796 . 14 1 1 A 68 68 VAL HA H 68 5.190 4.915 0.275 1
1 804 . 14 1 1 A 68 68 VAL C C 68 173.700 174.835 -1.135 1
1 805 . 14 1 1 A 68 68 VAL CA C 68 57.400 58.837 -1.437 1
1 806 . 14 1 1 A 68 68 VAL CB C 68 36.400 35.331 1.069 1
1 809 . 14 1 1 A 68 68 VAL N N 68 106.400 113.392 -6.992 1
1 810 . 14 1 1 A 69 69 GLU H H 69 8.880 9.068 -0.188 1
1 811 . 14 1 1 A 69 69 GLU HA H 69 4.660 4.914 -0.254 1
1 816 . 14 1 1 A 69 69 GLU C C 69 173.300 174.913 -1.613 1
1 817 . 14 1 1 A 69 69 GLU CA C 69 54.300 54.655 -0.355 1
1 818 . 14 1 1 A 69 69 GLU CB C 69 34.100 32.467 1.633 1
1 820 . 14 1 1 A 69 69 GLU N N 69 120.400 121.959 -1.559 1
1 821 . 14 1 1 A 70 70 ALA H H 70 8.730 8.535 0.195 1
1 822 . 14 1 1 A 70 70 ALA HA H 70 4.990 5.224 -0.234 1
1 826 . 14 1 1 A 70 70 ALA C C 70 176.500 175.067 1.433 1
1 827 . 14 1 1 A 70 70 ALA CA C 70 50.000 50.374 -0.374 1
1 828 . 14 1 1 A 70 70 ALA CB C 70 22.300 22.308 -0.008 1
1 829 . 14 1 1 A 70 70 ALA N N 70 122.800 121.169 1.631 1
1 830 . 14 1 1 A 71 71 ARG H H 71 8.670 9.245 -0.575 1
1 831 . 14 1 1 A 71 71 ARG HA H 71 4.630 5.121 -0.491 1
1 843 . 14 1 1 A 71 71 ARG C C 71 173.500 174.460 -0.960 1
1 844 . 14 1 1 A 71 71 ARG CA C 71 54.600 54.274 0.326 1
1 845 . 14 1 1 A 71 71 ARG CB C 71 33.600 33.933 -0.333 1
1 849 . 14 1 1 A 71 71 ARG N N 71 120.100 122.585 -2.485 1
1 851 . 14 1 1 A 72 72 ARG H H 72 8.780 8.590 0.190 1
1 852 . 14 1 1 A 72 72 ARG HA H 72 5.100 4.678 0.422 1
1 859 . 14 1 1 A 72 72 ARG C C 72 176.000 175.272 0.728 1
1 860 . 14 1 1 A 72 72 ARG CA C 72 54.900 55.980 -1.080 1
1 861 . 14 1 1 A 72 72 ARG CB C 72 32.500 30.971 1.529 1
1 864 . 14 1 1 A 72 72 ARG N N 72 123.600 127.450 -3.850 1
1 865 . 14 1 1 A 73 73 GLU H H 73 8.720 8.742 -0.022 1
1 866 . 14 1 1 A 73 73 GLU HA H 73 4.510 4.649 -0.139 1
1 871 . 14 1 1 A 73 73 GLU C C 73 175.900 176.657 -0.757 1
1 872 . 14 1 1 A 73 73 GLU CA C 73 55.700 55.018 0.682 1
1 873 . 14 1 1 A 73 73 GLU CB C 73 31.800 30.873 0.927 1
1 875 . 14 1 1 A 73 73 GLU N N 73 126.800 127.016 -0.216 1
1 876 . 14 1 1 A 74 74 GLY H H 74 9.190 8.926 0.264 1
1 877 . 14 1 1 A 74 74 GLY HA2 H 74 3.700 3.856 -0.156 1
1 878 . 14 1 1 A 74 74 GLY HA3 H 74 4.170 3.866 0.304 1
1 879 . 14 1 1 A 74 74 GLY C C 74 175.400 174.786 0.614 1
1 880 . 14 1 1 A 74 74 GLY CA C 74 47.100 47.326 -0.226 1
1 881 . 14 1 1 A 74 74 GLY N N 74 118.500 116.020 2.480 1
1 882 . 14 1 1 A 75 75 THR H H 75 8.780 8.721 0.059 1
1 883 . 14 1 1 A 75 75 THR HA H 75 4.290 4.370 -0.080 1
1 888 . 14 1 1 A 75 75 THR C C 75 174.600 174.358 0.242 1
1 889 . 14 1 1 A 75 75 THR CA C 75 62.000 63.391 -1.391 1
1 890 . 14 1 1 A 75 75 THR CB C 75 69.000 69.829 -0.829 1
1 892 . 14 1 1 A 75 75 THR N N 75 118.000 119.616 -1.616 1
1 893 . 14 1 1 A 76 76 ARG H H 76 8.030 8.072 -0.042 1
1 894 . 14 1 1 A 76 76 ARG HA H 76 4.610 4.700 -0.090 1
1 901 . 14 1 1 A 76 76 ARG C C 76 174.800 174.471 0.329 1
1 902 . 14 1 1 A 76 76 ARG CA C 76 55.500 54.346 1.154 1
1 903 . 14 1 1 A 76 76 ARG CB C 76 32.700 32.823 -0.123 1
1 906 . 14 1 1 A 76 76 ARG N N 76 122.600 120.417 2.183 1
1 907 . 14 1 1 A 77 77 GLN H H 77 8.580 8.609 -0.029 1
1 908 . 14 1 1 A 77 77 GLN HA H 77 4.910 5.079 -0.169 1
1 915 . 14 1 1 A 77 77 GLN C C 77 173.900 174.175 -0.275 1
1 916 . 14 1 1 A 77 77 GLN CA C 77 54.700 54.428 0.272 1
1 917 . 14 1 1 A 77 77 GLN CB C 77 31.800 31.993 -0.193 1
1 919 . 14 1 1 A 77 77 GLN N N 77 121.900 122.338 -0.438 1
1 921 . 14 1 1 A 78 78 TYR H H 78 8.890 9.302 -0.412 1
1 922 . 14 1 1 A 78 78 TYR HA H 78 4.750 5.207 -0.457 1
1 929 . 14 1 1 A 78 78 TYR C C 78 175.600 174.701 0.899 1
1 930 . 14 1 1 A 78 78 TYR CA C 78 57.000 56.265 0.735 1
1 931 . 14 1 1 A 78 78 TYR CB C 78 41.400 40.090 1.310 1
1 936 . 14 1 1 A 78 78 TYR N N 78 121.800 126.974 -5.174 1
1 937 . 14 1 1 A 79 79 TYR H H 79 9.010 9.791 -0.781 1
1 938 . 14 1 1 A 79 79 TYR HA H 79 5.410 5.672 -0.262 1
1 945 . 14 1 1 A 79 79 TYR C C 79 173.100 175.199 -2.099 1
1 946 . 14 1 1 A 79 79 TYR CA C 79 57.300 57.077 0.223 1
1 947 . 14 1 1 A 79 79 TYR CB C 79 43.300 41.793 1.507 1
1 952 . 14 1 1 A 79 79 TYR N N 79 122.500 122.432 0.068 1
1 953 . 14 1 1 A 80 80 ARG H H 80 8.720 8.924 -0.204 1
1 954 . 14 1 1 A 80 80 ARG HA H 80 5.120 5.006 0.114 1
1 962 . 14 1 1 A 80 80 ARG C C 80 175.500 175.056 0.444 1
1 963 . 14 1 1 A 80 80 ARG CA C 80 53.200 54.680 -1.480 1
1 964 . 14 1 1 A 80 80 ARG CB C 80 33.900 33.654 0.246 1
1 967 . 14 1 1 A 80 80 ARG N N 80 114.500 119.483 -4.983 1
1 969 . 14 1 1 A 81 81 ILE H H 81 9.300 8.731 0.569 1
1 970 . 14 1 1 A 81 81 ILE HA H 81 4.150 4.177 -0.027 1
1 980 . 14 1 1 A 81 81 ILE C C 81 177.800 176.766 1.034 1
1 981 . 14 1 1 A 81 81 ILE CA C 81 62.300 61.986 0.314 1
1 982 . 14 1 1 A 81 81 ILE CB C 81 37.800 37.668 0.132 1
1 986 . 14 1 1 A 81 81 ILE N N 81 122.100 121.432 0.668 1
1 987 . 14 1 1 A 82 82 ALA H H 82 7.930 8.532 -0.602 1
1 988 . 14 1 1 A 82 82 ALA HA H 82 3.930 4.352 -0.422 1
1 992 . 14 1 1 A 82 82 ALA C C 82 176.300 176.935 -0.635 1
1 993 . 14 1 1 A 82 82 ALA CA C 82 54.200 55.350 -1.150 1
1 994 . 14 1 1 A 82 82 ALA CB C 82 18.500 19.050 -0.550 1
1 995 . 14 1 1 A 82 82 ALA N N 82 127.200 128.409 -1.209 1
1 996 . 14 1 1 A 83 83 GLY H H 83 6.980 7.969 -0.989 1
1 997 . 14 1 1 A 83 83 GLY HA2 H 83 4.090 4.244 -0.154 1
1 998 . 14 1 1 A 83 83 GLY HA3 H 83 4.440 4.247 0.193 1
1 999 . 14 1 1 A 83 83 GLY C C 83 173.600 174.915 -1.315 1
1 1000 . 14 1 1 A 83 83 GLY CA C 83 45.200 43.661 1.539 1
1 1001 . 14 1 1 A 83 83 GLY N N 83 101.800 104.245 -2.445 1
1 1002 . 14 1 1 A 84 84 GLU H H 84 8.930 8.921 0.009 1
1 1003 . 14 1 1 A 84 84 GLU HA H 84 4.120 4.020 0.100 1
1 1008 . 14 1 1 A 84 84 GLU C C 84 178.300 177.805 0.495 1
1 1009 . 14 1 1 A 84 84 GLU CA C 84 58.900 59.115 -0.215 1
1 1010 . 14 1 1 A 84 84 GLU CB C 84 29.400 29.349 0.051 1
1 1012 . 14 1 1 A 84 84 GLU N N 84 120.300 120.311 -0.011 1
1 1013 . 14 1 1 A 85 85 ASP H H 85 8.950 8.008 0.942 1
1 1014 . 14 1 1 A 85 85 ASP HA H 85 4.310 4.440 -0.130 1
1 1017 . 14 1 1 A 85 85 ASP C C 85 178.000 178.888 -0.888 1
1 1018 . 14 1 1 A 85 85 ASP CA C 85 57.100 57.023 0.077 1
1 1019 . 14 1 1 A 85 85 ASP CB C 85 38.900 40.386 -1.486 1
1 1020 . 14 1 1 A 85 85 ASP N N 85 119.400 119.055 0.345 1
1 1021 . 14 1 1 A 86 86 VAL H H 86 7.620 8.074 -0.454 1
1 1022 . 14 1 1 A 86 86 VAL HA H 86 3.480 3.585 -0.105 1
1 1030 . 14 1 1 A 86 86 VAL C C 86 177.400 178.027 -0.627 1
1 1031 . 14 1 1 A 86 86 VAL CA C 86 66.800 66.504 0.296 1
1 1032 . 14 1 1 A 86 86 VAL CB C 86 31.300 31.619 -0.319 1
1 1035 . 14 1 1 A 86 86 VAL N N 86 121.600 120.803 0.797 1
1 1036 . 14 1 1 A 87 87 ALA H H 87 7.520 7.959 -0.439 1
1 1037 . 14 1 1 A 87 87 ALA HA H 87 4.110 3.961 0.149 1
1 1041 . 14 1 1 A 87 87 ALA C C 87 181.200 179.764 1.436 1
1 1042 . 14 1 1 A 87 87 ALA CA C 87 55.800 55.518 0.282 1
1 1043 . 14 1 1 A 87 87 ALA CB C 87 17.600 18.196 -0.596 1
1 1044 . 14 1 1 A 87 87 ALA N N 87 122.700 122.009 0.691 1
1 1045 . 14 1 1 A 88 88 ARG H H 88 8.380 8.117 0.263 1
1 1046 . 14 1 1 A 88 88 ARG HA H 88 4.090 4.028 0.062 1
1 1054 . 14 1 1 A 88 88 ARG C C 88 179.100 178.932 0.168 1
1 1055 . 14 1 1 A 88 88 ARG CA C 88 59.600 59.033 0.567 1
1 1056 . 14 1 1 A 88 88 ARG CB C 88 30.500 29.840 0.660 1
1 1059 . 14 1 1 A 88 88 ARG N N 88 119.200 118.019 1.181 1
1 1061 . 14 1 1 A 89 89 LEU H H 89 8.480 7.731 0.749 1
1 1062 . 14 1 1 A 89 89 LEU HA H 89 4.040 4.063 -0.023 1
1 1071 . 14 1 1 A 89 89 LEU C C 89 177.200 178.593 -1.393 1
1 1072 . 14 1 1 A 89 89 LEU CA C 89 58.300 58.017 0.283 1
1 1073 . 14 1 1 A 89 89 LEU CB C 89 41.300 41.970 -0.670 1
1 1076 . 14 1 1 A 89 89 LEU N N 89 123.300 121.717 1.583 1
1 1077 . 14 1 1 A 90 90 PHE H H 90 8.890 8.296 0.594 1
1 1078 . 14 1 1 A 90 90 PHE HA H 90 4.380 4.065 0.315 1
1 1086 . 14 1 1 A 90 90 PHE C C 90 177.500 178.243 -0.743 1
1 1087 . 14 1 1 A 90 90 PHE CA C 90 59.400 61.764 -2.364 1
1 1088 . 14 1 1 A 90 90 PHE CB C 90 38.600 39.184 -0.584 1
1 1094 . 14 1 1 A 90 90 PHE N N 90 119.400 119.542 -0.142 1
1 1095 . 14 1 1 A 91 91 ALA H H 91 7.920 8.288 -0.368 1
1 1096 . 14 1 1 A 91 91 ALA HA H 91 3.940 4.066 -0.126 1
1 1100 . 14 1 1 A 91 91 ALA C C 91 180.200 179.687 0.513 1
1 1101 . 14 1 1 A 91 91 ALA CA C 91 55.100 55.126 -0.026 1
1 1102 . 14 1 1 A 91 91 ALA CB C 91 18.000 18.422 -0.422 1
1 1103 . 14 1 1 A 91 91 ALA N N 91 120.500 121.387 -0.887 1
1 1104 . 14 1 1 A 92 92 LEU H H 92 8.190 8.258 -0.068 1
1 1105 . 14 1 1 A 92 92 LEU HA H 92 4.300 4.047 0.253 1
1 1115 . 14 1 1 A 92 92 LEU C C 92 178.900 178.216 0.684 1
1 1116 . 14 1 1 A 92 92 LEU CA C 92 57.500 57.877 -0.377 1
1 1117 . 14 1 1 A 92 92 LEU CB C 92 42.100 41.674 0.426 1
1 1121 . 14 1 1 A 92 92 LEU N N 92 120.200 120.464 -0.264 1
1 1122 . 14 1 1 A 93 93 VAL H H 93 8.890 7.810 1.080 1
1 1123 . 14 1 1 A 93 93 VAL HA H 93 3.810 3.792 0.018 1
1 1131 . 14 1 1 A 93 93 VAL C C 93 176.900 177.643 -0.743 1
1 1132 . 14 1 1 A 93 93 VAL CA C 93 66.000 65.416 0.584 1
1 1133 . 14 1 1 A 93 93 VAL CB C 93 31.200 31.115 0.085 1
1 1136 . 14 1 1 A 93 93 VAL N N 93 117.100 115.622 1.478 1
1 1137 . 14 1 1 A 94 94 GLN H H 94 6.920 7.500 -0.580 1
1 1138 . 14 1 1 A 94 94 GLN HA H 94 3.790 3.801 -0.011 1
1 1145 . 14 1 1 A 94 94 GLN C C 94 177.400 178.313 -0.913 1
1 1146 . 14 1 1 A 94 94 GLN CA C 94 60.000 58.837 1.163 1
1 1147 . 14 1 1 A 94 94 GLN CB C 94 30.300 27.982 2.318 1
1 1149 . 14 1 1 A 94 94 GLN N N 94 117.800 121.024 -3.224 1
1 1151 . 14 1 1 A 95 95 VAL H H 95 7.420 7.731 -0.311 1
1 1152 . 14 1 1 A 95 95 VAL HA H 95 3.760 3.597 0.163 1
1 1160 . 14 1 1 A 95 95 VAL C C 95 178.300 178.301 -0.001 1
1 1161 . 14 1 1 A 95 95 VAL CA C 95 66.600 66.467 0.133 1
1 1162 . 14 1 1 A 95 95 VAL CB C 95 31.900 31.512 0.388 1
1 1165 . 14 1 1 A 95 95 VAL N N 95 121.500 119.872 1.628 1
1 1166 . 14 1 1 A 96 96 VAL H H 96 8.340 8.206 0.134 1
1 1167 . 14 1 1 A 96 96 VAL HA H 96 3.810 3.703 0.107 1
1 1175 . 14 1 1 A 96 96 VAL C C 96 178.400 177.931 0.469 1
1 1176 . 14 1 1 A 96 96 VAL CA C 96 66.100 66.696 -0.596 1
1 1177 . 14 1 1 A 96 96 VAL CB C 96 32.200 31.582 0.618 1
1 1180 . 14 1 1 A 96 96 VAL N N 96 120.000 120.312 -0.312 1
1 1181 . 14 1 1 A 97 97 ALA H H 97 8.140 8.246 -0.106 1
1 1182 . 14 1 1 A 97 97 ALA HA H 97 4.010 3.950 0.060 1
1 1186 . 14 1 1 A 97 97 ALA C C 97 178.800 179.493 -0.693 1
1 1187 . 14 1 1 A 97 97 ALA CA C 97 54.900 55.698 -0.798 1
1 1188 . 14 1 1 A 97 97 ALA CB C 97 19.900 18.082 1.818 1
1 1189 . 14 1 1 A 97 97 ALA N N 97 121.400 121.663 -0.263 1
1 1190 . 14 1 1 A 98 98 ASP H H 98 8.170 8.649 -0.479 1
1 1191 . 14 1 1 A 98 98 ASP HA H 98 4.320 4.307 0.013 1
1 1194 . 14 1 1 A 98 98 ASP C C 98 178.100 178.116 -0.016 1
1 1195 . 14 1 1 A 98 98 ASP CA C 98 57.100 57.512 -0.412 1
1 1196 . 14 1 1 A 98 98 ASP CB C 98 41.800 40.464 1.336 1
1 1197 . 14 1 1 A 98 98 ASP N N 98 118.500 118.178 0.322 1
1 1198 . 14 1 1 A 99 99 GLU H H 99 8.220 8.070 0.150 1
1 1199 . 14 1 1 A 99 99 GLU HA H 99 4.000 4.114 -0.114 1
1 1204 . 14 1 1 A 99 99 GLU C C 99 178.300 178.639 -0.339 1
1 1205 . 14 1 1 A 99 99 GLU CA C 99 58.300 58.834 -0.534 1
1 1206 . 14 1 1 A 99 99 GLU CB C 99 29.800 29.671 0.129 1
1 1208 . 14 1 1 A 99 99 GLU N N 99 116.600 119.588 -2.988 1
1 1209 . 14 1 1 A 100 100 HIS H H 100 7.980 7.788 0.192 1
1 1210 . 14 1 1 A 100 100 HIS HA H 100 4.600 4.551 0.049 1
1 1214 . 14 1 1 A 100 100 HIS C C 100 175.900 176.153 -0.253 1
1 1215 . 14 1 1 A 100 100 HIS CA C 100 57.500 57.921 -0.421 1
1 1216 . 14 1 1 A 100 100 HIS CB C 100 30.800 29.051 1.749 1
1 1218 . 14 1 1 A 100 100 HIS N N 100 114.000 117.462 -3.462 1
1 1219 . 14 1 1 A 101 101 LEU H H 101 7.920 7.804 0.116 1
1 1220 . 14 1 1 A 101 101 LEU HA H 101 4.370 4.358 0.012 1
1 1230 . 14 1 1 A 101 101 LEU C C 101 177.700 176.397 1.303 1
1 1231 . 14 1 1 A 101 101 LEU CA C 101 55.900 55.159 0.741 1
1 1232 . 14 1 1 A 101 101 LEU CB C 101 42.100 42.852 -0.752 1
1 1236 . 14 1 1 A 101 101 LEU N N 101 118.500 119.259 -0.759 1
1 1237 . 14 1 1 A 102 102 GLU H H 102 8.100 8.035 0.065 1
1 1238 . 14 1 1 A 102 102 GLU HA H 102 4.160 4.321 -0.161 1
1 1243 . 14 1 1 A 102 102 GLU C C 102 176.700 175.947 0.753 1
1 1244 . 14 1 1 A 102 102 GLU CA C 102 57.000 57.510 -0.510 1
1 1245 . 14 1 1 A 102 102 GLU CB C 102 29.900 28.616 1.284 1
1 1247 . 14 1 1 A 102 102 GLU N N 102 119.100 117.374 1.726 1
1 1248 . 14 1 1 A 103 103 HIS H H 103 8.010 8.432 -0.422 1
1 1249 . 14 1 1 A 103 103 HIS HA H 103 4.520 4.649 -0.129 1
1 1252 . 14 1 1 A 103 103 HIS CA C 103 56.100 56.905 -0.805 1
1 1253 . 14 1 1 A 103 103 HIS CB C 103 29.700 31.322 -1.622 1
1 1254 . 14 1 1 A 103 103 HIS N N 103 117.300 124.897 -7.597 1
1 1255 . 14 1 1 A 107 107 HIS HA H 107 4.560 4.481 0.079 1
1 1258 . 14 1 1 A 107 107 HIS C C 107 173.900 174.346 -0.446 1
1 1259 . 14 1 1 A 107 107 HIS CA C 107 55.900 57.775 -1.875 1
1 1260 . 14 1 1 A 107 107 HIS CB C 107 30.200 28.331 1.869 1
1 4 . 15 1 1 A 2 2 ALA H H 2 8.450 8.568 -0.118 1
1 5 . 15 1 1 A 2 2 ALA HA H 2 4.390 3.945 0.445 1
1 9 . 15 1 1 A 2 2 ALA C C 2 178.300 176.437 1.863 1
1 10 . 15 1 1 A 2 2 ALA CA C 2 52.500 53.404 -0.904 1
1 11 . 15 1 1 A 2 2 ALA CB C 2 19.200 17.827 1.373 1
1 12 . 15 1 1 A 2 2 ALA N N 2 125.100 122.209 2.891 1
1 13 . 15 1 1 A 3 3 GLY H H 3 8.450 7.636 0.814 1
1 14 . 15 1 1 A 3 3 GLY HA2 H 3 4.030 4.048 -0.018 1
1 15 . 15 1 1 A 3 3 GLY HA3 H 3 4.030 4.048 -0.018 1
1 16 . 15 1 1 A 3 3 GLY C C 3 174.100 171.513 2.587 1
1 17 . 15 1 1 A 3 3 GLY CA C 3 45.200 46.382 -1.182 1
1 18 . 15 1 1 A 3 3 GLY N N 3 108.000 104.947 3.053 1
1 19 . 15 1 1 A 4 4 GLN H H 4 8.550 8.588 -0.038 1
1 20 . 15 1 1 A 4 4 GLN HA H 4 4.340 4.966 -0.626 1
1 27 . 15 1 1 A 4 4 GLN C C 4 176.700 174.535 2.165 1
1 28 . 15 1 1 A 4 4 GLN CA C 4 56.600 54.035 2.565 1
1 29 . 15 1 1 A 4 4 GLN CB C 4 29.300 31.992 -2.692 1
1 31 . 15 1 1 A 4 4 GLN N N 4 120.500 116.703 3.797 1
1 33 . 15 1 1 A 5 5 SER H H 5 8.540 8.648 -0.108 1
1 34 . 15 1 1 A 5 5 SER HA H 5 4.390 4.113 0.277 1
1 38 . 15 1 1 A 5 5 SER C C 5 174.800 174.148 0.652 1
1 39 . 15 1 1 A 5 5 SER CA C 5 59.100 58.919 0.181 1
1 40 . 15 1 1 A 5 5 SER CB C 5 63.500 61.858 1.642 1
1 41 . 15 1 1 A 5 5 SER N N 5 117.100 114.235 2.865 1
1 42 . 15 1 1 A 6 6 ASP H H 6 8.300 8.375 -0.075 1
1 43 . 15 1 1 A 6 6 ASP HA H 6 4.540 4.782 -0.242 1
1 46 . 15 1 1 A 6 6 ASP C C 6 177.300 176.869 0.431 1
1 47 . 15 1 1 A 6 6 ASP CA C 6 55.100 54.528 0.572 1
1 48 . 15 1 1 A 6 6 ASP CB C 6 40.800 40.962 -0.162 1
1 49 . 15 1 1 A 6 6 ASP N N 6 122.700 123.884 -1.184 1
1 50 . 15 1 1 A 7 7 ARG H H 7 8.270 8.522 -0.252 1
1 51 . 15 1 1 A 7 7 ARG HA H 7 4.150 4.139 0.011 1
1 58 . 15 1 1 A 7 7 ARG C C 7 177.600 178.628 -1.028 1
1 59 . 15 1 1 A 7 7 ARG CA C 7 58.000 57.932 0.068 1
1 60 . 15 1 1 A 7 7 ARG CB C 7 30.100 29.076 1.024 1
1 63 . 15 1 1 A 7 7 ARG N N 7 122.100 119.535 2.565 1
1 64 . 15 1 1 A 8 8 LYS H H 8 8.130 8.135 -0.005 1
1 65 . 15 1 1 A 8 8 LYS HA H 8 4.090 4.071 0.019 1
1 74 . 15 1 1 A 8 8 LYS C C 8 177.600 178.836 -1.236 1
1 75 . 15 1 1 A 8 8 LYS CA C 8 58.400 59.407 -1.007 1
1 76 . 15 1 1 A 8 8 LYS CB C 8 31.700 32.389 -0.689 1
1 80 . 15 1 1 A 8 8 LYS N N 8 120.900 120.153 0.747 1
1 81 . 15 1 1 A 9 9 ALA H H 9 8.050 8.066 -0.016 1
1 82 . 15 1 1 A 9 9 ALA HA H 9 3.950 4.054 -0.104 1
1 86 . 15 1 1 A 9 9 ALA C C 9 179.800 179.979 -0.179 1
1 87 . 15 1 1 A 9 9 ALA CA C 9 55.100 54.861 0.239 1
1 88 . 15 1 1 A 9 9 ALA CB C 9 18.100 18.393 -0.293 1
1 89 . 15 1 1 A 9 9 ALA N N 9 121.600 120.934 0.666 1
1 90 . 15 1 1 A 10 10 ALA H H 10 7.910 7.447 0.463 1
1 91 . 15 1 1 A 10 10 ALA HA H 10 4.200 4.123 0.077 1
1 95 . 15 1 1 A 10 10 ALA C C 10 180.500 180.386 0.114 1
1 96 . 15 1 1 A 10 10 ALA CA C 10 54.600 55.095 -0.495 1
1 97 . 15 1 1 A 10 10 ALA CB C 10 18.100 18.151 -0.051 1
1 98 . 15 1 1 A 10 10 ALA N N 10 120.200 120.427 -0.227 1
1 99 . 15 1 1 A 11 11 LEU H H 11 8.080 8.276 -0.196 1
1 100 . 15 1 1 A 11 11 LEU HA H 11 4.120 4.032 0.088 1
1 110 . 15 1 1 A 11 11 LEU C C 11 179.600 179.557 0.043 1
1 111 . 15 1 1 A 11 11 LEU CA C 11 57.800 57.621 0.179 1
1 112 . 15 1 1 A 11 11 LEU CB C 11 41.700 41.219 0.481 1
1 115 . 15 1 1 A 11 11 LEU N N 11 120.900 119.719 1.181 1
1 116 . 15 1 1 A 12 12 LEU H H 12 8.480 8.258 0.222 1
1 117 . 15 1 1 A 12 12 LEU HA H 12 4.040 3.938 0.102 1
1 127 . 15 1 1 A 12 12 LEU C C 12 178.900 178.614 0.286 1
1 128 . 15 1 1 A 12 12 LEU CA C 12 58.100 58.049 0.051 1
1 129 . 15 1 1 A 12 12 LEU CB C 12 40.100 41.114 -1.014 1
1 133 . 15 1 1 A 12 12 LEU N N 12 118.700 119.318 -0.618 1
1 134 . 15 1 1 A 13 13 ASP H H 13 7.990 8.516 -0.526 1
1 135 . 15 1 1 A 13 13 ASP HA H 13 4.420 4.248 0.172 1
1 138 . 15 1 1 A 13 13 ASP C C 13 178.900 178.526 0.374 1
1 139 . 15 1 1 A 13 13 ASP CA C 13 57.500 57.991 -0.491 1
1 140 . 15 1 1 A 13 13 ASP CB C 13 40.500 41.938 -1.438 1
1 141 . 15 1 1 A 13 13 ASP N N 13 119.500 119.478 0.022 1
1 142 . 15 1 1 A 14 14 GLN H H 14 7.620 7.483 0.137 1
1 143 . 15 1 1 A 14 14 GLN HA H 14 4.230 4.132 0.098 1
1 150 . 15 1 1 A 14 14 GLN C C 14 178.400 178.620 -0.220 1
1 151 . 15 1 1 A 14 14 GLN CA C 14 58.100 58.564 -0.464 1
1 152 . 15 1 1 A 14 14 GLN CB C 14 27.800 28.366 -0.566 1
1 154 . 15 1 1 A 14 14 GLN N N 14 118.900 119.868 -0.968 1
1 156 . 15 1 1 A 15 15 VAL H H 15 8.480 8.384 0.096 1
1 157 . 15 1 1 A 15 15 VAL HA H 15 3.380 3.587 -0.207 1
1 165 . 15 1 1 A 15 15 VAL C C 15 177.600 178.217 -0.617 1
1 166 . 15 1 1 A 15 15 VAL CA C 15 66.600 66.266 0.334 1
1 167 . 15 1 1 A 15 15 VAL CB C 15 30.500 31.681 -1.181 1
1 170 . 15 1 1 A 15 15 VAL N N 15 121.300 119.621 1.679 1
1 171 . 15 1 1 A 16 16 ALA H H 16 8.080 8.614 -0.534 1
1 172 . 15 1 1 A 16 16 ALA HA H 16 4.450 3.875 0.575 1
1 176 . 15 1 1 A 16 16 ALA C C 16 179.100 179.231 -0.131 1
1 177 . 15 1 1 A 16 16 ALA CA C 16 54.600 55.283 -0.683 1
1 178 . 15 1 1 A 16 16 ALA CB C 16 17.700 18.227 -0.527 1
1 179 . 15 1 1 A 16 16 ALA N N 16 121.400 121.836 -0.436 1
1 180 . 15 1 1 A 17 17 ARG H H 17 7.480 8.008 -0.528 1
1 181 . 15 1 1 A 17 17 ARG HA H 17 3.910 4.071 -0.161 1
1 187 . 15 1 1 A 17 17 ARG C C 17 179.700 178.865 0.835 1
1 188 . 15 1 1 A 17 17 ARG CA C 17 59.700 59.313 0.387 1
1 189 . 15 1 1 A 17 17 ARG CB C 17 30.400 29.821 0.579 1
1 191 . 15 1 1 A 17 17 ARG N N 17 116.900 118.985 -2.085 1
1 192 . 15 1 1 A 18 18 VAL H H 18 7.960 7.797 0.163 1
1 193 . 15 1 1 A 18 18 VAL HA H 18 3.690 3.660 0.030 1
1 201 . 15 1 1 A 18 18 VAL C C 18 177.900 178.090 -0.190 1
1 202 . 15 1 1 A 18 18 VAL CA C 18 66.600 65.948 0.652 1
1 203 . 15 1 1 A 18 18 VAL CB C 18 31.300 31.650 -0.350 1
1 206 . 15 1 1 A 18 18 VAL N N 18 123.000 119.221 3.779 1
1 207 . 15 1 1 A 19 19 GLY H H 19 8.270 8.326 -0.056 1
1 208 . 15 1 1 A 19 19 GLY HA2 H 19 3.430 3.766 -0.336 1
1 209 . 15 1 1 A 19 19 GLY HA3 H 19 3.430 3.772 -0.342 1
1 210 . 15 1 1 A 19 19 GLY C C 19 174.400 175.574 -1.174 1
1 211 . 15 1 1 A 19 19 GLY CA C 19 48.500 47.250 1.250 1
1 212 . 15 1 1 A 19 19 GLY N N 19 105.400 107.506 -2.106 1
1 213 . 15 1 1 A 20 20 LYS H H 20 8.250 8.547 -0.297 1
1 214 . 15 1 1 A 20 20 LYS HA H 20 3.710 4.035 -0.325 1
1 223 . 15 1 1 A 20 20 LYS C C 20 179.400 178.710 0.690 1
1 224 . 15 1 1 A 20 20 LYS CA C 20 59.300 58.788 0.512 1
1 225 . 15 1 1 A 20 20 LYS CB C 20 32.600 32.345 0.255 1
1 229 . 15 1 1 A 20 20 LYS N N 20 118.700 121.857 -3.157 1
1 230 . 15 1 1 A 21 21 ALA H H 21 7.640 7.643 -0.003 1
1 231 . 15 1 1 A 21 21 ALA HA H 21 3.790 4.145 -0.355 1
1 235 . 15 1 1 A 21 21 ALA C C 21 177.900 178.907 -1.007 1
1 236 . 15 1 1 A 21 21 ALA CA C 21 55.200 53.896 1.304 1
1 237 . 15 1 1 A 21 21 ALA CB C 21 19.200 18.531 0.669 1
1 238 . 15 1 1 A 21 21 ALA N N 21 121.700 121.131 0.569 1
1 239 . 15 1 1 A 22 22 LEU H H 22 7.330 7.976 -0.646 1
1 240 . 15 1 1 A 22 22 LEU HA H 22 4.140 4.316 -0.176 1
1 250 . 15 1 1 A 22 22 LEU C C 22 176.800 177.822 -1.022 1
1 251 . 15 1 1 A 22 22 LEU CA C 22 54.600 55.483 -0.883 1
1 252 . 15 1 1 A 22 22 LEU CB C 22 42.900 42.247 0.653 1
1 256 . 15 1 1 A 22 22 LEU N N 22 114.200 119.495 -5.295 1
1 257 . 15 1 1 A 23 23 ALA H H 23 7.160 7.624 -0.464 1
1 258 . 15 1 1 A 23 23 ALA HA H 23 4.720 4.331 0.389 1
1 262 . 15 1 1 A 23 23 ALA C C 23 176.700 176.451 0.249 1
1 263 . 15 1 1 A 23 23 ALA CA C 23 53.000 52.481 0.519 1
1 264 . 15 1 1 A 23 23 ALA CB C 23 18.200 18.447 -0.247 1
1 265 . 15 1 1 A 23 23 ALA N N 23 118.200 120.838 -2.638 1
1 266 . 15 1 1 A 24 24 ASN H H 24 7.440 7.560 -0.120 1
1 267 . 15 1 1 A 24 24 ASN HA H 24 4.730 5.053 -0.323 1
1 272 . 15 1 1 A 24 24 ASN C C 24 174.800 174.865 -0.065 1
1 273 . 15 1 1 A 24 24 ASN CA C 24 53.500 51.944 1.556 1
1 274 . 15 1 1 A 24 24 ASN CB C 24 41.700 41.710 -0.010 1
1 275 . 15 1 1 A 24 24 ASN N N 24 116.800 115.695 1.105 1
1 277 . 15 1 1 A 25 25 GLY H H 25 9.370 8.719 0.651 1
1 278 . 15 1 1 A 25 25 GLY HA2 H 25 3.650 3.879 -0.229 1
1 279 . 15 1 1 A 25 25 GLY HA3 H 25 4.110 3.892 0.218 1
1 280 . 15 1 1 A 25 25 GLY C C 25 175.300 175.449 -0.149 1
1 281 . 15 1 1 A 25 25 GLY CA C 25 47.600 46.700 0.900 1
1 282 . 15 1 1 A 25 25 GLY N N 25 114.800 112.020 2.780 1
1 283 . 15 1 1 A 26 26 ARG H H 26 8.050 8.013 0.037 1
1 284 . 15 1 1 A 26 26 ARG HA H 26 4.150 4.098 0.052 1
1 289 . 15 1 1 A 26 26 ARG C C 26 179.300 179.113 0.187 1
1 290 . 15 1 1 A 26 26 ARG CA C 26 57.000 58.769 -1.769 1
1 291 . 15 1 1 A 26 26 ARG CB C 26 29.900 30.085 -0.185 1
1 294 . 15 1 1 A 26 26 ARG N N 26 120.500 122.118 -1.618 1
1 295 . 15 1 1 A 27 27 ARG H H 27 7.930 7.785 0.145 1
1 296 . 15 1 1 A 27 27 ARG HA H 27 3.710 4.123 -0.413 1
1 301 . 15 1 1 A 27 27 ARG C C 27 178.300 178.706 -0.406 1
1 302 . 15 1 1 A 27 27 ARG CA C 27 61.000 58.620 2.380 1
1 303 . 15 1 1 A 27 27 ARG CB C 27 30.400 29.539 0.861 1
1 305 . 15 1 1 A 27 27 ARG N N 27 117.900 120.700 -2.800 1
1 306 . 15 1 1 A 28 28 LEU H H 28 7.640 8.136 -0.496 1
1 307 . 15 1 1 A 28 28 LEU HA H 28 3.950 4.044 -0.094 1
1 317 . 15 1 1 A 28 28 LEU C C 28 178.200 179.387 -1.187 1
1 318 . 15 1 1 A 28 28 LEU CA C 28 57.600 57.063 0.537 1
1 319 . 15 1 1 A 28 28 LEU CB C 28 41.900 41.196 0.704 1
1 323 . 15 1 1 A 28 28 LEU N N 28 117.600 119.548 -1.948 1
1 324 . 15 1 1 A 29 29 GLN H H 29 8.110 8.175 -0.065 1
1 325 . 15 1 1 A 29 29 GLN HA H 29 3.880 4.181 -0.301 1
1 332 . 15 1 1 A 29 29 GLN C C 29 179.400 179.126 0.274 1
1 333 . 15 1 1 A 29 29 GLN CA C 29 59.100 58.660 0.440 1
1 334 . 15 1 1 A 29 29 GLN CB C 29 28.800 28.179 0.621 1
1 336 . 15 1 1 A 29 29 GLN N N 29 119.300 118.499 0.801 1
1 338 . 15 1 1 A 30 30 ILE H H 30 7.530 7.551 -0.021 1
1 339 . 15 1 1 A 30 30 ILE HA H 30 3.340 3.613 -0.273 1
1 349 . 15 1 1 A 30 30 ILE C C 30 176.700 178.355 -1.655 1
1 350 . 15 1 1 A 30 30 ILE CA C 30 65.900 65.108 0.792 1
1 351 . 15 1 1 A 30 30 ILE CB C 30 37.400 37.880 -0.480 1
1 355 . 15 1 1 A 30 30 ILE N N 30 118.600 120.707 -2.107 1
1 356 . 15 1 1 A 31 31 LEU H H 31 7.500 8.020 -0.520 1
1 357 . 15 1 1 A 31 31 LEU HA H 31 3.520 3.717 -0.197 1
1 367 . 15 1 1 A 31 31 LEU C C 31 177.300 178.662 -1.362 1
1 368 . 15 1 1 A 31 31 LEU CA C 31 58.100 57.825 0.275 1
1 369 . 15 1 1 A 31 31 LEU CB C 31 41.100 40.486 0.614 1
1 373 . 15 1 1 A 31 31 LEU N N 31 119.900 119.403 0.497 1
1 374 . 15 1 1 A 32 32 ASP H H 32 7.950 8.181 -0.231 1
1 375 . 15 1 1 A 32 32 ASP HA H 32 4.300 4.427 -0.127 1
1 378 . 15 1 1 A 32 32 ASP C C 32 178.300 178.677 -0.377 1
1 379 . 15 1 1 A 32 32 ASP CA C 32 57.400 57.534 -0.134 1
1 380 . 15 1 1 A 32 32 ASP CB C 32 42.400 41.304 1.096 1
1 381 . 15 1 1 A 32 32 ASP N N 32 116.900 120.022 -3.122 1
1 382 . 15 1 1 A 33 33 LEU H H 33 7.350 8.067 -0.717 1
1 383 . 15 1 1 A 33 33 LEU HA H 33 4.130 4.022 0.108 1
1 393 . 15 1 1 A 33 33 LEU C C 33 180.000 179.227 0.773 1
1 394 . 15 1 1 A 33 33 LEU CA C 33 57.600 58.209 -0.609 1
1 395 . 15 1 1 A 33 33 LEU CB C 33 42.300 41.662 0.638 1
1 399 . 15 1 1 A 33 33 LEU N N 33 118.600 119.858 -1.258 1
1 400 . 15 1 1 A 34 34 LEU H H 34 8.300 8.225 0.075 1
1 401 . 15 1 1 A 34 34 LEU HA H 34 4.490 4.493 -0.003 1
1 411 . 15 1 1 A 34 34 LEU C C 34 178.900 179.048 -0.148 1
1 412 . 15 1 1 A 34 34 LEU CA C 34 55.800 57.008 -1.208 1
1 413 . 15 1 1 A 34 34 LEU CB C 34 41.300 41.442 -0.142 1
1 417 . 15 1 1 A 34 34 LEU N N 34 117.800 119.418 -1.618 1
1 418 . 15 1 1 A 35 35 ALA H H 35 8.160 7.730 0.430 1
1 419 . 15 1 1 A 35 35 ALA HA H 35 4.050 4.153 -0.103 1
1 423 . 15 1 1 A 35 35 ALA C C 35 179.000 179.248 -0.248 1
1 424 . 15 1 1 A 35 35 ALA CA C 35 54.900 54.625 0.275 1
1 425 . 15 1 1 A 35 35 ALA CB C 35 17.500 18.433 -0.933 1
1 426 . 15 1 1 A 35 35 ALA N N 35 123.900 121.961 1.939 1
1 427 . 15 1 1 A 36 36 GLN H H 36 7.600 7.767 -0.167 1
1 428 . 15 1 1 A 36 36 GLN HA H 36 4.340 4.206 0.134 1
1 435 . 15 1 1 A 36 36 GLN C C 36 176.100 176.065 0.035 1
1 436 . 15 1 1 A 36 36 GLN CA C 36 55.800 57.384 -1.584 1
1 437 . 15 1 1 A 36 36 GLN CB C 36 29.000 29.634 -0.634 1
1 439 . 15 1 1 A 36 36 GLN N N 36 113.300 114.248 -0.948 1
1 441 . 15 1 1 A 37 37 GLY H H 37 7.550 7.394 0.156 1
1 442 . 15 1 1 A 37 37 GLY HA2 H 37 3.730 4.058 -0.328 1
1 443 . 15 1 1 A 37 37 GLY HA3 H 37 4.490 4.063 0.427 1
1 444 . 15 1 1 A 37 37 GLY C C 37 171.500 172.816 -1.316 1
1 445 . 15 1 1 A 37 37 GLY CA C 37 44.500 45.631 -1.131 1
1 446 . 15 1 1 A 37 37 GLY N N 37 108.400 104.117 4.283 1
1 447 . 15 1 1 A 38 38 GLU H H 38 8.120 8.480 -0.360 1
1 448 . 15 1 1 A 38 38 GLU HA H 38 4.820 4.914 -0.094 1
1 453 . 15 1 1 A 38 38 GLU C C 38 177.000 176.132 0.868 1
1 454 . 15 1 1 A 38 38 GLU CA C 38 56.400 56.069 0.331 1
1 455 . 15 1 1 A 38 38 GLU CB C 38 31.200 29.866 1.334 1
1 457 . 15 1 1 A 38 38 GLU N N 38 119.600 118.928 0.672 1
1 458 . 15 1 1 A 39 39 ARG H H 39 8.580 8.589 -0.009 1
1 459 . 15 1 1 A 39 39 ARG HA H 39 4.970 4.847 0.123 1
1 467 . 15 1 1 A 39 39 ARG C C 39 174.800 175.806 -1.006 1
1 468 . 15 1 1 A 39 39 ARG CA C 39 53.900 54.285 -0.385 1
1 469 . 15 1 1 A 39 39 ARG CB C 39 36.400 33.026 3.374 1
1 472 . 15 1 1 A 39 39 ARG N N 39 121.500 125.572 -4.072 1
1 474 . 15 1 1 A 40 40 ALA H H 40 8.910 8.722 0.188 1
1 475 . 15 1 1 A 40 40 ALA HA H 40 4.920 4.605 0.315 1
1 479 . 15 1 1 A 40 40 ALA C C 40 179.200 178.335 0.865 1
1 480 . 15 1 1 A 40 40 ALA CA C 40 51.100 51.778 -0.678 1
1 481 . 15 1 1 A 40 40 ALA CB C 40 19.200 18.808 0.392 1
1 482 . 15 1 1 A 40 40 ALA N N 40 125.100 124.928 0.172 1
1 483 . 15 1 1 A 41 41 VAL H H 41 8.420 8.736 -0.316 1
1 484 . 15 1 1 A 41 41 VAL HA H 41 3.430 3.590 -0.160 1
1 492 . 15 1 1 A 41 41 VAL C C 41 176.800 177.162 -0.362 1
1 493 . 15 1 1 A 41 41 VAL CA C 41 67.600 66.835 0.765 1
1 494 . 15 1 1 A 41 41 VAL CB C 41 31.600 31.856 -0.256 1
1 497 . 15 1 1 A 41 41 VAL N N 41 120.900 121.094 -0.194 1
1 498 . 15 1 1 A 42 42 GLU H H 42 9.640 8.169 1.471 1
1 499 . 15 1 1 A 42 42 GLU HA H 42 3.880 3.980 -0.100 1
1 504 . 15 1 1 A 42 42 GLU C C 42 178.300 178.936 -0.636 1
1 505 . 15 1 1 A 42 42 GLU CA C 42 60.600 59.419 1.181 1
1 506 . 15 1 1 A 42 42 GLU CB C 42 28.300 29.635 -1.335 1
1 508 . 15 1 1 A 42 42 GLU N N 42 119.000 119.842 -0.842 1
1 509 . 15 1 1 A 43 43 ALA H H 43 6.870 7.743 -0.873 1
1 510 . 15 1 1 A 43 43 ALA HA H 43 4.290 4.040 0.250 1
1 514 . 15 1 1 A 43 43 ALA C C 43 180.700 179.896 0.804 1
1 515 . 15 1 1 A 43 43 ALA CA C 43 54.100 55.089 -0.989 1
1 516 . 15 1 1 A 43 43 ALA CB C 43 19.100 18.474 0.626 1
1 517 . 15 1 1 A 43 43 ALA N N 43 120.500 122.046 -1.546 1
1 518 . 15 1 1 A 44 44 ILE H H 44 7.970 7.981 -0.011 1
1 519 . 15 1 1 A 44 44 ILE HA H 44 3.470 3.617 -0.147 1
1 529 . 15 1 1 A 44 44 ILE C C 44 178.300 177.882 0.418 1
1 530 . 15 1 1 A 44 44 ILE CA C 44 64.700 65.452 -0.752 1
1 531 . 15 1 1 A 44 44 ILE CB C 44 38.100 37.993 0.107 1
1 535 . 15 1 1 A 44 44 ILE N N 44 120.500 119.421 1.079 1
1 536 . 15 1 1 A 45 45 ALA H H 45 8.460 7.935 0.525 1
1 537 . 15 1 1 A 45 45 ALA HA H 45 3.720 4.031 -0.311 1
1 541 . 15 1 1 A 45 45 ALA C C 45 178.500 179.507 -1.007 1
1 542 . 15 1 1 A 45 45 ALA CA C 45 56.200 55.319 0.881 1
1 543 . 15 1 1 A 45 45 ALA CB C 45 17.400 18.429 -1.029 1
1 544 . 15 1 1 A 45 45 ALA N N 45 124.500 122.703 1.797 1
1 545 . 15 1 1 A 46 46 THR H H 46 8.080 8.307 -0.227 1
1 546 . 15 1 1 A 46 46 THR HA H 46 3.900 3.816 0.084 1
1 551 . 15 1 1 A 46 46 THR C C 46 177.200 176.631 0.569 1
1 552 . 15 1 1 A 46 46 THR CA C 46 66.400 67.186 -0.786 1
1 553 . 15 1 1 A 46 46 THR CB C 46 68.800 68.726 0.074 1
1 555 . 15 1 1 A 46 46 THR N N 46 112.400 113.796 -1.396 1
1 556 . 15 1 1 A 47 47 ALA H H 47 7.930 8.226 -0.296 1
1 557 . 15 1 1 A 47 47 ALA HA H 47 4.200 4.083 0.117 1
1 561 . 15 1 1 A 47 47 ALA C C 47 179.200 179.747 -0.547 1
1 562 . 15 1 1 A 47 47 ALA CA C 47 54.800 55.207 -0.407 1
1 563 . 15 1 1 A 47 47 ALA CB C 47 19.800 18.266 1.534 1
1 564 . 15 1 1 A 47 47 ALA N N 47 121.400 123.877 -2.477 1
1 565 . 15 1 1 A 48 48 THR H H 48 7.560 7.529 0.031 1
1 566 . 15 1 1 A 48 48 THR HA H 48 4.390 4.374 0.016 1
1 571 . 15 1 1 A 48 48 THR C C 48 175.700 176.073 -0.373 1
1 572 . 15 1 1 A 48 48 THR CA C 48 61.800 62.851 -1.051 1
1 573 . 15 1 1 A 48 48 THR CB C 48 71.000 70.411 0.589 1
1 575 . 15 1 1 A 48 48 THR N N 48 103.500 106.936 -3.436 1
1 576 . 15 1 1 A 49 49 GLY H H 49 7.820 8.447 -0.627 1
1 577 . 15 1 1 A 49 49 GLY HA2 H 49 3.870 3.903 -0.033 1
1 578 . 15 1 1 A 49 49 GLY HA3 H 49 4.100 3.905 0.195 1
1 579 . 15 1 1 A 49 49 GLY C C 49 174.400 173.740 0.660 1
1 580 . 15 1 1 A 49 49 GLY CA C 49 46.300 46.061 0.239 1
1 581 . 15 1 1 A 49 49 GLY N N 49 111.100 112.253 -1.153 1
1 582 . 15 1 1 A 50 50 MET H H 50 7.930 7.815 0.115 1
1 583 . 15 1 1 A 50 50 MET HA H 50 4.540 4.886 -0.346 1
1 591 . 15 1 1 A 50 50 MET C C 50 174.800 175.022 -0.222 1
1 592 . 15 1 1 A 50 50 MET CA C 50 55.100 54.237 0.863 1
1 593 . 15 1 1 A 50 50 MET CB C 50 37.200 36.543 0.657 1
1 596 . 15 1 1 A 50 50 MET N N 50 119.300 118.537 0.763 1
1 597 . 15 1 1 A 51 51 ASN H H 51 8.040 8.782 -0.742 1
1 598 . 15 1 1 A 51 51 ASN HA H 51 4.580 4.904 -0.324 1
1 601 . 15 1 1 A 51 51 ASN C C 51 176.100 177.172 -1.072 1
1 602 . 15 1 1 A 51 51 ASN CA C 51 52.800 52.624 0.176 1
1 603 . 15 1 1 A 51 51 ASN CB C 51 41.100 39.285 1.815 1
1 604 . 15 1 1 A 51 51 ASN N N 51 118.000 118.498 -0.498 1
1 605 . 15 1 1 A 52 52 LEU H H 52 8.560 8.828 -0.268 1
1 606 . 15 1 1 A 52 52 LEU HA H 52 3.760 3.957 -0.197 1
1 616 . 15 1 1 A 52 52 LEU C C 52 179.600 178.956 0.644 1
1 617 . 15 1 1 A 52 52 LEU CA C 52 59.000 57.832 1.168 1
1 618 . 15 1 1 A 52 52 LEU CB C 52 41.800 41.307 0.493 1
1 622 . 15 1 1 A 52 52 LEU N N 52 120.600 123.807 -3.207 1
1 623 . 15 1 1 A 53 53 THR H H 53 8.230 8.117 0.113 1
1 624 . 15 1 1 A 53 53 THR HA H 53 3.880 3.934 -0.054 1
1 629 . 15 1 1 A 53 53 THR C C 53 176.900 176.804 0.096 1
1 630 . 15 1 1 A 53 53 THR CA C 53 66.500 65.573 0.927 1
1 631 . 15 1 1 A 53 53 THR CB C 53 68.400 68.928 -0.528 1
1 633 . 15 1 1 A 53 53 THR N N 53 115.800 113.208 2.592 1
1 634 . 15 1 1 A 54 54 THR H H 54 8.420 7.927 0.493 1
1 635 . 15 1 1 A 54 54 THR HA H 54 3.880 3.878 0.002 1
1 640 . 15 1 1 A 54 54 THR C C 54 177.300 176.085 1.215 1
1 641 . 15 1 1 A 54 54 THR CA C 54 66.600 66.240 0.360 1
1 642 . 15 1 1 A 54 54 THR CB C 54 66.600 68.701 -2.101 1
1 644 . 15 1 1 A 54 54 THR N N 54 122.300 117.136 5.164 1
1 645 . 15 1 1 A 55 55 ALA H H 55 8.860 8.579 0.281 1
1 646 . 15 1 1 A 55 55 ALA HA H 55 4.020 3.956 0.064 1
1 650 . 15 1 1 A 55 55 ALA C C 55 179.000 179.524 -0.524 1
1 651 . 15 1 1 A 55 55 ALA CA C 55 56.100 55.371 0.729 1
1 652 . 15 1 1 A 55 55 ALA CB C 55 17.000 18.066 -1.066 1
1 653 . 15 1 1 A 55 55 ALA N N 55 125.600 123.714 1.886 1
1 654 . 15 1 1 A 56 56 SER H H 56 8.440 8.663 -0.223 1
1 655 . 15 1 1 A 56 56 SER HA H 56 3.920 4.090 -0.170 1
1 658 . 15 1 1 A 56 56 SER C C 56 176.400 177.157 -0.757 1
1 659 . 15 1 1 A 56 56 SER CA C 56 62.600 61.383 1.217 1
1 660 . 15 1 1 A 56 56 SER CB C 56 62.700 62.227 0.473 1
1 661 . 15 1 1 A 56 56 SER N N 56 112.700 113.055 -0.355 1
1 662 . 15 1 1 A 57 57 ALA H H 57 8.090 7.976 0.114 1
1 663 . 15 1 1 A 57 57 ALA HA H 57 4.130 3.980 0.150 1
1 667 . 15 1 1 A 57 57 ALA C C 57 181.200 180.180 1.020 1
1 668 . 15 1 1 A 57 57 ALA CA C 57 55.200 55.235 -0.035 1
1 669 . 15 1 1 A 57 57 ALA CB C 57 17.900 18.558 -0.658 1
1 670 . 15 1 1 A 57 57 ALA N N 57 124.000 124.379 -0.379 1
1 671 . 15 1 1 A 58 58 ASN H H 58 7.970 7.794 0.176 1
1 672 . 15 1 1 A 58 58 ASN HA H 58 4.480 4.483 -0.003 1
1 677 . 15 1 1 A 58 58 ASN C C 58 177.500 178.325 -0.825 1
1 678 . 15 1 1 A 58 58 ASN CA C 58 56.900 56.373 0.527 1
1 679 . 15 1 1 A 58 58 ASN CB C 58 39.800 38.263 1.537 1
1 680 . 15 1 1 A 58 58 ASN N N 58 117.600 117.004 0.596 1
1 682 . 15 1 1 A 59 59 LEU H H 59 8.530 8.261 0.269 1
1 683 . 15 1 1 A 59 59 LEU HA H 59 3.710 3.755 -0.045 1
1 693 . 15 1 1 A 59 59 LEU C C 59 178.400 179.190 -0.790 1
1 694 . 15 1 1 A 59 59 LEU CA C 59 58.600 57.691 0.909 1
1 695 . 15 1 1 A 59 59 LEU CB C 59 40.500 40.603 -0.103 1
1 699 . 15 1 1 A 59 59 LEU N N 59 122.600 121.190 1.410 1
1 700 . 15 1 1 A 60 60 GLN H H 60 8.200 8.180 0.020 1
1 701 . 15 1 1 A 60 60 GLN HA H 60 4.020 4.113 -0.093 1
1 708 . 15 1 1 A 60 60 GLN C C 60 178.700 178.250 0.450 1
1 709 . 15 1 1 A 60 60 GLN CA C 60 58.800 58.868 -0.068 1
1 710 . 15 1 1 A 60 60 GLN CB C 60 27.700 28.256 -0.556 1
1 712 . 15 1 1 A 60 60 GLN N N 60 118.900 118.200 0.700 1
1 714 . 15 1 1 A 61 61 ALA H H 61 7.580 7.384 0.196 1
1 715 . 15 1 1 A 61 61 ALA HA H 61 4.230 4.090 0.140 1
1 719 . 15 1 1 A 61 61 ALA C C 61 181.300 178.716 2.584 1
1 720 . 15 1 1 A 61 61 ALA CA C 61 55.100 54.304 0.796 1
1 721 . 15 1 1 A 61 61 ALA CB C 61 17.600 18.271 -0.671 1
1 722 . 15 1 1 A 61 61 ALA N N 61 122.200 122.071 0.129 1
1 723 . 15 1 1 A 62 62 LEU H H 62 7.830 7.682 0.148 1
1 724 . 15 1 1 A 62 62 LEU HA H 62 3.980 4.215 -0.235 1
1 734 . 15 1 1 A 62 62 LEU C C 62 178.500 178.954 -0.454 1
1 735 . 15 1 1 A 62 62 LEU CA C 62 58.100 54.670 3.430 1
1 736 . 15 1 1 A 62 62 LEU CB C 62 43.300 42.056 1.244 1
1 739 . 15 1 1 A 62 62 LEU N N 62 119.000 118.037 0.963 1
1 740 . 15 1 1 A 63 63 LYS H H 63 8.580 7.960 0.620 1
1 741 . 15 1 1 A 63 63 LYS HA H 63 4.130 4.121 0.009 1
1 750 . 15 1 1 A 63 63 LYS C C 63 180.500 178.511 1.989 1
1 751 . 15 1 1 A 63 63 LYS CA C 63 59.700 59.234 0.466 1
1 752 . 15 1 1 A 63 63 LYS CB C 63 32.600 32.590 0.010 1
1 756 . 15 1 1 A 63 63 LYS N N 63 123.400 120.913 2.487 1
1 757 . 15 1 1 A 64 64 SER H H 64 8.640 8.108 0.532 1
1 758 . 15 1 1 A 64 64 SER HA H 64 4.300 4.253 0.047 1
1 761 . 15 1 1 A 64 64 SER C C 64 175.000 175.766 -0.766 1
1 762 . 15 1 1 A 64 64 SER CA C 64 61.400 61.419 -0.019 1
1 763 . 15 1 1 A 64 64 SER CB C 64 63.000 62.255 0.745 1
1 764 . 15 1 1 A 64 64 SER N N 64 117.700 113.590 4.110 1
1 765 . 15 1 1 A 65 65 GLY H H 65 7.280 7.691 -0.411 1
1 766 . 15 1 1 A 65 65 GLY HA2 H 65 3.240 4.169 -0.929 1
1 767 . 15 1 1 A 65 65 GLY HA3 H 65 3.980 4.171 -0.191 1
1 768 . 15 1 1 A 65 65 GLY C C 65 171.300 175.040 -3.740 1
1 769 . 15 1 1 A 65 65 GLY CA C 65 45.100 45.596 -0.496 1
1 770 . 15 1 1 A 65 65 GLY N N 65 104.400 108.526 -4.126 1
1 771 . 15 1 1 A 66 66 GLY H H 66 7.730 7.628 0.102 1
1 772 . 15 1 1 A 66 66 GLY HA2 H 66 3.650 3.999 -0.349 1
1 773 . 15 1 1 A 66 66 GLY HA3 H 66 3.750 4.003 -0.253 1
1 774 . 15 1 1 A 66 66 GLY C C 66 173.700 174.239 -0.539 1
1 775 . 15 1 1 A 66 66 GLY CA C 66 45.400 45.303 0.097 1
1 776 . 15 1 1 A 66 66 GLY N N 66 104.700 107.829 -3.129 1
1 777 . 15 1 1 A 67 67 LEU H H 67 7.520 7.674 -0.154 1
1 778 . 15 1 1 A 67 67 LEU HA H 67 4.310 3.875 0.435 1
1 788 . 15 1 1 A 67 67 LEU C C 67 177.700 175.089 2.611 1
1 789 . 15 1 1 A 67 67 LEU CA C 67 55.500 56.391 -0.891 1
1 790 . 15 1 1 A 67 67 LEU CB C 67 42.400 39.725 2.675 1
1 794 . 15 1 1 A 67 67 LEU N N 67 110.600 116.965 -6.365 1
1 795 . 15 1 1 A 68 68 VAL H H 68 6.890 7.467 -0.577 1
1 796 . 15 1 1 A 68 68 VAL HA H 68 5.190 4.886 0.304 1
1 804 . 15 1 1 A 68 68 VAL C C 68 173.700 174.806 -1.106 1
1 805 . 15 1 1 A 68 68 VAL CA C 68 57.400 58.876 -1.476 1
1 806 . 15 1 1 A 68 68 VAL CB C 68 36.400 35.148 1.252 1
1 809 . 15 1 1 A 68 68 VAL N N 68 106.400 113.367 -6.967 1
1 810 . 15 1 1 A 69 69 GLU H H 69 8.880 9.021 -0.141 1
1 811 . 15 1 1 A 69 69 GLU HA H 69 4.660 4.865 -0.205 1
1 816 . 15 1 1 A 69 69 GLU C C 69 173.300 174.629 -1.329 1
1 817 . 15 1 1 A 69 69 GLU CA C 69 54.300 54.715 -0.415 1
1 818 . 15 1 1 A 69 69 GLU CB C 69 34.100 33.285 0.815 1
1 820 . 15 1 1 A 69 69 GLU N N 69 120.400 121.216 -0.816 1
1 821 . 15 1 1 A 70 70 ALA H H 70 8.730 8.696 0.034 1
1 822 . 15 1 1 A 70 70 ALA HA H 70 4.990 4.906 0.084 1
1 826 . 15 1 1 A 70 70 ALA C C 70 176.500 175.051 1.449 1
1 827 . 15 1 1 A 70 70 ALA CA C 70 50.000 50.033 -0.033 1
1 828 . 15 1 1 A 70 70 ALA CB C 70 22.300 21.220 1.080 1
1 829 . 15 1 1 A 70 70 ALA N N 70 122.800 121.427 1.373 1
1 830 . 15 1 1 A 71 71 ARG H H 71 8.670 9.188 -0.518 1
1 831 . 15 1 1 A 71 71 ARG HA H 71 4.630 4.908 -0.278 1
1 843 . 15 1 1 A 71 71 ARG C C 71 173.500 174.730 -1.230 1
1 844 . 15 1 1 A 71 71 ARG CA C 71 54.600 54.225 0.375 1
1 845 . 15 1 1 A 71 71 ARG CB C 71 33.600 33.289 0.311 1
1 849 . 15 1 1 A 71 71 ARG N N 71 120.100 123.412 -3.312 1
1 851 . 15 1 1 A 72 72 ARG H H 72 8.780 8.815 -0.035 1
1 852 . 15 1 1 A 72 72 ARG HA H 72 5.100 5.073 0.027 1
1 859 . 15 1 1 A 72 72 ARG C C 72 176.000 174.821 1.179 1
1 860 . 15 1 1 A 72 72 ARG CA C 72 54.900 55.717 -0.817 1
1 861 . 15 1 1 A 72 72 ARG CB C 72 32.500 32.071 0.429 1
1 864 . 15 1 1 A 72 72 ARG N N 72 123.600 124.499 -0.899 1
1 865 . 15 1 1 A 73 73 GLU H H 73 8.720 9.070 -0.350 1
1 866 . 15 1 1 A 73 73 GLU HA H 73 4.510 4.638 -0.128 1
1 871 . 15 1 1 A 73 73 GLU C C 73 175.900 176.720 -0.820 1
1 872 . 15 1 1 A 73 73 GLU CA C 73 55.700 55.022 0.678 1
1 873 . 15 1 1 A 73 73 GLU CB C 73 31.800 30.922 0.878 1
1 875 . 15 1 1 A 73 73 GLU N N 73 126.800 124.089 2.711 1
1 876 . 15 1 1 A 74 74 GLY H H 74 9.190 8.910 0.280 1
1 877 . 15 1 1 A 74 74 GLY HA2 H 74 3.700 3.876 -0.176 1
1 878 . 15 1 1 A 74 74 GLY HA3 H 74 4.170 3.888 0.282 1
1 879 . 15 1 1 A 74 74 GLY C C 74 175.400 174.916 0.484 1
1 880 . 15 1 1 A 74 74 GLY CA C 74 47.100 47.308 -0.208 1
1 881 . 15 1 1 A 74 74 GLY N N 74 118.500 116.261 2.239 1
1 882 . 15 1 1 A 75 75 THR H H 75 8.780 8.233 0.547 1
1 883 . 15 1 1 A 75 75 THR HA H 75 4.290 4.422 -0.132 1
1 888 . 15 1 1 A 75 75 THR C C 75 174.600 174.442 0.158 1
1 889 . 15 1 1 A 75 75 THR CA C 75 62.000 62.980 -0.980 1
1 890 . 15 1 1 A 75 75 THR CB C 75 69.000 69.894 -0.894 1
1 892 . 15 1 1 A 75 75 THR N N 75 118.000 120.478 -2.478 1
1 893 . 15 1 1 A 76 76 ARG H H 76 8.030 7.850 0.180 1
1 894 . 15 1 1 A 76 76 ARG HA H 76 4.610 4.830 -0.220 1
1 901 . 15 1 1 A 76 76 ARG C C 76 174.800 175.213 -0.413 1
1 902 . 15 1 1 A 76 76 ARG CA C 76 55.500 54.614 0.886 1
1 903 . 15 1 1 A 76 76 ARG CB C 76 32.700 32.271 0.429 1
1 906 . 15 1 1 A 76 76 ARG N N 76 122.600 120.349 2.251 1
1 907 . 15 1 1 A 77 77 GLN H H 77 8.580 8.499 0.081 1
1 908 . 15 1 1 A 77 77 GLN HA H 77 4.910 5.030 -0.120 1
1 915 . 15 1 1 A 77 77 GLN C C 77 173.900 174.684 -0.784 1
1 916 . 15 1 1 A 77 77 GLN CA C 77 54.700 54.604 0.096 1
1 917 . 15 1 1 A 77 77 GLN CB C 77 31.800 30.756 1.044 1
1 919 . 15 1 1 A 77 77 GLN N N 77 121.900 120.590 1.310 1
1 921 . 15 1 1 A 78 78 TYR H H 78 8.890 9.705 -0.815 1
1 922 . 15 1 1 A 78 78 TYR HA H 78 4.750 5.321 -0.571 1
1 929 . 15 1 1 A 78 78 TYR C C 78 175.600 174.493 1.107 1
1 930 . 15 1 1 A 78 78 TYR CA C 78 57.000 56.178 0.822 1
1 931 . 15 1 1 A 78 78 TYR CB C 78 41.400 40.906 0.494 1
1 936 . 15 1 1 A 78 78 TYR N N 78 121.800 122.643 -0.843 1
1 937 . 15 1 1 A 79 79 TYR H H 79 9.010 9.542 -0.532 1
1 938 . 15 1 1 A 79 79 TYR HA H 79 5.410 5.469 -0.059 1
1 945 . 15 1 1 A 79 79 TYR C C 79 173.100 175.290 -2.190 1
1 946 . 15 1 1 A 79 79 TYR CA C 79 57.300 57.208 0.092 1
1 947 . 15 1 1 A 79 79 TYR CB C 79 43.300 41.261 2.039 1
1 952 . 15 1 1 A 79 79 TYR N N 79 122.500 123.229 -0.729 1
1 953 . 15 1 1 A 80 80 ARG H H 80 8.720 8.556 0.164 1
1 954 . 15 1 1 A 80 80 ARG HA H 80 5.120 4.742 0.378 1
1 962 . 15 1 1 A 80 80 ARG C C 80 175.500 174.802 0.698 1
1 963 . 15 1 1 A 80 80 ARG CA C 80 53.200 54.762 -1.562 1
1 964 . 15 1 1 A 80 80 ARG CB C 80 33.900 34.426 -0.526 1
1 967 . 15 1 1 A 80 80 ARG N N 80 114.500 121.566 -7.066 1
1 969 . 15 1 1 A 81 81 ILE H H 81 9.300 8.727 0.573 1
1 970 . 15 1 1 A 81 81 ILE HA H 81 4.150 4.157 -0.007 1
1 980 . 15 1 1 A 81 81 ILE C C 81 177.800 177.107 0.693 1
1 981 . 15 1 1 A 81 81 ILE CA C 81 62.300 62.198 0.102 1
1 982 . 15 1 1 A 81 81 ILE CB C 81 37.800 37.581 0.219 1
1 986 . 15 1 1 A 81 81 ILE N N 81 122.100 126.151 -4.051 1
1 987 . 15 1 1 A 82 82 ALA H H 82 7.930 8.483 -0.553 1
1 988 . 15 1 1 A 82 82 ALA HA H 82 3.930 4.114 -0.184 1
1 992 . 15 1 1 A 82 82 ALA C C 82 176.300 177.385 -1.085 1
1 993 . 15 1 1 A 82 82 ALA CA C 82 54.200 55.241 -1.041 1
1 994 . 15 1 1 A 82 82 ALA CB C 82 18.500 19.440 -0.940 1
1 995 . 15 1 1 A 82 82 ALA N N 82 127.200 128.748 -1.548 1
1 996 . 15 1 1 A 83 83 GLY H H 83 6.980 7.694 -0.714 1
1 997 . 15 1 1 A 83 83 GLY HA2 H 83 4.090 4.105 -0.015 1
1 998 . 15 1 1 A 83 83 GLY HA3 H 83 4.440 4.107 0.333 1
1 999 . 15 1 1 A 83 83 GLY C C 83 173.600 175.046 -1.446 1
1 1000 . 15 1 1 A 83 83 GLY CA C 83 45.200 44.592 0.608 1
1 1001 . 15 1 1 A 83 83 GLY N N 83 101.800 103.332 -1.532 1
1 1002 . 15 1 1 A 84 84 GLU H H 84 8.930 8.900 0.030 1
1 1003 . 15 1 1 A 84 84 GLU HA H 84 4.120 3.960 0.160 1
1 1008 . 15 1 1 A 84 84 GLU C C 84 178.300 177.749 0.551 1
1 1009 . 15 1 1 A 84 84 GLU CA C 84 58.900 59.302 -0.402 1
1 1010 . 15 1 1 A 84 84 GLU CB C 84 29.400 29.260 0.140 1
1 1012 . 15 1 1 A 84 84 GLU N N 84 120.300 120.643 -0.343 1
1 1013 . 15 1 1 A 85 85 ASP H H 85 8.950 8.427 0.523 1
1 1014 . 15 1 1 A 85 85 ASP HA H 85 4.310 4.405 -0.095 1
1 1017 . 15 1 1 A 85 85 ASP C C 85 178.000 178.698 -0.698 1
1 1018 . 15 1 1 A 85 85 ASP CA C 85 57.100 56.876 0.224 1
1 1019 . 15 1 1 A 85 85 ASP CB C 85 38.900 40.492 -1.592 1
1 1020 . 15 1 1 A 85 85 ASP N N 85 119.400 118.828 0.572 1
1 1021 . 15 1 1 A 86 86 VAL H H 86 7.620 8.208 -0.588 1
1 1022 . 15 1 1 A 86 86 VAL HA H 86 3.480 3.728 -0.248 1
1 1030 . 15 1 1 A 86 86 VAL C C 86 177.400 178.275 -0.875 1
1 1031 . 15 1 1 A 86 86 VAL CA C 86 66.800 66.435 0.365 1
1 1032 . 15 1 1 A 86 86 VAL CB C 86 31.300 31.484 -0.184 1
1 1035 . 15 1 1 A 86 86 VAL N N 86 121.600 119.870 1.730 1
1 1036 . 15 1 1 A 87 87 ALA H H 87 7.520 8.168 -0.648 1
1 1037 . 15 1 1 A 87 87 ALA HA H 87 4.110 3.975 0.135 1
1 1041 . 15 1 1 A 87 87 ALA C C 87 181.200 179.611 1.589 1
1 1042 . 15 1 1 A 87 87 ALA CA C 87 55.800 55.714 0.086 1
1 1043 . 15 1 1 A 87 87 ALA CB C 87 17.600 18.708 -1.108 1
1 1044 . 15 1 1 A 87 87 ALA N N 87 122.700 122.243 0.457 1
1 1045 . 15 1 1 A 88 88 ARG H H 88 8.380 8.182 0.198 1
1 1046 . 15 1 1 A 88 88 ARG HA H 88 4.090 4.155 -0.065 1
1 1054 . 15 1 1 A 88 88 ARG C C 88 179.100 178.791 0.309 1
1 1055 . 15 1 1 A 88 88 ARG CA C 88 59.600 58.317 1.283 1
1 1056 . 15 1 1 A 88 88 ARG CB C 88 30.500 30.037 0.463 1
1 1059 . 15 1 1 A 88 88 ARG N N 88 119.200 118.130 1.070 1
1 1061 . 15 1 1 A 89 89 LEU H H 89 8.480 8.048 0.432 1
1 1062 . 15 1 1 A 89 89 LEU HA H 89 4.040 4.043 -0.003 1
1 1071 . 15 1 1 A 89 89 LEU C C 89 177.200 178.644 -1.444 1
1 1072 . 15 1 1 A 89 89 LEU CA C 89 58.300 57.842 0.458 1
1 1073 . 15 1 1 A 89 89 LEU CB C 89 41.300 41.862 -0.562 1
1 1076 . 15 1 1 A 89 89 LEU N N 89 123.300 122.377 0.923 1
1 1077 . 15 1 1 A 90 90 PHE H H 90 8.890 8.428 0.462 1
1 1078 . 15 1 1 A 90 90 PHE HA H 90 4.380 4.013 0.367 1
1 1086 . 15 1 1 A 90 90 PHE C C 90 177.500 177.967 -0.467 1
1 1087 . 15 1 1 A 90 90 PHE CA C 90 59.400 62.221 -2.821 1
1 1088 . 15 1 1 A 90 90 PHE CB C 90 38.600 38.907 -0.307 1
1 1094 . 15 1 1 A 90 90 PHE N N 90 119.400 119.340 0.060 1
1 1095 . 15 1 1 A 91 91 ALA H H 91 7.920 8.324 -0.404 1
1 1096 . 15 1 1 A 91 91 ALA HA H 91 3.940 3.997 -0.057 1
1 1100 . 15 1 1 A 91 91 ALA C C 91 180.200 179.780 0.420 1
1 1101 . 15 1 1 A 91 91 ALA CA C 91 55.100 55.157 -0.057 1
1 1102 . 15 1 1 A 91 91 ALA CB C 91 18.000 17.716 0.284 1
1 1103 . 15 1 1 A 91 91 ALA N N 91 120.500 121.266 -0.766 1
1 1104 . 15 1 1 A 92 92 LEU H H 92 8.190 8.490 -0.300 1
1 1105 . 15 1 1 A 92 92 LEU HA H 92 4.300 3.999 0.301 1
1 1115 . 15 1 1 A 92 92 LEU C C 92 178.900 178.235 0.665 1
1 1116 . 15 1 1 A 92 92 LEU CA C 92 57.500 57.869 -0.369 1
1 1117 . 15 1 1 A 92 92 LEU CB C 92 42.100 41.566 0.534 1
1 1121 . 15 1 1 A 92 92 LEU N N 92 120.200 119.431 0.769 1
1 1122 . 15 1 1 A 93 93 VAL H H 93 8.890 7.645 1.245 1
1 1123 . 15 1 1 A 93 93 VAL HA H 93 3.810 3.804 0.006 1
1 1131 . 15 1 1 A 93 93 VAL C C 93 176.900 178.005 -1.105 1
1 1132 . 15 1 1 A 93 93 VAL CA C 93 66.000 65.356 0.644 1
1 1133 . 15 1 1 A 93 93 VAL CB C 93 31.200 31.166 0.034 1
1 1136 . 15 1 1 A 93 93 VAL N N 93 117.100 115.284 1.816 1
1 1137 . 15 1 1 A 94 94 GLN H H 94 6.920 7.497 -0.577 1
1 1138 . 15 1 1 A 94 94 GLN HA H 94 3.790 3.837 -0.047 1
1 1145 . 15 1 1 A 94 94 GLN C C 94 177.400 178.886 -1.486 1
1 1146 . 15 1 1 A 94 94 GLN CA C 94 60.000 58.252 1.748 1
1 1147 . 15 1 1 A 94 94 GLN CB C 94 30.300 28.375 1.925 1
1 1149 . 15 1 1 A 94 94 GLN N N 94 117.800 120.330 -2.530 1
1 1151 . 15 1 1 A 95 95 VAL H H 95 7.420 7.665 -0.245 1
1 1152 . 15 1 1 A 95 95 VAL HA H 95 3.760 3.516 0.244 1
1 1160 . 15 1 1 A 95 95 VAL C C 95 178.300 177.986 0.314 1
1 1161 . 15 1 1 A 95 95 VAL CA C 95 66.600 66.294 0.306 1
1 1162 . 15 1 1 A 95 95 VAL CB C 95 31.900 31.469 0.431 1
1 1165 . 15 1 1 A 95 95 VAL N N 95 121.500 119.903 1.597 1
1 1166 . 15 1 1 A 96 96 VAL H H 96 8.340 8.268 0.072 1
1 1167 . 15 1 1 A 96 96 VAL HA H 96 3.810 3.459 0.351 1
1 1175 . 15 1 1 A 96 96 VAL C C 96 178.400 176.955 1.445 1
1 1176 . 15 1 1 A 96 96 VAL CA C 96 66.100 64.675 1.425 1
1 1177 . 15 1 1 A 96 96 VAL CB C 96 32.200 31.104 1.096 1
1 1180 . 15 1 1 A 96 96 VAL N N 96 120.000 119.726 0.274 1
1 1181 . 15 1 1 A 97 97 ALA H H 97 8.140 7.645 0.495 1
1 1182 . 15 1 1 A 97 97 ALA HA H 97 4.010 3.980 0.030 1
1 1186 . 15 1 1 A 97 97 ALA C C 97 178.800 178.781 0.019 1
1 1187 . 15 1 1 A 97 97 ALA CA C 97 54.900 55.336 -0.436 1
1 1188 . 15 1 1 A 97 97 ALA CB C 97 19.900 17.985 1.915 1
1 1189 . 15 1 1 A 97 97 ALA N N 97 121.400 123.468 -2.068 1
1 1190 . 15 1 1 A 98 98 ASP H H 98 8.170 8.001 0.169 1
1 1191 . 15 1 1 A 98 98 ASP HA H 98 4.320 4.300 0.020 1
1 1194 . 15 1 1 A 98 98 ASP C C 98 178.100 178.225 -0.125 1
1 1195 . 15 1 1 A 98 98 ASP CA C 98 57.100 57.714 -0.614 1
1 1196 . 15 1 1 A 98 98 ASP CB C 98 41.800 41.396 0.404 1
1 1197 . 15 1 1 A 98 98 ASP N N 98 118.500 118.482 0.018 1
1 1198 . 15 1 1 A 99 99 GLU H H 99 8.220 8.485 -0.265 1
1 1199 . 15 1 1 A 99 99 GLU HA H 99 4.000 4.210 -0.210 1
1 1204 . 15 1 1 A 99 99 GLU C C 99 178.300 177.780 0.520 1
1 1205 . 15 1 1 A 99 99 GLU CA C 99 58.300 58.450 -0.150 1
1 1206 . 15 1 1 A 99 99 GLU CB C 99 29.800 28.119 1.681 1
1 1208 . 15 1 1 A 99 99 GLU N N 99 116.600 117.285 -0.685 1
1 1209 . 15 1 1 A 100 100 HIS H H 100 7.980 7.586 0.394 1
1 1210 . 15 1 1 A 100 100 HIS HA H 100 4.600 4.390 0.210 1
1 1214 . 15 1 1 A 100 100 HIS C C 100 175.900 177.413 -1.513 1
1 1215 . 15 1 1 A 100 100 HIS CA C 100 57.500 59.048 -1.548 1
1 1216 . 15 1 1 A 100 100 HIS CB C 100 30.800 30.353 0.447 1
1 1218 . 15 1 1 A 100 100 HIS N N 100 114.000 117.448 -3.448 1
1 1219 . 15 1 1 A 101 101 LEU H H 101 7.920 7.362 0.558 1
1 1220 . 15 1 1 A 101 101 LEU HA H 101 4.370 4.194 0.176 1
1 1230 . 15 1 1 A 101 101 LEU C C 101 177.700 176.793 0.907 1
1 1231 . 15 1 1 A 101 101 LEU CA C 101 55.900 55.172 0.728 1
1 1232 . 15 1 1 A 101 101 LEU CB C 101 42.100 42.491 -0.391 1
1 1236 . 15 1 1 A 101 101 LEU N N 101 118.500 119.245 -0.745 1
1 1237 . 15 1 1 A 102 102 GLU H H 102 8.100 7.444 0.656 1
1 1238 . 15 1 1 A 102 102 GLU HA H 102 4.160 4.175 -0.015 1
1 1243 . 15 1 1 A 102 102 GLU C C 102 176.700 176.257 0.443 1
1 1244 . 15 1 1 A 102 102 GLU CA C 102 57.000 55.371 1.629 1
1 1245 . 15 1 1 A 102 102 GLU CB C 102 29.900 30.373 -0.473 1
1 1247 . 15 1 1 A 102 102 GLU N N 102 119.100 120.426 -1.326 1
1 1248 . 15 1 1 A 103 103 HIS H H 103 8.010 8.305 -0.295 1
1 1249 . 15 1 1 A 103 103 HIS HA H 103 4.520 4.448 0.072 1
1 1252 . 15 1 1 A 103 103 HIS CA C 103 56.100 57.326 -1.226 1
1 1253 . 15 1 1 A 103 103 HIS CB C 103 29.700 29.505 0.195 1
1 1254 . 15 1 1 A 103 103 HIS N N 103 117.300 121.272 -3.972 1
1 1255 . 15 1 1 A 107 107 HIS HA H 107 4.560 4.702 -0.142 1
1 1258 . 15 1 1 A 107 107 HIS C C 107 173.900 173.061 0.839 1
1 1259 . 15 1 1 A 107 107 HIS CA C 107 55.900 54.311 1.589 1
1 1260 . 15 1 1 A 107 107 HIS CB C 107 30.200 34.264 -4.064 1
1 4 . 16 1 1 A 2 2 ALA H H 2 8.450 7.598 0.852 1
1 5 . 16 1 1 A 2 2 ALA HA H 2 4.390 4.649 -0.259 1
1 9 . 16 1 1 A 2 2 ALA C C 2 178.300 176.851 1.449 1
1 10 . 16 1 1 A 2 2 ALA CA C 2 52.500 52.127 0.373 1
1 11 . 16 1 1 A 2 2 ALA CB C 2 19.200 20.429 -1.229 1
1 12 . 16 1 1 A 2 2 ALA N N 2 125.100 118.820 6.280 1
1 13 . 16 1 1 A 3 3 GLY H H 3 8.450 8.487 -0.037 1
1 14 . 16 1 1 A 3 3 GLY HA2 H 3 4.030 4.038 -0.008 1
1 15 . 16 1 1 A 3 3 GLY HA3 H 3 4.030 4.038 -0.008 1
1 16 . 16 1 1 A 3 3 GLY C C 3 174.100 174.894 -0.794 1
1 17 . 16 1 1 A 3 3 GLY CA C 3 45.200 46.142 -0.942 1
1 18 . 16 1 1 A 3 3 GLY N N 3 108.000 111.010 -3.010 1
1 19 . 16 1 1 A 4 4 GLN H H 4 8.550 8.067 0.483 1
1 20 . 16 1 1 A 4 4 GLN HA H 4 4.340 3.982 0.358 1
1 27 . 16 1 1 A 4 4 GLN C C 4 176.700 174.697 2.003 1
1 28 . 16 1 1 A 4 4 GLN CA C 4 56.600 57.164 -0.564 1
1 29 . 16 1 1 A 4 4 GLN CB C 4 29.300 26.217 3.083 1
1 31 . 16 1 1 A 4 4 GLN N N 4 120.500 114.645 5.855 1
1 33 . 16 1 1 A 5 5 SER H H 5 8.540 7.849 0.691 1
1 34 . 16 1 1 A 5 5 SER HA H 5 4.390 4.750 -0.360 1
1 38 . 16 1 1 A 5 5 SER C C 5 174.800 174.130 0.670 1
1 39 . 16 1 1 A 5 5 SER CA C 5 59.100 59.336 -0.236 1
1 40 . 16 1 1 A 5 5 SER CB C 5 63.500 64.256 -0.756 1
1 41 . 16 1 1 A 5 5 SER N N 5 117.100 112.919 4.181 1
1 42 . 16 1 1 A 6 6 ASP H H 6 8.300 8.092 0.208 1
1 43 . 16 1 1 A 6 6 ASP HA H 6 4.540 4.404 0.136 1
1 46 . 16 1 1 A 6 6 ASP C C 6 177.300 175.883 1.417 1
1 47 . 16 1 1 A 6 6 ASP CA C 6 55.100 55.441 -0.341 1
1 48 . 16 1 1 A 6 6 ASP CB C 6 40.800 39.085 1.715 1
1 49 . 16 1 1 A 6 6 ASP N N 6 122.700 120.564 2.136 1
1 50 . 16 1 1 A 7 7 ARG H H 7 8.270 8.060 0.210 1
1 51 . 16 1 1 A 7 7 ARG HA H 7 4.150 4.023 0.127 1
1 58 . 16 1 1 A 7 7 ARG C C 7 177.600 178.705 -1.105 1
1 59 . 16 1 1 A 7 7 ARG CA C 7 58.000 59.476 -1.476 1
1 60 . 16 1 1 A 7 7 ARG CB C 7 30.100 29.828 0.272 1
1 63 . 16 1 1 A 7 7 ARG N N 7 122.100 118.785 3.315 1
1 64 . 16 1 1 A 8 8 LYS H H 8 8.130 7.924 0.206 1
1 65 . 16 1 1 A 8 8 LYS HA H 8 4.090 4.142 -0.052 1
1 74 . 16 1 1 A 8 8 LYS C C 8 177.600 178.654 -1.054 1
1 75 . 16 1 1 A 8 8 LYS CA C 8 58.400 58.444 -0.044 1
1 76 . 16 1 1 A 8 8 LYS CB C 8 31.700 32.085 -0.385 1
1 80 . 16 1 1 A 8 8 LYS N N 8 120.900 119.410 1.490 1
1 81 . 16 1 1 A 9 9 ALA H H 9 8.050 7.926 0.124 1
1 82 . 16 1 1 A 9 9 ALA HA H 9 3.950 4.117 -0.167 1
1 86 . 16 1 1 A 9 9 ALA C C 9 179.800 179.909 -0.109 1
1 87 . 16 1 1 A 9 9 ALA CA C 9 55.100 55.042 0.058 1
1 88 . 16 1 1 A 9 9 ALA CB C 9 18.100 17.837 0.263 1
1 89 . 16 1 1 A 9 9 ALA N N 9 121.600 121.801 -0.201 1
1 90 . 16 1 1 A 10 10 ALA H H 10 7.910 7.754 0.156 1
1 91 . 16 1 1 A 10 10 ALA HA H 10 4.200 4.136 0.064 1
1 95 . 16 1 1 A 10 10 ALA C C 10 180.500 180.435 0.065 1
1 96 . 16 1 1 A 10 10 ALA CA C 10 54.600 55.085 -0.485 1
1 97 . 16 1 1 A 10 10 ALA CB C 10 18.100 18.248 -0.148 1
1 98 . 16 1 1 A 10 10 ALA N N 10 120.200 120.809 -0.609 1
1 99 . 16 1 1 A 11 11 LEU H H 11 8.080 8.205 -0.125 1
1 100 . 16 1 1 A 11 11 LEU HA H 11 4.120 4.039 0.081 1
1 110 . 16 1 1 A 11 11 LEU C C 11 179.600 179.635 -0.035 1
1 111 . 16 1 1 A 11 11 LEU CA C 11 57.800 57.642 0.158 1
1 112 . 16 1 1 A 11 11 LEU CB C 11 41.700 41.554 0.146 1
1 115 . 16 1 1 A 11 11 LEU N N 11 120.900 119.675 1.225 1
1 116 . 16 1 1 A 12 12 LEU H H 12 8.480 8.499 -0.019 1
1 117 . 16 1 1 A 12 12 LEU HA H 12 4.040 4.060 -0.020 1
1 127 . 16 1 1 A 12 12 LEU C C 12 178.900 179.187 -0.287 1
1 128 . 16 1 1 A 12 12 LEU CA C 12 58.100 57.672 0.428 1
1 129 . 16 1 1 A 12 12 LEU CB C 12 40.100 40.994 -0.894 1
1 133 . 16 1 1 A 12 12 LEU N N 12 118.700 118.684 0.016 1
1 134 . 16 1 1 A 13 13 ASP H H 13 7.990 8.526 -0.536 1
1 135 . 16 1 1 A 13 13 ASP HA H 13 4.420 4.250 0.170 1
1 138 . 16 1 1 A 13 13 ASP C C 13 178.900 178.453 0.447 1
1 139 . 16 1 1 A 13 13 ASP CA C 13 57.500 58.011 -0.511 1
1 140 . 16 1 1 A 13 13 ASP CB C 13 40.500 41.285 -0.785 1
1 141 . 16 1 1 A 13 13 ASP N N 13 119.500 119.981 -0.481 1
1 142 . 16 1 1 A 14 14 GLN H H 14 7.620 7.630 -0.010 1
1 143 . 16 1 1 A 14 14 GLN HA H 14 4.230 3.999 0.231 1
1 150 . 16 1 1 A 14 14 GLN C C 14 178.400 178.951 -0.551 1
1 151 . 16 1 1 A 14 14 GLN CA C 14 58.100 58.903 -0.803 1
1 152 . 16 1 1 A 14 14 GLN CB C 14 27.800 28.600 -0.800 1
1 154 . 16 1 1 A 14 14 GLN N N 14 118.900 119.135 -0.235 1
1 156 . 16 1 1 A 15 15 VAL H H 15 8.480 8.144 0.336 1
1 157 . 16 1 1 A 15 15 VAL HA H 15 3.380 3.595 -0.215 1
1 165 . 16 1 1 A 15 15 VAL C C 15 177.600 178.143 -0.543 1
1 166 . 16 1 1 A 15 15 VAL CA C 15 66.600 66.423 0.177 1
1 167 . 16 1 1 A 15 15 VAL CB C 15 30.500 31.594 -1.094 1
1 170 . 16 1 1 A 15 15 VAL N N 15 121.300 120.359 0.941 1
1 171 . 16 1 1 A 16 16 ALA H H 16 8.080 8.645 -0.565 1
1 172 . 16 1 1 A 16 16 ALA HA H 16 4.450 3.993 0.457 1
1 176 . 16 1 1 A 16 16 ALA C C 16 179.100 179.941 -0.841 1
1 177 . 16 1 1 A 16 16 ALA CA C 16 54.600 54.893 -0.293 1
1 178 . 16 1 1 A 16 16 ALA CB C 16 17.700 18.074 -0.374 1
1 179 . 16 1 1 A 16 16 ALA N N 16 121.400 121.303 0.097 1
1 180 . 16 1 1 A 17 17 ARG H H 17 7.480 8.018 -0.538 1
1 181 . 16 1 1 A 17 17 ARG HA H 17 3.910 4.110 -0.200 1
1 187 . 16 1 1 A 17 17 ARG C C 17 179.700 179.204 0.496 1
1 188 . 16 1 1 A 17 17 ARG CA C 17 59.700 59.109 0.591 1
1 189 . 16 1 1 A 17 17 ARG CB C 17 30.400 29.891 0.509 1
1 191 . 16 1 1 A 17 17 ARG N N 17 116.900 119.250 -2.350 1
1 192 . 16 1 1 A 18 18 VAL H H 18 7.960 7.703 0.257 1
1 193 . 16 1 1 A 18 18 VAL HA H 18 3.690 3.675 0.015 1
1 201 . 16 1 1 A 18 18 VAL C C 18 177.900 177.817 0.083 1
1 202 . 16 1 1 A 18 18 VAL CA C 18 66.600 65.976 0.624 1
1 203 . 16 1 1 A 18 18 VAL CB C 18 31.300 31.662 -0.362 1
1 206 . 16 1 1 A 18 18 VAL N N 18 123.000 119.524 3.476 1
1 207 . 16 1 1 A 19 19 GLY H H 19 8.270 7.898 0.372 1
1 208 . 16 1 1 A 19 19 GLY HA2 H 19 3.430 3.742 -0.312 1
1 209 . 16 1 1 A 19 19 GLY HA3 H 19 3.430 3.749 -0.319 1
1 210 . 16 1 1 A 19 19 GLY C C 19 174.400 175.596 -1.196 1
1 211 . 16 1 1 A 19 19 GLY CA C 19 48.500 47.262 1.238 1
1 212 . 16 1 1 A 19 19 GLY N N 19 105.400 107.636 -2.236 1
1 213 . 16 1 1 A 20 20 LYS H H 20 8.250 8.610 -0.360 1
1 214 . 16 1 1 A 20 20 LYS HA H 20 3.710 4.153 -0.443 1
1 223 . 16 1 1 A 20 20 LYS C C 20 179.400 178.286 1.114 1
1 224 . 16 1 1 A 20 20 LYS CA C 20 59.300 58.456 0.844 1
1 225 . 16 1 1 A 20 20 LYS CB C 20 32.600 32.044 0.556 1
1 229 . 16 1 1 A 20 20 LYS N N 20 118.700 121.706 -3.006 1
1 230 . 16 1 1 A 21 21 ALA H H 21 7.640 7.728 -0.088 1
1 231 . 16 1 1 A 21 21 ALA HA H 21 3.790 4.217 -0.427 1
1 235 . 16 1 1 A 21 21 ALA C C 21 177.900 178.609 -0.709 1
1 236 . 16 1 1 A 21 21 ALA CA C 21 55.200 53.019 2.181 1
1 237 . 16 1 1 A 21 21 ALA CB C 21 19.200 19.149 0.051 1
1 238 . 16 1 1 A 21 21 ALA N N 21 121.700 121.037 0.663 1
1 239 . 16 1 1 A 22 22 LEU H H 22 7.330 7.883 -0.553 1
1 240 . 16 1 1 A 22 22 LEU HA H 22 4.140 4.338 -0.198 1
1 250 . 16 1 1 A 22 22 LEU C C 22 176.800 177.724 -0.924 1
1 251 . 16 1 1 A 22 22 LEU CA C 22 54.600 56.276 -1.676 1
1 252 . 16 1 1 A 22 22 LEU CB C 22 42.900 42.879 0.021 1
1 256 . 16 1 1 A 22 22 LEU N N 22 114.200 118.783 -4.583 1
1 257 . 16 1 1 A 23 23 ALA H H 23 7.160 7.727 -0.567 1
1 258 . 16 1 1 A 23 23 ALA HA H 23 4.720 4.375 0.345 1
1 262 . 16 1 1 A 23 23 ALA C C 23 176.700 176.103 0.597 1
1 263 . 16 1 1 A 23 23 ALA CA C 23 53.000 51.882 1.118 1
1 264 . 16 1 1 A 23 23 ALA CB C 23 18.200 17.405 0.795 1
1 265 . 16 1 1 A 23 23 ALA N N 23 118.200 120.628 -2.428 1
1 266 . 16 1 1 A 24 24 ASN H H 24 7.440 8.042 -0.602 1
1 267 . 16 1 1 A 24 24 ASN HA H 24 4.730 4.907 -0.177 1
1 272 . 16 1 1 A 24 24 ASN C C 24 174.800 175.502 -0.702 1
1 273 . 16 1 1 A 24 24 ASN CA C 24 53.500 53.009 0.491 1
1 274 . 16 1 1 A 24 24 ASN CB C 24 41.700 40.343 1.357 1
1 275 . 16 1 1 A 24 24 ASN N N 24 116.800 118.577 -1.777 1
1 277 . 16 1 1 A 25 25 GLY H H 25 9.370 8.951 0.419 1
1 278 . 16 1 1 A 25 25 GLY HA2 H 25 3.650 3.853 -0.203 1
1 279 . 16 1 1 A 25 25 GLY HA3 H 25 4.110 3.870 0.240 1
1 280 . 16 1 1 A 25 25 GLY C C 25 175.300 175.450 -0.150 1
1 281 . 16 1 1 A 25 25 GLY CA C 25 47.600 47.205 0.395 1
1 282 . 16 1 1 A 25 25 GLY N N 25 114.800 113.930 0.870 1
1 283 . 16 1 1 A 26 26 ARG H H 26 8.050 8.019 0.031 1
1 284 . 16 1 1 A 26 26 ARG HA H 26 4.150 3.979 0.171 1
1 289 . 16 1 1 A 26 26 ARG C C 26 179.300 178.977 0.323 1
1 290 . 16 1 1 A 26 26 ARG CA C 26 57.000 59.285 -2.285 1
1 291 . 16 1 1 A 26 26 ARG CB C 26 29.900 29.921 -0.021 1
1 294 . 16 1 1 A 26 26 ARG N N 26 120.500 121.752 -1.252 1
1 295 . 16 1 1 A 27 27 ARG H H 27 7.930 8.314 -0.384 1
1 296 . 16 1 1 A 27 27 ARG HA H 27 3.710 4.107 -0.397 1
1 301 . 16 1 1 A 27 27 ARG C C 27 178.300 177.425 0.875 1
1 302 . 16 1 1 A 27 27 ARG CA C 27 61.000 58.464 2.536 1
1 303 . 16 1 1 A 27 27 ARG CB C 27 30.400 29.727 0.673 1
1 305 . 16 1 1 A 27 27 ARG N N 27 117.900 118.659 -0.759 1
1 306 . 16 1 1 A 28 28 LEU H H 28 7.640 7.764 -0.124 1
1 307 . 16 1 1 A 28 28 LEU HA H 28 3.950 4.157 -0.207 1
1 317 . 16 1 1 A 28 28 LEU C C 28 178.200 178.523 -0.323 1
1 318 . 16 1 1 A 28 28 LEU CA C 28 57.600 56.000 1.600 1
1 319 . 16 1 1 A 28 28 LEU CB C 28 41.900 41.656 0.244 1
1 323 . 16 1 1 A 28 28 LEU N N 28 117.600 120.638 -3.038 1
1 324 . 16 1 1 A 29 29 GLN H H 29 8.110 7.738 0.372 1
1 325 . 16 1 1 A 29 29 GLN HA H 29 3.880 4.150 -0.270 1
1 332 . 16 1 1 A 29 29 GLN C C 29 179.400 179.082 0.318 1
1 333 . 16 1 1 A 29 29 GLN CA C 29 59.100 58.602 0.498 1
1 334 . 16 1 1 A 29 29 GLN CB C 29 28.800 28.254 0.546 1
1 336 . 16 1 1 A 29 29 GLN N N 29 119.300 118.362 0.938 1
1 338 . 16 1 1 A 30 30 ILE H H 30 7.530 7.590 -0.060 1
1 339 . 16 1 1 A 30 30 ILE HA H 30 3.340 3.624 -0.284 1
1 349 . 16 1 1 A 30 30 ILE C C 30 176.700 178.336 -1.636 1
1 350 . 16 1 1 A 30 30 ILE CA C 30 65.900 65.380 0.520 1
1 351 . 16 1 1 A 30 30 ILE CB C 30 37.400 37.764 -0.364 1
1 355 . 16 1 1 A 30 30 ILE N N 30 118.600 120.833 -2.233 1
1 356 . 16 1 1 A 31 31 LEU H H 31 7.500 8.104 -0.604 1
1 357 . 16 1 1 A 31 31 LEU HA H 31 3.520 3.799 -0.279 1
1 367 . 16 1 1 A 31 31 LEU C C 31 177.300 178.630 -1.330 1
1 368 . 16 1 1 A 31 31 LEU CA C 31 58.100 57.592 0.508 1
1 369 . 16 1 1 A 31 31 LEU CB C 31 41.100 40.099 1.001 1
1 373 . 16 1 1 A 31 31 LEU N N 31 119.900 119.351 0.549 1
1 374 . 16 1 1 A 32 32 ASP H H 32 7.950 8.244 -0.294 1
1 375 . 16 1 1 A 32 32 ASP HA H 32 4.300 4.357 -0.057 1
1 378 . 16 1 1 A 32 32 ASP C C 32 178.300 178.386 -0.086 1
1 379 . 16 1 1 A 32 32 ASP CA C 32 57.400 57.603 -0.203 1
1 380 . 16 1 1 A 32 32 ASP CB C 32 42.400 42.008 0.392 1
1 381 . 16 1 1 A 32 32 ASP N N 32 116.900 119.935 -3.035 1
1 382 . 16 1 1 A 33 33 LEU H H 33 7.350 7.404 -0.054 1
1 383 . 16 1 1 A 33 33 LEU HA H 33 4.130 4.131 -0.001 1
1 393 . 16 1 1 A 33 33 LEU C C 33 180.000 178.939 1.061 1
1 394 . 16 1 1 A 33 33 LEU CA C 33 57.600 57.338 0.262 1
1 395 . 16 1 1 A 33 33 LEU CB C 33 42.300 42.146 0.154 1
1 399 . 16 1 1 A 33 33 LEU N N 33 118.600 119.965 -1.365 1
1 400 . 16 1 1 A 34 34 LEU H H 34 8.300 8.332 -0.032 1
1 401 . 16 1 1 A 34 34 LEU HA H 34 4.490 4.192 0.298 1
1 411 . 16 1 1 A 34 34 LEU C C 34 178.900 179.224 -0.324 1
1 412 . 16 1 1 A 34 34 LEU CA C 34 55.800 57.332 -1.532 1
1 413 . 16 1 1 A 34 34 LEU CB C 34 41.300 40.837 0.463 1
1 417 . 16 1 1 A 34 34 LEU N N 34 117.800 118.763 -0.963 1
1 418 . 16 1 1 A 35 35 ALA H H 35 8.160 8.138 0.022 1
1 419 . 16 1 1 A 35 35 ALA HA H 35 4.050 4.085 -0.035 1
1 423 . 16 1 1 A 35 35 ALA C C 35 179.000 178.402 0.598 1
1 424 . 16 1 1 A 35 35 ALA CA C 35 54.900 54.408 0.492 1
1 425 . 16 1 1 A 35 35 ALA CB C 35 17.500 18.342 -0.842 1
1 426 . 16 1 1 A 35 35 ALA N N 35 123.900 122.165 1.735 1
1 427 . 16 1 1 A 36 36 GLN H H 36 7.600 7.652 -0.052 1
1 428 . 16 1 1 A 36 36 GLN HA H 36 4.340 4.274 0.066 1
1 435 . 16 1 1 A 36 36 GLN C C 36 176.100 175.890 0.210 1
1 436 . 16 1 1 A 36 36 GLN CA C 36 55.800 56.287 -0.487 1
1 437 . 16 1 1 A 36 36 GLN CB C 36 29.000 29.412 -0.412 1
1 439 . 16 1 1 A 36 36 GLN N N 36 113.300 113.792 -0.492 1
1 441 . 16 1 1 A 37 37 GLY H H 37 7.550 7.173 0.377 1
1 442 . 16 1 1 A 37 37 GLY HA2 H 37 3.730 4.078 -0.348 1
1 443 . 16 1 1 A 37 37 GLY HA3 H 37 4.490 4.082 0.408 1
1 444 . 16 1 1 A 37 37 GLY C C 37 171.500 172.806 -1.306 1
1 445 . 16 1 1 A 37 37 GLY CA C 37 44.500 44.818 -0.318 1
1 446 . 16 1 1 A 37 37 GLY N N 37 108.400 106.140 2.260 1
1 447 . 16 1 1 A 38 38 GLU H H 38 8.120 8.570 -0.450 1
1 448 . 16 1 1 A 38 38 GLU HA H 38 4.820 4.429 0.391 1
1 453 . 16 1 1 A 38 38 GLU C C 38 177.000 176.333 0.667 1
1 454 . 16 1 1 A 38 38 GLU CA C 38 56.400 56.553 -0.153 1
1 455 . 16 1 1 A 38 38 GLU CB C 38 31.200 29.907 1.293 1
1 457 . 16 1 1 A 38 38 GLU N N 38 119.600 118.389 1.211 1
1 458 . 16 1 1 A 39 39 ARG H H 39 8.580 9.088 -0.508 1
1 459 . 16 1 1 A 39 39 ARG HA H 39 4.970 4.866 0.104 1
1 467 . 16 1 1 A 39 39 ARG C C 39 174.800 175.408 -0.608 1
1 468 . 16 1 1 A 39 39 ARG CA C 39 53.900 54.406 -0.506 1
1 469 . 16 1 1 A 39 39 ARG CB C 39 36.400 33.383 3.017 1
1 472 . 16 1 1 A 39 39 ARG N N 39 121.500 124.577 -3.077 1
1 474 . 16 1 1 A 40 40 ALA H H 40 8.910 8.820 0.090 1
1 475 . 16 1 1 A 40 40 ALA HA H 40 4.920 4.120 0.800 1
1 479 . 16 1 1 A 40 40 ALA C C 40 179.200 178.281 0.919 1
1 480 . 16 1 1 A 40 40 ALA CA C 40 51.100 51.936 -0.836 1
1 481 . 16 1 1 A 40 40 ALA CB C 40 19.200 19.071 0.129 1
1 482 . 16 1 1 A 40 40 ALA N N 40 125.100 125.638 -0.538 1
1 483 . 16 1 1 A 41 41 VAL H H 41 8.420 8.486 -0.066 1
1 484 . 16 1 1 A 41 41 VAL HA H 41 3.430 3.551 -0.121 1
1 492 . 16 1 1 A 41 41 VAL C C 41 176.800 177.176 -0.376 1
1 493 . 16 1 1 A 41 41 VAL CA C 41 67.600 66.626 0.974 1
1 494 . 16 1 1 A 41 41 VAL CB C 41 31.600 31.491 0.109 1
1 497 . 16 1 1 A 41 41 VAL N N 41 120.900 121.434 -0.534 1
1 498 . 16 1 1 A 42 42 GLU H H 42 9.640 8.260 1.380 1
1 499 . 16 1 1 A 42 42 GLU HA H 42 3.880 3.977 -0.097 1
1 504 . 16 1 1 A 42 42 GLU C C 42 178.300 178.729 -0.429 1
1 505 . 16 1 1 A 42 42 GLU CA C 42 60.600 59.275 1.325 1
1 506 . 16 1 1 A 42 42 GLU CB C 42 28.300 29.577 -1.277 1
1 508 . 16 1 1 A 42 42 GLU N N 42 119.000 119.528 -0.528 1
1 509 . 16 1 1 A 43 43 ALA H H 43 6.870 7.836 -0.966 1
1 510 . 16 1 1 A 43 43 ALA HA H 43 4.290 4.048 0.242 1
1 514 . 16 1 1 A 43 43 ALA C C 43 180.700 180.035 0.665 1
1 515 . 16 1 1 A 43 43 ALA CA C 43 54.100 55.116 -1.016 1
1 516 . 16 1 1 A 43 43 ALA CB C 43 19.100 18.230 0.870 1
1 517 . 16 1 1 A 43 43 ALA N N 43 120.500 121.788 -1.288 1
1 518 . 16 1 1 A 44 44 ILE H H 44 7.970 7.947 0.023 1
1 519 . 16 1 1 A 44 44 ILE HA H 44 3.470 3.569 -0.099 1
1 529 . 16 1 1 A 44 44 ILE C C 44 178.300 177.825 0.475 1
1 530 . 16 1 1 A 44 44 ILE CA C 44 64.700 65.557 -0.857 1
1 531 . 16 1 1 A 44 44 ILE CB C 44 38.100 38.208 -0.108 1
1 535 . 16 1 1 A 44 44 ILE N N 44 120.500 119.703 0.797 1
1 536 . 16 1 1 A 45 45 ALA H H 45 8.460 8.205 0.255 1
1 537 . 16 1 1 A 45 45 ALA HA H 45 3.720 4.011 -0.291 1
1 541 . 16 1 1 A 45 45 ALA C C 45 178.500 179.705 -1.205 1
1 542 . 16 1 1 A 45 45 ALA CA C 45 56.200 55.235 0.965 1
1 543 . 16 1 1 A 45 45 ALA CB C 45 17.400 18.475 -1.075 1
1 544 . 16 1 1 A 45 45 ALA N N 45 124.500 122.092 2.408 1
1 545 . 16 1 1 A 46 46 THR H H 46 8.080 8.235 -0.155 1
1 546 . 16 1 1 A 46 46 THR HA H 46 3.900 3.830 0.070 1
1 551 . 16 1 1 A 46 46 THR C C 46 177.200 176.559 0.641 1
1 552 . 16 1 1 A 46 46 THR CA C 46 66.400 67.248 -0.848 1
1 553 . 16 1 1 A 46 46 THR CB C 46 68.800 68.751 0.049 1
1 555 . 16 1 1 A 46 46 THR N N 46 112.400 114.871 -2.471 1
1 556 . 16 1 1 A 47 47 ALA H H 47 7.930 8.093 -0.163 1
1 557 . 16 1 1 A 47 47 ALA HA H 47 4.200 4.140 0.060 1
1 561 . 16 1 1 A 47 47 ALA C C 47 179.200 179.726 -0.526 1
1 562 . 16 1 1 A 47 47 ALA CA C 47 54.800 55.246 -0.446 1
1 563 . 16 1 1 A 47 47 ALA CB C 47 19.800 18.105 1.695 1
1 564 . 16 1 1 A 47 47 ALA N N 47 121.400 123.666 -2.266 1
1 565 . 16 1 1 A 48 48 THR H H 48 7.560 7.744 -0.184 1
1 566 . 16 1 1 A 48 48 THR HA H 48 4.390 4.321 0.069 1
1 571 . 16 1 1 A 48 48 THR C C 48 175.700 175.612 0.088 1
1 572 . 16 1 1 A 48 48 THR CA C 48 61.800 62.913 -1.113 1
1 573 . 16 1 1 A 48 48 THR CB C 48 71.000 70.405 0.595 1
1 575 . 16 1 1 A 48 48 THR N N 48 103.500 106.669 -3.169 1
1 576 . 16 1 1 A 49 49 GLY H H 49 7.820 8.599 -0.779 1
1 577 . 16 1 1 A 49 49 GLY HA2 H 49 3.870 3.964 -0.094 1
1 578 . 16 1 1 A 49 49 GLY HA3 H 49 4.100 3.966 0.134 1
1 579 . 16 1 1 A 49 49 GLY C C 49 174.400 174.955 -0.555 1
1 580 . 16 1 1 A 49 49 GLY CA C 49 46.300 46.450 -0.150 1
1 581 . 16 1 1 A 49 49 GLY N N 49 111.100 112.447 -1.347 1
1 582 . 16 1 1 A 50 50 MET H H 50 7.930 8.106 -0.176 1
1 583 . 16 1 1 A 50 50 MET HA H 50 4.540 5.028 -0.488 1
1 591 . 16 1 1 A 50 50 MET C C 50 174.800 175.018 -0.218 1
1 592 . 16 1 1 A 50 50 MET CA C 50 55.100 53.307 1.793 1
1 593 . 16 1 1 A 50 50 MET CB C 50 37.200 36.257 0.943 1
1 596 . 16 1 1 A 50 50 MET N N 50 119.300 115.994 3.306 1
1 597 . 16 1 1 A 51 51 ASN H H 51 8.040 8.808 -0.768 1
1 598 . 16 1 1 A 51 51 ASN HA H 51 4.580 4.865 -0.285 1
1 601 . 16 1 1 A 51 51 ASN C C 51 176.100 177.254 -1.154 1
1 602 . 16 1 1 A 51 51 ASN CA C 51 52.800 53.058 -0.258 1
1 603 . 16 1 1 A 51 51 ASN CB C 51 41.100 39.293 1.807 1
1 604 . 16 1 1 A 51 51 ASN N N 51 118.000 117.151 0.849 1
1 605 . 16 1 1 A 52 52 LEU H H 52 8.560 8.782 -0.222 1
1 606 . 16 1 1 A 52 52 LEU HA H 52 3.760 3.924 -0.164 1
1 616 . 16 1 1 A 52 52 LEU C C 52 179.600 178.742 0.858 1
1 617 . 16 1 1 A 52 52 LEU CA C 52 59.000 57.832 1.168 1
1 618 . 16 1 1 A 52 52 LEU CB C 52 41.800 41.452 0.348 1
1 622 . 16 1 1 A 52 52 LEU N N 52 120.600 123.586 -2.986 1
1 623 . 16 1 1 A 53 53 THR H H 53 8.230 8.038 0.192 1
1 624 . 16 1 1 A 53 53 THR HA H 53 3.880 4.160 -0.280 1
1 629 . 16 1 1 A 53 53 THR C C 53 176.900 177.232 -0.332 1
1 630 . 16 1 1 A 53 53 THR CA C 53 66.500 65.916 0.584 1
1 631 . 16 1 1 A 53 53 THR CB C 53 68.400 68.385 0.015 1
1 633 . 16 1 1 A 53 53 THR N N 53 115.800 115.718 0.082 1
1 634 . 16 1 1 A 54 54 THR H H 54 8.420 8.035 0.385 1
1 635 . 16 1 1 A 54 54 THR HA H 54 3.880 3.866 0.014 1
1 640 . 16 1 1 A 54 54 THR C C 54 177.300 176.132 1.168 1
1 641 . 16 1 1 A 54 54 THR CA C 54 66.600 66.343 0.257 1
1 642 . 16 1 1 A 54 54 THR CB C 54 66.600 68.572 -1.972 1
1 644 . 16 1 1 A 54 54 THR N N 54 122.300 117.222 5.078 1
1 645 . 16 1 1 A 55 55 ALA H H 55 8.860 8.490 0.370 1
1 646 . 16 1 1 A 55 55 ALA HA H 55 4.020 3.973 0.047 1
1 650 . 16 1 1 A 55 55 ALA C C 55 179.000 179.802 -0.802 1
1 651 . 16 1 1 A 55 55 ALA CA C 55 56.100 55.312 0.788 1
1 652 . 16 1 1 A 55 55 ALA CB C 55 17.000 17.923 -0.923 1
1 653 . 16 1 1 A 55 55 ALA N N 55 125.600 123.806 1.794 1
1 654 . 16 1 1 A 56 56 SER H H 56 8.440 8.311 0.129 1
1 655 . 16 1 1 A 56 56 SER HA H 56 3.920 4.003 -0.083 1
1 658 . 16 1 1 A 56 56 SER C C 56 176.400 177.191 -0.791 1
1 659 . 16 1 1 A 56 56 SER CA C 56 62.600 61.284 1.316 1
1 660 . 16 1 1 A 56 56 SER CB C 56 62.700 62.452 0.248 1
1 661 . 16 1 1 A 56 56 SER N N 56 112.700 112.806 -0.106 1
1 662 . 16 1 1 A 57 57 ALA H H 57 8.090 7.923 0.167 1
1 663 . 16 1 1 A 57 57 ALA HA H 57 4.130 3.973 0.157 1
1 667 . 16 1 1 A 57 57 ALA C C 57 181.200 179.663 1.537 1
1 668 . 16 1 1 A 57 57 ALA CA C 57 55.200 55.384 -0.184 1
1 669 . 16 1 1 A 57 57 ALA CB C 57 17.900 17.978 -0.078 1
1 670 . 16 1 1 A 57 57 ALA N N 57 124.000 124.185 -0.185 1
1 671 . 16 1 1 A 58 58 ASN H H 58 7.970 7.800 0.170 1
1 672 . 16 1 1 A 58 58 ASN HA H 58 4.480 4.448 0.032 1
1 677 . 16 1 1 A 58 58 ASN C C 58 177.500 178.085 -0.585 1
1 678 . 16 1 1 A 58 58 ASN CA C 58 56.900 55.871 1.029 1
1 679 . 16 1 1 A 58 58 ASN CB C 58 39.800 38.038 1.762 1
1 680 . 16 1 1 A 58 58 ASN N N 58 117.600 117.106 0.494 1
1 682 . 16 1 1 A 59 59 LEU H H 59 8.530 8.656 -0.126 1
1 683 . 16 1 1 A 59 59 LEU HA H 59 3.710 3.825 -0.115 1
1 693 . 16 1 1 A 59 59 LEU C C 59 178.400 179.126 -0.726 1
1 694 . 16 1 1 A 59 59 LEU CA C 59 58.600 57.876 0.724 1
1 695 . 16 1 1 A 59 59 LEU CB C 59 40.500 40.969 -0.469 1
1 699 . 16 1 1 A 59 59 LEU N N 59 122.600 120.851 1.749 1
1 700 . 16 1 1 A 60 60 GLN H H 60 8.200 8.522 -0.322 1
1 701 . 16 1 1 A 60 60 GLN HA H 60 4.020 3.990 0.030 1
1 708 . 16 1 1 A 60 60 GLN C C 60 178.700 177.789 0.911 1
1 709 . 16 1 1 A 60 60 GLN CA C 60 58.800 59.134 -0.334 1
1 710 . 16 1 1 A 60 60 GLN CB C 60 27.700 28.631 -0.931 1
1 712 . 16 1 1 A 60 60 GLN N N 60 118.900 119.582 -0.682 1
1 714 . 16 1 1 A 61 61 ALA H H 61 7.580 7.603 -0.023 1
1 715 . 16 1 1 A 61 61 ALA HA H 61 4.230 4.233 -0.003 1
1 719 . 16 1 1 A 61 61 ALA C C 61 181.300 180.443 0.857 1
1 720 . 16 1 1 A 61 61 ALA CA C 61 55.100 55.052 0.048 1
1 721 . 16 1 1 A 61 61 ALA CB C 61 17.600 18.236 -0.636 1
1 722 . 16 1 1 A 61 61 ALA N N 61 122.200 122.024 0.176 1
1 723 . 16 1 1 A 62 62 LEU H H 62 7.830 8.079 -0.249 1
1 724 . 16 1 1 A 62 62 LEU HA H 62 3.980 4.023 -0.043 1
1 734 . 16 1 1 A 62 62 LEU C C 62 178.500 179.275 -0.775 1
1 735 . 16 1 1 A 62 62 LEU CA C 62 58.100 57.634 0.466 1
1 736 . 16 1 1 A 62 62 LEU CB C 62 43.300 41.227 2.073 1
1 739 . 16 1 1 A 62 62 LEU N N 62 119.000 119.241 -0.241 1
1 740 . 16 1 1 A 63 63 LYS H H 63 8.580 8.234 0.346 1
1 741 . 16 1 1 A 63 63 LYS HA H 63 4.130 4.102 0.028 1
1 750 . 16 1 1 A 63 63 LYS C C 63 180.500 178.967 1.533 1
1 751 . 16 1 1 A 63 63 LYS CA C 63 59.700 59.199 0.501 1
1 752 . 16 1 1 A 63 63 LYS CB C 63 32.600 32.454 0.146 1
1 756 . 16 1 1 A 63 63 LYS N N 63 123.400 121.847 1.553 1
1 757 . 16 1 1 A 64 64 SER H H 64 8.640 8.366 0.274 1
1 758 . 16 1 1 A 64 64 SER HA H 64 4.300 4.216 0.084 1
1 761 . 16 1 1 A 64 64 SER C C 64 175.000 176.772 -1.772 1
1 762 . 16 1 1 A 64 64 SER CA C 64 61.400 60.905 0.495 1
1 763 . 16 1 1 A 64 64 SER CB C 64 63.000 62.414 0.586 1
1 764 . 16 1 1 A 64 64 SER N N 64 117.700 115.373 2.327 1
1 765 . 16 1 1 A 65 65 GLY H H 65 7.280 8.074 -0.794 1
1 766 . 16 1 1 A 65 65 GLY HA2 H 65 3.240 3.913 -0.673 1
1 767 . 16 1 1 A 65 65 GLY HA3 H 65 3.980 3.914 0.066 1
1 768 . 16 1 1 A 65 65 GLY C C 65 171.300 175.080 -3.780 1
1 769 . 16 1 1 A 65 65 GLY CA C 65 45.100 46.077 -0.977 1
1 770 . 16 1 1 A 65 65 GLY N N 65 104.400 109.454 -5.054 1
1 771 . 16 1 1 A 66 66 GLY H H 66 7.730 7.715 0.015 1
1 772 . 16 1 1 A 66 66 GLY HA2 H 66 3.650 4.022 -0.372 1
1 773 . 16 1 1 A 66 66 GLY HA3 H 66 3.750 4.024 -0.274 1
1 774 . 16 1 1 A 66 66 GLY C C 66 173.700 174.910 -1.210 1
1 775 . 16 1 1 A 66 66 GLY CA C 66 45.400 45.932 -0.532 1
1 776 . 16 1 1 A 66 66 GLY N N 66 104.700 107.968 -3.268 1
1 777 . 16 1 1 A 67 67 LEU H H 67 7.520 8.241 -0.721 1
1 778 . 16 1 1 A 67 67 LEU HA H 67 4.310 4.351 -0.041 1
1 788 . 16 1 1 A 67 67 LEU C C 67 177.700 176.783 0.917 1
1 789 . 16 1 1 A 67 67 LEU CA C 67 55.500 55.695 -0.195 1
1 790 . 16 1 1 A 67 67 LEU CB C 67 42.400 43.002 -0.602 1
1 794 . 16 1 1 A 67 67 LEU N N 67 110.600 118.319 -7.719 1
1 795 . 16 1 1 A 68 68 VAL H H 68 6.890 7.025 -0.135 1
1 796 . 16 1 1 A 68 68 VAL HA H 68 5.190 5.044 0.146 1
1 804 . 16 1 1 A 68 68 VAL C C 68 173.700 174.834 -1.134 1
1 805 . 16 1 1 A 68 68 VAL CA C 68 57.400 58.933 -1.533 1
1 806 . 16 1 1 A 68 68 VAL CB C 68 36.400 34.902 1.498 1
1 809 . 16 1 1 A 68 68 VAL N N 68 106.400 112.953 -6.553 1
1 810 . 16 1 1 A 69 69 GLU H H 69 8.880 9.234 -0.354 1
1 811 . 16 1 1 A 69 69 GLU HA H 69 4.660 4.874 -0.214 1
1 816 . 16 1 1 A 69 69 GLU C C 69 173.300 175.060 -1.760 1
1 817 . 16 1 1 A 69 69 GLU CA C 69 54.300 54.644 -0.344 1
1 818 . 16 1 1 A 69 69 GLU CB C 69 34.100 32.734 1.366 1
1 820 . 16 1 1 A 69 69 GLU N N 69 120.400 121.523 -1.123 1
1 821 . 16 1 1 A 70 70 ALA H H 70 8.730 8.688 0.042 1
1 822 . 16 1 1 A 70 70 ALA HA H 70 4.990 4.727 0.263 1
1 826 . 16 1 1 A 70 70 ALA C C 70 176.500 175.838 0.662 1
1 827 . 16 1 1 A 70 70 ALA CA C 70 50.000 50.268 -0.268 1
1 828 . 16 1 1 A 70 70 ALA CB C 70 22.300 21.483 0.817 1
1 829 . 16 1 1 A 70 70 ALA N N 70 122.800 121.001 1.799 1
1 830 . 16 1 1 A 71 71 ARG H H 71 8.670 8.919 -0.249 1
1 831 . 16 1 1 A 71 71 ARG HA H 71 4.630 4.948 -0.318 1
1 843 . 16 1 1 A 71 71 ARG C C 71 173.500 174.252 -0.752 1
1 844 . 16 1 1 A 71 71 ARG CA C 71 54.600 54.193 0.407 1
1 845 . 16 1 1 A 71 71 ARG CB C 71 33.600 32.352 1.248 1
1 849 . 16 1 1 A 71 71 ARG N N 71 120.100 123.178 -3.078 1
1 851 . 16 1 1 A 72 72 ARG H H 72 8.780 8.884 -0.104 1
1 852 . 16 1 1 A 72 72 ARG HA H 72 5.100 4.792 0.308 1
1 859 . 16 1 1 A 72 72 ARG C C 72 176.000 174.619 1.381 1
1 860 . 16 1 1 A 72 72 ARG CA C 72 54.900 55.151 -0.251 1
1 861 . 16 1 1 A 72 72 ARG CB C 72 32.500 31.589 0.911 1
1 864 . 16 1 1 A 72 72 ARG N N 72 123.600 125.598 -1.998 1
1 865 . 16 1 1 A 73 73 GLU H H 73 8.720 8.937 -0.217 1
1 866 . 16 1 1 A 73 73 GLU HA H 73 4.510 4.696 -0.186 1
1 871 . 16 1 1 A 73 73 GLU C C 73 175.900 176.837 -0.937 1
1 872 . 16 1 1 A 73 73 GLU CA C 73 55.700 55.708 -0.008 1
1 873 . 16 1 1 A 73 73 GLU CB C 73 31.800 29.761 2.039 1
1 875 . 16 1 1 A 73 73 GLU N N 73 126.800 127.234 -0.434 1
1 876 . 16 1 1 A 74 74 GLY H H 74 9.190 8.864 0.326 1
1 877 . 16 1 1 A 74 74 GLY HA2 H 74 3.700 3.883 -0.183 1
1 878 . 16 1 1 A 74 74 GLY HA3 H 74 4.170 3.898 0.272 1
1 879 . 16 1 1 A 74 74 GLY C C 74 175.400 174.898 0.502 1
1 880 . 16 1 1 A 74 74 GLY CA C 74 47.100 47.248 -0.148 1
1 881 . 16 1 1 A 74 74 GLY N N 74 118.500 115.906 2.594 1
1 882 . 16 1 1 A 75 75 THR H H 75 8.780 8.588 0.192 1
1 883 . 16 1 1 A 75 75 THR HA H 75 4.290 4.418 -0.128 1
1 888 . 16 1 1 A 75 75 THR C C 75 174.600 174.133 0.467 1
1 889 . 16 1 1 A 75 75 THR CA C 75 62.000 62.739 -0.739 1
1 890 . 16 1 1 A 75 75 THR CB C 75 69.000 69.950 -0.950 1
1 892 . 16 1 1 A 75 75 THR N N 75 118.000 120.605 -2.605 1
1 893 . 16 1 1 A 76 76 ARG H H 76 8.030 7.595 0.435 1
1 894 . 16 1 1 A 76 76 ARG HA H 76 4.610 4.887 -0.277 1
1 901 . 16 1 1 A 76 76 ARG C C 76 174.800 174.685 0.115 1
1 902 . 16 1 1 A 76 76 ARG CA C 76 55.500 54.436 1.064 1
1 903 . 16 1 1 A 76 76 ARG CB C 76 32.700 33.023 -0.323 1
1 906 . 16 1 1 A 76 76 ARG N N 76 122.600 120.882 1.718 1
1 907 . 16 1 1 A 77 77 GLN H H 77 8.580 8.587 -0.007 1
1 908 . 16 1 1 A 77 77 GLN HA H 77 4.910 5.071 -0.161 1
1 915 . 16 1 1 A 77 77 GLN C C 77 173.900 174.484 -0.584 1
1 916 . 16 1 1 A 77 77 GLN CA C 77 54.700 54.650 0.050 1
1 917 . 16 1 1 A 77 77 GLN CB C 77 31.800 31.466 0.334 1
1 919 . 16 1 1 A 77 77 GLN N N 77 121.900 122.074 -0.174 1
1 921 . 16 1 1 A 78 78 TYR H H 78 8.890 9.636 -0.746 1
1 922 . 16 1 1 A 78 78 TYR HA H 78 4.750 5.353 -0.603 1
1 929 . 16 1 1 A 78 78 TYR C C 78 175.600 174.504 1.096 1
1 930 . 16 1 1 A 78 78 TYR CA C 78 57.000 56.559 0.441 1
1 931 . 16 1 1 A 78 78 TYR CB C 78 41.400 41.304 0.096 1
1 936 . 16 1 1 A 78 78 TYR N N 78 121.800 125.754 -3.954 1
1 937 . 16 1 1 A 79 79 TYR H H 79 9.010 9.491 -0.481 1
1 938 . 16 1 1 A 79 79 TYR HA H 79 5.410 5.423 -0.013 1
1 945 . 16 1 1 A 79 79 TYR C C 79 173.100 175.124 -2.024 1
1 946 . 16 1 1 A 79 79 TYR CA C 79 57.300 56.482 0.818 1
1 947 . 16 1 1 A 79 79 TYR CB C 79 43.300 41.756 1.544 1
1 952 . 16 1 1 A 79 79 TYR N N 79 122.500 120.912 1.588 1
1 953 . 16 1 1 A 80 80 ARG H H 80 8.720 8.752 -0.032 1
1 954 . 16 1 1 A 80 80 ARG HA H 80 5.120 5.037 0.083 1
1 962 . 16 1 1 A 80 80 ARG C C 80 175.500 174.824 0.676 1
1 963 . 16 1 1 A 80 80 ARG CA C 80 53.200 54.126 -0.926 1
1 964 . 16 1 1 A 80 80 ARG CB C 80 33.900 34.008 -0.108 1
1 967 . 16 1 1 A 80 80 ARG N N 80 114.500 120.067 -5.567 1
1 969 . 16 1 1 A 81 81 ILE H H 81 9.300 8.740 0.560 1
1 970 . 16 1 1 A 81 81 ILE HA H 81 4.150 4.189 -0.039 1
1 980 . 16 1 1 A 81 81 ILE C C 81 177.800 177.026 0.774 1
1 981 . 16 1 1 A 81 81 ILE CA C 81 62.300 61.878 0.422 1
1 982 . 16 1 1 A 81 81 ILE CB C 81 37.800 37.591 0.209 1
1 986 . 16 1 1 A 81 81 ILE N N 81 122.100 121.892 0.208 1
1 987 . 16 1 1 A 82 82 ALA H H 82 7.930 8.626 -0.696 1
1 988 . 16 1 1 A 82 82 ALA HA H 82 3.930 4.063 -0.133 1
1 992 . 16 1 1 A 82 82 ALA C C 82 176.300 177.264 -0.964 1
1 993 . 16 1 1 A 82 82 ALA CA C 82 54.200 55.197 -0.997 1
1 994 . 16 1 1 A 82 82 ALA CB C 82 18.500 19.605 -1.105 1
1 995 . 16 1 1 A 82 82 ALA N N 82 127.200 128.152 -0.952 1
1 996 . 16 1 1 A 83 83 GLY H H 83 6.980 7.377 -0.397 1
1 997 . 16 1 1 A 83 83 GLY HA2 H 83 4.090 4.009 0.081 1
1 998 . 16 1 1 A 83 83 GLY HA3 H 83 4.440 4.011 0.429 1
1 999 . 16 1 1 A 83 83 GLY C C 83 173.600 174.911 -1.311 1
1 1000 . 16 1 1 A 83 83 GLY CA C 83 45.200 45.658 -0.458 1
1 1001 . 16 1 1 A 83 83 GLY N N 83 101.800 103.042 -1.242 1
1 1002 . 16 1 1 A 84 84 GLU H H 84 8.930 8.913 0.017 1
1 1003 . 16 1 1 A 84 84 GLU HA H 84 4.120 3.971 0.149 1
1 1008 . 16 1 1 A 84 84 GLU C C 84 178.300 177.715 0.585 1
1 1009 . 16 1 1 A 84 84 GLU CA C 84 58.900 59.295 -0.395 1
1 1010 . 16 1 1 A 84 84 GLU CB C 84 29.400 29.383 0.017 1
1 1012 . 16 1 1 A 84 84 GLU N N 84 120.300 120.319 -0.019 1
1 1013 . 16 1 1 A 85 85 ASP H H 85 8.950 8.020 0.930 1
1 1014 . 16 1 1 A 85 85 ASP HA H 85 4.310 4.418 -0.108 1
1 1017 . 16 1 1 A 85 85 ASP C C 85 178.000 178.823 -0.823 1
1 1018 . 16 1 1 A 85 85 ASP CA C 85 57.100 57.277 -0.177 1
1 1019 . 16 1 1 A 85 85 ASP CB C 85 38.900 40.880 -1.980 1
1 1020 . 16 1 1 A 85 85 ASP N N 85 119.400 119.705 -0.305 1
1 1021 . 16 1 1 A 86 86 VAL H H 86 7.620 8.012 -0.392 1
1 1022 . 16 1 1 A 86 86 VAL HA H 86 3.480 3.554 -0.074 1
1 1030 . 16 1 1 A 86 86 VAL C C 86 177.400 178.080 -0.680 1
1 1031 . 16 1 1 A 86 86 VAL CA C 86 66.800 66.353 0.447 1
1 1032 . 16 1 1 A 86 86 VAL CB C 86 31.300 31.594 -0.294 1
1 1035 . 16 1 1 A 86 86 VAL N N 86 121.600 119.910 1.690 1
1 1036 . 16 1 1 A 87 87 ALA H H 87 7.520 7.930 -0.410 1
1 1037 . 16 1 1 A 87 87 ALA HA H 87 4.110 4.014 0.096 1
1 1041 . 16 1 1 A 87 87 ALA C C 87 181.200 179.858 1.342 1
1 1042 . 16 1 1 A 87 87 ALA CA C 87 55.800 55.768 0.032 1
1 1043 . 16 1 1 A 87 87 ALA CB C 87 17.600 18.542 -0.942 1
1 1044 . 16 1 1 A 87 87 ALA N N 87 122.700 122.100 0.600 1
1 1045 . 16 1 1 A 88 88 ARG H H 88 8.380 8.336 0.044 1
1 1046 . 16 1 1 A 88 88 ARG HA H 88 4.090 4.048 0.042 1
1 1054 . 16 1 1 A 88 88 ARG C C 88 179.100 179.017 0.083 1
1 1055 . 16 1 1 A 88 88 ARG CA C 88 59.600 59.162 0.438 1
1 1056 . 16 1 1 A 88 88 ARG CB C 88 30.500 29.926 0.574 1
1 1059 . 16 1 1 A 88 88 ARG N N 88 119.200 118.657 0.543 1
1 1061 . 16 1 1 A 89 89 LEU H H 89 8.480 7.978 0.502 1
1 1062 . 16 1 1 A 89 89 LEU HA H 89 4.040 4.053 -0.013 1
1 1071 . 16 1 1 A 89 89 LEU C C 89 177.200 178.725 -1.525 1
1 1072 . 16 1 1 A 89 89 LEU CA C 89 58.300 58.090 0.210 1
1 1073 . 16 1 1 A 89 89 LEU CB C 89 41.300 41.864 -0.564 1
1 1076 . 16 1 1 A 89 89 LEU N N 89 123.300 121.678 1.622 1
1 1077 . 16 1 1 A 90 90 PHE H H 90 8.890 8.369 0.521 1
1 1078 . 16 1 1 A 90 90 PHE HA H 90 4.380 4.002 0.378 1
1 1086 . 16 1 1 A 90 90 PHE C C 90 177.500 178.243 -0.743 1
1 1087 . 16 1 1 A 90 90 PHE CA C 90 59.400 62.362 -2.962 1
1 1088 . 16 1 1 A 90 90 PHE CB C 90 38.600 38.937 -0.337 1
1 1094 . 16 1 1 A 90 90 PHE N N 90 119.400 119.468 -0.068 1
1 1095 . 16 1 1 A 91 91 ALA H H 91 7.920 8.156 -0.236 1
1 1096 . 16 1 1 A 91 91 ALA HA H 91 3.940 4.024 -0.084 1
1 1100 . 16 1 1 A 91 91 ALA C C 91 180.200 179.641 0.559 1
1 1101 . 16 1 1 A 91 91 ALA CA C 91 55.100 55.198 -0.098 1
1 1102 . 16 1 1 A 91 91 ALA CB C 91 18.000 17.949 0.051 1
1 1103 . 16 1 1 A 91 91 ALA N N 91 120.500 121.378 -0.878 1
1 1104 . 16 1 1 A 92 92 LEU H H 92 8.190 8.376 -0.186 1
1 1105 . 16 1 1 A 92 92 LEU HA H 92 4.300 4.088 0.212 1
1 1115 . 16 1 1 A 92 92 LEU C C 92 178.900 178.288 0.612 1
1 1116 . 16 1 1 A 92 92 LEU CA C 92 57.500 57.500 0.000 1
1 1117 . 16 1 1 A 92 92 LEU CB C 92 42.100 41.791 0.309 1
1 1121 . 16 1 1 A 92 92 LEU N N 92 120.200 119.920 0.280 1
1 1122 . 16 1 1 A 93 93 VAL H H 93 8.890 8.387 0.503 1
1 1123 . 16 1 1 A 93 93 VAL HA H 93 3.810 3.767 0.043 1
1 1131 . 16 1 1 A 93 93 VAL C C 93 176.900 177.350 -0.450 1
1 1132 . 16 1 1 A 93 93 VAL CA C 93 66.000 64.935 1.065 1
1 1133 . 16 1 1 A 93 93 VAL CB C 93 31.200 31.264 -0.064 1
1 1136 . 16 1 1 A 93 93 VAL N N 93 117.100 118.364 -1.264 1
1 1137 . 16 1 1 A 94 94 GLN H H 94 6.920 7.620 -0.700 1
1 1138 . 16 1 1 A 94 94 GLN HA H 94 3.790 3.763 0.027 1
1 1145 . 16 1 1 A 94 94 GLN C C 94 177.400 178.011 -0.611 1
1 1146 . 16 1 1 A 94 94 GLN CA C 94 60.000 58.938 1.062 1
1 1147 . 16 1 1 A 94 94 GLN CB C 94 30.300 28.079 2.221 1
1 1149 . 16 1 1 A 94 94 GLN N N 94 117.800 120.545 -2.745 1
1 1151 . 16 1 1 A 95 95 VAL H H 95 7.420 7.635 -0.215 1
1 1152 . 16 1 1 A 95 95 VAL HA H 95 3.760 3.617 0.143 1
1 1160 . 16 1 1 A 95 95 VAL C C 95 178.300 178.185 0.115 1
1 1161 . 16 1 1 A 95 95 VAL CA C 95 66.600 66.557 0.043 1
1 1162 . 16 1 1 A 95 95 VAL CB C 95 31.900 31.627 0.273 1
1 1165 . 16 1 1 A 95 95 VAL N N 95 121.500 119.898 1.602 1
1 1166 . 16 1 1 A 96 96 VAL H H 96 8.340 7.829 0.511 1
1 1167 . 16 1 1 A 96 96 VAL HA H 96 3.810 3.627 0.183 1
1 1175 . 16 1 1 A 96 96 VAL C C 96 178.400 178.270 0.130 1
1 1176 . 16 1 1 A 96 96 VAL CA C 96 66.100 66.745 -0.645 1
1 1177 . 16 1 1 A 96 96 VAL CB C 96 32.200 31.660 0.540 1
1 1180 . 16 1 1 A 96 96 VAL N N 96 120.000 119.697 0.303 1
1 1181 . 16 1 1 A 97 97 ALA H H 97 8.140 8.231 -0.091 1
1 1182 . 16 1 1 A 97 97 ALA HA H 97 4.010 3.926 0.084 1
1 1186 . 16 1 1 A 97 97 ALA C C 97 178.800 178.883 -0.083 1
1 1187 . 16 1 1 A 97 97 ALA CA C 97 54.900 55.666 -0.766 1
1 1188 . 16 1 1 A 97 97 ALA CB C 97 19.900 18.004 1.896 1
1 1189 . 16 1 1 A 97 97 ALA N N 97 121.400 122.123 -0.723 1
1 1190 . 16 1 1 A 98 98 ASP H H 98 8.170 8.535 -0.365 1
1 1191 . 16 1 1 A 98 98 ASP HA H 98 4.320 4.329 -0.009 1
1 1194 . 16 1 1 A 98 98 ASP C C 98 178.100 178.375 -0.275 1
1 1195 . 16 1 1 A 98 98 ASP CA C 98 57.100 57.578 -0.478 1
1 1196 . 16 1 1 A 98 98 ASP CB C 98 41.800 41.236 0.564 1
1 1197 . 16 1 1 A 98 98 ASP N N 98 118.500 118.494 0.006 1
1 1198 . 16 1 1 A 99 99 GLU H H 99 8.220 8.507 -0.287 1
1 1199 . 16 1 1 A 99 99 GLU HA H 99 4.000 4.048 -0.048 1
1 1204 . 16 1 1 A 99 99 GLU C C 99 178.300 177.739 0.561 1
1 1205 . 16 1 1 A 99 99 GLU CA C 99 58.300 59.005 -0.705 1
1 1206 . 16 1 1 A 99 99 GLU CB C 99 29.800 29.472 0.328 1
1 1208 . 16 1 1 A 99 99 GLU N N 99 116.600 119.058 -2.458 1
1 1209 . 16 1 1 A 100 100 HIS H H 100 7.980 7.465 0.515 1
1 1210 . 16 1 1 A 100 100 HIS HA H 100 4.600 4.718 -0.118 1
1 1214 . 16 1 1 A 100 100 HIS C C 100 175.900 175.921 -0.021 1
1 1215 . 16 1 1 A 100 100 HIS CA C 100 57.500 55.343 2.157 1
1 1216 . 16 1 1 A 100 100 HIS CB C 100 30.800 30.296 0.504 1
1 1218 . 16 1 1 A 100 100 HIS N N 100 114.000 116.218 -2.218 1
1 1219 . 16 1 1 A 101 101 LEU H H 101 7.920 7.363 0.557 1
1 1220 . 16 1 1 A 101 101 LEU HA H 101 4.370 4.027 0.343 1
1 1230 . 16 1 1 A 101 101 LEU C C 101 177.700 176.068 1.632 1
1 1231 . 16 1 1 A 101 101 LEU CA C 101 55.900 57.653 -1.753 1
1 1232 . 16 1 1 A 101 101 LEU CB C 101 42.100 42.780 -0.680 1
1 1236 . 16 1 1 A 101 101 LEU N N 101 118.500 121.298 -2.798 1
1 1237 . 16 1 1 A 102 102 GLU H H 102 8.100 7.678 0.422 1
1 1238 . 16 1 1 A 102 102 GLU HA H 102 4.160 4.781 -0.621 1
1 1243 . 16 1 1 A 102 102 GLU C C 102 176.700 174.119 2.581 1
1 1244 . 16 1 1 A 102 102 GLU CA C 102 57.000 55.210 1.790 1
1 1245 . 16 1 1 A 102 102 GLU CB C 102 29.900 32.575 -2.675 1
1 1247 . 16 1 1 A 102 102 GLU N N 102 119.100 113.667 5.433 1
1 1248 . 16 1 1 A 103 103 HIS H H 103 8.010 8.934 -0.924 1
1 1249 . 16 1 1 A 103 103 HIS HA H 103 4.520 5.155 -0.635 1
1 1252 . 16 1 1 A 103 103 HIS CA C 103 56.100 53.650 2.450 1
1 1253 . 16 1 1 A 103 103 HIS CB C 103 29.700 30.741 -1.041 1
1 1254 . 16 1 1 A 103 103 HIS N N 103 117.300 121.410 -4.110 1
1 1255 . 16 1 1 A 107 107 HIS HA H 107 4.560 4.787 -0.227 1
1 1258 . 16 1 1 A 107 107 HIS C C 107 173.900 175.947 -2.047 1
1 1259 . 16 1 1 A 107 107 HIS CA C 107 55.900 56.027 -0.127 1
1 1260 . 16 1 1 A 107 107 HIS CB C 107 30.200 30.142 0.058 1
1 4 . 17 1 1 A 2 2 ALA H H 2 8.450 7.374 1.076 1
1 5 . 17 1 1 A 2 2 ALA HA H 2 4.390 4.408 -0.018 1
1 9 . 17 1 1 A 2 2 ALA C C 2 178.300 178.300 0.000 1
1 10 . 17 1 1 A 2 2 ALA CA C 2 52.500 51.330 1.170 1
1 11 . 17 1 1 A 2 2 ALA CB C 2 19.200 20.323 -1.123 1
1 12 . 17 1 1 A 2 2 ALA N N 2 125.100 123.868 1.232 1
1 13 . 17 1 1 A 3 3 GLY H H 3 8.450 8.860 -0.410 1
1 14 . 17 1 1 A 3 3 GLY HA2 H 3 4.030 3.984 0.046 1
1 15 . 17 1 1 A 3 3 GLY HA3 H 3 4.030 3.984 0.046 1
1 16 . 17 1 1 A 3 3 GLY C C 3 174.100 174.516 -0.416 1
1 17 . 17 1 1 A 3 3 GLY CA C 3 45.200 46.134 -0.934 1
1 18 . 17 1 1 A 3 3 GLY N N 3 108.000 111.565 -3.565 1
1 19 . 17 1 1 A 4 4 GLN H H 4 8.550 8.100 0.450 1
1 20 . 17 1 1 A 4 4 GLN HA H 4 4.340 3.921 0.419 1
1 27 . 17 1 1 A 4 4 GLN C C 4 176.700 175.667 1.033 1
1 28 . 17 1 1 A 4 4 GLN CA C 4 56.600 58.234 -1.634 1
1 29 . 17 1 1 A 4 4 GLN CB C 4 29.300 27.256 2.044 1
1 31 . 17 1 1 A 4 4 GLN N N 4 120.500 113.765 6.735 1
1 33 . 17 1 1 A 5 5 SER H H 5 8.540 8.052 0.488 1
1 34 . 17 1 1 A 5 5 SER HA H 5 4.390 4.264 0.126 1
1 38 . 17 1 1 A 5 5 SER C C 5 174.800 174.125 0.675 1
1 39 . 17 1 1 A 5 5 SER CA C 5 59.100 59.260 -0.160 1
1 40 . 17 1 1 A 5 5 SER CB C 5 63.500 61.531 1.969 1
1 41 . 17 1 1 A 5 5 SER N N 5 117.100 113.192 3.908 1
1 42 . 17 1 1 A 6 6 ASP H H 6 8.300 8.199 0.101 1
1 43 . 17 1 1 A 6 6 ASP HA H 6 4.540 4.741 -0.201 1
1 46 . 17 1 1 A 6 6 ASP C C 6 177.300 177.481 -0.181 1
1 47 . 17 1 1 A 6 6 ASP CA C 6 55.100 55.654 -0.554 1
1 48 . 17 1 1 A 6 6 ASP CB C 6 40.800 40.777 0.023 1
1 49 . 17 1 1 A 6 6 ASP N N 6 122.700 118.659 4.041 1
1 50 . 17 1 1 A 7 7 ARG H H 7 8.270 8.636 -0.366 1
1 51 . 17 1 1 A 7 7 ARG HA H 7 4.150 4.127 0.023 1
1 58 . 17 1 1 A 7 7 ARG C C 7 177.600 177.689 -0.089 1
1 59 . 17 1 1 A 7 7 ARG CA C 7 58.000 58.015 -0.015 1
1 60 . 17 1 1 A 7 7 ARG CB C 7 30.100 28.875 1.225 1
1 63 . 17 1 1 A 7 7 ARG N N 7 122.100 119.373 2.727 1
1 64 . 17 1 1 A 8 8 LYS H H 8 8.130 8.044 0.086 1
1 65 . 17 1 1 A 8 8 LYS HA H 8 4.090 4.104 -0.014 1
1 74 . 17 1 1 A 8 8 LYS C C 8 177.600 178.580 -0.980 1
1 75 . 17 1 1 A 8 8 LYS CA C 8 58.400 58.777 -0.377 1
1 76 . 17 1 1 A 8 8 LYS CB C 8 31.700 31.830 -0.130 1
1 80 . 17 1 1 A 8 8 LYS N N 8 120.900 119.829 1.071 1
1 81 . 17 1 1 A 9 9 ALA H H 9 8.050 8.094 -0.044 1
1 82 . 17 1 1 A 9 9 ALA HA H 9 3.950 4.061 -0.111 1
1 86 . 17 1 1 A 9 9 ALA C C 9 179.800 180.062 -0.262 1
1 87 . 17 1 1 A 9 9 ALA CA C 9 55.100 54.865 0.235 1
1 88 . 17 1 1 A 9 9 ALA CB C 9 18.100 18.149 -0.049 1
1 89 . 17 1 1 A 9 9 ALA N N 9 121.600 122.081 -0.481 1
1 90 . 17 1 1 A 10 10 ALA H H 10 7.910 7.812 0.098 1
1 91 . 17 1 1 A 10 10 ALA HA H 10 4.200 4.072 0.128 1
1 95 . 17 1 1 A 10 10 ALA C C 10 180.500 179.838 0.662 1
1 96 . 17 1 1 A 10 10 ALA CA C 10 54.600 55.004 -0.404 1
1 97 . 17 1 1 A 10 10 ALA CB C 10 18.100 18.270 -0.170 1
1 98 . 17 1 1 A 10 10 ALA N N 10 120.200 120.496 -0.296 1
1 99 . 17 1 1 A 11 11 LEU H H 11 8.080 7.952 0.128 1
1 100 . 17 1 1 A 11 11 LEU HA H 11 4.120 4.137 -0.017 1
1 110 . 17 1 1 A 11 11 LEU C C 11 179.600 178.916 0.684 1
1 111 . 17 1 1 A 11 11 LEU CA C 11 57.800 57.656 0.144 1
1 112 . 17 1 1 A 11 11 LEU CB C 11 41.700 41.560 0.140 1
1 115 . 17 1 1 A 11 11 LEU N N 11 120.900 119.942 0.958 1
1 116 . 17 1 1 A 12 12 LEU H H 12 8.480 8.598 -0.118 1
1 117 . 17 1 1 A 12 12 LEU HA H 12 4.040 4.047 -0.007 1
1 127 . 17 1 1 A 12 12 LEU C C 12 178.900 179.341 -0.441 1
1 128 . 17 1 1 A 12 12 LEU CA C 12 58.100 57.434 0.666 1
1 129 . 17 1 1 A 12 12 LEU CB C 12 40.100 40.688 -0.588 1
1 133 . 17 1 1 A 12 12 LEU N N 12 118.700 117.957 0.743 1
1 134 . 17 1 1 A 13 13 ASP H H 13 7.990 8.359 -0.369 1
1 135 . 17 1 1 A 13 13 ASP HA H 13 4.420 4.221 0.199 1
1 138 . 17 1 1 A 13 13 ASP C C 13 178.900 178.919 -0.019 1
1 139 . 17 1 1 A 13 13 ASP CA C 13 57.500 57.902 -0.402 1
1 140 . 17 1 1 A 13 13 ASP CB C 13 40.500 41.626 -1.126 1
1 141 . 17 1 1 A 13 13 ASP N N 13 119.500 119.916 -0.416 1
1 142 . 17 1 1 A 14 14 GLN H H 14 7.620 7.496 0.124 1
1 143 . 17 1 1 A 14 14 GLN HA H 14 4.230 4.141 0.089 1
1 150 . 17 1 1 A 14 14 GLN C C 14 178.400 178.456 -0.056 1
1 151 . 17 1 1 A 14 14 GLN CA C 14 58.100 58.552 -0.452 1
1 152 . 17 1 1 A 14 14 GLN CB C 14 27.800 28.187 -0.387 1
1 154 . 17 1 1 A 14 14 GLN N N 14 118.900 119.459 -0.559 1
1 156 . 17 1 1 A 15 15 VAL H H 15 8.480 8.137 0.343 1
1 157 . 17 1 1 A 15 15 VAL HA H 15 3.380 3.651 -0.271 1
1 165 . 17 1 1 A 15 15 VAL C C 15 177.600 178.484 -0.884 1
1 166 . 17 1 1 A 15 15 VAL CA C 15 66.600 66.298 0.302 1
1 167 . 17 1 1 A 15 15 VAL CB C 15 30.500 31.584 -1.084 1
1 170 . 17 1 1 A 15 15 VAL N N 15 121.300 120.164 1.136 1
1 171 . 17 1 1 A 16 16 ALA H H 16 8.080 8.662 -0.582 1
1 172 . 17 1 1 A 16 16 ALA HA H 16 4.450 3.907 0.543 1
1 176 . 17 1 1 A 16 16 ALA C C 16 179.100 179.727 -0.627 1
1 177 . 17 1 1 A 16 16 ALA CA C 16 54.600 55.144 -0.544 1
1 178 . 17 1 1 A 16 16 ALA CB C 16 17.700 17.932 -0.232 1
1 179 . 17 1 1 A 16 16 ALA N N 16 121.400 121.888 -0.488 1
1 180 . 17 1 1 A 17 17 ARG H H 17 7.480 7.762 -0.282 1
1 181 . 17 1 1 A 17 17 ARG HA H 17 3.910 4.150 -0.240 1
1 187 . 17 1 1 A 17 17 ARG C C 17 179.700 179.136 0.564 1
1 188 . 17 1 1 A 17 17 ARG CA C 17 59.700 58.700 1.000 1
1 189 . 17 1 1 A 17 17 ARG CB C 17 30.400 29.764 0.636 1
1 191 . 17 1 1 A 17 17 ARG N N 17 116.900 119.106 -2.206 1
1 192 . 17 1 1 A 18 18 VAL H H 18 7.960 8.072 -0.112 1
1 193 . 17 1 1 A 18 18 VAL HA H 18 3.690 3.689 0.001 1
1 201 . 17 1 1 A 18 18 VAL C C 18 177.900 177.988 -0.088 1
1 202 . 17 1 1 A 18 18 VAL CA C 18 66.600 66.439 0.161 1
1 203 . 17 1 1 A 18 18 VAL CB C 18 31.300 31.709 -0.409 1
1 206 . 17 1 1 A 18 18 VAL N N 18 123.000 119.924 3.076 1
1 207 . 17 1 1 A 19 19 GLY H H 19 8.270 8.690 -0.420 1
1 208 . 17 1 1 A 19 19 GLY HA2 H 19 3.430 3.729 -0.299 1
1 209 . 17 1 1 A 19 19 GLY HA3 H 19 3.430 3.735 -0.305 1
1 210 . 17 1 1 A 19 19 GLY C C 19 174.400 175.566 -1.166 1
1 211 . 17 1 1 A 19 19 GLY CA C 19 48.500 47.182 1.318 1
1 212 . 17 1 1 A 19 19 GLY N N 19 105.400 107.680 -2.280 1
1 213 . 17 1 1 A 20 20 LYS H H 20 8.250 8.415 -0.165 1
1 214 . 17 1 1 A 20 20 LYS HA H 20 3.710 4.018 -0.308 1
1 223 . 17 1 1 A 20 20 LYS C C 20 179.400 179.060 0.340 1
1 224 . 17 1 1 A 20 20 LYS CA C 20 59.300 58.811 0.489 1
1 225 . 17 1 1 A 20 20 LYS CB C 20 32.600 32.316 0.284 1
1 229 . 17 1 1 A 20 20 LYS N N 20 118.700 121.684 -2.984 1
1 230 . 17 1 1 A 21 21 ALA H H 21 7.640 7.614 0.026 1
1 231 . 17 1 1 A 21 21 ALA HA H 21 3.790 4.128 -0.338 1
1 235 . 17 1 1 A 21 21 ALA C C 21 177.900 179.988 -2.088 1
1 236 . 17 1 1 A 21 21 ALA CA C 21 55.200 54.214 0.986 1
1 237 . 17 1 1 A 21 21 ALA CB C 21 19.200 18.297 0.903 1
1 238 . 17 1 1 A 21 21 ALA N N 21 121.700 120.783 0.917 1
1 239 . 17 1 1 A 22 22 LEU H H 22 7.330 7.876 -0.546 1
1 240 . 17 1 1 A 22 22 LEU HA H 22 4.140 4.148 -0.008 1
1 250 . 17 1 1 A 22 22 LEU C C 22 176.800 177.408 -0.608 1
1 251 . 17 1 1 A 22 22 LEU CA C 22 54.600 57.317 -2.717 1
1 252 . 17 1 1 A 22 22 LEU CB C 22 42.900 42.101 0.799 1
1 256 . 17 1 1 A 22 22 LEU N N 22 114.200 119.523 -5.323 1
1 257 . 17 1 1 A 23 23 ALA H H 23 7.160 7.575 -0.415 1
1 258 . 17 1 1 A 23 23 ALA HA H 23 4.720 4.323 0.397 1
1 262 . 17 1 1 A 23 23 ALA C C 23 176.700 176.871 -0.171 1
1 263 . 17 1 1 A 23 23 ALA CA C 23 53.000 52.144 0.856 1
1 264 . 17 1 1 A 23 23 ALA CB C 23 18.200 18.598 -0.398 1
1 265 . 17 1 1 A 23 23 ALA N N 23 118.200 121.520 -3.320 1
1 266 . 17 1 1 A 24 24 ASN H H 24 7.440 8.754 -1.314 1
1 267 . 17 1 1 A 24 24 ASN HA H 24 4.730 4.938 -0.208 1
1 272 . 17 1 1 A 24 24 ASN C C 24 174.800 175.413 -0.613 1
1 273 . 17 1 1 A 24 24 ASN CA C 24 53.500 54.871 -1.371 1
1 274 . 17 1 1 A 24 24 ASN CB C 24 41.700 40.826 0.874 1
1 275 . 17 1 1 A 24 24 ASN N N 24 116.800 122.577 -5.777 1
1 277 . 17 1 1 A 25 25 GLY H H 25 9.370 7.797 1.573 1
1 278 . 17 1 1 A 25 25 GLY HA2 H 25 3.650 4.017 -0.367 1
1 279 . 17 1 1 A 25 25 GLY HA3 H 25 4.110 4.031 0.079 1
1 280 . 17 1 1 A 25 25 GLY C C 25 175.300 175.514 -0.214 1
1 281 . 17 1 1 A 25 25 GLY CA C 25 47.600 45.967 1.633 1
1 282 . 17 1 1 A 25 25 GLY N N 25 114.800 107.704 7.096 1
1 283 . 17 1 1 A 26 26 ARG H H 26 8.050 8.481 -0.431 1
1 284 . 17 1 1 A 26 26 ARG HA H 26 4.150 4.044 0.106 1
1 289 . 17 1 1 A 26 26 ARG C C 26 179.300 178.997 0.303 1
1 290 . 17 1 1 A 26 26 ARG CA C 26 57.000 58.621 -1.621 1
1 291 . 17 1 1 A 26 26 ARG CB C 26 29.900 30.016 -0.116 1
1 294 . 17 1 1 A 26 26 ARG N N 26 120.500 125.405 -4.905 1
1 295 . 17 1 1 A 27 27 ARG H H 27 7.930 8.292 -0.362 1
1 296 . 17 1 1 A 27 27 ARG HA H 27 3.710 4.082 -0.372 1
1 301 . 17 1 1 A 27 27 ARG C C 27 178.300 178.475 -0.175 1
1 302 . 17 1 1 A 27 27 ARG CA C 27 61.000 58.628 2.372 1
1 303 . 17 1 1 A 27 27 ARG CB C 27 30.400 29.719 0.681 1
1 305 . 17 1 1 A 27 27 ARG N N 27 117.900 120.585 -2.685 1
1 306 . 17 1 1 A 28 28 LEU H H 28 7.640 7.680 -0.040 1
1 307 . 17 1 1 A 28 28 LEU HA H 28 3.950 4.048 -0.098 1
1 317 . 17 1 1 A 28 28 LEU C C 28 178.200 178.917 -0.717 1
1 318 . 17 1 1 A 28 28 LEU CA C 28 57.600 56.268 1.332 1
1 319 . 17 1 1 A 28 28 LEU CB C 28 41.900 41.619 0.281 1
1 323 . 17 1 1 A 28 28 LEU N N 28 117.600 119.493 -1.893 1
1 324 . 17 1 1 A 29 29 GLN H H 29 8.110 8.002 0.108 1
1 325 . 17 1 1 A 29 29 GLN HA H 29 3.880 4.128 -0.248 1
1 332 . 17 1 1 A 29 29 GLN C C 29 179.400 178.268 1.132 1
1 333 . 17 1 1 A 29 29 GLN CA C 29 59.100 58.696 0.404 1
1 334 . 17 1 1 A 29 29 GLN CB C 29 28.800 28.739 0.061 1
1 336 . 17 1 1 A 29 29 GLN N N 29 119.300 119.421 -0.121 1
1 338 . 17 1 1 A 30 30 ILE H H 30 7.530 7.580 -0.050 1
1 339 . 17 1 1 A 30 30 ILE HA H 30 3.340 3.637 -0.297 1
1 349 . 17 1 1 A 30 30 ILE C C 30 176.700 178.227 -1.527 1
1 350 . 17 1 1 A 30 30 ILE CA C 30 65.900 64.901 0.999 1
1 351 . 17 1 1 A 30 30 ILE CB C 30 37.400 37.338 0.062 1
1 355 . 17 1 1 A 30 30 ILE N N 30 118.600 120.270 -1.670 1
1 356 . 17 1 1 A 31 31 LEU H H 31 7.500 7.914 -0.414 1
1 357 . 17 1 1 A 31 31 LEU HA H 31 3.520 3.826 -0.306 1
1 367 . 17 1 1 A 31 31 LEU C C 31 177.300 178.528 -1.228 1
1 368 . 17 1 1 A 31 31 LEU CA C 31 58.100 57.834 0.266 1
1 369 . 17 1 1 A 31 31 LEU CB C 31 41.100 39.858 1.242 1
1 373 . 17 1 1 A 31 31 LEU N N 31 119.900 120.127 -0.227 1
1 374 . 17 1 1 A 32 32 ASP H H 32 7.950 7.976 -0.026 1
1 375 . 17 1 1 A 32 32 ASP HA H 32 4.300 4.543 -0.243 1
1 378 . 17 1 1 A 32 32 ASP C C 32 178.300 178.139 0.161 1
1 379 . 17 1 1 A 32 32 ASP CA C 32 57.400 57.177 0.223 1
1 380 . 17 1 1 A 32 32 ASP CB C 32 42.400 41.901 0.499 1
1 381 . 17 1 1 A 32 32 ASP N N 32 116.900 119.576 -2.676 1
1 382 . 17 1 1 A 33 33 LEU H H 33 7.350 7.500 -0.150 1
1 383 . 17 1 1 A 33 33 LEU HA H 33 4.130 4.169 -0.039 1
1 393 . 17 1 1 A 33 33 LEU C C 33 180.000 178.903 1.097 1
1 394 . 17 1 1 A 33 33 LEU CA C 33 57.600 57.456 0.144 1
1 395 . 17 1 1 A 33 33 LEU CB C 33 42.300 42.106 0.194 1
1 399 . 17 1 1 A 33 33 LEU N N 33 118.600 120.151 -1.551 1
1 400 . 17 1 1 A 34 34 LEU H H 34 8.300 8.496 -0.196 1
1 401 . 17 1 1 A 34 34 LEU HA H 34 4.490 4.174 0.316 1
1 411 . 17 1 1 A 34 34 LEU C C 34 178.900 179.264 -0.364 1
1 412 . 17 1 1 A 34 34 LEU CA C 34 55.800 56.859 -1.059 1
1 413 . 17 1 1 A 34 34 LEU CB C 34 41.300 41.275 0.025 1
1 417 . 17 1 1 A 34 34 LEU N N 34 117.800 118.478 -0.678 1
1 418 . 17 1 1 A 35 35 ALA H H 35 8.160 7.719 0.441 1
1 419 . 17 1 1 A 35 35 ALA HA H 35 4.050 4.161 -0.111 1
1 423 . 17 1 1 A 35 35 ALA C C 35 179.000 178.317 0.683 1
1 424 . 17 1 1 A 35 35 ALA CA C 35 54.900 54.456 0.444 1
1 425 . 17 1 1 A 35 35 ALA CB C 35 17.500 18.436 -0.936 1
1 426 . 17 1 1 A 35 35 ALA N N 35 123.900 121.760 2.140 1
1 427 . 17 1 1 A 36 36 GLN H H 36 7.600 7.874 -0.274 1
1 428 . 17 1 1 A 36 36 GLN HA H 36 4.340 4.298 0.042 1
1 435 . 17 1 1 A 36 36 GLN C C 36 176.100 176.439 -0.339 1
1 436 . 17 1 1 A 36 36 GLN CA C 36 55.800 56.376 -0.576 1
1 437 . 17 1 1 A 36 36 GLN CB C 36 29.000 29.243 -0.243 1
1 439 . 17 1 1 A 36 36 GLN N N 36 113.300 113.651 -0.351 1
1 441 . 17 1 1 A 37 37 GLY H H 37 7.550 7.190 0.360 1
1 442 . 17 1 1 A 37 37 GLY HA2 H 37 3.730 4.169 -0.439 1
1 443 . 17 1 1 A 37 37 GLY HA3 H 37 4.490 4.171 0.319 1
1 444 . 17 1 1 A 37 37 GLY C C 37 171.500 172.077 -0.577 1
1 445 . 17 1 1 A 37 37 GLY CA C 37 44.500 44.382 0.118 1
1 446 . 17 1 1 A 37 37 GLY N N 37 108.400 106.420 1.980 1
1 447 . 17 1 1 A 38 38 GLU H H 38 8.120 8.461 -0.341 1
1 448 . 17 1 1 A 38 38 GLU HA H 38 4.820 4.911 -0.091 1
1 453 . 17 1 1 A 38 38 GLU C C 38 177.000 175.365 1.635 1
1 454 . 17 1 1 A 38 38 GLU CA C 38 56.400 56.190 0.210 1
1 455 . 17 1 1 A 38 38 GLU CB C 38 31.200 30.417 0.783 1
1 457 . 17 1 1 A 38 38 GLU N N 38 119.600 121.604 -2.004 1
1 458 . 17 1 1 A 39 39 ARG H H 39 8.580 8.950 -0.370 1
1 459 . 17 1 1 A 39 39 ARG HA H 39 4.970 5.164 -0.194 1
1 467 . 17 1 1 A 39 39 ARG C C 39 174.800 175.730 -0.930 1
1 468 . 17 1 1 A 39 39 ARG CA C 39 53.900 53.956 -0.056 1
1 469 . 17 1 1 A 39 39 ARG CB C 39 36.400 33.981 2.419 1
1 472 . 17 1 1 A 39 39 ARG N N 39 121.500 128.619 -7.119 1
1 474 . 17 1 1 A 40 40 ALA H H 40 8.910 8.827 0.083 1
1 475 . 17 1 1 A 40 40 ALA HA H 40 4.920 4.338 0.582 1
1 479 . 17 1 1 A 40 40 ALA C C 40 179.200 178.235 0.965 1
1 480 . 17 1 1 A 40 40 ALA CA C 40 51.100 51.796 -0.696 1
1 481 . 17 1 1 A 40 40 ALA CB C 40 19.200 19.316 -0.116 1
1 482 . 17 1 1 A 40 40 ALA N N 40 125.100 127.871 -2.771 1
1 483 . 17 1 1 A 41 41 VAL H H 41 8.420 8.490 -0.070 1
1 484 . 17 1 1 A 41 41 VAL HA H 41 3.430 3.552 -0.122 1
1 492 . 17 1 1 A 41 41 VAL C C 41 176.800 177.206 -0.406 1
1 493 . 17 1 1 A 41 41 VAL CA C 41 67.600 66.773 0.827 1
1 494 . 17 1 1 A 41 41 VAL CB C 41 31.600 31.640 -0.040 1
1 497 . 17 1 1 A 41 41 VAL N N 41 120.900 120.589 0.311 1
1 498 . 17 1 1 A 42 42 GLU H H 42 9.640 8.469 1.171 1
1 499 . 17 1 1 A 42 42 GLU HA H 42 3.880 3.949 -0.069 1
1 504 . 17 1 1 A 42 42 GLU C C 42 178.300 178.498 -0.198 1
1 505 . 17 1 1 A 42 42 GLU CA C 42 60.600 59.514 1.086 1
1 506 . 17 1 1 A 42 42 GLU CB C 42 28.300 29.502 -1.202 1
1 508 . 17 1 1 A 42 42 GLU N N 42 119.000 119.241 -0.241 1
1 509 . 17 1 1 A 43 43 ALA H H 43 6.870 7.762 -0.892 1
1 510 . 17 1 1 A 43 43 ALA HA H 43 4.290 4.083 0.207 1
1 514 . 17 1 1 A 43 43 ALA C C 43 180.700 179.820 0.880 1
1 515 . 17 1 1 A 43 43 ALA CA C 43 54.100 55.229 -1.129 1
1 516 . 17 1 1 A 43 43 ALA CB C 43 19.100 18.174 0.926 1
1 517 . 17 1 1 A 43 43 ALA N N 43 120.500 121.928 -1.428 1
1 518 . 17 1 1 A 44 44 ILE H H 44 7.970 7.662 0.308 1
1 519 . 17 1 1 A 44 44 ILE HA H 44 3.470 3.605 -0.135 1
1 529 . 17 1 1 A 44 44 ILE C C 44 178.300 178.089 0.211 1
1 530 . 17 1 1 A 44 44 ILE CA C 44 64.700 65.537 -0.837 1
1 531 . 17 1 1 A 44 44 ILE CB C 44 38.100 37.911 0.189 1
1 535 . 17 1 1 A 44 44 ILE N N 44 120.500 118.898 1.602 1
1 536 . 17 1 1 A 45 45 ALA H H 45 8.460 8.541 -0.081 1
1 537 . 17 1 1 A 45 45 ALA HA H 45 3.720 4.015 -0.295 1
1 541 . 17 1 1 A 45 45 ALA C C 45 178.500 179.681 -1.181 1
1 542 . 17 1 1 A 45 45 ALA CA C 45 56.200 55.344 0.856 1
1 543 . 17 1 1 A 45 45 ALA CB C 45 17.400 18.409 -1.009 1
1 544 . 17 1 1 A 45 45 ALA N N 45 124.500 122.085 2.415 1
1 545 . 17 1 1 A 46 46 THR H H 46 8.080 8.337 -0.257 1
1 546 . 17 1 1 A 46 46 THR HA H 46 3.900 3.841 0.059 1
1 551 . 17 1 1 A 46 46 THR C C 46 177.200 176.678 0.522 1
1 552 . 17 1 1 A 46 46 THR CA C 46 66.400 67.078 -0.678 1
1 553 . 17 1 1 A 46 46 THR CB C 46 68.800 68.869 -0.069 1
1 555 . 17 1 1 A 46 46 THR N N 46 112.400 114.322 -1.922 1
1 556 . 17 1 1 A 47 47 ALA H H 47 7.930 8.188 -0.258 1
1 557 . 17 1 1 A 47 47 ALA HA H 47 4.200 4.119 0.081 1
1 561 . 17 1 1 A 47 47 ALA C C 47 179.200 179.973 -0.773 1
1 562 . 17 1 1 A 47 47 ALA CA C 47 54.800 55.171 -0.371 1
1 563 . 17 1 1 A 47 47 ALA CB C 47 19.800 18.238 1.562 1
1 564 . 17 1 1 A 47 47 ALA N N 47 121.400 124.233 -2.833 1
1 565 . 17 1 1 A 48 48 THR H H 48 7.560 7.634 -0.074 1
1 566 . 17 1 1 A 48 48 THR HA H 48 4.390 4.743 -0.353 1
1 571 . 17 1 1 A 48 48 THR C C 48 175.700 176.234 -0.534 1
1 572 . 17 1 1 A 48 48 THR CA C 48 61.800 62.979 -1.179 1
1 573 . 17 1 1 A 48 48 THR CB C 48 71.000 70.510 0.490 1
1 575 . 17 1 1 A 48 48 THR N N 48 103.500 107.275 -3.775 1
1 576 . 17 1 1 A 49 49 GLY H H 49 7.820 8.492 -0.672 1
1 577 . 17 1 1 A 49 49 GLY HA2 H 49 3.870 3.917 -0.047 1
1 578 . 17 1 1 A 49 49 GLY HA3 H 49 4.100 3.918 0.182 1
1 579 . 17 1 1 A 49 49 GLY C C 49 174.400 173.831 0.569 1
1 580 . 17 1 1 A 49 49 GLY CA C 49 46.300 45.465 0.835 1
1 581 . 17 1 1 A 49 49 GLY N N 49 111.100 111.850 -0.750 1
1 582 . 17 1 1 A 50 50 MET H H 50 7.930 7.787 0.143 1
1 583 . 17 1 1 A 50 50 MET HA H 50 4.540 4.865 -0.325 1
1 591 . 17 1 1 A 50 50 MET C C 50 174.800 175.198 -0.398 1
1 592 . 17 1 1 A 50 50 MET CA C 50 55.100 54.240 0.860 1
1 593 . 17 1 1 A 50 50 MET CB C 50 37.200 36.227 0.973 1
1 596 . 17 1 1 A 50 50 MET N N 50 119.300 119.150 0.150 1
1 597 . 17 1 1 A 51 51 ASN H H 51 8.040 8.760 -0.720 1
1 598 . 17 1 1 A 51 51 ASN HA H 51 4.580 4.896 -0.316 1
1 601 . 17 1 1 A 51 51 ASN C C 51 176.100 177.047 -0.947 1
1 602 . 17 1 1 A 51 51 ASN CA C 51 52.800 52.809 -0.009 1
1 603 . 17 1 1 A 51 51 ASN CB C 51 41.100 39.424 1.676 1
1 604 . 17 1 1 A 51 51 ASN N N 51 118.000 118.523 -0.523 1
1 605 . 17 1 1 A 52 52 LEU H H 52 8.560 8.807 -0.247 1
1 606 . 17 1 1 A 52 52 LEU HA H 52 3.760 3.936 -0.176 1
1 616 . 17 1 1 A 52 52 LEU C C 52 179.600 178.986 0.614 1
1 617 . 17 1 1 A 52 52 LEU CA C 52 59.000 57.889 1.111 1
1 618 . 17 1 1 A 52 52 LEU CB C 52 41.800 41.497 0.303 1
1 622 . 17 1 1 A 52 52 LEU N N 52 120.600 123.718 -3.118 1
1 623 . 17 1 1 A 53 53 THR H H 53 8.230 8.125 0.105 1
1 624 . 17 1 1 A 53 53 THR HA H 53 3.880 4.184 -0.304 1
1 629 . 17 1 1 A 53 53 THR C C 53 176.900 176.749 0.151 1
1 630 . 17 1 1 A 53 53 THR CA C 53 66.500 65.389 1.111 1
1 631 . 17 1 1 A 53 53 THR CB C 53 68.400 68.713 -0.313 1
1 633 . 17 1 1 A 53 53 THR N N 53 115.800 112.529 3.271 1
1 634 . 17 1 1 A 54 54 THR H H 54 8.420 8.009 0.411 1
1 635 . 17 1 1 A 54 54 THR HA H 54 3.880 3.867 0.013 1
1 640 . 17 1 1 A 54 54 THR C C 54 177.300 176.145 1.155 1
1 641 . 17 1 1 A 54 54 THR CA C 54 66.600 66.350 0.250 1
1 642 . 17 1 1 A 54 54 THR CB C 54 66.600 68.643 -2.043 1
1 644 . 17 1 1 A 54 54 THR N N 54 122.300 116.627 5.673 1
1 645 . 17 1 1 A 55 55 ALA H H 55 8.860 8.520 0.340 1
1 646 . 17 1 1 A 55 55 ALA HA H 55 4.020 3.944 0.076 1
1 650 . 17 1 1 A 55 55 ALA C C 55 179.000 179.608 -0.608 1
1 651 . 17 1 1 A 55 55 ALA CA C 55 56.100 55.305 0.795 1
1 652 . 17 1 1 A 55 55 ALA CB C 55 17.000 17.915 -0.915 1
1 653 . 17 1 1 A 55 55 ALA N N 55 125.600 123.780 1.820 1
1 654 . 17 1 1 A 56 56 SER H H 56 8.440 8.431 0.009 1
1 655 . 17 1 1 A 56 56 SER HA H 56 3.920 4.041 -0.121 1
1 658 . 17 1 1 A 56 56 SER C C 56 176.400 177.263 -0.863 1
1 659 . 17 1 1 A 56 56 SER CA C 56 62.600 61.325 1.275 1
1 660 . 17 1 1 A 56 56 SER CB C 56 62.700 62.444 0.256 1
1 661 . 17 1 1 A 56 56 SER N N 56 112.700 113.031 -0.331 1
1 662 . 17 1 1 A 57 57 ALA H H 57 8.090 8.114 -0.024 1
1 663 . 17 1 1 A 57 57 ALA HA H 57 4.130 3.946 0.184 1
1 667 . 17 1 1 A 57 57 ALA C C 57 181.200 179.854 1.346 1
1 668 . 17 1 1 A 57 57 ALA CA C 57 55.200 55.326 -0.126 1
1 669 . 17 1 1 A 57 57 ALA CB C 57 17.900 18.046 -0.146 1
1 670 . 17 1 1 A 57 57 ALA N N 57 124.000 124.235 -0.235 1
1 671 . 17 1 1 A 58 58 ASN H H 58 7.970 7.675 0.295 1
1 672 . 17 1 1 A 58 58 ASN HA H 58 4.480 4.539 -0.059 1
1 677 . 17 1 1 A 58 58 ASN C C 58 177.500 178.369 -0.869 1
1 678 . 17 1 1 A 58 58 ASN CA C 58 56.900 56.380 0.520 1
1 679 . 17 1 1 A 58 58 ASN CB C 58 39.800 38.596 1.204 1
1 680 . 17 1 1 A 58 58 ASN N N 58 117.600 117.087 0.513 1
1 682 . 17 1 1 A 59 59 LEU H H 59 8.530 8.621 -0.091 1
1 683 . 17 1 1 A 59 59 LEU HA H 59 3.710 3.837 -0.127 1
1 693 . 17 1 1 A 59 59 LEU C C 59 178.400 179.198 -0.798 1
1 694 . 17 1 1 A 59 59 LEU CA C 59 58.600 57.828 0.772 1
1 695 . 17 1 1 A 59 59 LEU CB C 59 40.500 40.641 -0.141 1
1 699 . 17 1 1 A 59 59 LEU N N 59 122.600 121.291 1.309 1
1 700 . 17 1 1 A 60 60 GLN H H 60 8.200 8.627 -0.427 1
1 701 . 17 1 1 A 60 60 GLN HA H 60 4.020 4.011 0.009 1
1 708 . 17 1 1 A 60 60 GLN C C 60 178.700 177.777 0.923 1
1 709 . 17 1 1 A 60 60 GLN CA C 60 58.800 59.044 -0.244 1
1 710 . 17 1 1 A 60 60 GLN CB C 60 27.700 28.701 -1.001 1
1 712 . 17 1 1 A 60 60 GLN N N 60 118.900 119.473 -0.573 1
1 714 . 17 1 1 A 61 61 ALA H H 61 7.580 7.688 -0.108 1
1 715 . 17 1 1 A 61 61 ALA HA H 61 4.230 4.145 0.085 1
1 719 . 17 1 1 A 61 61 ALA C C 61 181.300 179.962 1.338 1
1 720 . 17 1 1 A 61 61 ALA CA C 61 55.100 55.055 0.045 1
1 721 . 17 1 1 A 61 61 ALA CB C 61 17.600 18.133 -0.533 1
1 722 . 17 1 1 A 61 61 ALA N N 61 122.200 122.013 0.187 1
1 723 . 17 1 1 A 62 62 LEU H H 62 7.830 8.044 -0.214 1
1 724 . 17 1 1 A 62 62 LEU HA H 62 3.980 3.940 0.040 1
1 734 . 17 1 1 A 62 62 LEU C C 62 178.500 179.315 -0.815 1
1 735 . 17 1 1 A 62 62 LEU CA C 62 58.100 57.733 0.367 1
1 736 . 17 1 1 A 62 62 LEU CB C 62 43.300 41.258 2.042 1
1 739 . 17 1 1 A 62 62 LEU N N 62 119.000 118.655 0.345 1
1 740 . 17 1 1 A 63 63 LYS H H 63 8.580 8.126 0.454 1
1 741 . 17 1 1 A 63 63 LYS HA H 63 4.130 4.079 0.051 1
1 750 . 17 1 1 A 63 63 LYS C C 63 180.500 179.408 1.092 1
1 751 . 17 1 1 A 63 63 LYS CA C 63 59.700 58.826 0.874 1
1 752 . 17 1 1 A 63 63 LYS CB C 63 32.600 31.975 0.625 1
1 756 . 17 1 1 A 63 63 LYS N N 63 123.400 121.027 2.373 1
1 757 . 17 1 1 A 64 64 SER H H 64 8.640 8.423 0.217 1
1 758 . 17 1 1 A 64 64 SER HA H 64 4.300 4.244 0.056 1
1 761 . 17 1 1 A 64 64 SER C C 64 175.000 177.207 -2.207 1
1 762 . 17 1 1 A 64 64 SER CA C 64 61.400 62.822 -1.422 1
1 763 . 17 1 1 A 64 64 SER CB C 64 63.000 62.549 0.451 1
1 764 . 17 1 1 A 64 64 SER N N 64 117.700 117.963 -0.263 1
1 765 . 17 1 1 A 65 65 GLY H H 65 7.280 7.924 -0.644 1
1 766 . 17 1 1 A 65 65 GLY HA2 H 65 3.240 3.908 -0.668 1
1 767 . 17 1 1 A 65 65 GLY HA3 H 65 3.980 3.909 0.071 1
1 768 . 17 1 1 A 65 65 GLY C C 65 171.300 174.877 -3.577 1
1 769 . 17 1 1 A 65 65 GLY CA C 65 45.100 45.946 -0.846 1
1 770 . 17 1 1 A 65 65 GLY N N 65 104.400 108.194 -3.794 1
1 771 . 17 1 1 A 66 66 GLY H H 66 7.730 7.758 -0.028 1
1 772 . 17 1 1 A 66 66 GLY HA2 H 66 3.650 4.012 -0.362 1
1 773 . 17 1 1 A 66 66 GLY HA3 H 66 3.750 4.013 -0.263 1
1 774 . 17 1 1 A 66 66 GLY C C 66 173.700 175.056 -1.356 1
1 775 . 17 1 1 A 66 66 GLY CA C 66 45.400 45.481 -0.081 1
1 776 . 17 1 1 A 66 66 GLY N N 66 104.700 107.923 -3.223 1
1 777 . 17 1 1 A 67 67 LEU H H 67 7.520 8.197 -0.677 1
1 778 . 17 1 1 A 67 67 LEU HA H 67 4.310 4.307 0.003 1
1 788 . 17 1 1 A 67 67 LEU C C 67 177.700 176.896 0.804 1
1 789 . 17 1 1 A 67 67 LEU CA C 67 55.500 55.754 -0.254 1
1 790 . 17 1 1 A 67 67 LEU CB C 67 42.400 42.791 -0.391 1
1 794 . 17 1 1 A 67 67 LEU N N 67 110.600 118.265 -7.665 1
1 795 . 17 1 1 A 68 68 VAL H H 68 6.890 7.381 -0.491 1
1 796 . 17 1 1 A 68 68 VAL HA H 68 5.190 5.033 0.157 1
1 804 . 17 1 1 A 68 68 VAL C C 68 173.700 174.723 -1.023 1
1 805 . 17 1 1 A 68 68 VAL CA C 68 57.400 58.876 -1.476 1
1 806 . 17 1 1 A 68 68 VAL CB C 68 36.400 35.196 1.204 1
1 809 . 17 1 1 A 68 68 VAL N N 68 106.400 112.148 -5.748 1
1 810 . 17 1 1 A 69 69 GLU H H 69 8.880 9.160 -0.280 1
1 811 . 17 1 1 A 69 69 GLU HA H 69 4.660 4.934 -0.274 1
1 816 . 17 1 1 A 69 69 GLU C C 69 173.300 175.015 -1.715 1
1 817 . 17 1 1 A 69 69 GLU CA C 69 54.300 54.663 -0.363 1
1 818 . 17 1 1 A 69 69 GLU CB C 69 34.100 33.667 0.433 1
1 820 . 17 1 1 A 69 69 GLU N N 69 120.400 120.816 -0.416 1
1 821 . 17 1 1 A 70 70 ALA H H 70 8.730 8.589 0.141 1
1 822 . 17 1 1 A 70 70 ALA HA H 70 4.990 4.854 0.136 1
1 826 . 17 1 1 A 70 70 ALA C C 70 176.500 175.726 0.774 1
1 827 . 17 1 1 A 70 70 ALA CA C 70 50.000 51.035 -1.035 1
1 828 . 17 1 1 A 70 70 ALA CB C 70 22.300 21.955 0.345 1
1 829 . 17 1 1 A 70 70 ALA N N 70 122.800 120.790 2.010 1
1 830 . 17 1 1 A 71 71 ARG H H 71 8.670 9.321 -0.651 1
1 831 . 17 1 1 A 71 71 ARG HA H 71 4.630 4.912 -0.282 1
1 843 . 17 1 1 A 71 71 ARG C C 71 173.500 174.537 -1.037 1
1 844 . 17 1 1 A 71 71 ARG CA C 71 54.600 54.139 0.461 1
1 845 . 17 1 1 A 71 71 ARG CB C 71 33.600 32.257 1.343 1
1 849 . 17 1 1 A 71 71 ARG N N 71 120.100 122.940 -2.840 1
1 851 . 17 1 1 A 72 72 ARG H H 72 8.780 8.558 0.222 1
1 852 . 17 1 1 A 72 72 ARG HA H 72 5.100 4.829 0.271 1
1 859 . 17 1 1 A 72 72 ARG C C 72 176.000 175.208 0.792 1
1 860 . 17 1 1 A 72 72 ARG CA C 72 54.900 55.966 -1.066 1
1 861 . 17 1 1 A 72 72 ARG CB C 72 32.500 30.861 1.639 1
1 864 . 17 1 1 A 72 72 ARG N N 72 123.600 125.433 -1.833 1
1 865 . 17 1 1 A 73 73 GLU H H 73 8.720 8.811 -0.091 1
1 866 . 17 1 1 A 73 73 GLU HA H 73 4.510 4.763 -0.253 1
1 871 . 17 1 1 A 73 73 GLU C C 73 175.900 176.785 -0.885 1
1 872 . 17 1 1 A 73 73 GLU CA C 73 55.700 55.217 0.483 1
1 873 . 17 1 1 A 73 73 GLU CB C 73 31.800 31.422 0.378 1
1 875 . 17 1 1 A 73 73 GLU N N 73 126.800 127.256 -0.456 1
1 876 . 17 1 1 A 74 74 GLY H H 74 9.190 8.929 0.261 1
1 877 . 17 1 1 A 74 74 GLY HA2 H 74 3.700 3.881 -0.181 1
1 878 . 17 1 1 A 74 74 GLY HA3 H 74 4.170 3.917 0.253 1
1 879 . 17 1 1 A 74 74 GLY C C 74 175.400 174.650 0.750 1
1 880 . 17 1 1 A 74 74 GLY CA C 74 47.100 47.320 -0.220 1
1 881 . 17 1 1 A 74 74 GLY N N 74 118.500 116.238 2.262 1
1 882 . 17 1 1 A 75 75 THR H H 75 8.780 8.577 0.203 1
1 883 . 17 1 1 A 75 75 THR HA H 75 4.290 4.543 -0.253 1
1 888 . 17 1 1 A 75 75 THR C C 75 174.600 173.587 1.013 1
1 889 . 17 1 1 A 75 75 THR CA C 75 62.000 62.121 -0.121 1
1 890 . 17 1 1 A 75 75 THR CB C 75 69.000 70.332 -1.332 1
1 892 . 17 1 1 A 75 75 THR N N 75 118.000 120.064 -2.064 1
1 893 . 17 1 1 A 76 76 ARG H H 76 8.030 7.806 0.224 1
1 894 . 17 1 1 A 76 76 ARG HA H 76 4.610 4.686 -0.076 1
1 901 . 17 1 1 A 76 76 ARG C C 76 174.800 174.953 -0.153 1
1 902 . 17 1 1 A 76 76 ARG CA C 76 55.500 54.143 1.357 1
1 903 . 17 1 1 A 76 76 ARG CB C 76 32.700 33.377 -0.677 1
1 906 . 17 1 1 A 76 76 ARG N N 76 122.600 120.593 2.007 1
1 907 . 17 1 1 A 77 77 GLN H H 77 8.580 8.553 0.027 1
1 908 . 17 1 1 A 77 77 GLN HA H 77 4.910 4.938 -0.028 1
1 915 . 17 1 1 A 77 77 GLN C C 77 173.900 174.588 -0.688 1
1 916 . 17 1 1 A 77 77 GLN CA C 77 54.700 54.636 0.064 1
1 917 . 17 1 1 A 77 77 GLN CB C 77 31.800 30.331 1.469 1
1 919 . 17 1 1 A 77 77 GLN N N 77 121.900 120.070 1.830 1
1 921 . 17 1 1 A 78 78 TYR H H 78 8.890 9.602 -0.712 1
1 922 . 17 1 1 A 78 78 TYR HA H 78 4.750 5.469 -0.719 1
1 929 . 17 1 1 A 78 78 TYR C C 78 175.600 174.440 1.160 1
1 930 . 17 1 1 A 78 78 TYR CA C 78 57.000 56.184 0.816 1
1 931 . 17 1 1 A 78 78 TYR CB C 78 41.400 40.657 0.743 1
1 936 . 17 1 1 A 78 78 TYR N N 78 121.800 122.531 -0.731 1
1 937 . 17 1 1 A 79 79 TYR H H 79 9.010 9.477 -0.467 1
1 938 . 17 1 1 A 79 79 TYR HA H 79 5.410 5.314 0.096 1
1 945 . 17 1 1 A 79 79 TYR C C 79 173.100 175.465 -2.365 1
1 946 . 17 1 1 A 79 79 TYR CA C 79 57.300 57.324 -0.024 1
1 947 . 17 1 1 A 79 79 TYR CB C 79 43.300 41.198 2.102 1
1 952 . 17 1 1 A 79 79 TYR N N 79 122.500 123.170 -0.670 1
1 953 . 17 1 1 A 80 80 ARG H H 80 8.720 9.361 -0.641 1
1 954 . 17 1 1 A 80 80 ARG HA H 80 5.120 5.003 0.117 1
1 962 . 17 1 1 A 80 80 ARG C C 80 175.500 174.826 0.674 1
1 963 . 17 1 1 A 80 80 ARG CA C 80 53.200 54.112 -0.912 1
1 964 . 17 1 1 A 80 80 ARG CB C 80 33.900 33.900 0.000 1
1 967 . 17 1 1 A 80 80 ARG N N 80 114.500 119.674 -5.174 1
1 969 . 17 1 1 A 81 81 ILE H H 81 9.300 8.730 0.570 1
1 970 . 17 1 1 A 81 81 ILE HA H 81 4.150 4.275 -0.125 1
1 980 . 17 1 1 A 81 81 ILE C C 81 177.800 176.788 1.012 1
1 981 . 17 1 1 A 81 81 ILE CA C 81 62.300 60.681 1.619 1
1 982 . 17 1 1 A 81 81 ILE CB C 81 37.800 38.186 -0.386 1
1 986 . 17 1 1 A 81 81 ILE N N 81 122.100 121.105 0.995 1
1 987 . 17 1 1 A 82 82 ALA H H 82 7.930 8.827 -0.897 1
1 988 . 17 1 1 A 82 82 ALA HA H 82 3.930 4.439 -0.509 1
1 992 . 17 1 1 A 82 82 ALA C C 82 176.300 176.543 -0.243 1
1 993 . 17 1 1 A 82 82 ALA CA C 82 54.200 51.765 2.435 1
1 994 . 17 1 1 A 82 82 ALA CB C 82 18.500 18.427 0.073 1
1 995 . 17 1 1 A 82 82 ALA N N 82 127.200 128.345 -1.145 1
1 996 . 17 1 1 A 83 83 GLY H H 83 6.980 7.358 -0.378 1
1 997 . 17 1 1 A 83 83 GLY HA2 H 83 4.090 4.108 -0.018 1
1 998 . 17 1 1 A 83 83 GLY HA3 H 83 4.440 4.111 0.329 1
1 999 . 17 1 1 A 83 83 GLY C C 83 173.600 174.680 -1.080 1
1 1000 . 17 1 1 A 83 83 GLY CA C 83 45.200 45.384 -0.184 1
1 1001 . 17 1 1 A 83 83 GLY N N 83 101.800 106.850 -5.050 1
1 1002 . 17 1 1 A 84 84 GLU H H 84 8.930 8.829 0.101 1
1 1003 . 17 1 1 A 84 84 GLU HA H 84 4.120 3.945 0.175 1
1 1008 . 17 1 1 A 84 84 GLU C C 84 178.300 177.639 0.661 1
1 1009 . 17 1 1 A 84 84 GLU CA C 84 58.900 58.826 0.074 1
1 1010 . 17 1 1 A 84 84 GLU CB C 84 29.400 29.390 0.010 1
1 1012 . 17 1 1 A 84 84 GLU N N 84 120.300 121.002 -0.702 1
1 1013 . 17 1 1 A 85 85 ASP H H 85 8.950 8.087 0.863 1
1 1014 . 17 1 1 A 85 85 ASP HA H 85 4.310 4.443 -0.133 1
1 1017 . 17 1 1 A 85 85 ASP C C 85 178.000 178.698 -0.698 1
1 1018 . 17 1 1 A 85 85 ASP CA C 85 57.100 57.041 0.059 1
1 1019 . 17 1 1 A 85 85 ASP CB C 85 38.900 40.342 -1.442 1
1 1020 . 17 1 1 A 85 85 ASP N N 85 119.400 119.069 0.331 1
1 1021 . 17 1 1 A 86 86 VAL H H 86 7.620 7.828 -0.208 1
1 1022 . 17 1 1 A 86 86 VAL HA H 86 3.480 3.597 -0.117 1
1 1030 . 17 1 1 A 86 86 VAL C C 86 177.400 177.903 -0.503 1
1 1031 . 17 1 1 A 86 86 VAL CA C 86 66.800 66.455 0.345 1
1 1032 . 17 1 1 A 86 86 VAL CB C 86 31.300 31.407 -0.107 1
1 1035 . 17 1 1 A 86 86 VAL N N 86 121.600 121.148 0.452 1
1 1036 . 17 1 1 A 87 87 ALA H H 87 7.520 8.196 -0.676 1
1 1037 . 17 1 1 A 87 87 ALA HA H 87 4.110 4.006 0.104 1
1 1041 . 17 1 1 A 87 87 ALA C C 87 181.200 179.743 1.457 1
1 1042 . 17 1 1 A 87 87 ALA CA C 87 55.800 55.743 0.057 1
1 1043 . 17 1 1 A 87 87 ALA CB C 87 17.600 18.099 -0.499 1
1 1044 . 17 1 1 A 87 87 ALA N N 87 122.700 121.720 0.980 1
1 1045 . 17 1 1 A 88 88 ARG H H 88 8.380 8.201 0.179 1
1 1046 . 17 1 1 A 88 88 ARG HA H 88 4.090 4.089 0.001 1
1 1054 . 17 1 1 A 88 88 ARG C C 88 179.100 178.843 0.257 1
1 1055 . 17 1 1 A 88 88 ARG CA C 88 59.600 58.484 1.116 1
1 1056 . 17 1 1 A 88 88 ARG CB C 88 30.500 30.262 0.238 1
1 1059 . 17 1 1 A 88 88 ARG N N 88 119.200 117.969 1.231 1
1 1061 . 17 1 1 A 89 89 LEU H H 89 8.480 7.803 0.677 1
1 1062 . 17 1 1 A 89 89 LEU HA H 89 4.040 4.047 -0.007 1
1 1071 . 17 1 1 A 89 89 LEU C C 89 177.200 178.649 -1.449 1
1 1072 . 17 1 1 A 89 89 LEU CA C 89 58.300 57.994 0.306 1
1 1073 . 17 1 1 A 89 89 LEU CB C 89 41.300 41.950 -0.650 1
1 1076 . 17 1 1 A 89 89 LEU N N 89 123.300 122.275 1.025 1
1 1077 . 17 1 1 A 90 90 PHE H H 90 8.890 8.245 0.645 1
1 1078 . 17 1 1 A 90 90 PHE HA H 90 4.380 3.997 0.383 1
1 1086 . 17 1 1 A 90 90 PHE C C 90 177.500 177.587 -0.087 1
1 1087 . 17 1 1 A 90 90 PHE CA C 90 59.400 62.412 -3.012 1
1 1088 . 17 1 1 A 90 90 PHE CB C 90 38.600 38.649 -0.049 1
1 1094 . 17 1 1 A 90 90 PHE N N 90 119.400 119.408 -0.008 1
1 1095 . 17 1 1 A 91 91 ALA H H 91 7.920 8.209 -0.289 1
1 1096 . 17 1 1 A 91 91 ALA HA H 91 3.940 3.942 -0.002 1
1 1100 . 17 1 1 A 91 91 ALA C C 91 180.200 179.818 0.382 1
1 1101 . 17 1 1 A 91 91 ALA CA C 91 55.100 55.263 -0.163 1
1 1102 . 17 1 1 A 91 91 ALA CB C 91 18.000 18.028 -0.028 1
1 1103 . 17 1 1 A 91 91 ALA N N 91 120.500 121.312 -0.812 1
1 1104 . 17 1 1 A 92 92 LEU H H 92 8.190 8.537 -0.347 1
1 1105 . 17 1 1 A 92 92 LEU HA H 92 4.300 4.024 0.276 1
1 1115 . 17 1 1 A 92 92 LEU C C 92 178.900 178.238 0.662 1
1 1116 . 17 1 1 A 92 92 LEU CA C 92 57.500 57.992 -0.492 1
1 1117 . 17 1 1 A 92 92 LEU CB C 92 42.100 41.586 0.514 1
1 1121 . 17 1 1 A 92 92 LEU N N 92 120.200 119.482 0.718 1
1 1122 . 17 1 1 A 93 93 VAL H H 93 8.890 8.005 0.885 1
1 1123 . 17 1 1 A 93 93 VAL HA H 93 3.810 3.705 0.105 1
1 1131 . 17 1 1 A 93 93 VAL C C 93 176.900 177.246 -0.346 1
1 1132 . 17 1 1 A 93 93 VAL CA C 93 66.000 64.900 1.100 1
1 1133 . 17 1 1 A 93 93 VAL CB C 93 31.200 31.177 0.023 1
1 1136 . 17 1 1 A 93 93 VAL N N 93 117.100 118.426 -1.326 1
1 1137 . 17 1 1 A 94 94 GLN H H 94 6.920 7.586 -0.666 1
1 1138 . 17 1 1 A 94 94 GLN HA H 94 3.790 3.794 -0.004 1
1 1145 . 17 1 1 A 94 94 GLN C C 94 177.400 178.400 -1.000 1
1 1146 . 17 1 1 A 94 94 GLN CA C 94 60.000 58.613 1.387 1
1 1147 . 17 1 1 A 94 94 GLN CB C 94 30.300 27.908 2.392 1
1 1149 . 17 1 1 A 94 94 GLN N N 94 117.800 120.717 -2.917 1
1 1151 . 17 1 1 A 95 95 VAL H H 95 7.420 7.738 -0.318 1
1 1152 . 17 1 1 A 95 95 VAL HA H 95 3.760 3.543 0.217 1
1 1160 . 17 1 1 A 95 95 VAL C C 95 178.300 178.130 0.170 1
1 1161 . 17 1 1 A 95 95 VAL CA C 95 66.600 66.399 0.201 1
1 1162 . 17 1 1 A 95 95 VAL CB C 95 31.900 31.467 0.433 1
1 1165 . 17 1 1 A 95 95 VAL N N 95 121.500 119.986 1.514 1
1 1166 . 17 1 1 A 96 96 VAL H H 96 8.340 8.183 0.157 1
1 1167 . 17 1 1 A 96 96 VAL HA H 96 3.810 3.349 0.461 1
1 1175 . 17 1 1 A 96 96 VAL C C 96 178.400 177.833 0.567 1
1 1176 . 17 1 1 A 96 96 VAL CA C 96 66.100 66.170 -0.070 1
1 1177 . 17 1 1 A 96 96 VAL CB C 96 32.200 31.371 0.829 1
1 1180 . 17 1 1 A 96 96 VAL N N 96 120.000 120.071 -0.071 1
1 1181 . 17 1 1 A 97 97 ALA H H 97 8.140 8.219 -0.079 1
1 1182 . 17 1 1 A 97 97 ALA HA H 97 4.010 3.790 0.220 1
1 1186 . 17 1 1 A 97 97 ALA C C 97 178.800 178.750 0.050 1
1 1187 . 17 1 1 A 97 97 ALA CA C 97 54.900 55.562 -0.662 1
1 1188 . 17 1 1 A 97 97 ALA CB C 97 19.900 17.981 1.919 1
1 1189 . 17 1 1 A 97 97 ALA N N 97 121.400 121.732 -0.332 1
1 1190 . 17 1 1 A 98 98 ASP H H 98 8.170 8.310 -0.140 1
1 1191 . 17 1 1 A 98 98 ASP HA H 98 4.320 4.304 0.016 1
1 1194 . 17 1 1 A 98 98 ASP C C 98 178.100 178.725 -0.625 1
1 1195 . 17 1 1 A 98 98 ASP CA C 98 57.100 57.583 -0.483 1
1 1196 . 17 1 1 A 98 98 ASP CB C 98 41.800 41.392 0.408 1
1 1197 . 17 1 1 A 98 98 ASP N N 98 118.500 118.522 -0.022 1
1 1198 . 17 1 1 A 99 99 GLU H H 99 8.220 8.237 -0.017 1
1 1199 . 17 1 1 A 99 99 GLU HA H 99 4.000 4.043 -0.043 1
1 1204 . 17 1 1 A 99 99 GLU C C 99 178.300 178.667 -0.367 1
1 1205 . 17 1 1 A 99 99 GLU CA C 99 58.300 59.166 -0.866 1
1 1206 . 17 1 1 A 99 99 GLU CB C 99 29.800 29.266 0.534 1
1 1208 . 17 1 1 A 99 99 GLU N N 99 116.600 119.380 -2.780 1
1 1209 . 17 1 1 A 100 100 HIS H H 100 7.980 7.687 0.293 1
1 1210 . 17 1 1 A 100 100 HIS HA H 100 4.600 4.162 0.438 1
1 1214 . 17 1 1 A 100 100 HIS C C 100 175.900 177.944 -2.044 1
1 1215 . 17 1 1 A 100 100 HIS CA C 100 57.500 59.554 -2.054 1
1 1216 . 17 1 1 A 100 100 HIS CB C 100 30.800 29.645 1.155 1
1 1218 . 17 1 1 A 100 100 HIS N N 100 114.000 118.730 -4.730 1
1 1219 . 17 1 1 A 101 101 LEU H H 101 7.920 8.160 -0.240 1
1 1220 . 17 1 1 A 101 101 LEU HA H 101 4.370 3.876 0.494 1
1 1230 . 17 1 1 A 101 101 LEU C C 101 177.700 179.151 -1.451 1
1 1231 . 17 1 1 A 101 101 LEU CA C 101 55.900 57.792 -1.892 1
1 1232 . 17 1 1 A 101 101 LEU CB C 101 42.100 40.988 1.112 1
1 1236 . 17 1 1 A 101 101 LEU N N 101 118.500 119.965 -1.465 1
1 1237 . 17 1 1 A 102 102 GLU H H 102 8.100 7.926 0.174 1
1 1238 . 17 1 1 A 102 102 GLU HA H 102 4.160 4.195 -0.035 1
1 1243 . 17 1 1 A 102 102 GLU C C 102 176.700 176.334 0.366 1
1 1244 . 17 1 1 A 102 102 GLU CA C 102 57.000 59.156 -2.156 1
1 1245 . 17 1 1 A 102 102 GLU CB C 102 29.900 29.939 -0.039 1
1 1247 . 17 1 1 A 102 102 GLU N N 102 119.100 119.582 -0.482 1
1 1248 . 17 1 1 A 103 103 HIS H H 103 8.010 7.854 0.156 1
1 1249 . 17 1 1 A 103 103 HIS HA H 103 4.520 4.532 -0.012 1
1 1252 . 17 1 1 A 103 103 HIS CA C 103 56.100 58.275 -2.175 1
1 1253 . 17 1 1 A 103 103 HIS CB C 103 29.700 28.472 1.228 1
1 1254 . 17 1 1 A 103 103 HIS N N 103 117.300 117.260 0.040 1
1 1255 . 17 1 1 A 107 107 HIS HA H 107 4.560 4.723 -0.163 1
1 1258 . 17 1 1 A 107 107 HIS C C 107 173.900 174.422 -0.522 1
1 1259 . 17 1 1 A 107 107 HIS CA C 107 55.900 56.861 -0.961 1
1 1260 . 17 1 1 A 107 107 HIS CB C 107 30.200 31.231 -1.031 1
1 4 . 18 1 1 A 2 2 ALA H H 2 8.450 8.511 -0.061 1
1 5 . 18 1 1 A 2 2 ALA HA H 2 4.390 4.511 -0.121 1
1 9 . 18 1 1 A 2 2 ALA C C 2 178.300 176.882 1.418 1
1 10 . 18 1 1 A 2 2 ALA CA C 2 52.500 51.697 0.803 1
1 11 . 18 1 1 A 2 2 ALA CB C 2 19.200 17.558 1.642 1
1 12 . 18 1 1 A 2 2 ALA N N 2 125.100 125.361 -0.261 1
1 13 . 18 1 1 A 3 3 GLY H H 3 8.450 7.957 0.493 1
1 14 . 18 1 1 A 3 3 GLY HA2 H 3 4.030 4.111 -0.081 1
1 15 . 18 1 1 A 3 3 GLY HA3 H 3 4.030 4.111 -0.081 1
1 16 . 18 1 1 A 3 3 GLY C C 3 174.100 172.248 1.852 1
1 17 . 18 1 1 A 3 3 GLY CA C 3 45.200 45.746 -0.546 1
1 18 . 18 1 1 A 3 3 GLY N N 3 108.000 109.965 -1.965 1
1 19 . 18 1 1 A 4 4 GLN H H 4 8.550 8.344 0.206 1
1 20 . 18 1 1 A 4 4 GLN HA H 4 4.340 4.507 -0.167 1
1 27 . 18 1 1 A 4 4 GLN C C 4 176.700 175.025 1.675 1
1 28 . 18 1 1 A 4 4 GLN CA C 4 56.600 55.487 1.113 1
1 29 . 18 1 1 A 4 4 GLN CB C 4 29.300 28.892 0.408 1
1 31 . 18 1 1 A 4 4 GLN N N 4 120.500 121.856 -1.356 1
1 33 . 18 1 1 A 5 5 SER H H 5 8.540 8.853 -0.313 1
1 34 . 18 1 1 A 5 5 SER HA H 5 4.390 4.670 -0.280 1
1 38 . 18 1 1 A 5 5 SER C C 5 174.800 174.182 0.618 1
1 39 . 18 1 1 A 5 5 SER CA C 5 59.100 58.649 0.451 1
1 40 . 18 1 1 A 5 5 SER CB C 5 63.500 63.425 0.075 1
1 41 . 18 1 1 A 5 5 SER N N 5 117.100 122.374 -5.274 1
1 42 . 18 1 1 A 6 6 ASP H H 6 8.300 9.090 -0.790 1
1 43 . 18 1 1 A 6 6 ASP HA H 6 4.540 4.199 0.341 1
1 46 . 18 1 1 A 6 6 ASP C C 6 177.300 175.846 1.454 1
1 47 . 18 1 1 A 6 6 ASP CA C 6 55.100 55.089 0.011 1
1 48 . 18 1 1 A 6 6 ASP CB C 6 40.800 39.129 1.671 1
1 49 . 18 1 1 A 6 6 ASP N N 6 122.700 124.372 -1.672 1
1 50 . 18 1 1 A 7 7 ARG H H 7 8.270 8.053 0.217 1
1 51 . 18 1 1 A 7 7 ARG HA H 7 4.150 4.127 0.023 1
1 58 . 18 1 1 A 7 7 ARG C C 7 177.600 179.026 -1.426 1
1 59 . 18 1 1 A 7 7 ARG CA C 7 58.000 58.843 -0.843 1
1 60 . 18 1 1 A 7 7 ARG CB C 7 30.100 30.544 -0.444 1
1 63 . 18 1 1 A 7 7 ARG N N 7 122.100 120.427 1.673 1
1 64 . 18 1 1 A 8 8 LYS H H 8 8.130 7.862 0.268 1
1 65 . 18 1 1 A 8 8 LYS HA H 8 4.090 4.076 0.014 1
1 74 . 18 1 1 A 8 8 LYS C C 8 177.600 179.647 -2.047 1
1 75 . 18 1 1 A 8 8 LYS CA C 8 58.400 59.092 -0.692 1
1 76 . 18 1 1 A 8 8 LYS CB C 8 31.700 31.954 -0.254 1
1 80 . 18 1 1 A 8 8 LYS N N 8 120.900 118.494 2.406 1
1 81 . 18 1 1 A 9 9 ALA H H 9 8.050 8.277 -0.227 1
1 82 . 18 1 1 A 9 9 ALA HA H 9 3.950 4.045 -0.095 1
1 86 . 18 1 1 A 9 9 ALA C C 9 179.800 179.671 0.129 1
1 87 . 18 1 1 A 9 9 ALA CA C 9 55.100 54.786 0.314 1
1 88 . 18 1 1 A 9 9 ALA CB C 9 18.100 17.939 0.161 1
1 89 . 18 1 1 A 9 9 ALA N N 9 121.600 121.333 0.267 1
1 90 . 18 1 1 A 10 10 ALA H H 10 7.910 7.757 0.153 1
1 91 . 18 1 1 A 10 10 ALA HA H 10 4.200 4.257 -0.057 1
1 95 . 18 1 1 A 10 10 ALA C C 10 180.500 179.764 0.736 1
1 96 . 18 1 1 A 10 10 ALA CA C 10 54.600 54.095 0.505 1
1 97 . 18 1 1 A 10 10 ALA CB C 10 18.100 18.915 -0.815 1
1 98 . 18 1 1 A 10 10 ALA N N 10 120.200 119.861 0.339 1
1 99 . 18 1 1 A 11 11 LEU H H 11 8.080 7.650 0.430 1
1 100 . 18 1 1 A 11 11 LEU HA H 11 4.120 4.019 0.101 1
1 110 . 18 1 1 A 11 11 LEU C C 11 179.600 178.989 0.611 1
1 111 . 18 1 1 A 11 11 LEU CA C 11 57.800 57.865 -0.065 1
1 112 . 18 1 1 A 11 11 LEU CB C 11 41.700 41.941 -0.241 1
1 115 . 18 1 1 A 11 11 LEU N N 11 120.900 119.874 1.026 1
1 116 . 18 1 1 A 12 12 LEU H H 12 8.480 8.471 0.009 1
1 117 . 18 1 1 A 12 12 LEU HA H 12 4.040 4.109 -0.069 1
1 127 . 18 1 1 A 12 12 LEU C C 12 178.900 179.212 -0.312 1
1 128 . 18 1 1 A 12 12 LEU CA C 12 58.100 57.042 1.058 1
1 129 . 18 1 1 A 12 12 LEU CB C 12 40.100 41.352 -1.252 1
1 133 . 18 1 1 A 12 12 LEU N N 12 118.700 117.402 1.298 1
1 134 . 18 1 1 A 13 13 ASP H H 13 7.990 8.348 -0.358 1
1 135 . 18 1 1 A 13 13 ASP HA H 13 4.420 4.238 0.182 1
1 138 . 18 1 1 A 13 13 ASP C C 13 178.900 178.574 0.326 1
1 139 . 18 1 1 A 13 13 ASP CA C 13 57.500 58.057 -0.557 1
1 140 . 18 1 1 A 13 13 ASP CB C 13 40.500 41.070 -0.570 1
1 141 . 18 1 1 A 13 13 ASP N N 13 119.500 119.974 -0.474 1
1 142 . 18 1 1 A 14 14 GLN H H 14 7.620 7.622 -0.002 1
1 143 . 18 1 1 A 14 14 GLN HA H 14 4.230 4.036 0.194 1
1 150 . 18 1 1 A 14 14 GLN C C 14 178.400 178.257 0.143 1
1 151 . 18 1 1 A 14 14 GLN CA C 14 58.100 58.651 -0.551 1
1 152 . 18 1 1 A 14 14 GLN CB C 14 27.800 28.341 -0.541 1
1 154 . 18 1 1 A 14 14 GLN N N 14 118.900 118.147 0.753 1
1 156 . 18 1 1 A 15 15 VAL H H 15 8.480 8.078 0.402 1
1 157 . 18 1 1 A 15 15 VAL HA H 15 3.380 3.753 -0.373 1
1 165 . 18 1 1 A 15 15 VAL C C 15 177.600 178.221 -0.621 1
1 166 . 18 1 1 A 15 15 VAL CA C 15 66.600 66.176 0.424 1
1 167 . 18 1 1 A 15 15 VAL CB C 15 30.500 31.340 -0.840 1
1 170 . 18 1 1 A 15 15 VAL N N 15 121.300 119.951 1.349 1
1 171 . 18 1 1 A 16 16 ALA H H 16 8.080 8.258 -0.178 1
1 172 . 18 1 1 A 16 16 ALA HA H 16 4.450 4.003 0.447 1
1 176 . 18 1 1 A 16 16 ALA C C 16 179.100 179.549 -0.449 1
1 177 . 18 1 1 A 16 16 ALA CA C 16 54.600 55.880 -1.280 1
1 178 . 18 1 1 A 16 16 ALA CB C 16 17.700 18.187 -0.487 1
1 179 . 18 1 1 A 16 16 ALA N N 16 121.400 122.234 -0.834 1
1 180 . 18 1 1 A 17 17 ARG H H 17 7.480 7.665 -0.185 1
1 181 . 18 1 1 A 17 17 ARG HA H 17 3.910 4.100 -0.190 1
1 187 . 18 1 1 A 17 17 ARG C C 17 179.700 178.714 0.986 1
1 188 . 18 1 1 A 17 17 ARG CA C 17 59.700 59.056 0.644 1
1 189 . 18 1 1 A 17 17 ARG CB C 17 30.400 29.702 0.698 1
1 191 . 18 1 1 A 17 17 ARG N N 17 116.900 117.285 -0.385 1
1 192 . 18 1 1 A 18 18 VAL H H 18 7.960 8.043 -0.083 1
1 193 . 18 1 1 A 18 18 VAL HA H 18 3.690 3.681 0.009 1
1 201 . 18 1 1 A 18 18 VAL C C 18 177.900 178.170 -0.270 1
1 202 . 18 1 1 A 18 18 VAL CA C 18 66.600 66.064 0.536 1
1 203 . 18 1 1 A 18 18 VAL CB C 18 31.300 31.664 -0.364 1
1 206 . 18 1 1 A 18 18 VAL N N 18 123.000 120.962 2.038 1
1 207 . 18 1 1 A 19 19 GLY H H 19 8.270 8.599 -0.329 1
1 208 . 18 1 1 A 19 19 GLY HA2 H 19 3.430 3.775 -0.345 1
1 209 . 18 1 1 A 19 19 GLY HA3 H 19 3.430 3.781 -0.351 1
1 210 . 18 1 1 A 19 19 GLY C C 19 174.400 175.644 -1.244 1
1 211 . 18 1 1 A 19 19 GLY CA C 19 48.500 47.474 1.026 1
1 212 . 18 1 1 A 19 19 GLY N N 19 105.400 107.385 -1.985 1
1 213 . 18 1 1 A 20 20 LYS H H 20 8.250 8.255 -0.005 1
1 214 . 18 1 1 A 20 20 LYS HA H 20 3.710 4.154 -0.444 1
1 223 . 18 1 1 A 20 20 LYS C C 20 179.400 178.413 0.987 1
1 224 . 18 1 1 A 20 20 LYS CA C 20 59.300 58.453 0.847 1
1 225 . 18 1 1 A 20 20 LYS CB C 20 32.600 32.210 0.390 1
1 229 . 18 1 1 A 20 20 LYS N N 20 118.700 121.757 -3.057 1
1 230 . 18 1 1 A 21 21 ALA H H 21 7.640 7.948 -0.308 1
1 231 . 18 1 1 A 21 21 ALA HA H 21 3.790 4.078 -0.288 1
1 235 . 18 1 1 A 21 21 ALA C C 21 177.900 179.895 -1.995 1
1 236 . 18 1 1 A 21 21 ALA CA C 21 55.200 54.962 0.238 1
1 237 . 18 1 1 A 21 21 ALA CB C 21 19.200 18.415 0.785 1
1 238 . 18 1 1 A 21 21 ALA N N 21 121.700 121.982 -0.282 1
1 239 . 18 1 1 A 22 22 LEU H H 22 7.330 8.017 -0.687 1
1 240 . 18 1 1 A 22 22 LEU HA H 22 4.140 4.109 0.031 1
1 250 . 18 1 1 A 22 22 LEU C C 22 176.800 177.736 -0.936 1
1 251 . 18 1 1 A 22 22 LEU CA C 22 54.600 57.652 -3.052 1
1 252 . 18 1 1 A 22 22 LEU CB C 22 42.900 41.172 1.728 1
1 256 . 18 1 1 A 22 22 LEU N N 22 114.200 120.671 -6.471 1
1 257 . 18 1 1 A 23 23 ALA H H 23 7.160 7.741 -0.581 1
1 258 . 18 1 1 A 23 23 ALA HA H 23 4.720 4.295 0.425 1
1 262 . 18 1 1 A 23 23 ALA C C 23 176.700 177.145 -0.445 1
1 263 . 18 1 1 A 23 23 ALA CA C 23 53.000 52.229 0.771 1
1 264 . 18 1 1 A 23 23 ALA CB C 23 18.200 18.597 -0.397 1
1 265 . 18 1 1 A 23 23 ALA N N 23 118.200 121.101 -2.901 1
1 266 . 18 1 1 A 24 24 ASN H H 24 7.440 8.808 -1.368 1
1 267 . 18 1 1 A 24 24 ASN HA H 24 4.730 4.977 -0.247 1
1 272 . 18 1 1 A 24 24 ASN C C 24 174.800 175.710 -0.910 1
1 273 . 18 1 1 A 24 24 ASN CA C 24 53.500 54.486 -0.986 1
1 274 . 18 1 1 A 24 24 ASN CB C 24 41.700 41.129 0.571 1
1 275 . 18 1 1 A 24 24 ASN N N 24 116.800 123.148 -6.348 1
1 277 . 18 1 1 A 25 25 GLY H H 25 9.370 8.145 1.225 1
1 278 . 18 1 1 A 25 25 GLY HA2 H 25 3.650 4.001 -0.351 1
1 279 . 18 1 1 A 25 25 GLY HA3 H 25 4.110 4.017 0.093 1
1 280 . 18 1 1 A 25 25 GLY C C 25 175.300 175.884 -0.584 1
1 281 . 18 1 1 A 25 25 GLY CA C 25 47.600 45.624 1.976 1
1 282 . 18 1 1 A 25 25 GLY N N 25 114.800 107.736 7.064 1
1 283 . 18 1 1 A 26 26 ARG H H 26 8.050 8.388 -0.338 1
1 284 . 18 1 1 A 26 26 ARG HA H 26 4.150 4.040 0.110 1
1 289 . 18 1 1 A 26 26 ARG C C 26 179.300 178.434 0.866 1
1 290 . 18 1 1 A 26 26 ARG CA C 26 57.000 59.185 -2.185 1
1 291 . 18 1 1 A 26 26 ARG CB C 26 29.900 29.949 -0.049 1
1 294 . 18 1 1 A 26 26 ARG N N 26 120.500 121.204 -0.704 1
1 295 . 18 1 1 A 27 27 ARG H H 27 7.930 7.748 0.182 1
1 296 . 18 1 1 A 27 27 ARG HA H 27 3.710 4.137 -0.427 1
1 301 . 18 1 1 A 27 27 ARG C C 27 178.300 177.521 0.779 1
1 302 . 18 1 1 A 27 27 ARG CA C 27 61.000 58.137 2.863 1
1 303 . 18 1 1 A 27 27 ARG CB C 27 30.400 30.186 0.214 1
1 305 . 18 1 1 A 27 27 ARG N N 27 117.900 118.685 -0.785 1
1 306 . 18 1 1 A 28 28 LEU H H 28 7.640 7.725 -0.085 1
1 307 . 18 1 1 A 28 28 LEU HA H 28 3.950 4.151 -0.201 1
1 317 . 18 1 1 A 28 28 LEU C C 28 178.200 178.774 -0.574 1
1 318 . 18 1 1 A 28 28 LEU CA C 28 57.600 55.958 1.642 1
1 319 . 18 1 1 A 28 28 LEU CB C 28 41.900 41.876 0.024 1
1 323 . 18 1 1 A 28 28 LEU N N 28 117.600 117.502 0.098 1
1 324 . 18 1 1 A 29 29 GLN H H 29 8.110 7.862 0.248 1
1 325 . 18 1 1 A 29 29 GLN HA H 29 3.880 4.127 -0.247 1
1 332 . 18 1 1 A 29 29 GLN C C 29 179.400 178.739 0.661 1
1 333 . 18 1 1 A 29 29 GLN CA C 29 59.100 58.514 0.586 1
1 334 . 18 1 1 A 29 29 GLN CB C 29 28.800 28.247 0.553 1
1 336 . 18 1 1 A 29 29 GLN N N 29 119.300 119.065 0.235 1
1 338 . 18 1 1 A 30 30 ILE H H 30 7.530 7.590 -0.060 1
1 339 . 18 1 1 A 30 30 ILE HA H 30 3.340 3.621 -0.281 1
1 349 . 18 1 1 A 30 30 ILE C C 30 176.700 178.071 -1.371 1
1 350 . 18 1 1 A 30 30 ILE CA C 30 65.900 65.371 0.529 1
1 351 . 18 1 1 A 30 30 ILE CB C 30 37.400 38.105 -0.705 1
1 355 . 18 1 1 A 30 30 ILE N N 30 118.600 120.985 -2.385 1
1 356 . 18 1 1 A 31 31 LEU H H 31 7.500 8.133 -0.633 1
1 357 . 18 1 1 A 31 31 LEU HA H 31 3.520 3.704 -0.184 1
1 367 . 18 1 1 A 31 31 LEU C C 31 177.300 178.529 -1.229 1
1 368 . 18 1 1 A 31 31 LEU CA C 31 58.100 57.820 0.280 1
1 369 . 18 1 1 A 31 31 LEU CB C 31 41.100 40.655 0.445 1
1 373 . 18 1 1 A 31 31 LEU N N 31 119.900 118.920 0.980 1
1 374 . 18 1 1 A 32 32 ASP H H 32 7.950 8.202 -0.252 1
1 375 . 18 1 1 A 32 32 ASP HA H 32 4.300 4.329 -0.029 1
1 378 . 18 1 1 A 32 32 ASP C C 32 178.300 178.377 -0.077 1
1 379 . 18 1 1 A 32 32 ASP CA C 32 57.400 57.691 -0.291 1
1 380 . 18 1 1 A 32 32 ASP CB C 32 42.400 41.968 0.432 1
1 381 . 18 1 1 A 32 32 ASP N N 32 116.900 119.688 -2.788 1
1 382 . 18 1 1 A 33 33 LEU H H 33 7.350 7.600 -0.250 1
1 383 . 18 1 1 A 33 33 LEU HA H 33 4.130 4.121 0.009 1
1 393 . 18 1 1 A 33 33 LEU C C 33 180.000 178.809 1.191 1
1 394 . 18 1 1 A 33 33 LEU CA C 33 57.600 57.574 0.026 1
1 395 . 18 1 1 A 33 33 LEU CB C 33 42.300 41.759 0.541 1
1 399 . 18 1 1 A 33 33 LEU N N 33 118.600 120.316 -1.716 1
1 400 . 18 1 1 A 34 34 LEU H H 34 8.300 8.093 0.207 1
1 401 . 18 1 1 A 34 34 LEU HA H 34 4.490 4.500 -0.010 1
1 411 . 18 1 1 A 34 34 LEU C C 34 178.900 179.357 -0.457 1
1 412 . 18 1 1 A 34 34 LEU CA C 34 55.800 56.439 -0.639 1
1 413 . 18 1 1 A 34 34 LEU CB C 34 41.300 41.564 -0.264 1
1 417 . 18 1 1 A 34 34 LEU N N 34 117.800 117.878 -0.078 1
1 418 . 18 1 1 A 35 35 ALA H H 35 8.160 7.470 0.690 1
1 419 . 18 1 1 A 35 35 ALA HA H 35 4.050 4.138 -0.088 1
1 423 . 18 1 1 A 35 35 ALA C C 35 179.000 178.025 0.975 1
1 424 . 18 1 1 A 35 35 ALA CA C 35 54.900 54.285 0.615 1
1 425 . 18 1 1 A 35 35 ALA CB C 35 17.500 18.249 -0.749 1
1 426 . 18 1 1 A 35 35 ALA N N 35 123.900 121.412 2.488 1
1 427 . 18 1 1 A 36 36 GLN H H 36 7.600 7.594 0.006 1
1 428 . 18 1 1 A 36 36 GLN HA H 36 4.340 4.338 0.002 1
1 435 . 18 1 1 A 36 36 GLN C C 36 176.100 175.489 0.611 1
1 436 . 18 1 1 A 36 36 GLN CA C 36 55.800 54.781 1.019 1
1 437 . 18 1 1 A 36 36 GLN CB C 36 29.000 28.147 0.853 1
1 439 . 18 1 1 A 36 36 GLN N N 36 113.300 113.779 -0.479 1
1 441 . 18 1 1 A 37 37 GLY H H 37 7.550 6.976 0.574 1
1 442 . 18 1 1 A 37 37 GLY HA2 H 37 3.730 4.022 -0.292 1
1 443 . 18 1 1 A 37 37 GLY HA3 H 37 4.490 4.026 0.464 1
1 444 . 18 1 1 A 37 37 GLY C C 37 171.500 172.968 -1.468 1
1 445 . 18 1 1 A 37 37 GLY CA C 37 44.500 44.534 -0.034 1
1 446 . 18 1 1 A 37 37 GLY N N 37 108.400 108.287 0.113 1
1 447 . 18 1 1 A 38 38 GLU H H 38 8.120 8.465 -0.345 1
1 448 . 18 1 1 A 38 38 GLU HA H 38 4.820 4.521 0.299 1
1 453 . 18 1 1 A 38 38 GLU C C 38 177.000 175.925 1.075 1
1 454 . 18 1 1 A 38 38 GLU CA C 38 56.400 56.520 -0.120 1
1 455 . 18 1 1 A 38 38 GLU CB C 38 31.200 29.919 1.281 1
1 457 . 18 1 1 A 38 38 GLU N N 38 119.600 119.283 0.317 1
1 458 . 18 1 1 A 39 39 ARG H H 39 8.580 9.050 -0.470 1
1 459 . 18 1 1 A 39 39 ARG HA H 39 4.970 5.123 -0.153 1
1 467 . 18 1 1 A 39 39 ARG C C 39 174.800 175.651 -0.851 1
1 468 . 18 1 1 A 39 39 ARG CA C 39 53.900 54.106 -0.206 1
1 469 . 18 1 1 A 39 39 ARG CB C 39 36.400 33.934 2.466 1
1 472 . 18 1 1 A 39 39 ARG N N 39 121.500 124.304 -2.804 1
1 474 . 18 1 1 A 40 40 ALA H H 40 8.910 9.018 -0.108 1
1 475 . 18 1 1 A 40 40 ALA HA H 40 4.920 4.557 0.363 1
1 479 . 18 1 1 A 40 40 ALA C C 40 179.200 178.483 0.717 1
1 480 . 18 1 1 A 40 40 ALA CA C 40 51.100 52.196 -1.096 1
1 481 . 18 1 1 A 40 40 ALA CB C 40 19.200 19.475 -0.275 1
1 482 . 18 1 1 A 40 40 ALA N N 40 125.100 126.743 -1.643 1
1 483 . 18 1 1 A 41 41 VAL H H 41 8.420 8.463 -0.043 1
1 484 . 18 1 1 A 41 41 VAL HA H 41 3.430 3.556 -0.126 1
1 492 . 18 1 1 A 41 41 VAL C C 41 176.800 177.132 -0.332 1
1 493 . 18 1 1 A 41 41 VAL CA C 41 67.600 66.981 0.619 1
1 494 . 18 1 1 A 41 41 VAL CB C 41 31.600 32.066 -0.466 1
1 497 . 18 1 1 A 41 41 VAL N N 41 120.900 120.654 0.246 1
1 498 . 18 1 1 A 42 42 GLU H H 42 9.640 8.322 1.318 1
1 499 . 18 1 1 A 42 42 GLU HA H 42 3.880 3.997 -0.117 1
1 504 . 18 1 1 A 42 42 GLU C C 42 178.300 178.895 -0.595 1
1 505 . 18 1 1 A 42 42 GLU CA C 42 60.600 59.400 1.200 1
1 506 . 18 1 1 A 42 42 GLU CB C 42 28.300 29.435 -1.135 1
1 508 . 18 1 1 A 42 42 GLU N N 42 119.000 119.084 -0.084 1
1 509 . 18 1 1 A 43 43 ALA H H 43 6.870 7.724 -0.854 1
1 510 . 18 1 1 A 43 43 ALA HA H 43 4.290 4.136 0.154 1
1 514 . 18 1 1 A 43 43 ALA C C 43 180.700 179.876 0.824 1
1 515 . 18 1 1 A 43 43 ALA CA C 43 54.100 55.187 -1.087 1
1 516 . 18 1 1 A 43 43 ALA CB C 43 19.100 18.378 0.722 1
1 517 . 18 1 1 A 43 43 ALA N N 43 120.500 122.166 -1.666 1
1 518 . 18 1 1 A 44 44 ILE H H 44 7.970 8.158 -0.188 1
1 519 . 18 1 1 A 44 44 ILE HA H 44 3.470 3.638 -0.168 1
1 529 . 18 1 1 A 44 44 ILE C C 44 178.300 177.913 0.387 1
1 530 . 18 1 1 A 44 44 ILE CA C 44 64.700 65.471 -0.771 1
1 531 . 18 1 1 A 44 44 ILE CB C 44 38.100 38.044 0.056 1
1 535 . 18 1 1 A 44 44 ILE N N 44 120.500 118.548 1.952 1
1 536 . 18 1 1 A 45 45 ALA H H 45 8.460 8.141 0.319 1
1 537 . 18 1 1 A 45 45 ALA HA H 45 3.720 4.008 -0.288 1
1 541 . 18 1 1 A 45 45 ALA C C 45 178.500 179.665 -1.165 1
1 542 . 18 1 1 A 45 45 ALA CA C 45 56.200 55.259 0.941 1
1 543 . 18 1 1 A 45 45 ALA CB C 45 17.400 18.454 -1.054 1
1 544 . 18 1 1 A 45 45 ALA N N 45 124.500 122.517 1.983 1
1 545 . 18 1 1 A 46 46 THR H H 46 8.080 8.258 -0.178 1
1 546 . 18 1 1 A 46 46 THR HA H 46 3.900 3.856 0.044 1
1 551 . 18 1 1 A 46 46 THR C C 46 177.200 176.488 0.712 1
1 552 . 18 1 1 A 46 46 THR CA C 46 66.400 66.834 -0.434 1
1 553 . 18 1 1 A 46 46 THR CB C 46 68.800 68.788 0.012 1
1 555 . 18 1 1 A 46 46 THR N N 46 112.400 114.540 -2.140 1
1 556 . 18 1 1 A 47 47 ALA H H 47 7.930 8.319 -0.389 1
1 557 . 18 1 1 A 47 47 ALA HA H 47 4.200 4.086 0.114 1
1 561 . 18 1 1 A 47 47 ALA C C 47 179.200 179.616 -0.416 1
1 562 . 18 1 1 A 47 47 ALA CA C 47 54.800 55.256 -0.456 1
1 563 . 18 1 1 A 47 47 ALA CB C 47 19.800 18.125 1.675 1
1 564 . 18 1 1 A 47 47 ALA N N 47 121.400 123.894 -2.494 1
1 565 . 18 1 1 A 48 48 THR H H 48 7.560 7.594 -0.034 1
1 566 . 18 1 1 A 48 48 THR HA H 48 4.390 4.382 0.008 1
1 571 . 18 1 1 A 48 48 THR C C 48 175.700 175.878 -0.178 1
1 572 . 18 1 1 A 48 48 THR CA C 48 61.800 62.823 -1.023 1
1 573 . 18 1 1 A 48 48 THR CB C 48 71.000 70.420 0.580 1
1 575 . 18 1 1 A 48 48 THR N N 48 103.500 106.920 -3.420 1
1 576 . 18 1 1 A 49 49 GLY H H 49 7.820 8.342 -0.522 1
1 577 . 18 1 1 A 49 49 GLY HA2 H 49 3.870 3.912 -0.042 1
1 578 . 18 1 1 A 49 49 GLY HA3 H 49 4.100 3.913 0.187 1
1 579 . 18 1 1 A 49 49 GLY C C 49 174.400 174.057 0.343 1
1 580 . 18 1 1 A 49 49 GLY CA C 49 46.300 46.081 0.219 1
1 581 . 18 1 1 A 49 49 GLY N N 49 111.100 112.322 -1.222 1
1 582 . 18 1 1 A 50 50 MET H H 50 7.930 7.812 0.118 1
1 583 . 18 1 1 A 50 50 MET HA H 50 4.540 4.861 -0.321 1
1 591 . 18 1 1 A 50 50 MET C C 50 174.800 175.172 -0.372 1
1 592 . 18 1 1 A 50 50 MET CA C 50 55.100 54.562 0.538 1
1 593 . 18 1 1 A 50 50 MET CB C 50 37.200 35.744 1.456 1
1 596 . 18 1 1 A 50 50 MET N N 50 119.300 119.068 0.232 1
1 597 . 18 1 1 A 51 51 ASN H H 51 8.040 8.700 -0.660 1
1 598 . 18 1 1 A 51 51 ASN HA H 51 4.580 4.827 -0.247 1
1 601 . 18 1 1 A 51 51 ASN C C 51 176.100 177.228 -1.128 1
1 602 . 18 1 1 A 51 51 ASN CA C 51 52.800 53.455 -0.655 1
1 603 . 18 1 1 A 51 51 ASN CB C 51 41.100 39.096 2.004 1
1 604 . 18 1 1 A 51 51 ASN N N 51 118.000 118.636 -0.636 1
1 605 . 18 1 1 A 52 52 LEU H H 52 8.560 8.759 -0.199 1
1 606 . 18 1 1 A 52 52 LEU HA H 52 3.760 3.899 -0.139 1
1 616 . 18 1 1 A 52 52 LEU C C 52 179.600 178.778 0.822 1
1 617 . 18 1 1 A 52 52 LEU CA C 52 59.000 57.738 1.262 1
1 618 . 18 1 1 A 52 52 LEU CB C 52 41.800 41.249 0.551 1
1 622 . 18 1 1 A 52 52 LEU N N 52 120.600 123.900 -3.300 1
1 623 . 18 1 1 A 53 53 THR H H 53 8.230 8.041 0.189 1
1 624 . 18 1 1 A 53 53 THR HA H 53 3.880 3.856 0.024 1
1 629 . 18 1 1 A 53 53 THR C C 53 176.900 176.693 0.207 1
1 630 . 18 1 1 A 53 53 THR CA C 53 66.500 66.687 -0.187 1
1 631 . 18 1 1 A 53 53 THR CB C 53 68.400 68.583 -0.183 1
1 633 . 18 1 1 A 53 53 THR N N 53 115.800 115.963 -0.163 1
1 634 . 18 1 1 A 54 54 THR H H 54 8.420 8.166 0.254 1
1 635 . 18 1 1 A 54 54 THR HA H 54 3.880 3.827 0.053 1
1 640 . 18 1 1 A 54 54 THR C C 54 177.300 176.128 1.172 1
1 641 . 18 1 1 A 54 54 THR CA C 54 66.600 66.668 -0.068 1
1 642 . 18 1 1 A 54 54 THR CB C 54 66.600 68.648 -2.048 1
1 644 . 18 1 1 A 54 54 THR N N 54 122.300 116.583 5.717 1
1 645 . 18 1 1 A 55 55 ALA H H 55 8.860 8.468 0.392 1
1 646 . 18 1 1 A 55 55 ALA HA H 55 4.020 3.934 0.086 1
1 650 . 18 1 1 A 55 55 ALA C C 55 179.000 179.578 -0.578 1
1 651 . 18 1 1 A 55 55 ALA CA C 55 56.100 55.297 0.803 1
1 652 . 18 1 1 A 55 55 ALA CB C 55 17.000 18.485 -1.485 1
1 653 . 18 1 1 A 55 55 ALA N N 55 125.600 123.454 2.146 1
1 654 . 18 1 1 A 56 56 SER H H 56 8.440 8.437 0.003 1
1 655 . 18 1 1 A 56 56 SER HA H 56 3.920 4.048 -0.128 1
1 658 . 18 1 1 A 56 56 SER C C 56 176.400 177.263 -0.863 1
1 659 . 18 1 1 A 56 56 SER CA C 56 62.600 61.333 1.267 1
1 660 . 18 1 1 A 56 56 SER CB C 56 62.700 62.186 0.514 1
1 661 . 18 1 1 A 56 56 SER N N 56 112.700 112.745 -0.045 1
1 662 . 18 1 1 A 57 57 ALA H H 57 8.090 8.085 0.005 1
1 663 . 18 1 1 A 57 57 ALA HA H 57 4.130 3.959 0.171 1
1 667 . 18 1 1 A 57 57 ALA C C 57 181.200 179.851 1.349 1
1 668 . 18 1 1 A 57 57 ALA CA C 57 55.200 55.272 -0.072 1
1 669 . 18 1 1 A 57 57 ALA CB C 57 17.900 18.390 -0.490 1
1 670 . 18 1 1 A 57 57 ALA N N 57 124.000 124.466 -0.466 1
1 671 . 18 1 1 A 58 58 ASN H H 58 7.970 7.697 0.273 1
1 672 . 18 1 1 A 58 58 ASN HA H 58 4.480 4.551 -0.071 1
1 677 . 18 1 1 A 58 58 ASN C C 58 177.500 178.220 -0.720 1
1 678 . 18 1 1 A 58 58 ASN CA C 58 56.900 56.369 0.531 1
1 679 . 18 1 1 A 58 58 ASN CB C 58 39.800 38.672 1.128 1
1 680 . 18 1 1 A 58 58 ASN N N 58 117.600 116.729 0.871 1
1 682 . 18 1 1 A 59 59 LEU H H 59 8.530 8.673 -0.143 1
1 683 . 18 1 1 A 59 59 LEU HA H 59 3.710 3.851 -0.141 1
1 693 . 18 1 1 A 59 59 LEU C C 59 178.400 179.296 -0.896 1
1 694 . 18 1 1 A 59 59 LEU CA C 59 58.600 57.807 0.793 1
1 695 . 18 1 1 A 59 59 LEU CB C 59 40.500 40.941 -0.441 1
1 699 . 18 1 1 A 59 59 LEU N N 59 122.600 121.298 1.302 1
1 700 . 18 1 1 A 60 60 GLN H H 60 8.200 8.090 0.110 1
1 701 . 18 1 1 A 60 60 GLN HA H 60 4.020 4.185 -0.165 1
1 708 . 18 1 1 A 60 60 GLN C C 60 178.700 178.479 0.221 1
1 709 . 18 1 1 A 60 60 GLN CA C 60 58.800 58.924 -0.124 1
1 710 . 18 1 1 A 60 60 GLN CB C 60 27.700 28.292 -0.592 1
1 712 . 18 1 1 A 60 60 GLN N N 60 118.900 118.247 0.653 1
1 714 . 18 1 1 A 61 61 ALA H H 61 7.580 7.613 -0.033 1
1 715 . 18 1 1 A 61 61 ALA HA H 61 4.230 4.075 0.155 1
1 719 . 18 1 1 A 61 61 ALA C C 61 181.300 180.164 1.136 1
1 720 . 18 1 1 A 61 61 ALA CA C 61 55.100 54.939 0.161 1
1 721 . 18 1 1 A 61 61 ALA CB C 61 17.600 18.216 -0.616 1
1 722 . 18 1 1 A 61 61 ALA N N 61 122.200 123.110 -0.910 1
1 723 . 18 1 1 A 62 62 LEU H H 62 7.830 8.510 -0.680 1
1 724 . 18 1 1 A 62 62 LEU HA H 62 3.980 4.041 -0.061 1
1 734 . 18 1 1 A 62 62 LEU C C 62 178.500 179.428 -0.928 1
1 735 . 18 1 1 A 62 62 LEU CA C 62 58.100 57.441 0.659 1
1 736 . 18 1 1 A 62 62 LEU CB C 62 43.300 41.740 1.560 1
1 739 . 18 1 1 A 62 62 LEU N N 62 119.000 118.712 0.288 1
1 740 . 18 1 1 A 63 63 LYS H H 63 8.580 8.238 0.342 1
1 741 . 18 1 1 A 63 63 LYS HA H 63 4.130 4.233 -0.103 1
1 750 . 18 1 1 A 63 63 LYS C C 63 180.500 179.036 1.464 1
1 751 . 18 1 1 A 63 63 LYS CA C 63 59.700 59.171 0.529 1
1 752 . 18 1 1 A 63 63 LYS CB C 63 32.600 32.175 0.425 1
1 756 . 18 1 1 A 63 63 LYS N N 63 123.400 121.724 1.676 1
1 757 . 18 1 1 A 64 64 SER H H 64 8.640 7.991 0.649 1
1 758 . 18 1 1 A 64 64 SER HA H 64 4.300 4.333 -0.033 1
1 761 . 18 1 1 A 64 64 SER C C 64 175.000 176.517 -1.517 1
1 762 . 18 1 1 A 64 64 SER CA C 64 61.400 62.309 -0.909 1
1 763 . 18 1 1 A 64 64 SER CB C 64 63.000 62.826 0.174 1
1 764 . 18 1 1 A 64 64 SER N N 64 117.700 117.764 -0.064 1
1 765 . 18 1 1 A 65 65 GLY H H 65 7.280 7.578 -0.298 1
1 766 . 18 1 1 A 65 65 GLY HA2 H 65 3.240 3.949 -0.709 1
1 767 . 18 1 1 A 65 65 GLY HA3 H 65 3.980 3.950 0.030 1
1 768 . 18 1 1 A 65 65 GLY C C 65 171.300 174.745 -3.445 1
1 769 . 18 1 1 A 65 65 GLY CA C 65 45.100 45.446 -0.346 1
1 770 . 18 1 1 A 65 65 GLY N N 65 104.400 108.320 -3.920 1
1 771 . 18 1 1 A 66 66 GLY H H 66 7.730 7.598 0.132 1
1 772 . 18 1 1 A 66 66 GLY HA2 H 66 3.650 4.025 -0.375 1
1 773 . 18 1 1 A 66 66 GLY HA3 H 66 3.750 4.027 -0.277 1
1 774 . 18 1 1 A 66 66 GLY C C 66 173.700 174.997 -1.297 1
1 775 . 18 1 1 A 66 66 GLY CA C 66 45.400 46.129 -0.729 1
1 776 . 18 1 1 A 66 66 GLY N N 66 104.700 108.278 -3.578 1
1 777 . 18 1 1 A 67 67 LEU H H 67 7.520 8.571 -1.051 1
1 778 . 18 1 1 A 67 67 LEU HA H 67 4.310 4.274 0.036 1
1 788 . 18 1 1 A 67 67 LEU C C 67 177.700 176.856 0.844 1
1 789 . 18 1 1 A 67 67 LEU CA C 67 55.500 55.993 -0.493 1
1 790 . 18 1 1 A 67 67 LEU CB C 67 42.400 42.760 -0.360 1
1 794 . 18 1 1 A 67 67 LEU N N 67 110.600 118.364 -7.764 1
1 795 . 18 1 1 A 68 68 VAL H H 68 6.890 7.424 -0.534 1
1 796 . 18 1 1 A 68 68 VAL HA H 68 5.190 5.156 0.034 1
1 804 . 18 1 1 A 68 68 VAL C C 68 173.700 174.059 -0.359 1
1 805 . 18 1 1 A 68 68 VAL CA C 68 57.400 58.980 -1.580 1
1 806 . 18 1 1 A 68 68 VAL CB C 68 36.400 35.081 1.319 1
1 809 . 18 1 1 A 68 68 VAL N N 68 106.400 112.826 -6.426 1
1 810 . 18 1 1 A 69 69 GLU H H 69 8.880 9.352 -0.472 1
1 811 . 18 1 1 A 69 69 GLU HA H 69 4.660 5.017 -0.357 1
1 816 . 18 1 1 A 69 69 GLU C C 69 173.300 174.446 -1.146 1
1 817 . 18 1 1 A 69 69 GLU CA C 69 54.300 54.760 -0.460 1
1 818 . 18 1 1 A 69 69 GLU CB C 69 34.100 33.534 0.566 1
1 820 . 18 1 1 A 69 69 GLU N N 69 120.400 121.503 -1.103 1
1 821 . 18 1 1 A 70 70 ALA H H 70 8.730 8.802 -0.072 1
1 822 . 18 1 1 A 70 70 ALA HA H 70 4.990 4.819 0.171 1
1 826 . 18 1 1 A 70 70 ALA C C 70 176.500 174.795 1.705 1
1 827 . 18 1 1 A 70 70 ALA CA C 70 50.000 49.657 0.343 1
1 828 . 18 1 1 A 70 70 ALA CB C 70 22.300 21.357 0.943 1
1 829 . 18 1 1 A 70 70 ALA N N 70 122.800 123.599 -0.799 1
1 830 . 18 1 1 A 71 71 ARG H H 71 8.670 9.490 -0.820 1
1 831 . 18 1 1 A 71 71 ARG HA H 71 4.630 4.792 -0.162 1
1 843 . 18 1 1 A 71 71 ARG C C 71 173.500 174.561 -1.061 1
1 844 . 18 1 1 A 71 71 ARG CA C 71 54.600 54.580 0.020 1
1 845 . 18 1 1 A 71 71 ARG CB C 71 33.600 32.391 1.209 1
1 849 . 18 1 1 A 71 71 ARG N N 71 120.100 123.857 -3.757 1
1 851 . 18 1 1 A 72 72 ARG H H 72 8.780 8.813 -0.033 1
1 852 . 18 1 1 A 72 72 ARG HA H 72 5.100 4.846 0.254 1
1 859 . 18 1 1 A 72 72 ARG C C 72 176.000 175.074 0.926 1
1 860 . 18 1 1 A 72 72 ARG CA C 72 54.900 55.849 -0.949 1
1 861 . 18 1 1 A 72 72 ARG CB C 72 32.500 31.112 1.388 1
1 864 . 18 1 1 A 72 72 ARG N N 72 123.600 128.766 -5.166 1
1 865 . 18 1 1 A 73 73 GLU H H 73 8.720 8.876 -0.156 1
1 866 . 18 1 1 A 73 73 GLU HA H 73 4.510 4.613 -0.103 1
1 871 . 18 1 1 A 73 73 GLU C C 73 175.900 176.468 -0.568 1
1 872 . 18 1 1 A 73 73 GLU CA C 73 55.700 55.155 0.545 1
1 873 . 18 1 1 A 73 73 GLU CB C 73 31.800 31.559 0.241 1
1 875 . 18 1 1 A 73 73 GLU N N 73 126.800 126.656 0.144 1
1 876 . 18 1 1 A 74 74 GLY H H 74 9.190 8.943 0.247 1
1 877 . 18 1 1 A 74 74 GLY HA2 H 74 3.700 3.879 -0.179 1
1 878 . 18 1 1 A 74 74 GLY HA3 H 74 4.170 3.885 0.285 1
1 879 . 18 1 1 A 74 74 GLY C C 74 175.400 174.968 0.432 1
1 880 . 18 1 1 A 74 74 GLY CA C 74 47.100 47.090 0.010 1
1 881 . 18 1 1 A 74 74 GLY N N 74 118.500 116.316 2.184 1
1 882 . 18 1 1 A 75 75 THR H H 75 8.780 8.732 0.048 1
1 883 . 18 1 1 A 75 75 THR HA H 75 4.290 4.374 -0.084 1
1 888 . 18 1 1 A 75 75 THR C C 75 174.600 174.328 0.272 1
1 889 . 18 1 1 A 75 75 THR CA C 75 62.000 62.928 -0.928 1
1 890 . 18 1 1 A 75 75 THR CB C 75 69.000 69.463 -0.463 1
1 892 . 18 1 1 A 75 75 THR N N 75 118.000 119.667 -1.667 1
1 893 . 18 1 1 A 76 76 ARG H H 76 8.030 7.467 0.563 1
1 894 . 18 1 1 A 76 76 ARG HA H 76 4.610 4.836 -0.226 1
1 901 . 18 1 1 A 76 76 ARG C C 76 174.800 174.646 0.154 1
1 902 . 18 1 1 A 76 76 ARG CA C 76 55.500 54.529 0.971 1
1 903 . 18 1 1 A 76 76 ARG CB C 76 32.700 32.913 -0.213 1
1 906 . 18 1 1 A 76 76 ARG N N 76 122.600 121.705 0.895 1
1 907 . 18 1 1 A 77 77 GLN H H 77 8.580 8.839 -0.259 1
1 908 . 18 1 1 A 77 77 GLN HA H 77 4.910 5.154 -0.244 1
1 915 . 18 1 1 A 77 77 GLN C C 77 173.900 174.482 -0.582 1
1 916 . 18 1 1 A 77 77 GLN CA C 77 54.700 54.345 0.355 1
1 917 . 18 1 1 A 77 77 GLN CB C 77 31.800 30.817 0.983 1
1 919 . 18 1 1 A 77 77 GLN N N 77 121.900 121.602 0.298 1
1 921 . 18 1 1 A 78 78 TYR H H 78 8.890 9.405 -0.515 1
1 922 . 18 1 1 A 78 78 TYR HA H 78 4.750 5.128 -0.378 1
1 929 . 18 1 1 A 78 78 TYR C C 78 175.600 174.785 0.815 1
1 930 . 18 1 1 A 78 78 TYR CA C 78 57.000 56.632 0.368 1
1 931 . 18 1 1 A 78 78 TYR CB C 78 41.400 39.619 1.781 1
1 936 . 18 1 1 A 78 78 TYR N N 78 121.800 123.780 -1.980 1
1 937 . 18 1 1 A 79 79 TYR H H 79 9.010 9.934 -0.924 1
1 938 . 18 1 1 A 79 79 TYR HA H 79 5.410 5.430 -0.020 1
1 945 . 18 1 1 A 79 79 TYR C C 79 173.100 175.463 -2.363 1
1 946 . 18 1 1 A 79 79 TYR CA C 79 57.300 57.383 -0.083 1
1 947 . 18 1 1 A 79 79 TYR CB C 79 43.300 41.267 2.033 1
1 952 . 18 1 1 A 79 79 TYR N N 79 122.500 123.177 -0.677 1
1 953 . 18 1 1 A 80 80 ARG H H 80 8.720 9.301 -0.581 1
1 954 . 18 1 1 A 80 80 ARG HA H 80 5.120 5.011 0.109 1
1 962 . 18 1 1 A 80 80 ARG C C 80 175.500 175.076 0.424 1
1 963 . 18 1 1 A 80 80 ARG CA C 80 53.200 54.039 -0.839 1
1 964 . 18 1 1 A 80 80 ARG CB C 80 33.900 33.891 0.009 1
1 967 . 18 1 1 A 80 80 ARG N N 80 114.500 119.889 -5.389 1
1 969 . 18 1 1 A 81 81 ILE H H 81 9.300 8.748 0.552 1
1 970 . 18 1 1 A 81 81 ILE HA H 81 4.150 4.098 0.052 1
1 980 . 18 1 1 A 81 81 ILE C C 81 177.800 176.564 1.236 1
1 981 . 18 1 1 A 81 81 ILE CA C 81 62.300 62.231 0.069 1
1 982 . 18 1 1 A 81 81 ILE CB C 81 37.800 37.349 0.451 1
1 986 . 18 1 1 A 81 81 ILE N N 81 122.100 121.433 0.667 1
1 987 . 18 1 1 A 82 82 ALA H H 82 7.930 8.792 -0.862 1
1 988 . 18 1 1 A 82 82 ALA HA H 82 3.930 4.053 -0.123 1
1 992 . 18 1 1 A 82 82 ALA C C 82 176.300 177.231 -0.931 1
1 993 . 18 1 1 A 82 82 ALA CA C 82 54.200 55.389 -1.189 1
1 994 . 18 1 1 A 82 82 ALA CB C 82 18.500 19.177 -0.677 1
1 995 . 18 1 1 A 82 82 ALA N N 82 127.200 129.440 -2.240 1
1 996 . 18 1 1 A 83 83 GLY H H 83 6.980 7.705 -0.725 1
1 997 . 18 1 1 A 83 83 GLY HA2 H 83 4.090 4.128 -0.038 1
1 998 . 18 1 1 A 83 83 GLY HA3 H 83 4.440 4.132 0.308 1
1 999 . 18 1 1 A 83 83 GLY C C 83 173.600 174.958 -1.358 1
1 1000 . 18 1 1 A 83 83 GLY CA C 83 45.200 44.474 0.726 1
1 1001 . 18 1 1 A 83 83 GLY N N 83 101.800 103.024 -1.224 1
1 1002 . 18 1 1 A 84 84 GLU H H 84 8.930 8.888 0.042 1
1 1003 . 18 1 1 A 84 84 GLU HA H 84 4.120 3.978 0.142 1
1 1008 . 18 1 1 A 84 84 GLU C C 84 178.300 177.739 0.561 1
1 1009 . 18 1 1 A 84 84 GLU CA C 84 58.900 58.997 -0.097 1
1 1010 . 18 1 1 A 84 84 GLU CB C 84 29.400 29.410 -0.010 1
1 1012 . 18 1 1 A 84 84 GLU N N 84 120.300 120.910 -0.610 1
1 1013 . 18 1 1 A 85 85 ASP H H 85 8.950 8.006 0.944 1
1 1014 . 18 1 1 A 85 85 ASP HA H 85 4.310 4.365 -0.055 1
1 1017 . 18 1 1 A 85 85 ASP C C 85 178.000 178.770 -0.770 1
1 1018 . 18 1 1 A 85 85 ASP CA C 85 57.100 57.345 -0.245 1
1 1019 . 18 1 1 A 85 85 ASP CB C 85 38.900 40.815 -1.915 1
1 1020 . 18 1 1 A 85 85 ASP N N 85 119.400 119.394 0.006 1
1 1021 . 18 1 1 A 86 86 VAL H H 86 7.620 8.065 -0.445 1
1 1022 . 18 1 1 A 86 86 VAL HA H 86 3.480 3.575 -0.095 1
1 1030 . 18 1 1 A 86 86 VAL C C 86 177.400 177.953 -0.553 1
1 1031 . 18 1 1 A 86 86 VAL CA C 86 66.800 66.433 0.367 1
1 1032 . 18 1 1 A 86 86 VAL CB C 86 31.300 31.553 -0.253 1
1 1035 . 18 1 1 A 86 86 VAL N N 86 121.600 119.936 1.664 1
1 1036 . 18 1 1 A 87 87 ALA H H 87 7.520 8.181 -0.661 1
1 1037 . 18 1 1 A 87 87 ALA HA H 87 4.110 4.016 0.094 1
1 1041 . 18 1 1 A 87 87 ALA C C 87 181.200 179.738 1.462 1
1 1042 . 18 1 1 A 87 87 ALA CA C 87 55.800 55.878 -0.078 1
1 1043 . 18 1 1 A 87 87 ALA CB C 87 17.600 18.685 -1.085 1
1 1044 . 18 1 1 A 87 87 ALA N N 87 122.700 121.611 1.089 1
1 1045 . 18 1 1 A 88 88 ARG H H 88 8.380 8.354 0.026 1
1 1046 . 18 1 1 A 88 88 ARG HA H 88 4.090 4.103 -0.013 1
1 1054 . 18 1 1 A 88 88 ARG C C 88 179.100 178.822 0.278 1
1 1055 . 18 1 1 A 88 88 ARG CA C 88 59.600 58.573 1.027 1
1 1056 . 18 1 1 A 88 88 ARG CB C 88 30.500 29.874 0.626 1
1 1059 . 18 1 1 A 88 88 ARG N N 88 119.200 117.869 1.331 1
1 1061 . 18 1 1 A 89 89 LEU H H 89 8.480 7.946 0.534 1
1 1062 . 18 1 1 A 89 89 LEU HA H 89 4.040 4.057 -0.017 1
1 1071 . 18 1 1 A 89 89 LEU C C 89 177.200 178.615 -1.415 1
1 1072 . 18 1 1 A 89 89 LEU CA C 89 58.300 57.841 0.459 1
1 1073 . 18 1 1 A 89 89 LEU CB C 89 41.300 41.903 -0.603 1
1 1076 . 18 1 1 A 89 89 LEU N N 89 123.300 122.310 0.990 1
1 1077 . 18 1 1 A 90 90 PHE H H 90 8.890 8.779 0.111 1
1 1078 . 18 1 1 A 90 90 PHE HA H 90 4.380 4.012 0.368 1
1 1086 . 18 1 1 A 90 90 PHE C C 90 177.500 178.086 -0.586 1
1 1087 . 18 1 1 A 90 90 PHE CA C 90 59.400 62.089 -2.689 1
1 1088 . 18 1 1 A 90 90 PHE CB C 90 38.600 39.167 -0.567 1
1 1094 . 18 1 1 A 90 90 PHE N N 90 119.400 119.299 0.101 1
1 1095 . 18 1 1 A 91 91 ALA H H 91 7.920 8.197 -0.277 1
1 1096 . 18 1 1 A 91 91 ALA HA H 91 3.940 4.162 -0.222 1
1 1100 . 18 1 1 A 91 91 ALA C C 91 180.200 179.539 0.661 1
1 1101 . 18 1 1 A 91 91 ALA CA C 91 55.100 55.119 -0.019 1
1 1102 . 18 1 1 A 91 91 ALA CB C 91 18.000 17.815 0.185 1
1 1103 . 18 1 1 A 91 91 ALA N N 91 120.500 121.442 -0.942 1
1 1104 . 18 1 1 A 92 92 LEU H H 92 8.190 8.183 0.007 1
1 1105 . 18 1 1 A 92 92 LEU HA H 92 4.300 4.000 0.300 1
1 1115 . 18 1 1 A 92 92 LEU C C 92 178.900 178.295 0.605 1
1 1116 . 18 1 1 A 92 92 LEU CA C 92 57.500 57.831 -0.331 1
1 1117 . 18 1 1 A 92 92 LEU CB C 92 42.100 41.744 0.356 1
1 1121 . 18 1 1 A 92 92 LEU N N 92 120.200 119.932 0.268 1
1 1122 . 18 1 1 A 93 93 VAL H H 93 8.890 7.972 0.918 1
1 1123 . 18 1 1 A 93 93 VAL HA H 93 3.810 3.832 -0.022 1
1 1131 . 18 1 1 A 93 93 VAL C C 93 176.900 177.957 -1.057 1
1 1132 . 18 1 1 A 93 93 VAL CA C 93 66.000 65.471 0.529 1
1 1133 . 18 1 1 A 93 93 VAL CB C 93 31.200 31.200 0.000 1
1 1136 . 18 1 1 A 93 93 VAL N N 93 117.100 115.629 1.471 1
1 1137 . 18 1 1 A 94 94 GLN H H 94 6.920 7.533 -0.613 1
1 1138 . 18 1 1 A 94 94 GLN HA H 94 3.790 3.852 -0.062 1
1 1145 . 18 1 1 A 94 94 GLN C C 94 177.400 178.820 -1.420 1
1 1146 . 18 1 1 A 94 94 GLN CA C 94 60.000 58.614 1.386 1
1 1147 . 18 1 1 A 94 94 GLN CB C 94 30.300 28.163 2.137 1
1 1149 . 18 1 1 A 94 94 GLN N N 94 117.800 120.448 -2.648 1
1 1151 . 18 1 1 A 95 95 VAL H H 95 7.420 7.631 -0.211 1
1 1152 . 18 1 1 A 95 95 VAL HA H 95 3.760 3.538 0.222 1
1 1160 . 18 1 1 A 95 95 VAL C C 95 178.300 178.098 0.202 1
1 1161 . 18 1 1 A 95 95 VAL CA C 95 66.600 66.556 0.044 1
1 1162 . 18 1 1 A 95 95 VAL CB C 95 31.900 31.588 0.312 1
1 1165 . 18 1 1 A 95 95 VAL N N 95 121.500 119.699 1.801 1
1 1166 . 18 1 1 A 96 96 VAL H H 96 8.340 8.165 0.175 1
1 1167 . 18 1 1 A 96 96 VAL HA H 96 3.810 3.787 0.023 1
1 1175 . 18 1 1 A 96 96 VAL C C 96 178.400 177.152 1.248 1
1 1176 . 18 1 1 A 96 96 VAL CA C 96 66.100 65.028 1.072 1
1 1177 . 18 1 1 A 96 96 VAL CB C 96 32.200 31.302 0.898 1
1 1180 . 18 1 1 A 96 96 VAL N N 96 120.000 120.107 -0.107 1
1 1181 . 18 1 1 A 97 97 ALA H H 97 8.140 7.636 0.504 1
1 1182 . 18 1 1 A 97 97 ALA HA H 97 4.010 4.329 -0.319 1
1 1186 . 18 1 1 A 97 97 ALA C C 97 178.800 178.854 -0.054 1
1 1187 . 18 1 1 A 97 97 ALA CA C 97 54.900 54.870 0.030 1
1 1188 . 18 1 1 A 97 97 ALA CB C 97 19.900 18.679 1.221 1
1 1189 . 18 1 1 A 97 97 ALA N N 97 121.400 123.449 -2.049 1
1 1190 . 18 1 1 A 98 98 ASP H H 98 8.170 8.269 -0.099 1
1 1191 . 18 1 1 A 98 98 ASP HA H 98 4.320 4.139 0.181 1
1 1194 . 18 1 1 A 98 98 ASP C C 98 178.100 178.335 -0.235 1
1 1195 . 18 1 1 A 98 98 ASP CA C 98 57.100 57.095 0.005 1
1 1196 . 18 1 1 A 98 98 ASP CB C 98 41.800 40.986 0.814 1
1 1197 . 18 1 1 A 98 98 ASP N N 98 118.500 118.458 0.042 1
1 1198 . 18 1 1 A 99 99 GLU H H 99 8.220 8.132 0.088 1
1 1199 . 18 1 1 A 99 99 GLU HA H 99 4.000 4.052 -0.052 1
1 1204 . 18 1 1 A 99 99 GLU C C 99 178.300 178.170 0.130 1
1 1205 . 18 1 1 A 99 99 GLU CA C 99 58.300 58.881 -0.581 1
1 1206 . 18 1 1 A 99 99 GLU CB C 99 29.800 29.424 0.376 1
1 1208 . 18 1 1 A 99 99 GLU N N 99 116.600 119.596 -2.996 1
1 1209 . 18 1 1 A 100 100 HIS H H 100 7.980 7.769 0.211 1
1 1210 . 18 1 1 A 100 100 HIS HA H 100 4.600 4.572 0.028 1
1 1214 . 18 1 1 A 100 100 HIS C C 100 175.900 176.751 -0.851 1
1 1215 . 18 1 1 A 100 100 HIS CA C 100 57.500 56.831 0.669 1
1 1216 . 18 1 1 A 100 100 HIS CB C 100 30.800 30.117 0.683 1
1 1218 . 18 1 1 A 100 100 HIS N N 100 114.000 117.697 -3.697 1
1 1219 . 18 1 1 A 101 101 LEU H H 101 7.920 7.580 0.340 1
1 1220 . 18 1 1 A 101 101 LEU HA H 101 4.370 3.911 0.459 1
1 1230 . 18 1 1 A 101 101 LEU C C 101 177.700 177.385 0.315 1
1 1231 . 18 1 1 A 101 101 LEU CA C 101 55.900 57.607 -1.707 1
1 1232 . 18 1 1 A 101 101 LEU CB C 101 42.100 41.824 0.276 1
1 1236 . 18 1 1 A 101 101 LEU N N 101 118.500 119.034 -0.534 1
1 1237 . 18 1 1 A 102 102 GLU H H 102 8.100 7.836 0.264 1
1 1238 . 18 1 1 A 102 102 GLU HA H 102 4.160 4.008 0.152 1
1 1243 . 18 1 1 A 102 102 GLU C C 102 176.700 177.366 -0.666 1
1 1244 . 18 1 1 A 102 102 GLU CA C 102 57.000 58.070 -1.070 1
1 1245 . 18 1 1 A 102 102 GLU CB C 102 29.900 29.845 0.055 1
1 1247 . 18 1 1 A 102 102 GLU N N 102 119.100 118.097 1.003 1
1 1248 . 18 1 1 A 103 103 HIS H H 103 8.010 8.915 -0.905 1
1 1249 . 18 1 1 A 103 103 HIS HA H 103 4.520 4.200 0.320 1
1 1252 . 18 1 1 A 103 103 HIS CA C 103 56.100 57.174 -1.074 1
1 1253 . 18 1 1 A 103 103 HIS CB C 103 29.700 27.137 2.563 1
1 1254 . 18 1 1 A 103 103 HIS N N 103 117.300 123.192 -5.892 1
1 1255 . 18 1 1 A 107 107 HIS HA H 107 4.560 4.679 -0.119 1
1 1258 . 18 1 1 A 107 107 HIS C C 107 173.900 174.589 -0.689 1
1 1259 . 18 1 1 A 107 107 HIS CA C 107 55.900 55.778 0.122 1
1 1260 . 18 1 1 A 107 107 HIS CB C 107 30.200 31.546 -1.346 1
1 4 . 19 1 1 A 2 2 ALA H H 2 8.450 7.660 0.790 1
1 5 . 19 1 1 A 2 2 ALA HA H 2 4.390 4.492 -0.102 1
1 9 . 19 1 1 A 2 2 ALA C C 2 178.300 178.246 0.054 1
1 10 . 19 1 1 A 2 2 ALA CA C 2 52.500 52.549 -0.049 1
1 11 . 19 1 1 A 2 2 ALA CB C 2 19.200 21.579 -2.379 1
1 12 . 19 1 1 A 2 2 ALA N N 2 125.100 117.551 7.549 1
1 13 . 19 1 1 A 3 3 GLY H H 3 8.450 8.117 0.333 1
1 14 . 19 1 1 A 3 3 GLY HA2 H 3 4.030 3.901 0.129 1
1 15 . 19 1 1 A 3 3 GLY HA3 H 3 4.030 3.901 0.129 1
1 16 . 19 1 1 A 3 3 GLY C C 3 174.100 174.787 -0.687 1
1 17 . 19 1 1 A 3 3 GLY CA C 3 45.200 46.710 -1.510 1
1 18 . 19 1 1 A 3 3 GLY N N 3 108.000 107.455 0.545 1
1 19 . 19 1 1 A 4 4 GLN H H 4 8.550 7.814 0.736 1
1 20 . 19 1 1 A 4 4 GLN HA H 4 4.340 4.415 -0.075 1
1 27 . 19 1 1 A 4 4 GLN C C 4 176.700 175.934 0.766 1
1 28 . 19 1 1 A 4 4 GLN CA C 4 56.600 55.147 1.453 1
1 29 . 19 1 1 A 4 4 GLN CB C 4 29.300 28.571 0.729 1
1 31 . 19 1 1 A 4 4 GLN N N 4 120.500 120.271 0.229 1
1 33 . 19 1 1 A 5 5 SER H H 5 8.540 8.981 -0.441 1
1 34 . 19 1 1 A 5 5 SER HA H 5 4.390 4.814 -0.424 1
1 38 . 19 1 1 A 5 5 SER C C 5 174.800 174.733 0.067 1
1 39 . 19 1 1 A 5 5 SER CA C 5 59.100 57.500 1.600 1
1 40 . 19 1 1 A 5 5 SER CB C 5 63.500 63.824 -0.324 1
1 41 . 19 1 1 A 5 5 SER N N 5 117.100 122.760 -5.660 1
1 42 . 19 1 1 A 6 6 ASP H H 6 8.300 8.045 0.255 1
1 43 . 19 1 1 A 6 6 ASP HA H 6 4.540 4.829 -0.289 1
1 46 . 19 1 1 A 6 6 ASP C C 6 177.300 176.727 0.573 1
1 47 . 19 1 1 A 6 6 ASP CA C 6 55.100 54.352 0.748 1
1 48 . 19 1 1 A 6 6 ASP CB C 6 40.800 41.423 -0.623 1
1 49 . 19 1 1 A 6 6 ASP N N 6 122.700 121.094 1.606 1
1 50 . 19 1 1 A 7 7 ARG H H 7 8.270 7.813 0.457 1
1 51 . 19 1 1 A 7 7 ARG HA H 7 4.150 4.043 0.107 1
1 58 . 19 1 1 A 7 7 ARG C C 7 177.600 178.718 -1.118 1
1 59 . 19 1 1 A 7 7 ARG CA C 7 58.000 59.582 -1.582 1
1 60 . 19 1 1 A 7 7 ARG CB C 7 30.100 29.777 0.323 1
1 63 . 19 1 1 A 7 7 ARG N N 7 122.100 120.820 1.280 1
1 64 . 19 1 1 A 8 8 LYS H H 8 8.130 8.068 0.062 1
1 65 . 19 1 1 A 8 8 LYS HA H 8 4.090 4.057 0.033 1
1 74 . 19 1 1 A 8 8 LYS C C 8 177.600 178.875 -1.275 1
1 75 . 19 1 1 A 8 8 LYS CA C 8 58.400 59.181 -0.781 1
1 76 . 19 1 1 A 8 8 LYS CB C 8 31.700 31.798 -0.098 1
1 80 . 19 1 1 A 8 8 LYS N N 8 120.900 118.242 2.658 1
1 81 . 19 1 1 A 9 9 ALA H H 9 8.050 7.891 0.159 1
1 82 . 19 1 1 A 9 9 ALA HA H 9 3.950 4.118 -0.168 1
1 86 . 19 1 1 A 9 9 ALA C C 9 179.800 180.360 -0.560 1
1 87 . 19 1 1 A 9 9 ALA CA C 9 55.100 54.909 0.191 1
1 88 . 19 1 1 A 9 9 ALA CB C 9 18.100 18.195 -0.095 1
1 89 . 19 1 1 A 9 9 ALA N N 9 121.600 121.739 -0.139 1
1 90 . 19 1 1 A 10 10 ALA H H 10 7.910 7.821 0.089 1
1 91 . 19 1 1 A 10 10 ALA HA H 10 4.200 4.112 0.088 1
1 95 . 19 1 1 A 10 10 ALA C C 10 180.500 179.760 0.740 1
1 96 . 19 1 1 A 10 10 ALA CA C 10 54.600 54.925 -0.325 1
1 97 . 19 1 1 A 10 10 ALA CB C 10 18.100 18.469 -0.369 1
1 98 . 19 1 1 A 10 10 ALA N N 10 120.200 120.820 -0.620 1
1 99 . 19 1 1 A 11 11 LEU H H 11 8.080 7.624 0.456 1
1 100 . 19 1 1 A 11 11 LEU HA H 11 4.120 4.114 0.006 1
1 110 . 19 1 1 A 11 11 LEU C C 11 179.600 178.726 0.874 1
1 111 . 19 1 1 A 11 11 LEU CA C 11 57.800 57.836 -0.036 1
1 112 . 19 1 1 A 11 11 LEU CB C 11 41.700 41.966 -0.266 1
1 115 . 19 1 1 A 11 11 LEU N N 11 120.900 120.606 0.294 1
1 116 . 19 1 1 A 12 12 LEU H H 12 8.480 8.055 0.425 1
1 117 . 19 1 1 A 12 12 LEU HA H 12 4.040 4.018 0.022 1
1 127 . 19 1 1 A 12 12 LEU C C 12 178.900 179.161 -0.261 1
1 128 . 19 1 1 A 12 12 LEU CA C 12 58.100 57.472 0.628 1
1 129 . 19 1 1 A 12 12 LEU CB C 12 40.100 40.635 -0.535 1
1 133 . 19 1 1 A 12 12 LEU N N 12 118.700 118.020 0.680 1
1 134 . 19 1 1 A 13 13 ASP H H 13 7.990 8.255 -0.265 1
1 135 . 19 1 1 A 13 13 ASP HA H 13 4.420 4.264 0.156 1
1 138 . 19 1 1 A 13 13 ASP C C 13 178.900 178.743 0.157 1
1 139 . 19 1 1 A 13 13 ASP CA C 13 57.500 57.993 -0.493 1
1 140 . 19 1 1 A 13 13 ASP CB C 13 40.500 41.115 -0.615 1
1 141 . 19 1 1 A 13 13 ASP N N 13 119.500 119.933 -0.433 1
1 142 . 19 1 1 A 14 14 GLN H H 14 7.620 7.547 0.073 1
1 143 . 19 1 1 A 14 14 GLN HA H 14 4.230 4.160 0.070 1
1 150 . 19 1 1 A 14 14 GLN C C 14 178.400 178.542 -0.142 1
1 151 . 19 1 1 A 14 14 GLN CA C 14 58.100 58.553 -0.453 1
1 152 . 19 1 1 A 14 14 GLN CB C 14 27.800 28.335 -0.535 1
1 154 . 19 1 1 A 14 14 GLN N N 14 118.900 119.602 -0.702 1
1 156 . 19 1 1 A 15 15 VAL H H 15 8.480 7.855 0.625 1
1 157 . 19 1 1 A 15 15 VAL HA H 15 3.380 3.674 -0.294 1
1 165 . 19 1 1 A 15 15 VAL C C 15 177.600 178.326 -0.726 1
1 166 . 19 1 1 A 15 15 VAL CA C 15 66.600 66.380 0.220 1
1 167 . 19 1 1 A 15 15 VAL CB C 15 30.500 31.506 -1.006 1
1 170 . 19 1 1 A 15 15 VAL N N 15 121.300 120.035 1.265 1
1 171 . 19 1 1 A 16 16 ALA H H 16 8.080 8.567 -0.487 1
1 172 . 19 1 1 A 16 16 ALA HA H 16 4.450 3.913 0.537 1
1 176 . 19 1 1 A 16 16 ALA C C 16 179.100 179.140 -0.040 1
1 177 . 19 1 1 A 16 16 ALA CA C 16 54.600 55.621 -1.021 1
1 178 . 19 1 1 A 16 16 ALA CB C 16 17.700 18.485 -0.785 1
1 179 . 19 1 1 A 16 16 ALA N N 16 121.400 121.916 -0.516 1
1 180 . 19 1 1 A 17 17 ARG H H 17 7.480 7.901 -0.421 1
1 181 . 19 1 1 A 17 17 ARG HA H 17 3.910 4.151 -0.241 1
1 187 . 19 1 1 A 17 17 ARG C C 17 179.700 178.961 0.739 1
1 188 . 19 1 1 A 17 17 ARG CA C 17 59.700 58.828 0.872 1
1 189 . 19 1 1 A 17 17 ARG CB C 17 30.400 29.666 0.734 1
1 191 . 19 1 1 A 17 17 ARG N N 17 116.900 119.356 -2.456 1
1 192 . 19 1 1 A 18 18 VAL H H 18 7.960 7.810 0.150 1
1 193 . 19 1 1 A 18 18 VAL HA H 18 3.690 3.685 0.005 1
1 201 . 19 1 1 A 18 18 VAL C C 18 177.900 178.057 -0.157 1
1 202 . 19 1 1 A 18 18 VAL CA C 18 66.600 66.313 0.287 1
1 203 . 19 1 1 A 18 18 VAL CB C 18 31.300 31.700 -0.400 1
1 206 . 19 1 1 A 18 18 VAL N N 18 123.000 119.530 3.470 1
1 207 . 19 1 1 A 19 19 GLY H H 19 8.270 8.422 -0.152 1
1 208 . 19 1 1 A 19 19 GLY HA2 H 19 3.430 3.765 -0.335 1
1 209 . 19 1 1 A 19 19 GLY HA3 H 19 3.430 3.771 -0.341 1
1 210 . 19 1 1 A 19 19 GLY C C 19 174.400 175.591 -1.191 1
1 211 . 19 1 1 A 19 19 GLY CA C 19 48.500 47.301 1.199 1
1 212 . 19 1 1 A 19 19 GLY N N 19 105.400 107.533 -2.133 1
1 213 . 19 1 1 A 20 20 LYS H H 20 8.250 8.581 -0.331 1
1 214 . 19 1 1 A 20 20 LYS HA H 20 3.710 4.118 -0.408 1
1 223 . 19 1 1 A 20 20 LYS C C 20 179.400 178.204 1.196 1
1 224 . 19 1 1 A 20 20 LYS CA C 20 59.300 58.519 0.781 1
1 225 . 19 1 1 A 20 20 LYS CB C 20 32.600 32.169 0.431 1
1 229 . 19 1 1 A 20 20 LYS N N 20 118.700 121.745 -3.045 1
1 230 . 19 1 1 A 21 21 ALA H H 21 7.640 7.608 0.032 1
1 231 . 19 1 1 A 21 21 ALA HA H 21 3.790 4.122 -0.332 1
1 235 . 19 1 1 A 21 21 ALA C C 21 177.900 180.025 -2.125 1
1 236 . 19 1 1 A 21 21 ALA CA C 21 55.200 54.373 0.827 1
1 237 . 19 1 1 A 21 21 ALA CB C 21 19.200 18.385 0.815 1
1 238 . 19 1 1 A 21 21 ALA N N 21 121.700 121.592 0.108 1
1 239 . 19 1 1 A 22 22 LEU H H 22 7.330 8.005 -0.675 1
1 240 . 19 1 1 A 22 22 LEU HA H 22 4.140 4.126 0.014 1
1 250 . 19 1 1 A 22 22 LEU C C 22 176.800 177.871 -1.071 1
1 251 . 19 1 1 A 22 22 LEU CA C 22 54.600 57.341 -2.741 1
1 252 . 19 1 1 A 22 22 LEU CB C 22 42.900 41.763 1.137 1
1 256 . 19 1 1 A 22 22 LEU N N 22 114.200 120.061 -5.861 1
1 257 . 19 1 1 A 23 23 ALA H H 23 7.160 7.963 -0.803 1
1 258 . 19 1 1 A 23 23 ALA HA H 23 4.720 4.231 0.489 1
1 262 . 19 1 1 A 23 23 ALA C C 23 176.700 177.295 -0.595 1
1 263 . 19 1 1 A 23 23 ALA CA C 23 53.000 52.543 0.457 1
1 264 . 19 1 1 A 23 23 ALA CB C 23 18.200 18.779 -0.579 1
1 265 . 19 1 1 A 23 23 ALA N N 23 118.200 121.348 -3.148 1
1 266 . 19 1 1 A 24 24 ASN H H 24 7.440 8.721 -1.281 1
1 267 . 19 1 1 A 24 24 ASN HA H 24 4.730 4.956 -0.226 1
1 272 . 19 1 1 A 24 24 ASN C C 24 174.800 175.714 -0.914 1
1 273 . 19 1 1 A 24 24 ASN CA C 24 53.500 54.771 -1.271 1
1 274 . 19 1 1 A 24 24 ASN CB C 24 41.700 40.755 0.945 1
1 275 . 19 1 1 A 24 24 ASN N N 24 116.800 122.849 -6.049 1
1 277 . 19 1 1 A 25 25 GLY H H 25 9.370 8.147 1.223 1
1 278 . 19 1 1 A 25 25 GLY HA2 H 25 3.650 3.978 -0.328 1
1 279 . 19 1 1 A 25 25 GLY HA3 H 25 4.110 3.993 0.117 1
1 280 . 19 1 1 A 25 25 GLY C C 25 175.300 175.959 -0.659 1
1 281 . 19 1 1 A 25 25 GLY CA C 25 47.600 45.460 2.140 1
1 282 . 19 1 1 A 25 25 GLY N N 25 114.800 107.770 7.030 1
1 283 . 19 1 1 A 26 26 ARG H H 26 8.050 8.112 -0.062 1
1 284 . 19 1 1 A 26 26 ARG HA H 26 4.150 4.069 0.081 1
1 289 . 19 1 1 A 26 26 ARG C C 26 179.300 179.040 0.260 1
1 290 . 19 1 1 A 26 26 ARG CA C 26 57.000 59.162 -2.162 1
1 291 . 19 1 1 A 26 26 ARG CB C 26 29.900 29.844 0.056 1
1 294 . 19 1 1 A 26 26 ARG N N 26 120.500 120.698 -0.198 1
1 295 . 19 1 1 A 27 27 ARG H H 27 7.930 7.987 -0.057 1
1 296 . 19 1 1 A 27 27 ARG HA H 27 3.710 4.053 -0.343 1
1 301 . 19 1 1 A 27 27 ARG C C 27 178.300 178.346 -0.046 1
1 302 . 19 1 1 A 27 27 ARG CA C 27 61.000 58.358 2.642 1
1 303 . 19 1 1 A 27 27 ARG CB C 27 30.400 30.267 0.133 1
1 305 . 19 1 1 A 27 27 ARG N N 27 117.900 118.589 -0.689 1
1 306 . 19 1 1 A 28 28 LEU H H 28 7.640 8.121 -0.481 1
1 307 . 19 1 1 A 28 28 LEU HA H 28 3.950 4.043 -0.093 1
1 317 . 19 1 1 A 28 28 LEU C C 28 178.200 178.905 -0.705 1
1 318 . 19 1 1 A 28 28 LEU CA C 28 57.600 57.427 0.173 1
1 319 . 19 1 1 A 28 28 LEU CB C 28 41.900 41.401 0.499 1
1 323 . 19 1 1 A 28 28 LEU N N 28 117.600 118.356 -0.756 1
1 324 . 19 1 1 A 29 29 GLN H H 29 8.110 7.939 0.171 1
1 325 . 19 1 1 A 29 29 GLN HA H 29 3.880 4.080 -0.200 1
1 332 . 19 1 1 A 29 29 GLN C C 29 179.400 178.445 0.955 1
1 333 . 19 1 1 A 29 29 GLN CA C 29 59.100 58.884 0.216 1
1 334 . 19 1 1 A 29 29 GLN CB C 29 28.800 28.423 0.377 1
1 336 . 19 1 1 A 29 29 GLN N N 29 119.300 118.681 0.619 1
1 338 . 19 1 1 A 30 30 ILE H H 30 7.530 7.388 0.142 1
1 339 . 19 1 1 A 30 30 ILE HA H 30 3.340 3.612 -0.272 1
1 349 . 19 1 1 A 30 30 ILE C C 30 176.700 178.495 -1.795 1
1 350 . 19 1 1 A 30 30 ILE CA C 30 65.900 65.401 0.499 1
1 351 . 19 1 1 A 30 30 ILE CB C 30 37.400 37.804 -0.404 1
1 355 . 19 1 1 A 30 30 ILE N N 30 118.600 120.800 -2.200 1
1 356 . 19 1 1 A 31 31 LEU H H 31 7.500 7.712 -0.212 1
1 357 . 19 1 1 A 31 31 LEU HA H 31 3.520 3.700 -0.180 1
1 367 . 19 1 1 A 31 31 LEU C C 31 177.300 178.305 -1.005 1
1 368 . 19 1 1 A 31 31 LEU CA C 31 58.100 57.815 0.285 1
1 369 . 19 1 1 A 31 31 LEU CB C 31 41.100 40.361 0.739 1
1 373 . 19 1 1 A 31 31 LEU N N 31 119.900 119.409 0.491 1
1 374 . 19 1 1 A 32 32 ASP H H 32 7.950 8.171 -0.221 1
1 375 . 19 1 1 A 32 32 ASP HA H 32 4.300 4.441 -0.141 1
1 378 . 19 1 1 A 32 32 ASP C C 32 178.300 178.469 -0.169 1
1 379 . 19 1 1 A 32 32 ASP CA C 32 57.400 57.748 -0.348 1
1 380 . 19 1 1 A 32 32 ASP CB C 32 42.400 42.280 0.120 1
1 381 . 19 1 1 A 32 32 ASP N N 32 116.900 119.599 -2.699 1
1 382 . 19 1 1 A 33 33 LEU H H 33 7.350 7.484 -0.134 1
1 383 . 19 1 1 A 33 33 LEU HA H 33 4.130 4.128 0.002 1
1 393 . 19 1 1 A 33 33 LEU C C 33 180.000 178.830 1.170 1
1 394 . 19 1 1 A 33 33 LEU CA C 33 57.600 57.770 -0.170 1
1 395 . 19 1 1 A 33 33 LEU CB C 33 42.300 41.604 0.696 1
1 399 . 19 1 1 A 33 33 LEU N N 33 118.600 120.252 -1.652 1
1 400 . 19 1 1 A 34 34 LEU H H 34 8.300 8.291 0.009 1
1 401 . 19 1 1 A 34 34 LEU HA H 34 4.490 4.305 0.185 1
1 411 . 19 1 1 A 34 34 LEU C C 34 178.900 178.543 0.357 1
1 412 . 19 1 1 A 34 34 LEU CA C 34 55.800 57.227 -1.427 1
1 413 . 19 1 1 A 34 34 LEU CB C 34 41.300 41.310 -0.010 1
1 417 . 19 1 1 A 34 34 LEU N N 34 117.800 118.570 -0.770 1
1 418 . 19 1 1 A 35 35 ALA H H 35 8.160 7.840 0.320 1
1 419 . 19 1 1 A 35 35 ALA HA H 35 4.050 4.181 -0.131 1
1 423 . 19 1 1 A 35 35 ALA C C 35 179.000 177.887 1.113 1
1 424 . 19 1 1 A 35 35 ALA CA C 35 54.900 53.812 1.088 1
1 425 . 19 1 1 A 35 35 ALA CB C 35 17.500 18.392 -0.892 1
1 426 . 19 1 1 A 35 35 ALA N N 35 123.900 121.356 2.544 1
1 427 . 19 1 1 A 36 36 GLN H H 36 7.600 7.950 -0.350 1
1 428 . 19 1 1 A 36 36 GLN HA H 36 4.340 4.438 -0.098 1
1 435 . 19 1 1 A 36 36 GLN C C 36 176.100 175.258 0.842 1
1 436 . 19 1 1 A 36 36 GLN CA C 36 55.800 55.643 0.157 1
1 437 . 19 1 1 A 36 36 GLN CB C 36 29.000 29.704 -0.704 1
1 439 . 19 1 1 A 36 36 GLN N N 36 113.300 115.130 -1.830 1
1 441 . 19 1 1 A 37 37 GLY H H 37 7.550 6.954 0.596 1
1 442 . 19 1 1 A 37 37 GLY HA2 H 37 3.730 4.050 -0.320 1
1 443 . 19 1 1 A 37 37 GLY HA3 H 37 4.490 4.055 0.435 1
1 444 . 19 1 1 A 37 37 GLY C C 37 171.500 172.997 -1.497 1
1 445 . 19 1 1 A 37 37 GLY CA C 37 44.500 44.638 -0.138 1
1 446 . 19 1 1 A 37 37 GLY N N 37 108.400 107.901 0.499 1
1 447 . 19 1 1 A 38 38 GLU H H 38 8.120 8.460 -0.340 1
1 448 . 19 1 1 A 38 38 GLU HA H 38 4.820 4.808 0.012 1
1 453 . 19 1 1 A 38 38 GLU C C 38 177.000 176.308 0.692 1
1 454 . 19 1 1 A 38 38 GLU CA C 38 56.400 56.581 -0.181 1
1 455 . 19 1 1 A 38 38 GLU CB C 38 31.200 29.919 1.281 1
1 457 . 19 1 1 A 38 38 GLU N N 38 119.600 119.455 0.145 1
1 458 . 19 1 1 A 39 39 ARG H H 39 8.580 8.704 -0.124 1
1 459 . 19 1 1 A 39 39 ARG HA H 39 4.970 5.024 -0.054 1
1 467 . 19 1 1 A 39 39 ARG C C 39 174.800 175.718 -0.918 1
1 468 . 19 1 1 A 39 39 ARG CA C 39 53.900 54.506 -0.606 1
1 469 . 19 1 1 A 39 39 ARG CB C 39 36.400 33.261 3.139 1
1 472 . 19 1 1 A 39 39 ARG N N 39 121.500 124.356 -2.856 1
1 474 . 19 1 1 A 40 40 ALA H H 40 8.910 8.616 0.294 1
1 475 . 19 1 1 A 40 40 ALA HA H 40 4.920 4.386 0.534 1
1 479 . 19 1 1 A 40 40 ALA C C 40 179.200 178.387 0.813 1
1 480 . 19 1 1 A 40 40 ALA CA C 40 51.100 51.779 -0.679 1
1 481 . 19 1 1 A 40 40 ALA CB C 40 19.200 18.739 0.461 1
1 482 . 19 1 1 A 40 40 ALA N N 40 125.100 124.410 0.690 1
1 483 . 19 1 1 A 41 41 VAL H H 41 8.420 8.745 -0.325 1
1 484 . 19 1 1 A 41 41 VAL HA H 41 3.430 3.614 -0.184 1
1 492 . 19 1 1 A 41 41 VAL C C 41 176.800 177.120 -0.320 1
1 493 . 19 1 1 A 41 41 VAL CA C 41 67.600 66.647 0.953 1
1 494 . 19 1 1 A 41 41 VAL CB C 41 31.600 31.662 -0.062 1
1 497 . 19 1 1 A 41 41 VAL N N 41 120.900 121.173 -0.273 1
1 498 . 19 1 1 A 42 42 GLU H H 42 9.640 8.494 1.146 1
1 499 . 19 1 1 A 42 42 GLU HA H 42 3.880 3.936 -0.056 1
1 504 . 19 1 1 A 42 42 GLU C C 42 178.300 178.860 -0.560 1
1 505 . 19 1 1 A 42 42 GLU CA C 42 60.600 59.528 1.072 1
1 506 . 19 1 1 A 42 42 GLU CB C 42 28.300 29.321 -1.021 1
1 508 . 19 1 1 A 42 42 GLU N N 42 119.000 119.165 -0.165 1
1 509 . 19 1 1 A 43 43 ALA H H 43 6.870 7.594 -0.724 1
1 510 . 19 1 1 A 43 43 ALA HA H 43 4.290 4.040 0.250 1
1 514 . 19 1 1 A 43 43 ALA C C 43 180.700 179.881 0.819 1
1 515 . 19 1 1 A 43 43 ALA CA C 43 54.100 54.799 -0.699 1
1 516 . 19 1 1 A 43 43 ALA CB C 43 19.100 18.210 0.890 1
1 517 . 19 1 1 A 43 43 ALA N N 43 120.500 121.819 -1.319 1
1 518 . 19 1 1 A 44 44 ILE H H 44 7.970 8.337 -0.367 1
1 519 . 19 1 1 A 44 44 ILE HA H 44 3.470 3.605 -0.135 1
1 529 . 19 1 1 A 44 44 ILE C C 44 178.300 178.090 0.210 1
1 530 . 19 1 1 A 44 44 ILE CA C 44 64.700 65.449 -0.749 1
1 531 . 19 1 1 A 44 44 ILE CB C 44 38.100 37.705 0.395 1
1 535 . 19 1 1 A 44 44 ILE N N 44 120.500 119.238 1.262 1
1 536 . 19 1 1 A 45 45 ALA H H 45 8.460 8.476 -0.016 1
1 537 . 19 1 1 A 45 45 ALA HA H 45 3.720 4.016 -0.296 1
1 541 . 19 1 1 A 45 45 ALA C C 45 178.500 179.718 -1.218 1
1 542 . 19 1 1 A 45 45 ALA CA C 45 56.200 55.316 0.884 1
1 543 . 19 1 1 A 45 45 ALA CB C 45 17.400 18.443 -1.043 1
1 544 . 19 1 1 A 45 45 ALA N N 45 124.500 122.113 2.387 1
1 545 . 19 1 1 A 46 46 THR H H 46 8.080 7.883 0.197 1
1 546 . 19 1 1 A 46 46 THR HA H 46 3.900 3.826 0.074 1
1 551 . 19 1 1 A 46 46 THR C C 46 177.200 176.534 0.666 1
1 552 . 19 1 1 A 46 46 THR CA C 46 66.400 67.062 -0.662 1
1 553 . 19 1 1 A 46 46 THR CB C 46 68.800 68.870 -0.070 1
1 555 . 19 1 1 A 46 46 THR N N 46 112.400 114.187 -1.787 1
1 556 . 19 1 1 A 47 47 ALA H H 47 7.930 8.344 -0.414 1
1 557 . 19 1 1 A 47 47 ALA HA H 47 4.200 4.138 0.062 1
1 561 . 19 1 1 A 47 47 ALA C C 47 179.200 179.676 -0.476 1
1 562 . 19 1 1 A 47 47 ALA CA C 47 54.800 55.199 -0.399 1
1 563 . 19 1 1 A 47 47 ALA CB C 47 19.800 18.371 1.429 1
1 564 . 19 1 1 A 47 47 ALA N N 47 121.400 124.058 -2.658 1
1 565 . 19 1 1 A 48 48 THR H H 48 7.560 7.675 -0.115 1
1 566 . 19 1 1 A 48 48 THR HA H 48 4.390 4.420 -0.030 1
1 571 . 19 1 1 A 48 48 THR C C 48 175.700 175.775 -0.075 1
1 572 . 19 1 1 A 48 48 THR CA C 48 61.800 62.858 -1.058 1
1 573 . 19 1 1 A 48 48 THR CB C 48 71.000 70.418 0.582 1
1 575 . 19 1 1 A 48 48 THR N N 48 103.500 106.707 -3.207 1
1 576 . 19 1 1 A 49 49 GLY H H 49 7.820 8.444 -0.624 1
1 577 . 19 1 1 A 49 49 GLY HA2 H 49 3.870 3.945 -0.075 1
1 578 . 19 1 1 A 49 49 GLY HA3 H 49 4.100 3.947 0.153 1
1 579 . 19 1 1 A 49 49 GLY C C 49 174.400 174.593 -0.193 1
1 580 . 19 1 1 A 49 49 GLY CA C 49 46.300 46.371 -0.071 1
1 581 . 19 1 1 A 49 49 GLY N N 49 111.100 112.357 -1.257 1
1 582 . 19 1 1 A 50 50 MET H H 50 7.930 8.154 -0.224 1
1 583 . 19 1 1 A 50 50 MET HA H 50 4.540 5.021 -0.481 1
1 591 . 19 1 1 A 50 50 MET C C 50 174.800 174.522 0.278 1
1 592 . 19 1 1 A 50 50 MET CA C 50 55.100 53.301 1.799 1
1 593 . 19 1 1 A 50 50 MET CB C 50 37.200 36.737 0.463 1
1 596 . 19 1 1 A 50 50 MET N N 50 119.300 115.948 3.352 1
1 597 . 19 1 1 A 51 51 ASN H H 51 8.040 8.556 -0.516 1
1 598 . 19 1 1 A 51 51 ASN HA H 51 4.580 5.024 -0.444 1
1 601 . 19 1 1 A 51 51 ASN C C 51 176.100 176.420 -0.320 1
1 602 . 19 1 1 A 51 51 ASN CA C 51 52.800 51.593 1.207 1
1 603 . 19 1 1 A 51 51 ASN CB C 51 41.100 39.620 1.480 1
1 604 . 19 1 1 A 51 51 ASN N N 51 118.000 118.473 -0.473 1
1 605 . 19 1 1 A 52 52 LEU H H 52 8.560 8.823 -0.263 1
1 606 . 19 1 1 A 52 52 LEU HA H 52 3.760 3.905 -0.145 1
1 616 . 19 1 1 A 52 52 LEU C C 52 179.600 178.669 0.931 1
1 617 . 19 1 1 A 52 52 LEU CA C 52 59.000 57.774 1.226 1
1 618 . 19 1 1 A 52 52 LEU CB C 52 41.800 41.229 0.571 1
1 622 . 19 1 1 A 52 52 LEU N N 52 120.600 121.310 -0.710 1
1 623 . 19 1 1 A 53 53 THR H H 53 8.230 7.947 0.283 1
1 624 . 19 1 1 A 53 53 THR HA H 53 3.880 3.916 -0.036 1
1 629 . 19 1 1 A 53 53 THR C C 53 176.900 176.843 0.057 1
1 630 . 19 1 1 A 53 53 THR CA C 53 66.500 66.630 -0.130 1
1 631 . 19 1 1 A 53 53 THR CB C 53 68.400 68.687 -0.287 1
1 633 . 19 1 1 A 53 53 THR N N 53 115.800 115.714 0.086 1
1 634 . 19 1 1 A 54 54 THR H H 54 8.420 8.311 0.109 1
1 635 . 19 1 1 A 54 54 THR HA H 54 3.880 3.825 0.055 1
1 640 . 19 1 1 A 54 54 THR C C 54 177.300 176.099 1.201 1
1 641 . 19 1 1 A 54 54 THR CA C 54 66.600 66.498 0.102 1
1 642 . 19 1 1 A 54 54 THR CB C 54 66.600 68.538 -1.938 1
1 644 . 19 1 1 A 54 54 THR N N 54 122.300 116.130 6.170 1
1 645 . 19 1 1 A 55 55 ALA H H 55 8.860 8.602 0.258 1
1 646 . 19 1 1 A 55 55 ALA HA H 55 4.020 3.924 0.096 1
1 650 . 19 1 1 A 55 55 ALA C C 55 179.000 179.675 -0.675 1
1 651 . 19 1 1 A 55 55 ALA CA C 55 56.100 55.365 0.735 1
1 652 . 19 1 1 A 55 55 ALA CB C 55 17.000 18.424 -1.424 1
1 653 . 19 1 1 A 55 55 ALA N N 55 125.600 123.419 2.181 1
1 654 . 19 1 1 A 56 56 SER H H 56 8.440 8.417 0.023 1
1 655 . 19 1 1 A 56 56 SER HA H 56 3.920 3.917 0.003 1
1 658 . 19 1 1 A 56 56 SER C C 56 176.400 177.024 -0.624 1
1 659 . 19 1 1 A 56 56 SER CA C 56 62.600 61.387 1.213 1
1 660 . 19 1 1 A 56 56 SER CB C 56 62.700 63.000 -0.300 1
1 661 . 19 1 1 A 56 56 SER N N 56 112.700 112.601 0.099 1
1 662 . 19 1 1 A 57 57 ALA H H 57 8.090 7.850 0.240 1
1 663 . 19 1 1 A 57 57 ALA HA H 57 4.130 3.950 0.180 1
1 667 . 19 1 1 A 57 57 ALA C C 57 181.200 179.504 1.696 1
1 668 . 19 1 1 A 57 57 ALA CA C 57 55.200 55.258 -0.058 1
1 669 . 19 1 1 A 57 57 ALA CB C 57 17.900 17.837 0.063 1
1 670 . 19 1 1 A 57 57 ALA N N 57 124.000 123.473 0.527 1
1 671 . 19 1 1 A 58 58 ASN H H 58 7.970 8.271 -0.301 1
1 672 . 19 1 1 A 58 58 ASN HA H 58 4.480 4.425 0.055 1
1 677 . 19 1 1 A 58 58 ASN C C 58 177.500 178.046 -0.546 1
1 678 . 19 1 1 A 58 58 ASN CA C 58 56.900 56.205 0.695 1
1 679 . 19 1 1 A 58 58 ASN CB C 58 39.800 38.249 1.551 1
1 680 . 19 1 1 A 58 58 ASN N N 58 117.600 117.500 0.100 1
1 682 . 19 1 1 A 59 59 LEU H H 59 8.530 8.561 -0.031 1
1 683 . 19 1 1 A 59 59 LEU HA H 59 3.710 3.810 -0.100 1
1 693 . 19 1 1 A 59 59 LEU C C 59 178.400 178.989 -0.589 1
1 694 . 19 1 1 A 59 59 LEU CA C 59 58.600 57.782 0.818 1
1 695 . 19 1 1 A 59 59 LEU CB C 59 40.500 41.005 -0.505 1
1 699 . 19 1 1 A 59 59 LEU N N 59 122.600 120.472 2.128 1
1 700 . 19 1 1 A 60 60 GLN H H 60 8.200 8.489 -0.289 1
1 701 . 19 1 1 A 60 60 GLN HA H 60 4.020 3.947 0.073 1
1 708 . 19 1 1 A 60 60 GLN C C 60 178.700 177.829 0.871 1
1 709 . 19 1 1 A 60 60 GLN CA C 60 58.800 59.053 -0.253 1
1 710 . 19 1 1 A 60 60 GLN CB C 60 27.700 28.722 -1.022 1
1 712 . 19 1 1 A 60 60 GLN N N 60 118.900 118.800 0.100 1
1 714 . 19 1 1 A 61 61 ALA H H 61 7.580 7.754 -0.174 1
1 715 . 19 1 1 A 61 61 ALA HA H 61 4.230 4.089 0.141 1
1 719 . 19 1 1 A 61 61 ALA C C 61 181.300 180.225 1.075 1
1 720 . 19 1 1 A 61 61 ALA CA C 61 55.100 55.068 0.032 1
1 721 . 19 1 1 A 61 61 ALA CB C 61 17.600 18.155 -0.555 1
1 722 . 19 1 1 A 61 61 ALA N N 61 122.200 122.249 -0.049 1
1 723 . 19 1 1 A 62 62 LEU H H 62 7.830 8.130 -0.300 1
1 724 . 19 1 1 A 62 62 LEU HA H 62 3.980 3.997 -0.017 1
1 734 . 19 1 1 A 62 62 LEU C C 62 178.500 179.221 -0.721 1
1 735 . 19 1 1 A 62 62 LEU CA C 62 58.100 57.486 0.614 1
1 736 . 19 1 1 A 62 62 LEU CB C 62 43.300 41.112 2.188 1
1 739 . 19 1 1 A 62 62 LEU N N 62 119.000 118.417 0.583 1
1 740 . 19 1 1 A 63 63 LYS H H 63 8.580 8.327 0.253 1
1 741 . 19 1 1 A 63 63 LYS HA H 63 4.130 4.116 0.014 1
1 750 . 19 1 1 A 63 63 LYS C C 63 180.500 179.140 1.360 1
1 751 . 19 1 1 A 63 63 LYS CA C 63 59.700 58.972 0.728 1
1 752 . 19 1 1 A 63 63 LYS CB C 63 32.600 32.211 0.389 1
1 756 . 19 1 1 A 63 63 LYS N N 63 123.400 121.537 1.863 1
1 757 . 19 1 1 A 64 64 SER H H 64 8.640 8.636 0.004 1
1 758 . 19 1 1 A 64 64 SER HA H 64 4.300 4.295 0.005 1
1 761 . 19 1 1 A 64 64 SER C C 64 175.000 177.314 -2.314 1
1 762 . 19 1 1 A 64 64 SER CA C 64 61.400 62.493 -1.093 1
1 763 . 19 1 1 A 64 64 SER CB C 64 63.000 62.649 0.351 1
1 764 . 19 1 1 A 64 64 SER N N 64 117.700 117.373 0.327 1
1 765 . 19 1 1 A 65 65 GLY H H 65 7.280 8.009 -0.729 1
1 766 . 19 1 1 A 65 65 GLY HA2 H 65 3.240 3.925 -0.685 1
1 767 . 19 1 1 A 65 65 GLY HA3 H 65 3.980 3.926 0.054 1
1 768 . 19 1 1 A 65 65 GLY C C 65 171.300 175.051 -3.751 1
1 769 . 19 1 1 A 65 65 GLY CA C 65 45.100 46.079 -0.979 1
1 770 . 19 1 1 A 65 65 GLY N N 65 104.400 108.342 -3.942 1
1 771 . 19 1 1 A 66 66 GLY H H 66 7.730 7.810 -0.080 1
1 772 . 19 1 1 A 66 66 GLY HA2 H 66 3.650 4.043 -0.393 1
1 773 . 19 1 1 A 66 66 GLY HA3 H 66 3.750 4.046 -0.296 1
1 774 . 19 1 1 A 66 66 GLY C C 66 173.700 175.195 -1.495 1
1 775 . 19 1 1 A 66 66 GLY CA C 66 45.400 45.172 0.228 1
1 776 . 19 1 1 A 66 66 GLY N N 66 104.700 107.966 -3.266 1
1 777 . 19 1 1 A 67 67 LEU H H 67 7.520 8.537 -1.017 1
1 778 . 19 1 1 A 67 67 LEU HA H 67 4.310 4.262 0.048 1
1 788 . 19 1 1 A 67 67 LEU C C 67 177.700 176.949 0.751 1
1 789 . 19 1 1 A 67 67 LEU CA C 67 55.500 56.029 -0.529 1
1 790 . 19 1 1 A 67 67 LEU CB C 67 42.400 42.660 -0.260 1
1 794 . 19 1 1 A 67 67 LEU N N 67 110.600 118.642 -8.042 1
1 795 . 19 1 1 A 68 68 VAL H H 68 6.890 7.397 -0.507 1
1 796 . 19 1 1 A 68 68 VAL HA H 68 5.190 4.918 0.272 1
1 804 . 19 1 1 A 68 68 VAL C C 68 173.700 174.820 -1.120 1
1 805 . 19 1 1 A 68 68 VAL CA C 68 57.400 58.844 -1.444 1
1 806 . 19 1 1 A 68 68 VAL CB C 68 36.400 35.160 1.240 1
1 809 . 19 1 1 A 68 68 VAL N N 68 106.400 112.576 -6.176 1
1 810 . 19 1 1 A 69 69 GLU H H 69 8.880 9.283 -0.403 1
1 811 . 19 1 1 A 69 69 GLU HA H 69 4.660 4.882 -0.222 1
1 816 . 19 1 1 A 69 69 GLU C C 69 173.300 174.717 -1.417 1
1 817 . 19 1 1 A 69 69 GLU CA C 69 54.300 54.698 -0.398 1
1 818 . 19 1 1 A 69 69 GLU CB C 69 34.100 33.195 0.905 1
1 820 . 19 1 1 A 69 69 GLU N N 69 120.400 121.451 -1.051 1
1 821 . 19 1 1 A 70 70 ALA H H 70 8.730 8.776 -0.046 1
1 822 . 19 1 1 A 70 70 ALA HA H 70 4.990 4.997 -0.007 1
1 826 . 19 1 1 A 70 70 ALA C C 70 176.500 174.790 1.710 1
1 827 . 19 1 1 A 70 70 ALA CA C 70 50.000 49.935 0.065 1
1 828 . 19 1 1 A 70 70 ALA CB C 70 22.300 21.374 0.926 1
1 829 . 19 1 1 A 70 70 ALA N N 70 122.800 121.323 1.477 1
1 830 . 19 1 1 A 71 71 ARG H H 71 8.670 9.453 -0.783 1
1 831 . 19 1 1 A 71 71 ARG HA H 71 4.630 4.718 -0.088 1
1 843 . 19 1 1 A 71 71 ARG C C 71 173.500 175.049 -1.549 1
1 844 . 19 1 1 A 71 71 ARG CA C 71 54.600 54.528 0.072 1
1 845 . 19 1 1 A 71 71 ARG CB C 71 33.600 31.978 1.622 1
1 849 . 19 1 1 A 71 71 ARG N N 71 120.100 123.791 -3.691 1
1 851 . 19 1 1 A 72 72 ARG H H 72 8.780 8.785 -0.005 1
1 852 . 19 1 1 A 72 72 ARG HA H 72 5.100 4.647 0.453 1
1 859 . 19 1 1 A 72 72 ARG C C 72 176.000 175.110 0.890 1
1 860 . 19 1 1 A 72 72 ARG CA C 72 54.900 55.728 -0.828 1
1 861 . 19 1 1 A 72 72 ARG CB C 72 32.500 30.890 1.610 1
1 864 . 19 1 1 A 72 72 ARG N N 72 123.600 128.568 -4.968 1
1 865 . 19 1 1 A 73 73 GLU H H 73 8.720 8.946 -0.226 1
1 866 . 19 1 1 A 73 73 GLU HA H 73 4.510 4.680 -0.170 1
1 871 . 19 1 1 A 73 73 GLU C C 73 175.900 176.685 -0.785 1
1 872 . 19 1 1 A 73 73 GLU CA C 73 55.700 55.326 0.374 1
1 873 . 19 1 1 A 73 73 GLU CB C 73 31.800 31.194 0.606 1
1 875 . 19 1 1 A 73 73 GLU N N 73 126.800 127.327 -0.527 1
1 876 . 19 1 1 A 74 74 GLY H H 74 9.190 8.866 0.324 1
1 877 . 19 1 1 A 74 74 GLY HA2 H 74 3.700 3.880 -0.180 1
1 878 . 19 1 1 A 74 74 GLY HA3 H 74 4.170 3.894 0.276 1
1 879 . 19 1 1 A 74 74 GLY C C 74 175.400 174.773 0.627 1
1 880 . 19 1 1 A 74 74 GLY CA C 74 47.100 47.200 -0.100 1
1 881 . 19 1 1 A 74 74 GLY N N 74 118.500 116.367 2.133 1
1 882 . 19 1 1 A 75 75 THR H H 75 8.780 8.520 0.260 1
1 883 . 19 1 1 A 75 75 THR HA H 75 4.290 4.467 -0.177 1
1 888 . 19 1 1 A 75 75 THR C C 75 174.600 173.221 1.379 1
1 889 . 19 1 1 A 75 75 THR CA C 75 62.000 61.709 0.291 1
1 890 . 19 1 1 A 75 75 THR CB C 75 69.000 69.032 -0.032 1
1 892 . 19 1 1 A 75 75 THR N N 75 118.000 120.399 -2.399 1
1 893 . 19 1 1 A 76 76 ARG H H 76 8.030 7.718 0.312 1
1 894 . 19 1 1 A 76 76 ARG HA H 76 4.610 4.821 -0.211 1
1 901 . 19 1 1 A 76 76 ARG C C 76 174.800 174.686 0.114 1
1 902 . 19 1 1 A 76 76 ARG CA C 76 55.500 54.164 1.336 1
1 903 . 19 1 1 A 76 76 ARG CB C 76 32.700 33.887 -1.187 1
1 906 . 19 1 1 A 76 76 ARG N N 76 122.600 120.310 2.290 1
1 907 . 19 1 1 A 77 77 GLN H H 77 8.580 8.687 -0.107 1
1 908 . 19 1 1 A 77 77 GLN HA H 77 4.910 4.982 -0.072 1
1 915 . 19 1 1 A 77 77 GLN C C 77 173.900 174.715 -0.815 1
1 916 . 19 1 1 A 77 77 GLN CA C 77 54.700 54.598 0.102 1
1 917 . 19 1 1 A 77 77 GLN CB C 77 31.800 30.601 1.199 1
1 919 . 19 1 1 A 77 77 GLN N N 77 121.900 121.459 0.441 1
1 921 . 19 1 1 A 78 78 TYR H H 78 8.890 9.441 -0.551 1
1 922 . 19 1 1 A 78 78 TYR HA H 78 4.750 5.523 -0.773 1
1 929 . 19 1 1 A 78 78 TYR C C 78 175.600 174.500 1.100 1
1 930 . 19 1 1 A 78 78 TYR CA C 78 57.000 55.792 1.208 1
1 931 . 19 1 1 A 78 78 TYR CB C 78 41.400 40.665 0.735 1
1 936 . 19 1 1 A 78 78 TYR N N 78 121.800 122.897 -1.097 1
1 937 . 19 1 1 A 79 79 TYR H H 79 9.010 9.532 -0.522 1
1 938 . 19 1 1 A 79 79 TYR HA H 79 5.410 5.554 -0.144 1
1 945 . 19 1 1 A 79 79 TYR C C 79 173.100 174.998 -1.898 1
1 946 . 19 1 1 A 79 79 TYR CA C 79 57.300 56.870 0.430 1
1 947 . 19 1 1 A 79 79 TYR CB C 79 43.300 42.327 0.973 1
1 952 . 19 1 1 A 79 79 TYR N N 79 122.500 121.612 0.888 1
1 953 . 19 1 1 A 80 80 ARG H H 80 8.720 8.510 0.210 1
1 954 . 19 1 1 A 80 80 ARG HA H 80 5.120 4.696 0.424 1
1 962 . 19 1 1 A 80 80 ARG C C 80 175.500 174.689 0.811 1
1 963 . 19 1 1 A 80 80 ARG CA C 80 53.200 55.092 -1.892 1
1 964 . 19 1 1 A 80 80 ARG CB C 80 33.900 34.267 -0.367 1
1 967 . 19 1 1 A 80 80 ARG N N 80 114.500 121.843 -7.343 1
1 969 . 19 1 1 A 81 81 ILE H H 81 9.300 8.663 0.637 1
1 970 . 19 1 1 A 81 81 ILE HA H 81 4.150 4.103 0.047 1
1 980 . 19 1 1 A 81 81 ILE C C 81 177.800 176.610 1.190 1
1 981 . 19 1 1 A 81 81 ILE CA C 81 62.300 62.345 -0.045 1
1 982 . 19 1 1 A 81 81 ILE CB C 81 37.800 37.883 -0.083 1
1 986 . 19 1 1 A 81 81 ILE N N 81 122.100 125.416 -3.316 1
1 987 . 19 1 1 A 82 82 ALA H H 82 7.930 8.918 -0.988 1
1 988 . 19 1 1 A 82 82 ALA HA H 82 3.930 4.108 -0.178 1
1 992 . 19 1 1 A 82 82 ALA C C 82 176.300 177.020 -0.720 1
1 993 . 19 1 1 A 82 82 ALA CA C 82 54.200 55.336 -1.136 1
1 994 . 19 1 1 A 82 82 ALA CB C 82 18.500 19.147 -0.647 1
1 995 . 19 1 1 A 82 82 ALA N N 82 127.200 129.398 -2.198 1
1 996 . 19 1 1 A 83 83 GLY H H 83 6.980 7.882 -0.902 1
1 997 . 19 1 1 A 83 83 GLY HA2 H 83 4.090 4.225 -0.135 1
1 998 . 19 1 1 A 83 83 GLY HA3 H 83 4.440 4.227 0.213 1
1 999 . 19 1 1 A 83 83 GLY C C 83 173.600 175.165 -1.565 1
1 1000 . 19 1 1 A 83 83 GLY CA C 83 45.200 43.704 1.496 1
1 1001 . 19 1 1 A 83 83 GLY N N 83 101.800 104.222 -2.422 1
1 1002 . 19 1 1 A 84 84 GLU H H 84 8.930 8.902 0.028 1
1 1003 . 19 1 1 A 84 84 GLU HA H 84 4.120 3.980 0.140 1
1 1008 . 19 1 1 A 84 84 GLU C C 84 178.300 177.882 0.418 1
1 1009 . 19 1 1 A 84 84 GLU CA C 84 58.900 59.331 -0.431 1
1 1010 . 19 1 1 A 84 84 GLU CB C 84 29.400 29.195 0.205 1
1 1012 . 19 1 1 A 84 84 GLU N N 84 120.300 120.078 0.222 1
1 1013 . 19 1 1 A 85 85 ASP H H 85 8.950 8.451 0.499 1
1 1014 . 19 1 1 A 85 85 ASP HA H 85 4.310 4.383 -0.073 1
1 1017 . 19 1 1 A 85 85 ASP C C 85 178.000 178.760 -0.760 1
1 1018 . 19 1 1 A 85 85 ASP CA C 85 57.100 56.949 0.151 1
1 1019 . 19 1 1 A 85 85 ASP CB C 85 38.900 40.173 -1.273 1
1 1020 . 19 1 1 A 85 85 ASP N N 85 119.400 118.444 0.956 1
1 1021 . 19 1 1 A 86 86 VAL H H 86 7.620 8.129 -0.509 1
1 1022 . 19 1 1 A 86 86 VAL HA H 86 3.480 3.546 -0.066 1
1 1030 . 19 1 1 A 86 86 VAL C C 86 177.400 178.067 -0.667 1
1 1031 . 19 1 1 A 86 86 VAL CA C 86 66.800 66.236 0.564 1
1 1032 . 19 1 1 A 86 86 VAL CB C 86 31.300 31.548 -0.248 1
1 1035 . 19 1 1 A 86 86 VAL N N 86 121.600 120.717 0.883 1
1 1036 . 19 1 1 A 87 87 ALA H H 87 7.520 8.029 -0.509 1
1 1037 . 19 1 1 A 87 87 ALA HA H 87 4.110 4.019 0.091 1
1 1041 . 19 1 1 A 87 87 ALA C C 87 181.200 180.009 1.191 1
1 1042 . 19 1 1 A 87 87 ALA CA C 87 55.800 55.826 -0.026 1
1 1043 . 19 1 1 A 87 87 ALA CB C 87 17.600 18.796 -1.196 1
1 1044 . 19 1 1 A 87 87 ALA N N 87 122.700 122.055 0.645 1
1 1045 . 19 1 1 A 88 88 ARG H H 88 8.380 8.288 0.092 1
1 1046 . 19 1 1 A 88 88 ARG HA H 88 4.090 4.056 0.034 1
1 1054 . 19 1 1 A 88 88 ARG C C 88 179.100 179.042 0.058 1
1 1055 . 19 1 1 A 88 88 ARG CA C 88 59.600 59.083 0.517 1
1 1056 . 19 1 1 A 88 88 ARG CB C 88 30.500 29.911 0.589 1
1 1059 . 19 1 1 A 88 88 ARG N N 88 119.200 118.635 0.565 1
1 1061 . 19 1 1 A 89 89 LEU H H 89 8.480 7.952 0.528 1
1 1062 . 19 1 1 A 89 89 LEU HA H 89 4.040 4.073 -0.033 1
1 1071 . 19 1 1 A 89 89 LEU C C 89 177.200 178.638 -1.438 1
1 1072 . 19 1 1 A 89 89 LEU CA C 89 58.300 58.128 0.172 1
1 1073 . 19 1 1 A 89 89 LEU CB C 89 41.300 41.956 -0.656 1
1 1076 . 19 1 1 A 89 89 LEU N N 89 123.300 121.489 1.811 1
1 1077 . 19 1 1 A 90 90 PHE H H 90 8.890 8.685 0.205 1
1 1078 . 19 1 1 A 90 90 PHE HA H 90 4.380 4.039 0.341 1
1 1086 . 19 1 1 A 90 90 PHE C C 90 177.500 177.980 -0.480 1
1 1087 . 19 1 1 A 90 90 PHE CA C 90 59.400 62.301 -2.901 1
1 1088 . 19 1 1 A 90 90 PHE CB C 90 38.600 38.887 -0.287 1
1 1094 . 19 1 1 A 90 90 PHE N N 90 119.400 119.520 -0.120 1
1 1095 . 19 1 1 A 91 91 ALA H H 91 7.920 8.337 -0.417 1
1 1096 . 19 1 1 A 91 91 ALA HA H 91 3.940 3.937 0.003 1
1 1100 . 19 1 1 A 91 91 ALA C C 91 180.200 179.814 0.386 1
1 1101 . 19 1 1 A 91 91 ALA CA C 91 55.100 55.286 -0.186 1
1 1102 . 19 1 1 A 91 91 ALA CB C 91 18.000 17.974 0.026 1
1 1103 . 19 1 1 A 91 91 ALA N N 91 120.500 121.347 -0.847 1
1 1104 . 19 1 1 A 92 92 LEU H H 92 8.190 8.595 -0.405 1
1 1105 . 19 1 1 A 92 92 LEU HA H 92 4.300 4.053 0.247 1
1 1115 . 19 1 1 A 92 92 LEU C C 92 178.900 178.370 0.530 1
1 1116 . 19 1 1 A 92 92 LEU CA C 92 57.500 58.076 -0.576 1
1 1117 . 19 1 1 A 92 92 LEU CB C 92 42.100 41.883 0.217 1
1 1121 . 19 1 1 A 92 92 LEU N N 92 120.200 119.596 0.604 1
1 1122 . 19 1 1 A 93 93 VAL H H 93 8.890 8.136 0.754 1
1 1123 . 19 1 1 A 93 93 VAL HA H 93 3.810 3.712 0.098 1
1 1131 . 19 1 1 A 93 93 VAL C C 93 176.900 177.390 -0.490 1
1 1132 . 19 1 1 A 93 93 VAL CA C 93 66.000 64.974 1.026 1
1 1133 . 19 1 1 A 93 93 VAL CB C 93 31.200 31.070 0.130 1
1 1136 . 19 1 1 A 93 93 VAL N N 93 117.100 118.427 -1.327 1
1 1137 . 19 1 1 A 94 94 GLN H H 94 6.920 7.498 -0.578 1
1 1138 . 19 1 1 A 94 94 GLN HA H 94 3.790 3.792 -0.002 1
1 1145 . 19 1 1 A 94 94 GLN C C 94 177.400 178.240 -0.840 1
1 1146 . 19 1 1 A 94 94 GLN CA C 94 60.000 58.860 1.140 1
1 1147 . 19 1 1 A 94 94 GLN CB C 94 30.300 28.084 2.216 1
1 1149 . 19 1 1 A 94 94 GLN N N 94 117.800 120.576 -2.776 1
1 1151 . 19 1 1 A 95 95 VAL H H 95 7.420 8.095 -0.675 1
1 1152 . 19 1 1 A 95 95 VAL HA H 95 3.760 3.582 0.178 1
1 1160 . 19 1 1 A 95 95 VAL C C 95 178.300 178.393 -0.093 1
1 1161 . 19 1 1 A 95 95 VAL CA C 95 66.600 66.428 0.172 1
1 1162 . 19 1 1 A 95 95 VAL CB C 95 31.900 31.467 0.433 1
1 1165 . 19 1 1 A 95 95 VAL N N 95 121.500 119.516 1.984 1
1 1166 . 19 1 1 A 96 96 VAL H H 96 8.340 8.375 -0.035 1
1 1167 . 19 1 1 A 96 96 VAL HA H 96 3.810 3.675 0.135 1
1 1175 . 19 1 1 A 96 96 VAL C C 96 178.400 178.046 0.354 1
1 1176 . 19 1 1 A 96 96 VAL CA C 96 66.100 66.687 -0.587 1
1 1177 . 19 1 1 A 96 96 VAL CB C 96 32.200 31.444 0.756 1
1 1180 . 19 1 1 A 96 96 VAL N N 96 120.000 120.238 -0.238 1
1 1181 . 19 1 1 A 97 97 ALA H H 97 8.140 8.460 -0.320 1
1 1182 . 19 1 1 A 97 97 ALA HA H 97 4.010 3.926 0.084 1
1 1186 . 19 1 1 A 97 97 ALA C C 97 178.800 178.691 0.109 1
1 1187 . 19 1 1 A 97 97 ALA CA C 97 54.900 55.705 -0.805 1
1 1188 . 19 1 1 A 97 97 ALA CB C 97 19.900 18.056 1.844 1
1 1189 . 19 1 1 A 97 97 ALA N N 97 121.400 121.430 -0.030 1
1 1190 . 19 1 1 A 98 98 ASP H H 98 8.170 8.704 -0.534 1
1 1191 . 19 1 1 A 98 98 ASP HA H 98 4.320 4.313 0.007 1
1 1194 . 19 1 1 A 98 98 ASP C C 98 178.100 178.464 -0.364 1
1 1195 . 19 1 1 A 98 98 ASP CA C 98 57.100 57.813 -0.713 1
1 1196 . 19 1 1 A 98 98 ASP CB C 98 41.800 41.853 -0.053 1
1 1197 . 19 1 1 A 98 98 ASP N N 98 118.500 118.435 0.065 1
1 1198 . 19 1 1 A 99 99 GLU H H 99 8.220 8.385 -0.165 1
1 1199 . 19 1 1 A 99 99 GLU HA H 99 4.000 4.204 -0.204 1
1 1204 . 19 1 1 A 99 99 GLU C C 99 178.300 178.234 0.066 1
1 1205 . 19 1 1 A 99 99 GLU CA C 99 58.300 58.076 0.224 1
1 1206 . 19 1 1 A 99 99 GLU CB C 99 29.800 29.398 0.402 1
1 1208 . 19 1 1 A 99 99 GLU N N 99 116.600 118.218 -1.618 1
1 1209 . 19 1 1 A 100 100 HIS H H 100 7.980 7.693 0.287 1
1 1210 . 19 1 1 A 100 100 HIS HA H 100 4.600 4.474 0.126 1
1 1214 . 19 1 1 A 100 100 HIS C C 100 175.900 176.936 -1.036 1
1 1215 . 19 1 1 A 100 100 HIS CA C 100 57.500 59.193 -1.693 1
1 1216 . 19 1 1 A 100 100 HIS CB C 100 30.800 30.547 0.253 1
1 1218 . 19 1 1 A 100 100 HIS N N 100 114.000 117.402 -3.402 1
1 1219 . 19 1 1 A 101 101 LEU H H 101 7.920 8.046 -0.126 1
1 1220 . 19 1 1 A 101 101 LEU HA H 101 4.370 4.214 0.156 1
1 1230 . 19 1 1 A 101 101 LEU C C 101 177.700 178.321 -0.621 1
1 1231 . 19 1 1 A 101 101 LEU CA C 101 55.900 56.813 -0.913 1
1 1232 . 19 1 1 A 101 101 LEU CB C 101 42.100 42.774 -0.674 1
1 1236 . 19 1 1 A 101 101 LEU N N 101 118.500 121.917 -3.417 1
1 1237 . 19 1 1 A 102 102 GLU H H 102 8.100 7.963 0.137 1
1 1238 . 19 1 1 A 102 102 GLU HA H 102 4.160 4.087 0.073 1
1 1243 . 19 1 1 A 102 102 GLU C C 102 176.700 177.193 -0.493 1
1 1244 . 19 1 1 A 102 102 GLU CA C 102 57.000 59.650 -2.650 1
1 1245 . 19 1 1 A 102 102 GLU CB C 102 29.900 29.867 0.033 1
1 1247 . 19 1 1 A 102 102 GLU N N 102 119.100 119.520 -0.420 1
1 1248 . 19 1 1 A 103 103 HIS H H 103 8.010 7.681 0.329 1
1 1249 . 19 1 1 A 103 103 HIS HA H 103 4.520 4.510 0.010 1
1 1252 . 19 1 1 A 103 103 HIS CA C 103 56.100 57.363 -1.263 1
1 1253 . 19 1 1 A 103 103 HIS CB C 103 29.700 30.208 -0.508 1
1 1254 . 19 1 1 A 103 103 HIS N N 103 117.300 116.333 0.967 1
1 1255 . 19 1 1 A 107 107 HIS HA H 107 4.560 4.422 0.138 1
1 1258 . 19 1 1 A 107 107 HIS C C 107 173.900 175.260 -1.360 1
1 1259 . 19 1 1 A 107 107 HIS CA C 107 55.900 56.246 -0.346 1
1 1260 . 19 1 1 A 107 107 HIS CB C 107 30.200 29.801 0.399 1
1 4 . 20 1 1 A 2 2 ALA H H 2 8.450 8.298 0.152 1
1 5 . 20 1 1 A 2 2 ALA HA H 2 4.390 4.234 0.156 1
1 9 . 20 1 1 A 2 2 ALA C C 2 178.300 177.210 1.090 1
1 10 . 20 1 1 A 2 2 ALA CA C 2 52.500 52.744 -0.244 1
1 11 . 20 1 1 A 2 2 ALA CB C 2 19.200 19.056 0.144 1
1 12 . 20 1 1 A 2 2 ALA N N 2 125.100 123.875 1.225 1
1 13 . 20 1 1 A 3 3 GLY H H 3 8.450 8.308 0.142 1
1 14 . 20 1 1 A 3 3 GLY HA2 H 3 4.030 4.214 -0.184 1
1 15 . 20 1 1 A 3 3 GLY HA3 H 3 4.030 4.214 -0.184 1
1 16 . 20 1 1 A 3 3 GLY C C 3 174.100 173.590 0.510 1
1 17 . 20 1 1 A 3 3 GLY CA C 3 45.200 46.040 -0.840 1
1 18 . 20 1 1 A 3 3 GLY N N 3 108.000 108.019 -0.019 1
1 19 . 20 1 1 A 4 4 GLN H H 4 8.550 8.638 -0.088 1
1 20 . 20 1 1 A 4 4 GLN HA H 4 4.340 4.367 -0.027 1
1 27 . 20 1 1 A 4 4 GLN C C 4 176.700 176.465 0.235 1
1 28 . 20 1 1 A 4 4 GLN CA C 4 56.600 55.703 0.897 1
1 29 . 20 1 1 A 4 4 GLN CB C 4 29.300 28.019 1.281 1
1 31 . 20 1 1 A 4 4 GLN N N 4 120.500 119.310 1.190 1
1 33 . 20 1 1 A 5 5 SER H H 5 8.540 7.539 1.001 1
1 34 . 20 1 1 A 5 5 SER HA H 5 4.390 4.359 0.031 1
1 38 . 20 1 1 A 5 5 SER C C 5 174.800 174.211 0.589 1
1 39 . 20 1 1 A 5 5 SER CA C 5 59.100 58.651 0.449 1
1 40 . 20 1 1 A 5 5 SER CB C 5 63.500 63.332 0.168 1
1 41 . 20 1 1 A 5 5 SER N N 5 117.100 115.451 1.649 1
1 42 . 20 1 1 A 6 6 ASP H H 6 8.300 9.027 -0.727 1
1 43 . 20 1 1 A 6 6 ASP HA H 6 4.540 4.580 -0.040 1
1 46 . 20 1 1 A 6 6 ASP C C 6 177.300 176.662 0.638 1
1 47 . 20 1 1 A 6 6 ASP CA C 6 55.100 55.673 -0.573 1
1 48 . 20 1 1 A 6 6 ASP CB C 6 40.800 40.634 0.166 1
1 49 . 20 1 1 A 6 6 ASP N N 6 122.700 121.338 1.362 1
1 50 . 20 1 1 A 7 7 ARG H H 7 8.270 8.024 0.246 1
1 51 . 20 1 1 A 7 7 ARG HA H 7 4.150 3.977 0.173 1
1 58 . 20 1 1 A 7 7 ARG C C 7 177.600 178.520 -0.920 1
1 59 . 20 1 1 A 7 7 ARG CA C 7 58.000 59.315 -1.315 1
1 60 . 20 1 1 A 7 7 ARG CB C 7 30.100 29.905 0.195 1
1 63 . 20 1 1 A 7 7 ARG N N 7 122.100 118.335 3.765 1
1 64 . 20 1 1 A 8 8 LYS H H 8 8.130 7.915 0.215 1
1 65 . 20 1 1 A 8 8 LYS HA H 8 4.090 4.113 -0.023 1
1 74 . 20 1 1 A 8 8 LYS C C 8 177.600 178.733 -1.133 1
1 75 . 20 1 1 A 8 8 LYS CA C 8 58.400 58.910 -0.510 1
1 76 . 20 1 1 A 8 8 LYS CB C 8 31.700 32.156 -0.456 1
1 80 . 20 1 1 A 8 8 LYS N N 8 120.900 119.078 1.822 1
1 81 . 20 1 1 A 9 9 ALA H H 9 8.050 7.990 0.060 1
1 82 . 20 1 1 A 9 9 ALA HA H 9 3.950 4.080 -0.130 1
1 86 . 20 1 1 A 9 9 ALA C C 9 179.800 180.658 -0.858 1
1 87 . 20 1 1 A 9 9 ALA CA C 9 55.100 54.896 0.204 1
1 88 . 20 1 1 A 9 9 ALA CB C 9 18.100 18.170 -0.070 1
1 89 . 20 1 1 A 9 9 ALA N N 9 121.600 120.785 0.815 1
1 90 . 20 1 1 A 10 10 ALA H H 10 7.910 7.917 -0.007 1
1 91 . 20 1 1 A 10 10 ALA HA H 10 4.200 4.108 0.092 1
1 95 . 20 1 1 A 10 10 ALA C C 10 180.500 180.036 0.464 1
1 96 . 20 1 1 A 10 10 ALA CA C 10 54.600 54.525 0.075 1
1 97 . 20 1 1 A 10 10 ALA CB C 10 18.100 18.445 -0.345 1
1 98 . 20 1 1 A 10 10 ALA N N 10 120.200 120.579 -0.379 1
1 99 . 20 1 1 A 11 11 LEU H H 11 8.080 8.057 0.023 1
1 100 . 20 1 1 A 11 11 LEU HA H 11 4.120 4.055 0.065 1
1 110 . 20 1 1 A 11 11 LEU C C 11 179.600 179.456 0.144 1
1 111 . 20 1 1 A 11 11 LEU CA C 11 57.800 57.721 0.079 1
1 112 . 20 1 1 A 11 11 LEU CB C 11 41.700 41.981 -0.281 1
1 115 . 20 1 1 A 11 11 LEU N N 11 120.900 119.286 1.614 1
1 116 . 20 1 1 A 12 12 LEU H H 12 8.480 8.004 0.476 1
1 117 . 20 1 1 A 12 12 LEU HA H 12 4.040 3.983 0.057 1
1 127 . 20 1 1 A 12 12 LEU C C 12 178.900 178.894 0.006 1
1 128 . 20 1 1 A 12 12 LEU CA C 12 58.100 58.012 0.088 1
1 129 . 20 1 1 A 12 12 LEU CB C 12 40.100 40.465 -0.365 1
1 133 . 20 1 1 A 12 12 LEU N N 12 118.700 118.509 0.191 1
1 134 . 20 1 1 A 13 13 ASP H H 13 7.990 8.468 -0.478 1
1 135 . 20 1 1 A 13 13 ASP HA H 13 4.420 4.279 0.141 1
1 138 . 20 1 1 A 13 13 ASP C C 13 178.900 178.442 0.458 1
1 139 . 20 1 1 A 13 13 ASP CA C 13 57.500 57.904 -0.404 1
1 140 . 20 1 1 A 13 13 ASP CB C 13 40.500 41.028 -0.528 1
1 141 . 20 1 1 A 13 13 ASP N N 13 119.500 119.836 -0.336 1
1 142 . 20 1 1 A 14 14 GLN H H 14 7.620 7.845 -0.225 1
1 143 . 20 1 1 A 14 14 GLN HA H 14 4.230 4.119 0.111 1
1 150 . 20 1 1 A 14 14 GLN C C 14 178.400 178.423 -0.023 1
1 151 . 20 1 1 A 14 14 GLN CA C 14 58.100 58.412 -0.312 1
1 152 . 20 1 1 A 14 14 GLN CB C 14 27.800 28.602 -0.802 1
1 154 . 20 1 1 A 14 14 GLN N N 14 118.900 119.820 -0.920 1
1 156 . 20 1 1 A 15 15 VAL H H 15 8.480 7.894 0.586 1
1 157 . 20 1 1 A 15 15 VAL HA H 15 3.380 3.965 -0.585 1
1 165 . 20 1 1 A 15 15 VAL C C 15 177.600 178.078 -0.478 1
1 166 . 20 1 1 A 15 15 VAL CA C 15 66.600 64.101 2.499 1
1 167 . 20 1 1 A 15 15 VAL CB C 15 30.500 31.387 -0.887 1
1 170 . 20 1 1 A 15 15 VAL N N 15 121.300 118.813 2.487 1
1 171 . 20 1 1 A 16 16 ALA H H 16 8.080 7.853 0.227 1
1 172 . 20 1 1 A 16 16 ALA HA H 16 4.450 3.989 0.461 1
1 176 . 20 1 1 A 16 16 ALA C C 16 179.100 179.796 -0.696 1
1 177 . 20 1 1 A 16 16 ALA CA C 16 54.600 55.250 -0.650 1
1 178 . 20 1 1 A 16 16 ALA CB C 16 17.700 18.210 -0.510 1
1 179 . 20 1 1 A 16 16 ALA N N 16 121.400 124.109 -2.709 1
1 180 . 20 1 1 A 17 17 ARG H H 17 7.480 7.716 -0.236 1
1 181 . 20 1 1 A 17 17 ARG HA H 17 3.910 4.125 -0.215 1
1 187 . 20 1 1 A 17 17 ARG C C 17 179.700 179.046 0.654 1
1 188 . 20 1 1 A 17 17 ARG CA C 17 59.700 58.872 0.828 1
1 189 . 20 1 1 A 17 17 ARG CB C 17 30.400 29.779 0.621 1
1 191 . 20 1 1 A 17 17 ARG N N 17 116.900 119.175 -2.275 1
1 192 . 20 1 1 A 18 18 VAL H H 18 7.960 7.681 0.279 1
1 193 . 20 1 1 A 18 18 VAL HA H 18 3.690 3.686 0.004 1
1 201 . 20 1 1 A 18 18 VAL C C 18 177.900 178.214 -0.314 1
1 202 . 20 1 1 A 18 18 VAL CA C 18 66.600 66.139 0.461 1
1 203 . 20 1 1 A 18 18 VAL CB C 18 31.300 31.675 -0.375 1
1 206 . 20 1 1 A 18 18 VAL N N 18 123.000 119.350 3.650 1
1 207 . 20 1 1 A 19 19 GLY H H 19 8.270 8.380 -0.110 1
1 208 . 20 1 1 A 19 19 GLY HA2 H 19 3.430 3.788 -0.358 1
1 209 . 20 1 1 A 19 19 GLY HA3 H 19 3.430 3.796 -0.366 1
1 210 . 20 1 1 A 19 19 GLY C C 19 174.400 175.571 -1.171 1
1 211 . 20 1 1 A 19 19 GLY CA C 19 48.500 47.204 1.296 1
1 212 . 20 1 1 A 19 19 GLY N N 19 105.400 107.511 -2.111 1
1 213 . 20 1 1 A 20 20 LYS H H 20 8.250 8.300 -0.050 1
1 214 . 20 1 1 A 20 20 LYS HA H 20 3.710 4.072 -0.362 1
1 223 . 20 1 1 A 20 20 LYS C C 20 179.400 178.573 0.827 1
1 224 . 20 1 1 A 20 20 LYS CA C 20 59.300 58.578 0.722 1
1 225 . 20 1 1 A 20 20 LYS CB C 20 32.600 32.586 0.014 1
1 229 . 20 1 1 A 20 20 LYS N N 20 118.700 121.613 -2.913 1
1 230 . 20 1 1 A 21 21 ALA H H 21 7.640 7.738 -0.098 1
1 231 . 20 1 1 A 21 21 ALA HA H 21 3.790 4.128 -0.338 1
1 235 . 20 1 1 A 21 21 ALA C C 21 177.900 180.088 -2.188 1
1 236 . 20 1 1 A 21 21 ALA CA C 21 55.200 54.398 0.802 1
1 237 . 20 1 1 A 21 21 ALA CB C 21 19.200 18.168 1.032 1
1 238 . 20 1 1 A 21 21 ALA N N 21 121.700 120.879 0.821 1
1 239 . 20 1 1 A 22 22 LEU H H 22 7.330 7.957 -0.627 1
1 240 . 20 1 1 A 22 22 LEU HA H 22 4.140 4.155 -0.015 1
1 250 . 20 1 1 A 22 22 LEU C C 22 176.800 178.341 -1.541 1
1 251 . 20 1 1 A 22 22 LEU CA C 22 54.600 57.393 -2.793 1
1 252 . 20 1 1 A 22 22 LEU CB C 22 42.900 41.599 1.301 1
1 256 . 20 1 1 A 22 22 LEU N N 22 114.200 120.565 -6.365 1
1 257 . 20 1 1 A 23 23 ALA H H 23 7.160 7.905 -0.745 1
1 258 . 20 1 1 A 23 23 ALA HA H 23 4.720 4.257 0.463 1
1 262 . 20 1 1 A 23 23 ALA C C 23 176.700 177.864 -1.164 1
1 263 . 20 1 1 A 23 23 ALA CA C 23 53.000 52.980 0.020 1
1 264 . 20 1 1 A 23 23 ALA CB C 23 18.200 17.711 0.489 1
1 265 . 20 1 1 A 23 23 ALA N N 23 118.200 120.362 -2.162 1
1 266 . 20 1 1 A 24 24 ASN H H 24 7.440 7.833 -0.393 1
1 267 . 20 1 1 A 24 24 ASN HA H 24 4.730 4.786 -0.056 1
1 272 . 20 1 1 A 24 24 ASN C C 24 174.800 175.601 -0.801 1
1 273 . 20 1 1 A 24 24 ASN CA C 24 53.500 53.507 -0.007 1
1 274 . 20 1 1 A 24 24 ASN CB C 24 41.700 39.277 2.423 1
1 275 . 20 1 1 A 24 24 ASN N N 24 116.800 116.470 0.330 1
1 277 . 20 1 1 A 25 25 GLY H H 25 9.370 7.439 1.931 1
1 278 . 20 1 1 A 25 25 GLY HA2 H 25 3.650 3.990 -0.340 1
1 279 . 20 1 1 A 25 25 GLY HA3 H 25 4.110 4.005 0.105 1
1 280 . 20 1 1 A 25 25 GLY C C 25 175.300 174.904 0.396 1
1 281 . 20 1 1 A 25 25 GLY CA C 25 47.600 45.798 1.802 1
1 282 . 20 1 1 A 25 25 GLY N N 25 114.800 107.533 7.267 1
1 283 . 20 1 1 A 26 26 ARG H H 26 8.050 8.305 -0.255 1
1 284 . 20 1 1 A 26 26 ARG HA H 26 4.150 4.134 0.016 1
1 289 . 20 1 1 A 26 26 ARG C C 26 179.300 177.706 1.594 1
1 290 . 20 1 1 A 26 26 ARG CA C 26 57.000 58.286 -1.286 1
1 291 . 20 1 1 A 26 26 ARG CB C 26 29.900 29.550 0.350 1
1 294 . 20 1 1 A 26 26 ARG N N 26 120.500 121.636 -1.136 1
1 295 . 20 1 1 A 27 27 ARG H H 27 7.930 7.972 -0.042 1
1 296 . 20 1 1 A 27 27 ARG HA H 27 3.710 4.099 -0.389 1
1 301 . 20 1 1 A 27 27 ARG C C 27 178.300 177.620 0.680 1
1 302 . 20 1 1 A 27 27 ARG CA C 27 61.000 58.392 2.608 1
1 303 . 20 1 1 A 27 27 ARG CB C 27 30.400 30.290 0.110 1
1 305 . 20 1 1 A 27 27 ARG N N 27 117.900 118.702 -0.802 1
1 306 . 20 1 1 A 28 28 LEU H H 28 7.640 7.823 -0.183 1
1 307 . 20 1 1 A 28 28 LEU HA H 28 3.950 4.026 -0.076 1
1 317 . 20 1 1 A 28 28 LEU C C 28 178.200 178.908 -0.708 1
1 318 . 20 1 1 A 28 28 LEU CA C 28 57.600 56.426 1.174 1
1 319 . 20 1 1 A 28 28 LEU CB C 28 41.900 42.031 -0.131 1
1 323 . 20 1 1 A 28 28 LEU N N 28 117.600 117.684 -0.084 1
1 324 . 20 1 1 A 29 29 GLN H H 29 8.110 7.676 0.434 1
1 325 . 20 1 1 A 29 29 GLN HA H 29 3.880 4.026 -0.146 1
1 332 . 20 1 1 A 29 29 GLN C C 29 179.400 178.423 0.977 1
1 333 . 20 1 1 A 29 29 GLN CA C 29 59.100 58.918 0.182 1
1 334 . 20 1 1 A 29 29 GLN CB C 29 28.800 28.153 0.647 1
1 336 . 20 1 1 A 29 29 GLN N N 29 119.300 119.547 -0.247 1
1 338 . 20 1 1 A 30 30 ILE H H 30 7.530 7.428 0.102 1
1 339 . 20 1 1 A 30 30 ILE HA H 30 3.340 3.600 -0.260 1
1 349 . 20 1 1 A 30 30 ILE C C 30 176.700 178.597 -1.897 1
1 350 . 20 1 1 A 30 30 ILE CA C 30 65.900 65.543 0.357 1
1 351 . 20 1 1 A 30 30 ILE CB C 30 37.400 37.648 -0.248 1
1 355 . 20 1 1 A 30 30 ILE N N 30 118.600 120.927 -2.327 1
1 356 . 20 1 1 A 31 31 LEU H H 31 7.500 7.551 -0.051 1
1 357 . 20 1 1 A 31 31 LEU HA H 31 3.520 3.770 -0.250 1
1 367 . 20 1 1 A 31 31 LEU C C 31 177.300 178.267 -0.967 1
1 368 . 20 1 1 A 31 31 LEU CA C 31 58.100 57.912 0.188 1
1 369 . 20 1 1 A 31 31 LEU CB C 31 41.100 40.330 0.770 1
1 373 . 20 1 1 A 31 31 LEU N N 31 119.900 119.417 0.483 1
1 374 . 20 1 1 A 32 32 ASP H H 32 7.950 8.348 -0.398 1
1 375 . 20 1 1 A 32 32 ASP HA H 32 4.300 4.442 -0.142 1
1 378 . 20 1 1 A 32 32 ASP C C 32 178.300 178.467 -0.167 1
1 379 . 20 1 1 A 32 32 ASP CA C 32 57.400 57.792 -0.392 1
1 380 . 20 1 1 A 32 32 ASP CB C 32 42.400 42.571 -0.171 1
1 381 . 20 1 1 A 32 32 ASP N N 32 116.900 119.552 -2.652 1
1 382 . 20 1 1 A 33 33 LEU H H 33 7.350 7.563 -0.213 1
1 383 . 20 1 1 A 33 33 LEU HA H 33 4.130 4.132 -0.002 1
1 393 . 20 1 1 A 33 33 LEU C C 33 180.000 178.905 1.095 1
1 394 . 20 1 1 A 33 33 LEU CA C 33 57.600 57.634 -0.034 1
1 395 . 20 1 1 A 33 33 LEU CB C 33 42.300 41.789 0.511 1
1 399 . 20 1 1 A 33 33 LEU N N 33 118.600 120.160 -1.560 1
1 400 . 20 1 1 A 34 34 LEU H H 34 8.300 8.556 -0.256 1
1 401 . 20 1 1 A 34 34 LEU HA H 34 4.490 4.267 0.223 1
1 411 . 20 1 1 A 34 34 LEU C C 34 178.900 179.115 -0.215 1
1 412 . 20 1 1 A 34 34 LEU CA C 34 55.800 56.279 -0.479 1
1 413 . 20 1 1 A 34 34 LEU CB C 34 41.300 41.193 0.107 1
1 417 . 20 1 1 A 34 34 LEU N N 34 117.800 118.672 -0.872 1
1 418 . 20 1 1 A 35 35 ALA H H 35 8.160 7.579 0.581 1
1 419 . 20 1 1 A 35 35 ALA HA H 35 4.050 4.117 -0.067 1
1 423 . 20 1 1 A 35 35 ALA C C 35 179.000 179.090 -0.090 1
1 424 . 20 1 1 A 35 35 ALA CA C 35 54.900 54.555 0.345 1
1 425 . 20 1 1 A 35 35 ALA CB C 35 17.500 18.384 -0.884 1
1 426 . 20 1 1 A 35 35 ALA N N 35 123.900 122.139 1.761 1
1 427 . 20 1 1 A 36 36 GLN H H 36 7.600 7.706 -0.106 1
1 428 . 20 1 1 A 36 36 GLN HA H 36 4.340 4.212 0.128 1
1 435 . 20 1 1 A 36 36 GLN C C 36 176.100 175.275 0.825 1
1 436 . 20 1 1 A 36 36 GLN CA C 36 55.800 55.367 0.433 1
1 437 . 20 1 1 A 36 36 GLN CB C 36 29.000 28.286 0.714 1
1 439 . 20 1 1 A 36 36 GLN N N 36 113.300 113.972 -0.672 1
1 441 . 20 1 1 A 37 37 GLY H H 37 7.550 7.149 0.401 1
1 442 . 20 1 1 A 37 37 GLY HA2 H 37 3.730 4.095 -0.365 1
1 443 . 20 1 1 A 37 37 GLY HA3 H 37 4.490 4.096 0.394 1
1 444 . 20 1 1 A 37 37 GLY C C 37 171.500 172.870 -1.370 1
1 445 . 20 1 1 A 37 37 GLY CA C 37 44.500 44.264 0.236 1
1 446 . 20 1 1 A 37 37 GLY N N 37 108.400 107.222 1.178 1
1 447 . 20 1 1 A 38 38 GLU H H 38 8.120 8.481 -0.361 1
1 448 . 20 1 1 A 38 38 GLU HA H 38 4.820 4.941 -0.121 1
1 453 . 20 1 1 A 38 38 GLU C C 38 177.000 176.220 0.780 1
1 454 . 20 1 1 A 38 38 GLU CA C 38 56.400 56.345 0.055 1
1 455 . 20 1 1 A 38 38 GLU CB C 38 31.200 30.077 1.123 1
1 457 . 20 1 1 A 38 38 GLU N N 38 119.600 117.787 1.813 1
1 458 . 20 1 1 A 39 39 ARG H H 39 8.580 8.723 -0.143 1
1 459 . 20 1 1 A 39 39 ARG HA H 39 4.970 5.001 -0.031 1
1 467 . 20 1 1 A 39 39 ARG C C 39 174.800 175.986 -1.186 1
1 468 . 20 1 1 A 39 39 ARG CA C 39 53.900 54.432 -0.532 1
1 469 . 20 1 1 A 39 39 ARG CB C 39 36.400 32.877 3.523 1
1 472 . 20 1 1 A 39 39 ARG N N 39 121.500 124.643 -3.143 1
1 474 . 20 1 1 A 40 40 ALA H H 40 8.910 8.962 -0.052 1
1 475 . 20 1 1 A 40 40 ALA HA H 40 4.920 4.191 0.729 1
1 479 . 20 1 1 A 40 40 ALA C C 40 179.200 178.371 0.829 1
1 480 . 20 1 1 A 40 40 ALA CA C 40 51.100 52.222 -1.122 1
1 481 . 20 1 1 A 40 40 ALA CB C 40 19.200 18.930 0.270 1
1 482 . 20 1 1 A 40 40 ALA N N 40 125.100 124.866 0.234 1
1 483 . 20 1 1 A 41 41 VAL H H 41 8.420 8.393 0.027 1
1 484 . 20 1 1 A 41 41 VAL HA H 41 3.430 3.602 -0.172 1
1 492 . 20 1 1 A 41 41 VAL C C 41 176.800 177.522 -0.722 1
1 493 . 20 1 1 A 41 41 VAL CA C 41 67.600 66.650 0.950 1
1 494 . 20 1 1 A 41 41 VAL CB C 41 31.600 31.625 -0.025 1
1 497 . 20 1 1 A 41 41 VAL N N 41 120.900 121.222 -0.322 1
1 498 . 20 1 1 A 42 42 GLU H H 42 9.640 8.330 1.310 1
1 499 . 20 1 1 A 42 42 GLU HA H 42 3.880 3.904 -0.024 1
1 504 . 20 1 1 A 42 42 GLU C C 42 178.300 178.459 -0.159 1
1 505 . 20 1 1 A 42 42 GLU CA C 42 60.600 59.545 1.055 1
1 506 . 20 1 1 A 42 42 GLU CB C 42 28.300 29.395 -1.095 1
1 508 . 20 1 1 A 42 42 GLU N N 42 119.000 120.075 -1.075 1
1 509 . 20 1 1 A 43 43 ALA H H 43 6.870 7.600 -0.730 1
1 510 . 20 1 1 A 43 43 ALA HA H 43 4.290 4.100 0.190 1
1 514 . 20 1 1 A 43 43 ALA C C 43 180.700 179.637 1.063 1
1 515 . 20 1 1 A 43 43 ALA CA C 43 54.100 55.249 -1.149 1
1 516 . 20 1 1 A 43 43 ALA CB C 43 19.100 18.441 0.659 1
1 517 . 20 1 1 A 43 43 ALA N N 43 120.500 121.677 -1.177 1
1 518 . 20 1 1 A 44 44 ILE H H 44 7.970 8.297 -0.327 1
1 519 . 20 1 1 A 44 44 ILE HA H 44 3.470 3.630 -0.160 1
1 529 . 20 1 1 A 44 44 ILE C C 44 178.300 178.117 0.183 1
1 530 . 20 1 1 A 44 44 ILE CA C 44 64.700 65.456 -0.756 1
1 531 . 20 1 1 A 44 44 ILE CB C 44 38.100 37.723 0.377 1
1 535 . 20 1 1 A 44 44 ILE N N 44 120.500 118.422 2.078 1
1 536 . 20 1 1 A 45 45 ALA H H 45 8.460 8.254 0.206 1
1 537 . 20 1 1 A 45 45 ALA HA H 45 3.720 4.004 -0.284 1
1 541 . 20 1 1 A 45 45 ALA C C 45 178.500 179.849 -1.349 1
1 542 . 20 1 1 A 45 45 ALA CA C 45 56.200 55.344 0.856 1
1 543 . 20 1 1 A 45 45 ALA CB C 45 17.400 18.581 -1.181 1
1 544 . 20 1 1 A 45 45 ALA N N 45 124.500 122.145 2.355 1
1 545 . 20 1 1 A 46 46 THR H H 46 8.080 7.921 0.159 1
1 546 . 20 1 1 A 46 46 THR HA H 46 3.900 3.863 0.037 1
1 551 . 20 1 1 A 46 46 THR C C 46 177.200 176.743 0.457 1
1 552 . 20 1 1 A 46 46 THR CA C 46 66.400 66.736 -0.336 1
1 553 . 20 1 1 A 46 46 THR CB C 46 68.800 68.663 0.137 1
1 555 . 20 1 1 A 46 46 THR N N 46 112.400 113.535 -1.135 1
1 556 . 20 1 1 A 47 47 ALA H H 47 7.930 8.307 -0.377 1
1 557 . 20 1 1 A 47 47 ALA HA H 47 4.200 4.212 -0.012 1
1 561 . 20 1 1 A 47 47 ALA C C 47 179.200 178.813 0.387 1
1 562 . 20 1 1 A 47 47 ALA CA C 47 54.800 54.696 0.104 1
1 563 . 20 1 1 A 47 47 ALA CB C 47 19.800 18.225 1.575 1
1 564 . 20 1 1 A 47 47 ALA N N 47 121.400 124.102 -2.702 1
1 565 . 20 1 1 A 48 48 THR H H 48 7.560 7.492 0.068 1
1 566 . 20 1 1 A 48 48 THR HA H 48 4.390 4.482 -0.092 1
1 571 . 20 1 1 A 48 48 THR C C 48 175.700 175.551 0.149 1
1 572 . 20 1 1 A 48 48 THR CA C 48 61.800 62.229 -0.429 1
1 573 . 20 1 1 A 48 48 THR CB C 48 71.000 70.496 0.504 1
1 575 . 20 1 1 A 48 48 THR N N 48 103.500 106.796 -3.296 1
1 576 . 20 1 1 A 49 49 GLY H H 49 7.820 8.190 -0.370 1
1 577 . 20 1 1 A 49 49 GLY HA2 H 49 3.870 3.955 -0.085 1
1 578 . 20 1 1 A 49 49 GLY HA3 H 49 4.100 3.957 0.143 1
1 579 . 20 1 1 A 49 49 GLY C C 49 174.400 173.951 0.449 1
1 580 . 20 1 1 A 49 49 GLY CA C 49 46.300 46.425 -0.125 1
1 581 . 20 1 1 A 49 49 GLY N N 49 111.100 112.473 -1.373 1
1 582 . 20 1 1 A 50 50 MET H H 50 7.930 8.063 -0.133 1
1 583 . 20 1 1 A 50 50 MET HA H 50 4.540 4.933 -0.393 1
1 591 . 20 1 1 A 50 50 MET C C 50 174.800 174.914 -0.114 1
1 592 . 20 1 1 A 50 50 MET CA C 50 55.100 54.157 0.943 1
1 593 . 20 1 1 A 50 50 MET CB C 50 37.200 36.756 0.444 1
1 596 . 20 1 1 A 50 50 MET N N 50 119.300 118.284 1.016 1
1 597 . 20 1 1 A 51 51 ASN H H 51 8.040 8.867 -0.827 1
1 598 . 20 1 1 A 51 51 ASN HA H 51 4.580 4.798 -0.218 1
1 601 . 20 1 1 A 51 51 ASN C C 51 176.100 177.251 -1.151 1
1 602 . 20 1 1 A 51 51 ASN CA C 51 52.800 53.283 -0.483 1
1 603 . 20 1 1 A 51 51 ASN CB C 51 41.100 39.321 1.779 1
1 604 . 20 1 1 A 51 51 ASN N N 51 118.000 119.498 -1.498 1
1 605 . 20 1 1 A 52 52 LEU H H 52 8.560 8.768 -0.208 1
1 606 . 20 1 1 A 52 52 LEU HA H 52 3.760 3.926 -0.166 1
1 616 . 20 1 1 A 52 52 LEU C C 52 179.600 178.831 0.769 1
1 617 . 20 1 1 A 52 52 LEU CA C 52 59.000 57.777 1.223 1
1 618 . 20 1 1 A 52 52 LEU CB C 52 41.800 41.385 0.415 1
1 622 . 20 1 1 A 52 52 LEU N N 52 120.600 123.910 -3.310 1
1 623 . 20 1 1 A 53 53 THR H H 53 8.230 7.877 0.353 1
1 624 . 20 1 1 A 53 53 THR HA H 53 3.880 4.032 -0.152 1
1 629 . 20 1 1 A 53 53 THR C C 53 176.900 176.963 -0.063 1
1 630 . 20 1 1 A 53 53 THR CA C 53 66.500 65.968 0.532 1
1 631 . 20 1 1 A 53 53 THR CB C 53 68.400 68.014 0.386 1
1 633 . 20 1 1 A 53 53 THR N N 53 115.800 110.553 5.247 1
1 634 . 20 1 1 A 54 54 THR H H 54 8.420 8.187 0.233 1
1 635 . 20 1 1 A 54 54 THR HA H 54 3.880 3.864 0.016 1
1 640 . 20 1 1 A 54 54 THR C C 54 177.300 176.351 0.949 1
1 641 . 20 1 1 A 54 54 THR CA C 54 66.600 66.552 0.048 1
1 642 . 20 1 1 A 54 54 THR CB C 54 66.600 68.781 -2.181 1
1 644 . 20 1 1 A 54 54 THR N N 54 122.300 117.313 4.987 1
1 645 . 20 1 1 A 55 55 ALA H H 55 8.860 8.808 0.052 1
1 646 . 20 1 1 A 55 55 ALA HA H 55 4.020 3.924 0.096 1
1 650 . 20 1 1 A 55 55 ALA C C 55 179.000 179.174 -0.174 1
1 651 . 20 1 1 A 55 55 ALA CA C 55 56.100 55.349 0.751 1
1 652 . 20 1 1 A 55 55 ALA CB C 55 17.000 18.026 -1.026 1
1 653 . 20 1 1 A 55 55 ALA N N 55 125.600 123.369 2.231 1
1 654 . 20 1 1 A 56 56 SER H H 56 8.440 8.052 0.388 1
1 655 . 20 1 1 A 56 56 SER HA H 56 3.920 3.945 -0.025 1
1 658 . 20 1 1 A 56 56 SER C C 56 176.400 176.298 0.102 1
1 659 . 20 1 1 A 56 56 SER CA C 56 62.600 61.451 1.149 1
1 660 . 20 1 1 A 56 56 SER CB C 56 62.700 62.683 0.017 1
1 661 . 20 1 1 A 56 56 SER N N 56 112.700 113.151 -0.451 1
1 662 . 20 1 1 A 57 57 ALA H H 57 8.090 8.119 -0.029 1
1 663 . 20 1 1 A 57 57 ALA HA H 57 4.130 3.939 0.191 1
1 667 . 20 1 1 A 57 57 ALA C C 57 181.200 179.616 1.584 1
1 668 . 20 1 1 A 57 57 ALA CA C 57 55.200 55.278 -0.078 1
1 669 . 20 1 1 A 57 57 ALA CB C 57 17.900 18.017 -0.117 1
1 670 . 20 1 1 A 57 57 ALA N N 57 124.000 123.620 0.380 1
1 671 . 20 1 1 A 58 58 ASN H H 58 7.970 7.596 0.374 1
1 672 . 20 1 1 A 58 58 ASN HA H 58 4.480 4.592 -0.112 1
1 677 . 20 1 1 A 58 58 ASN C C 58 177.500 178.102 -0.602 1
1 678 . 20 1 1 A 58 58 ASN CA C 58 56.900 56.264 0.636 1
1 679 . 20 1 1 A 58 58 ASN CB C 58 39.800 38.596 1.204 1
1 680 . 20 1 1 A 58 58 ASN N N 58 117.600 116.524 1.076 1
1 682 . 20 1 1 A 59 59 LEU H H 59 8.530 8.716 -0.186 1
1 683 . 20 1 1 A 59 59 LEU HA H 59 3.710 3.842 -0.132 1
1 693 . 20 1 1 A 59 59 LEU C C 59 178.400 178.950 -0.550 1
1 694 . 20 1 1 A 59 59 LEU CA C 59 58.600 57.811 0.789 1
1 695 . 20 1 1 A 59 59 LEU CB C 59 40.500 40.916 -0.416 1
1 699 . 20 1 1 A 59 59 LEU N N 59 122.600 121.353 1.247 1
1 700 . 20 1 1 A 60 60 GLN H H 60 8.200 8.423 -0.223 1
1 701 . 20 1 1 A 60 60 GLN HA H 60 4.020 3.992 0.028 1
1 708 . 20 1 1 A 60 60 GLN C C 60 178.700 177.905 0.795 1
1 709 . 20 1 1 A 60 60 GLN CA C 60 58.800 57.506 1.294 1
1 710 . 20 1 1 A 60 60 GLN CB C 60 27.700 29.456 -1.756 1
1 712 . 20 1 1 A 60 60 GLN N N 60 118.900 118.344 0.556 1
1 714 . 20 1 1 A 61 61 ALA H H 61 7.580 7.571 0.009 1
1 715 . 20 1 1 A 61 61 ALA HA H 61 4.230 4.000 0.230 1
1 719 . 20 1 1 A 61 61 ALA C C 61 181.300 180.156 1.144 1
1 720 . 20 1 1 A 61 61 ALA CA C 61 55.100 54.978 0.122 1
1 721 . 20 1 1 A 61 61 ALA CB C 61 17.600 18.191 -0.591 1
1 722 . 20 1 1 A 61 61 ALA N N 61 122.200 122.749 -0.549 1
1 723 . 20 1 1 A 62 62 LEU H H 62 7.830 8.447 -0.617 1
1 724 . 20 1 1 A 62 62 LEU HA H 62 3.980 4.020 -0.040 1
1 734 . 20 1 1 A 62 62 LEU C C 62 178.500 179.057 -0.557 1
1 735 . 20 1 1 A 62 62 LEU CA C 62 58.100 57.514 0.586 1
1 736 . 20 1 1 A 62 62 LEU CB C 62 43.300 41.113 2.187 1
1 739 . 20 1 1 A 62 62 LEU N N 62 119.000 118.604 0.396 1
1 740 . 20 1 1 A 63 63 LYS H H 63 8.580 8.379 0.201 1
1 741 . 20 1 1 A 63 63 LYS HA H 63 4.130 4.139 -0.009 1
1 750 . 20 1 1 A 63 63 LYS C C 63 180.500 179.266 1.234 1
1 751 . 20 1 1 A 63 63 LYS CA C 63 59.700 58.821 0.879 1
1 752 . 20 1 1 A 63 63 LYS CB C 63 32.600 31.959 0.641 1
1 756 . 20 1 1 A 63 63 LYS N N 63 123.400 121.915 1.485 1
1 757 . 20 1 1 A 64 64 SER H H 64 8.640 8.285 0.355 1
1 758 . 20 1 1 A 64 64 SER HA H 64 4.300 4.332 -0.032 1
1 761 . 20 1 1 A 64 64 SER C C 64 175.000 176.945 -1.945 1
1 762 . 20 1 1 A 64 64 SER CA C 64 61.400 62.319 -0.919 1
1 763 . 20 1 1 A 64 64 SER CB C 64 63.000 62.875 0.125 1
1 764 . 20 1 1 A 64 64 SER N N 64 117.700 117.798 -0.098 1
1 765 . 20 1 1 A 65 65 GLY H H 65 7.280 7.761 -0.481 1
1 766 . 20 1 1 A 65 65 GLY HA2 H 65 3.240 3.933 -0.693 1
1 767 . 20 1 1 A 65 65 GLY HA3 H 65 3.980 3.934 0.046 1
1 768 . 20 1 1 A 65 65 GLY C C 65 171.300 174.723 -3.423 1
1 769 . 20 1 1 A 65 65 GLY CA C 65 45.100 45.586 -0.486 1
1 770 . 20 1 1 A 65 65 GLY N N 65 104.400 108.755 -4.355 1
1 771 . 20 1 1 A 66 66 GLY H H 66 7.730 7.586 0.144 1
1 772 . 20 1 1 A 66 66 GLY HA2 H 66 3.650 4.010 -0.360 1
1 773 . 20 1 1 A 66 66 GLY HA3 H 66 3.750 4.013 -0.263 1
1 774 . 20 1 1 A 66 66 GLY C C 66 173.700 174.907 -1.207 1
1 775 . 20 1 1 A 66 66 GLY CA C 66 45.400 46.069 -0.669 1
1 776 . 20 1 1 A 66 66 GLY N N 66 104.700 107.937 -3.237 1
1 777 . 20 1 1 A 67 67 LEU H H 67 7.520 8.349 -0.829 1
1 778 . 20 1 1 A 67 67 LEU HA H 67 4.310 4.292 0.018 1
1 788 . 20 1 1 A 67 67 LEU C C 67 177.700 176.850 0.850 1
1 789 . 20 1 1 A 67 67 LEU CA C 67 55.500 55.733 -0.233 1
1 790 . 20 1 1 A 67 67 LEU CB C 67 42.400 42.649 -0.249 1
1 794 . 20 1 1 A 67 67 LEU N N 67 110.600 118.127 -7.527 1
1 795 . 20 1 1 A 68 68 VAL H H 68 6.890 7.381 -0.491 1
1 796 . 20 1 1 A 68 68 VAL HA H 68 5.190 4.998 0.192 1
1 804 . 20 1 1 A 68 68 VAL C C 68 173.700 174.405 -0.705 1
1 805 . 20 1 1 A 68 68 VAL CA C 68 57.400 58.614 -1.214 1
1 806 . 20 1 1 A 68 68 VAL CB C 68 36.400 35.539 0.861 1
1 809 . 20 1 1 A 68 68 VAL N N 68 106.400 110.908 -4.508 1
1 810 . 20 1 1 A 69 69 GLU H H 69 8.880 9.162 -0.282 1
1 811 . 20 1 1 A 69 69 GLU HA H 69 4.660 4.878 -0.218 1
1 816 . 20 1 1 A 69 69 GLU C C 69 173.300 174.688 -1.388 1
1 817 . 20 1 1 A 69 69 GLU CA C 69 54.300 54.697 -0.397 1
1 818 . 20 1 1 A 69 69 GLU CB C 69 34.100 33.291 0.809 1
1 820 . 20 1 1 A 69 69 GLU N N 69 120.400 121.757 -1.357 1
1 821 . 20 1 1 A 70 70 ALA H H 70 8.730 8.729 0.001 1
1 822 . 20 1 1 A 70 70 ALA HA H 70 4.990 4.612 0.378 1
1 826 . 20 1 1 A 70 70 ALA C C 70 176.500 175.608 0.892 1
1 827 . 20 1 1 A 70 70 ALA CA C 70 50.000 50.115 -0.115 1
1 828 . 20 1 1 A 70 70 ALA CB C 70 22.300 20.529 1.771 1
1 829 . 20 1 1 A 70 70 ALA N N 70 122.800 122.325 0.475 1
1 830 . 20 1 1 A 71 71 ARG H H 71 8.670 9.235 -0.565 1
1 831 . 20 1 1 A 71 71 ARG HA H 71 4.630 4.802 -0.172 1
1 843 . 20 1 1 A 71 71 ARG C C 71 173.500 175.689 -2.189 1
1 844 . 20 1 1 A 71 71 ARG CA C 71 54.600 54.679 -0.079 1
1 845 . 20 1 1 A 71 71 ARG CB C 71 33.600 31.337 2.263 1
1 849 . 20 1 1 A 71 71 ARG N N 71 120.100 123.209 -3.109 1
1 851 . 20 1 1 A 72 72 ARG H H 72 8.780 8.616 0.164 1
1 852 . 20 1 1 A 72 72 ARG HA H 72 5.100 4.813 0.287 1
1 859 . 20 1 1 A 72 72 ARG C C 72 176.000 175.349 0.651 1
1 860 . 20 1 1 A 72 72 ARG CA C 72 54.900 55.824 -0.924 1
1 861 . 20 1 1 A 72 72 ARG CB C 72 32.500 31.082 1.418 1
1 864 . 20 1 1 A 72 72 ARG N N 72 123.600 124.030 -0.430 1
1 865 . 20 1 1 A 73 73 GLU H H 73 8.720 9.260 -0.540 1
1 866 . 20 1 1 A 73 73 GLU HA H 73 4.510 4.688 -0.178 1
1 871 . 20 1 1 A 73 73 GLU C C 73 175.900 176.739 -0.839 1
1 872 . 20 1 1 A 73 73 GLU CA C 73 55.700 55.424 0.276 1
1 873 . 20 1 1 A 73 73 GLU CB C 73 31.800 31.720 0.080 1
1 875 . 20 1 1 A 73 73 GLU N N 73 126.800 123.045 3.755 1
1 876 . 20 1 1 A 74 74 GLY H H 74 9.190 9.035 0.155 1
1 877 . 20 1 1 A 74 74 GLY HA2 H 74 3.700 3.888 -0.188 1
1 878 . 20 1 1 A 74 74 GLY HA3 H 74 4.170 3.908 0.262 1
1 879 . 20 1 1 A 74 74 GLY C C 74 175.400 174.605 0.795 1
1 880 . 20 1 1 A 74 74 GLY CA C 74 47.100 47.250 -0.150 1
1 881 . 20 1 1 A 74 74 GLY N N 74 118.500 117.592 0.908 1
1 882 . 20 1 1 A 75 75 THR H H 75 8.780 8.670 0.110 1
1 883 . 20 1 1 A 75 75 THR HA H 75 4.290 4.382 -0.092 1
1 888 . 20 1 1 A 75 75 THR C C 75 174.600 173.736 0.864 1
1 889 . 20 1 1 A 75 75 THR CA C 75 62.000 62.200 -0.200 1
1 890 . 20 1 1 A 75 75 THR CB C 75 69.000 70.117 -1.117 1
1 892 . 20 1 1 A 75 75 THR N N 75 118.000 119.791 -1.791 1
1 893 . 20 1 1 A 76 76 ARG H H 76 8.030 7.581 0.449 1
1 894 . 20 1 1 A 76 76 ARG HA H 76 4.610 4.854 -0.244 1
1 901 . 20 1 1 A 76 76 ARG C C 76 174.800 174.770 0.030 1
1 902 . 20 1 1 A 76 76 ARG CA C 76 55.500 54.705 0.795 1
1 903 . 20 1 1 A 76 76 ARG CB C 76 32.700 32.651 0.049 1
1 906 . 20 1 1 A 76 76 ARG N N 76 122.600 122.105 0.495 1
1 907 . 20 1 1 A 77 77 GLN H H 77 8.580 8.575 0.005 1
1 908 . 20 1 1 A 77 77 GLN HA H 77 4.910 4.988 -0.078 1
1 915 . 20 1 1 A 77 77 GLN C C 77 173.900 174.101 -0.201 1
1 916 . 20 1 1 A 77 77 GLN CA C 77 54.700 54.358 0.342 1
1 917 . 20 1 1 A 77 77 GLN CB C 77 31.800 32.004 -0.204 1
1 919 . 20 1 1 A 77 77 GLN N N 77 121.900 122.319 -0.419 1
1 921 . 20 1 1 A 78 78 TYR H H 78 8.890 9.463 -0.573 1
1 922 . 20 1 1 A 78 78 TYR HA H 78 4.750 5.511 -0.761 1
1 929 . 20 1 1 A 78 78 TYR C C 78 175.600 174.448 1.152 1
1 930 . 20 1 1 A 78 78 TYR CA C 78 57.000 55.882 1.118 1
1 931 . 20 1 1 A 78 78 TYR CB C 78 41.400 40.726 0.674 1
1 936 . 20 1 1 A 78 78 TYR N N 78 121.800 126.870 -5.070 1
1 937 . 20 1 1 A 79 79 TYR H H 79 9.010 9.587 -0.577 1
1 938 . 20 1 1 A 79 79 TYR HA H 79 5.410 5.443 -0.033 1
1 945 . 20 1 1 A 79 79 TYR C C 79 173.100 175.163 -2.063 1
1 946 . 20 1 1 A 79 79 TYR CA C 79 57.300 57.153 0.147 1
1 947 . 20 1 1 A 79 79 TYR CB C 79 43.300 41.264 2.036 1
1 952 . 20 1 1 A 79 79 TYR N N 79 122.500 122.764 -0.264 1
1 953 . 20 1 1 A 80 80 ARG H H 80 8.720 8.383 0.337 1
1 954 . 20 1 1 A 80 80 ARG HA H 80 5.120 4.771 0.349 1
1 962 . 20 1 1 A 80 80 ARG C C 80 175.500 174.807 0.693 1
1 963 . 20 1 1 A 80 80 ARG CA C 80 53.200 54.757 -1.557 1
1 964 . 20 1 1 A 80 80 ARG CB C 80 33.900 34.548 -0.648 1
1 967 . 20 1 1 A 80 80 ARG N N 80 114.500 122.091 -7.591 1
1 969 . 20 1 1 A 81 81 ILE H H 81 9.300 8.546 0.754 1
1 970 . 20 1 1 A 81 81 ILE HA H 81 4.150 4.304 -0.154 1
1 980 . 20 1 1 A 81 81 ILE C C 81 177.800 177.240 0.560 1
1 981 . 20 1 1 A 81 81 ILE CA C 81 62.300 62.480 -0.180 1
1 982 . 20 1 1 A 81 81 ILE CB C 81 37.800 38.108 -0.308 1
1 986 . 20 1 1 A 81 81 ILE N N 81 122.100 125.134 -3.034 1
1 987 . 20 1 1 A 82 82 ALA H H 82 7.930 8.827 -0.897 1
1 988 . 20 1 1 A 82 82 ALA HA H 82 3.930 4.069 -0.139 1
1 992 . 20 1 1 A 82 82 ALA C C 82 176.300 177.170 -0.870 1
1 993 . 20 1 1 A 82 82 ALA CA C 82 54.200 55.145 -0.945 1
1 994 . 20 1 1 A 82 82 ALA CB C 82 18.500 19.562 -1.062 1
1 995 . 20 1 1 A 82 82 ALA N N 82 127.200 129.481 -2.281 1
1 996 . 20 1 1 A 83 83 GLY H H 83 6.980 7.442 -0.462 1
1 997 . 20 1 1 A 83 83 GLY HA2 H 83 4.090 4.046 0.044 1
1 998 . 20 1 1 A 83 83 GLY HA3 H 83 4.440 4.048 0.392 1
1 999 . 20 1 1 A 83 83 GLY C C 83 173.600 175.073 -1.473 1
1 1000 . 20 1 1 A 83 83 GLY CA C 83 45.200 45.361 -0.161 1
1 1001 . 20 1 1 A 83 83 GLY N N 83 101.800 103.124 -1.324 1
1 1002 . 20 1 1 A 84 84 GLU H H 84 8.930 8.898 0.032 1
1 1003 . 20 1 1 A 84 84 GLU HA H 84 4.120 3.988 0.132 1
1 1008 . 20 1 1 A 84 84 GLU C C 84 178.300 177.769 0.531 1
1 1009 . 20 1 1 A 84 84 GLU CA C 84 58.900 59.065 -0.165 1
1 1010 . 20 1 1 A 84 84 GLU CB C 84 29.400 29.447 -0.047 1
1 1012 . 20 1 1 A 84 84 GLU N N 84 120.300 120.626 -0.326 1
1 1013 . 20 1 1 A 85 85 ASP H H 85 8.950 8.192 0.758 1
1 1014 . 20 1 1 A 85 85 ASP HA H 85 4.310 4.293 0.017 1
1 1017 . 20 1 1 A 85 85 ASP C C 85 178.000 179.050 -1.050 1
1 1018 . 20 1 1 A 85 85 ASP CA C 85 57.100 57.277 -0.177 1
1 1019 . 20 1 1 A 85 85 ASP CB C 85 38.900 40.500 -1.600 1
1 1020 . 20 1 1 A 85 85 ASP N N 85 119.400 119.827 -0.427 1
1 1021 . 20 1 1 A 86 86 VAL H H 86 7.620 8.205 -0.585 1
1 1022 . 20 1 1 A 86 86 VAL HA H 86 3.480 3.592 -0.112 1
1 1030 . 20 1 1 A 86 86 VAL C C 86 177.400 178.006 -0.606 1
1 1031 . 20 1 1 A 86 86 VAL CA C 86 66.800 66.436 0.364 1
1 1032 . 20 1 1 A 86 86 VAL CB C 86 31.300 31.575 -0.275 1
1 1035 . 20 1 1 A 86 86 VAL N N 86 121.600 119.611 1.989 1
1 1036 . 20 1 1 A 87 87 ALA H H 87 7.520 8.144 -0.624 1
1 1037 . 20 1 1 A 87 87 ALA HA H 87 4.110 4.030 0.080 1
1 1041 . 20 1 1 A 87 87 ALA C C 87 181.200 179.922 1.278 1
1 1042 . 20 1 1 A 87 87 ALA CA C 87 55.800 55.898 -0.098 1
1 1043 . 20 1 1 A 87 87 ALA CB C 87 17.600 18.439 -0.839 1
1 1044 . 20 1 1 A 87 87 ALA N N 87 122.700 121.831 0.869 1
1 1045 . 20 1 1 A 88 88 ARG H H 88 8.380 8.670 -0.290 1
1 1046 . 20 1 1 A 88 88 ARG HA H 88 4.090 4.055 0.035 1
1 1054 . 20 1 1 A 88 88 ARG C C 88 179.100 178.998 0.102 1
1 1055 . 20 1 1 A 88 88 ARG CA C 88 59.600 58.915 0.685 1
1 1056 . 20 1 1 A 88 88 ARG CB C 88 30.500 29.635 0.865 1
1 1059 . 20 1 1 A 88 88 ARG N N 88 119.200 117.772 1.428 1
1 1061 . 20 1 1 A 89 89 LEU H H 89 8.480 7.923 0.557 1
1 1062 . 20 1 1 A 89 89 LEU HA H 89 4.040 4.059 -0.019 1
1 1071 . 20 1 1 A 89 89 LEU C C 89 177.200 178.602 -1.402 1
1 1072 . 20 1 1 A 89 89 LEU CA C 89 58.300 57.986 0.314 1
1 1073 . 20 1 1 A 89 89 LEU CB C 89 41.300 41.936 -0.636 1
1 1076 . 20 1 1 A 89 89 LEU N N 89 123.300 121.778 1.522 1
1 1077 . 20 1 1 A 90 90 PHE H H 90 8.890 8.920 -0.030 1
1 1078 . 20 1 1 A 90 90 PHE HA H 90 4.380 4.023 0.357 1
1 1086 . 20 1 1 A 90 90 PHE C C 90 177.500 177.960 -0.460 1
1 1087 . 20 1 1 A 90 90 PHE CA C 90 59.400 62.288 -2.888 1
1 1088 . 20 1 1 A 90 90 PHE CB C 90 38.600 39.108 -0.508 1
1 1094 . 20 1 1 A 90 90 PHE N N 90 119.400 119.482 -0.082 1
1 1095 . 20 1 1 A 91 91 ALA H H 91 7.920 8.213 -0.293 1
1 1096 . 20 1 1 A 91 91 ALA HA H 91 3.940 3.880 0.060 1
1 1100 . 20 1 1 A 91 91 ALA C C 91 180.200 179.920 0.280 1
1 1101 . 20 1 1 A 91 91 ALA CA C 91 55.100 55.187 -0.087 1
1 1102 . 20 1 1 A 91 91 ALA CB C 91 18.000 18.124 -0.124 1
1 1103 . 20 1 1 A 91 91 ALA N N 91 120.500 121.301 -0.801 1
1 1104 . 20 1 1 A 92 92 LEU H H 92 8.190 8.236 -0.046 1
1 1105 . 20 1 1 A 92 92 LEU HA H 92 4.300 4.010 0.290 1
1 1115 . 20 1 1 A 92 92 LEU C C 92 178.900 178.247 0.653 1
1 1116 . 20 1 1 A 92 92 LEU CA C 92 57.500 57.816 -0.316 1
1 1117 . 20 1 1 A 92 92 LEU CB C 92 42.100 41.630 0.470 1
1 1121 . 20 1 1 A 92 92 LEU N N 92 120.200 119.545 0.655 1
1 1122 . 20 1 1 A 93 93 VAL H H 93 8.890 8.309 0.581 1
1 1123 . 20 1 1 A 93 93 VAL HA H 93 3.810 3.748 0.062 1
1 1131 . 20 1 1 A 93 93 VAL C C 93 176.900 177.436 -0.536 1
1 1132 . 20 1 1 A 93 93 VAL CA C 93 66.000 64.888 1.112 1
1 1133 . 20 1 1 A 93 93 VAL CB C 93 31.200 31.318 -0.118 1
1 1136 . 20 1 1 A 93 93 VAL N N 93 117.100 118.525 -1.425 1
1 1137 . 20 1 1 A 94 94 GLN H H 94 6.920 7.595 -0.675 1
1 1138 . 20 1 1 A 94 94 GLN HA H 94 3.790 3.760 0.030 1
1 1145 . 20 1 1 A 94 94 GLN C C 94 177.400 178.247 -0.847 1
1 1146 . 20 1 1 A 94 94 GLN CA C 94 60.000 58.736 1.264 1
1 1147 . 20 1 1 A 94 94 GLN CB C 94 30.300 28.048 2.252 1
1 1149 . 20 1 1 A 94 94 GLN N N 94 117.800 120.771 -2.971 1
1 1151 . 20 1 1 A 95 95 VAL H H 95 7.420 7.905 -0.485 1
1 1152 . 20 1 1 A 95 95 VAL HA H 95 3.760 3.602 0.158 1
1 1160 . 20 1 1 A 95 95 VAL C C 95 178.300 178.080 0.220 1
1 1161 . 20 1 1 A 95 95 VAL CA C 95 66.600 66.395 0.205 1
1 1162 . 20 1 1 A 95 95 VAL CB C 95 31.900 31.418 0.482 1
1 1165 . 20 1 1 A 95 95 VAL N N 95 121.500 119.999 1.501 1
1 1166 . 20 1 1 A 96 96 VAL H H 96 8.340 7.982 0.358 1
1 1167 . 20 1 1 A 96 96 VAL HA H 96 3.810 3.370 0.440 1
1 1175 . 20 1 1 A 96 96 VAL C C 96 178.400 177.853 0.547 1
1 1176 . 20 1 1 A 96 96 VAL CA C 96 66.100 66.589 -0.489 1
1 1177 . 20 1 1 A 96 96 VAL CB C 96 32.200 31.566 0.634 1
1 1180 . 20 1 1 A 96 96 VAL N N 96 120.000 119.863 0.137 1
1 1181 . 20 1 1 A 97 97 ALA H H 97 8.140 7.907 0.233 1
1 1182 . 20 1 1 A 97 97 ALA HA H 97 4.010 4.012 -0.002 1
1 1186 . 20 1 1 A 97 97 ALA C C 97 178.800 179.063 -0.263 1
1 1187 . 20 1 1 A 97 97 ALA CA C 97 54.900 55.336 -0.436 1
1 1188 . 20 1 1 A 97 97 ALA CB C 97 19.900 18.257 1.643 1
1 1189 . 20 1 1 A 97 97 ALA N N 97 121.400 121.679 -0.279 1
1 1190 . 20 1 1 A 98 98 ASP H H 98 8.170 8.622 -0.452 1
1 1191 . 20 1 1 A 98 98 ASP HA H 98 4.320 4.261 0.059 1
1 1194 . 20 1 1 A 98 98 ASP C C 98 178.100 178.704 -0.604 1
1 1195 . 20 1 1 A 98 98 ASP CA C 98 57.100 57.306 -0.206 1
1 1196 . 20 1 1 A 98 98 ASP CB C 98 41.800 41.452 0.348 1
1 1197 . 20 1 1 A 98 98 ASP N N 98 118.500 118.199 0.301 1
1 1198 . 20 1 1 A 99 99 GLU H H 99 8.220 8.263 -0.043 1
1 1199 . 20 1 1 A 99 99 GLU HA H 99 4.000 4.118 -0.118 1
1 1204 . 20 1 1 A 99 99 GLU C C 99 178.300 178.289 0.011 1
1 1205 . 20 1 1 A 99 99 GLU CA C 99 58.300 58.293 0.007 1
1 1206 . 20 1 1 A 99 99 GLU CB C 99 29.800 29.418 0.382 1
1 1208 . 20 1 1 A 99 99 GLU N N 99 116.600 117.099 -0.499 1
1 1209 . 20 1 1 A 100 100 HIS H H 100 7.980 7.774 0.206 1
1 1210 . 20 1 1 A 100 100 HIS HA H 100 4.600 4.480 0.120 1
1 1214 . 20 1 1 A 100 100 HIS C C 100 175.900 177.717 -1.817 1
1 1215 . 20 1 1 A 100 100 HIS CA C 100 57.500 59.483 -1.983 1
1 1216 . 20 1 1 A 100 100 HIS CB C 100 30.800 30.593 0.207 1
1 1218 . 20 1 1 A 100 100 HIS N N 100 114.000 117.439 -3.439 1
1 1219 . 20 1 1 A 101 101 LEU H H 101 7.920 8.223 -0.303 1
1 1220 . 20 1 1 A 101 101 LEU HA H 101 4.370 3.682 0.688 1
1 1230 . 20 1 1 A 101 101 LEU C C 101 177.700 178.456 -0.756 1
1 1231 . 20 1 1 A 101 101 LEU CA C 101 55.900 57.989 -2.089 1
1 1232 . 20 1 1 A 101 101 LEU CB C 101 42.100 41.168 0.932 1
1 1236 . 20 1 1 A 101 101 LEU N N 101 118.500 119.261 -0.761 1
1 1237 . 20 1 1 A 102 102 GLU H H 102 8.100 7.887 0.213 1
1 1238 . 20 1 1 A 102 102 GLU HA H 102 4.160 4.096 0.064 1
1 1243 . 20 1 1 A 102 102 GLU C C 102 176.700 177.265 -0.565 1
1 1244 . 20 1 1 A 102 102 GLU CA C 102 57.000 56.839 0.161 1
1 1245 . 20 1 1 A 102 102 GLU CB C 102 29.900 28.863 1.037 1
1 1247 . 20 1 1 A 102 102 GLU N N 102 119.100 117.818 1.282 1
1 1248 . 20 1 1 A 103 103 HIS H H 103 8.010 7.528 0.482 1
1 1249 . 20 1 1 A 103 103 HIS HA H 103 4.520 4.244 0.276 1
1 1252 . 20 1 1 A 103 103 HIS CA C 103 56.100 57.326 -1.226 1
1 1253 . 20 1 1 A 103 103 HIS CB C 103 29.700 30.123 -0.423 1
1 1254 . 20 1 1 A 103 103 HIS N N 103 117.300 119.112 -1.812 1
1 1255 . 20 1 1 A 107 107 HIS HA H 107 4.560 5.124 -0.564 1
1 1258 . 20 1 1 A 107 107 HIS C C 107 173.900 174.478 -0.578 1
1 1259 . 20 1 1 A 107 107 HIS CA C 107 55.900 54.003 1.897 1
1 1260 . 20 1 1 A 107 107 HIS CB C 107 30.200 32.266 -2.066 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 102 1.044 1
2 1 1 1 "RMS(OBS, PRED)" CA 103 0.950 1
3 1 1 1 "RMS(OBS, PRED)" CB 94 0.986 1
4 1 1 1 "RMS(OBS, PRED)" H 102 0.443 1
5 1 1 1 "RMS(OBS, PRED)" HA 112 0.225 1
6 1 1 1 "RMS(OBS, PRED)" N 102 2.848 1
7 1 2 1 "RMS(OBS, PRED)" C 102 0.943 1
8 1 2 1 "RMS(OBS, PRED)" CA 103 0.913 1
9 1 2 1 "RMS(OBS, PRED)" CB 94 1.054 1
10 1 2 1 "RMS(OBS, PRED)" H 102 0.429 1
11 1 2 1 "RMS(OBS, PRED)" HA 112 0.257 1
12 1 2 1 "RMS(OBS, PRED)" N 102 2.531 1
13 1 3 1 "RMS(OBS, PRED)" C 102 0.943 1
14 1 3 1 "RMS(OBS, PRED)" CA 103 0.897 1
15 1 3 1 "RMS(OBS, PRED)" CB 94 1.014 1
16 1 3 1 "RMS(OBS, PRED)" H 102 0.391 1
17 1 3 1 "RMS(OBS, PRED)" HA 112 0.262 1
18 1 3 1 "RMS(OBS, PRED)" N 102 2.401 1
19 1 4 1 "RMS(OBS, PRED)" C 102 0.961 1
20 1 4 1 "RMS(OBS, PRED)" CA 103 0.946 1
21 1 4 1 "RMS(OBS, PRED)" CB 94 1.113 1
22 1 4 1 "RMS(OBS, PRED)" H 102 0.436 1
23 1 4 1 "RMS(OBS, PRED)" HA 112 0.247 1
24 1 4 1 "RMS(OBS, PRED)" N 102 2.707 1
25 1 5 1 "RMS(OBS, PRED)" C 102 0.938 1
26 1 5 1 "RMS(OBS, PRED)" CA 103 1.051 1
27 1 5 1 "RMS(OBS, PRED)" CB 94 1.021 1
28 1 5 1 "RMS(OBS, PRED)" H 102 0.411 1
29 1 5 1 "RMS(OBS, PRED)" HA 112 0.247 1
30 1 5 1 "RMS(OBS, PRED)" N 102 2.540 1
31 1 6 1 "RMS(OBS, PRED)" C 102 0.980 1
32 1 6 1 "RMS(OBS, PRED)" CA 103 0.919 1
33 1 6 1 "RMS(OBS, PRED)" CB 94 1.012 1
34 1 6 1 "RMS(OBS, PRED)" H 102 0.478 1
35 1 6 1 "RMS(OBS, PRED)" HA 112 0.241 1
36 1 6 1 "RMS(OBS, PRED)" N 102 2.602 1
37 1 7 1 "RMS(OBS, PRED)" C 102 0.987 1
38 1 7 1 "RMS(OBS, PRED)" CA 103 1.052 1
39 1 7 1 "RMS(OBS, PRED)" CB 94 0.982 1
40 1 7 1 "RMS(OBS, PRED)" H 102 0.421 1
41 1 7 1 "RMS(OBS, PRED)" HA 112 0.248 1
42 1 7 1 "RMS(OBS, PRED)" N 102 2.438 1
43 1 8 1 "RMS(OBS, PRED)" C 102 0.967 1
44 1 8 1 "RMS(OBS, PRED)" CA 103 0.932 1
45 1 8 1 "RMS(OBS, PRED)" CB 94 0.923 1
46 1 8 1 "RMS(OBS, PRED)" H 102 0.399 1
47 1 8 1 "RMS(OBS, PRED)" HA 112 0.244 1
48 1 8 1 "RMS(OBS, PRED)" N 102 2.859 1
49 1 9 1 "RMS(OBS, PRED)" C 102 1.003 1
50 1 9 1 "RMS(OBS, PRED)" CA 103 0.956 1
51 1 9 1 "RMS(OBS, PRED)" CB 94 1.133 1
52 1 9 1 "RMS(OBS, PRED)" H 102 0.457 1
53 1 9 1 "RMS(OBS, PRED)" HA 112 0.251 1
54 1 9 1 "RMS(OBS, PRED)" N 102 2.403 1
55 1 10 1 "RMS(OBS, PRED)" C 102 1.018 1
56 1 10 1 "RMS(OBS, PRED)" CA 103 0.977 1
57 1 10 1 "RMS(OBS, PRED)" CB 94 1.038 1
58 1 10 1 "RMS(OBS, PRED)" H 102 0.403 1
59 1 10 1 "RMS(OBS, PRED)" HA 112 0.235 1
60 1 10 1 "RMS(OBS, PRED)" N 102 2.577 1
61 1 11 1 "RMS(OBS, PRED)" C 102 0.951 1
62 1 11 1 "RMS(OBS, PRED)" CA 103 0.967 1
63 1 11 1 "RMS(OBS, PRED)" CB 94 1.033 1
64 1 11 1 "RMS(OBS, PRED)" H 102 0.440 1
65 1 11 1 "RMS(OBS, PRED)" HA 112 0.231 1
66 1 11 1 "RMS(OBS, PRED)" N 102 2.665 1
67 1 12 1 "RMS(OBS, PRED)" C 102 1.037 1
68 1 12 1 "RMS(OBS, PRED)" CA 103 0.902 1
69 1 12 1 "RMS(OBS, PRED)" CB 94 0.998 1
70 1 12 1 "RMS(OBS, PRED)" H 102 0.474 1
71 1 12 1 "RMS(OBS, PRED)" HA 112 0.243 1
72 1 12 1 "RMS(OBS, PRED)" N 102 2.587 1
73 1 13 1 "RMS(OBS, PRED)" C 102 1.009 1
74 1 13 1 "RMS(OBS, PRED)" CA 103 0.948 1
75 1 13 1 "RMS(OBS, PRED)" CB 94 1.146 1
76 1 13 1 "RMS(OBS, PRED)" H 102 0.410 1
77 1 13 1 "RMS(OBS, PRED)" HA 112 0.251 1
78 1 13 1 "RMS(OBS, PRED)" N 102 2.615 1
79 1 14 1 "RMS(OBS, PRED)" C 102 1.055 1
80 1 14 1 "RMS(OBS, PRED)" CA 103 1.025 1
81 1 14 1 "RMS(OBS, PRED)" CB 94 1.010 1
82 1 14 1 "RMS(OBS, PRED)" H 102 0.461 1
83 1 14 1 "RMS(OBS, PRED)" HA 112 0.260 1
84 1 14 1 "RMS(OBS, PRED)" N 102 2.483 1
85 1 15 1 "RMS(OBS, PRED)" C 102 1.064 1
86 1 15 1 "RMS(OBS, PRED)" CA 103 0.983 1
87 1 15 1 "RMS(OBS, PRED)" CB 94 1.104 1
88 1 15 1 "RMS(OBS, PRED)" H 102 0.432 1
89 1 15 1 "RMS(OBS, PRED)" HA 112 0.244 1
90 1 15 1 "RMS(OBS, PRED)" N 102 2.420 1
91 1 16 1 "RMS(OBS, PRED)" C 102 1.015 1
92 1 16 1 "RMS(OBS, PRED)" CA 103 0.955 1
93 1 16 1 "RMS(OBS, PRED)" CB 94 1.043 1
94 1 16 1 "RMS(OBS, PRED)" H 102 0.431 1
95 1 16 1 "RMS(OBS, PRED)" HA 112 0.253 1
96 1 16 1 "RMS(OBS, PRED)" N 102 2.509 1
97 1 17 1 "RMS(OBS, PRED)" C 102 0.963 1
98 1 17 1 "RMS(OBS, PRED)" CA 103 1.014 1
99 1 17 1 "RMS(OBS, PRED)" CB 94 0.952 1
100 1 17 1 "RMS(OBS, PRED)" H 102 0.459 1
101 1 17 1 "RMS(OBS, PRED)" HA 112 0.245 1
102 1 17 1 "RMS(OBS, PRED)" N 102 2.692 1
103 1 18 1 "RMS(OBS, PRED)" C 102 1.018 1
104 1 18 1 "RMS(OBS, PRED)" CA 103 0.914 1
105 1 18 1 "RMS(OBS, PRED)" CB 94 0.975 1
106 1 18 1 "RMS(OBS, PRED)" H 102 0.481 1
107 1 18 1 "RMS(OBS, PRED)" HA 112 0.222 1
108 1 18 1 "RMS(OBS, PRED)" N 102 2.517 1
109 1 19 1 "RMS(OBS, PRED)" C 102 0.996 1
110 1 19 1 "RMS(OBS, PRED)" CA 103 1.013 1
111 1 19 1 "RMS(OBS, PRED)" CB 94 0.925 1
112 1 19 1 "RMS(OBS, PRED)" H 102 0.461 1
113 1 19 1 "RMS(OBS, PRED)" HA 112 0.233 1
114 1 19 1 "RMS(OBS, PRED)" N 102 2.649 1
115 1 20 1 "RMS(OBS, PRED)" C 102 0.983 1
116 1 20 1 "RMS(OBS, PRED)" CA 103 0.926 1
117 1 20 1 "RMS(OBS, PRED)" CB 94 1.012 1
118 1 20 1 "RMS(OBS, PRED)" H 102 0.461 1
119 1 20 1 "RMS(OBS, PRED)" HA 112 0.251 1
120 1 20 1 "RMS(OBS, PRED)" N 102 2.434 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 4 . 1 1 A 2 2 ALA H H 2 8.450 8.373 0.077 2
1 5 . 1 1 A 2 2 ALA HA H 2 4.390 4.454 -0.064 2
1 9 . 1 1 A 2 2 ALA C C 2 178.300 177.315 0.985 2
1 10 . 1 1 A 2 2 ALA CA C 2 52.500 52.514 -0.014 2
1 11 . 1 1 A 2 2 ALA CB C 2 19.200 19.948 -0.748 2
1 12 . 1 1 A 2 2 ALA N N 2 125.100 123.419 1.681 2
1 13 . 1 1 A 3 3 GLY H H 3 8.450 8.387 0.063 2
1 14 . 1 1 A 3 3 GLY HA2 H 3 4.030 4.037 -0.007 2
1 15 . 1 1 A 3 3 GLY HA3 H 3 4.030 4.037 -0.007 2
1 16 . 1 1 A 3 3 GLY C C 3 174.100 173.708 0.392 2
1 17 . 1 1 A 3 3 GLY CA C 3 45.200 45.811 -0.611 2
1 18 . 1 1 A 3 3 GLY N N 3 108.000 108.127 -0.127 2
1 19 . 1 1 A 4 4 GLN H H 4 8.550 8.352 0.198 2
1 20 . 1 1 A 4 4 GLN HA H 4 4.340 4.342 -0.002 2
1 27 . 1 1 A 4 4 GLN C C 4 176.700 175.518 1.182 2
1 28 . 1 1 A 4 4 GLN CA C 4 56.600 56.299 0.301 2
1 29 . 1 1 A 4 4 GLN CB C 4 29.300 28.847 0.453 2
1 31 . 1 1 A 4 4 GLN N N 4 120.500 119.550 0.950 2
1 33 . 1 1 A 5 5 SER H H 5 8.540 8.419 0.121 2
1 34 . 1 1 A 5 5 SER HA H 5 4.390 4.495 -0.105 2
1 38 . 1 1 A 5 5 SER C C 5 174.800 174.270 0.530 2
1 39 . 1 1 A 5 5 SER CA C 5 59.100 58.849 0.252 2
1 40 . 1 1 A 5 5 SER CB C 5 63.500 63.191 0.309 2
1 41 . 1 1 A 5 5 SER N N 5 117.100 117.045 0.055 2
1 42 . 1 1 A 6 6 ASP H H 6 8.300 8.417 -0.117 2
1 43 . 1 1 A 6 6 ASP HA H 6 4.540 4.650 -0.110 2
1 46 . 1 1 A 6 6 ASP C C 6 177.300 176.968 0.332 2
1 47 . 1 1 A 6 6 ASP CA C 6 55.100 54.793 0.307 2
1 48 . 1 1 A 6 6 ASP CB C 6 40.800 40.368 0.432 2
1 49 . 1 1 A 6 6 ASP N N 6 122.700 122.666 0.034 2
1 50 . 1 1 A 7 7 ARG H H 7 8.270 8.178 0.092 2
1 51 . 1 1 A 7 7 ARG HA H 7 4.150 4.067 0.083 2
1 58 . 1 1 A 7 7 ARG C C 7 177.600 178.657 -1.057 2
1 59 . 1 1 A 7 7 ARG CA C 7 58.000 59.007 -1.006 2
1 60 . 1 1 A 7 7 ARG CB C 7 30.100 29.807 0.293 2
1 63 . 1 1 A 7 7 ARG N N 7 122.100 121.397 0.703 2
1 64 . 1 1 A 8 8 LYS H H 8 8.130 8.034 0.096 2
1 65 . 1 1 A 8 8 LYS HA H 8 4.090 4.092 -0.002 2
1 74 . 1 1 A 8 8 LYS C C 8 177.600 178.798 -1.198 2
1 75 . 1 1 A 8 8 LYS CA C 8 58.400 58.878 -0.478 2
1 76 . 1 1 A 8 8 LYS CB C 8 31.700 31.966 -0.266 2
1 80 . 1 1 A 8 8 LYS N N 8 120.900 119.311 1.589 2
1 81 . 1 1 A 9 9 ALA H H 9 8.050 8.050 -0.000 2
1 82 . 1 1 A 9 9 ALA HA H 9 3.950 4.085 -0.135 2
1 86 . 1 1 A 9 9 ALA C C 9 179.800 180.138 -0.338 2
1 87 . 1 1 A 9 9 ALA CA C 9 55.100 54.863 0.237 2
1 88 . 1 1 A 9 9 ALA CB C 9 18.100 18.117 -0.017 2
1 89 . 1 1 A 9 9 ALA N N 9 121.600 121.726 -0.126 2
1 90 . 1 1 A 10 10 ALA H H 10 7.910 7.752 0.158 2
1 91 . 1 1 A 10 10 ALA HA H 10 4.200 4.118 0.082 2
1 95 . 1 1 A 10 10 ALA C C 10 180.500 180.062 0.438 2
1 96 . 1 1 A 10 10 ALA CA C 10 54.600 54.897 -0.297 2
1 97 . 1 1 A 10 10 ALA CB C 10 18.100 18.397 -0.297 2
1 98 . 1 1 A 10 10 ALA N N 10 120.200 120.517 -0.317 2
1 99 . 1 1 A 11 11 LEU H H 11 8.080 7.937 0.143 2
1 100 . 1 1 A 11 11 LEU HA H 11 4.120 4.065 0.055 2
1 110 . 1 1 A 11 11 LEU C C 11 179.600 179.333 0.267 2
1 111 . 1 1 A 11 11 LEU CA C 11 57.800 57.636 0.164 2
1 112 . 1 1 A 11 11 LEU CB C 11 41.700 41.616 0.084 2
1 115 . 1 1 A 11 11 LEU N N 11 120.900 119.909 0.991 2
1 116 . 1 1 A 12 12 LEU H H 12 8.480 8.297 0.183 2
1 117 . 1 1 A 12 12 LEU HA H 12 4.040 4.003 0.037 2
1 127 . 1 1 A 12 12 LEU C C 12 178.900 179.071 -0.171 2
1 128 . 1 1 A 12 12 LEU CA C 12 58.100 57.795 0.305 2
1 129 . 1 1 A 12 12 LEU CB C 12 40.100 40.777 -0.677 2
1 133 . 1 1 A 12 12 LEU N N 12 118.700 118.701 -0.002 2
1 134 . 1 1 A 13 13 ASP H H 13 7.990 8.320 -0.330 2
1 135 . 1 1 A 13 13 ASP HA H 13 4.420 4.290 0.130 2
1 138 . 1 1 A 13 13 ASP C C 13 178.900 178.615 0.285 2
1 139 . 1 1 A 13 13 ASP CA C 13 57.500 57.775 -0.275 2
1 140 . 1 1 A 13 13 ASP CB C 13 40.500 41.178 -0.678 2
1 141 . 1 1 A 13 13 ASP N N 13 119.500 120.010 -0.510 2
1 142 . 1 1 A 14 14 GLN H H 14 7.620 7.644 -0.024 2
1 143 . 1 1 A 14 14 GLN HA H 14 4.230 4.104 0.126 2
1 150 . 1 1 A 14 14 GLN C C 14 178.400 178.485 -0.085 2
1 151 . 1 1 A 14 14 GLN CA C 14 58.100 58.597 -0.497 2
1 152 . 1 1 A 14 14 GLN CB C 14 27.800 28.378 -0.578 2
1 154 . 1 1 A 14 14 GLN N N 14 118.900 119.201 -0.301 2
1 156 . 1 1 A 15 15 VAL H H 15 8.480 8.103 0.377 2
1 157 . 1 1 A 15 15 VAL HA H 15 3.380 3.751 -0.371 2
1 165 . 1 1 A 15 15 VAL C C 15 177.600 178.290 -0.690 2
1 166 . 1 1 A 15 15 VAL CA C 15 66.600 65.523 1.077 2
1 167 . 1 1 A 15 15 VAL CB C 15 30.500 31.554 -1.054 2
1 170 . 1 1 A 15 15 VAL N N 15 121.300 119.470 1.830 2
1 171 . 1 1 A 16 16 ALA H H 16 8.080 8.307 -0.227 2
1 172 . 1 1 A 16 16 ALA HA H 16 4.450 3.964 0.486 2
1 176 . 1 1 A 16 16 ALA C C 16 179.100 179.556 -0.456 2
1 177 . 1 1 A 16 16 ALA CA C 16 54.600 55.258 -0.658 2
1 178 . 1 1 A 16 16 ALA CB C 16 17.700 18.156 -0.456 2
1 179 . 1 1 A 16 16 ALA N N 16 121.400 122.547 -1.147 2
1 180 . 1 1 A 17 17 ARG H H 17 7.480 7.834 -0.354 2
1 181 . 1 1 A 17 17 ARG HA H 17 3.910 4.102 -0.192 2
1 187 . 1 1 A 17 17 ARG C C 17 179.700 178.887 0.812 2
1 188 . 1 1 A 17 17 ARG CA C 17 59.700 59.155 0.545 2
1 189 . 1 1 A 17 17 ARG CB C 17 30.400 29.851 0.549 2
1 191 . 1 1 A 17 17 ARG N N 17 116.900 118.942 -2.043 2
1 192 . 1 1 A 18 18 VAL H H 18 7.960 7.851 0.108 2
1 193 . 1 1 A 18 18 VAL HA H 18 3.690 3.720 -0.030 2
1 201 . 1 1 A 18 18 VAL C C 18 177.900 178.236 -0.336 2
1 202 . 1 1 A 18 18 VAL CA C 18 66.600 65.981 0.619 2
1 203 . 1 1 A 18 18 VAL CB C 18 31.300 31.596 -0.296 2
1 206 . 1 1 A 18 18 VAL N N 18 123.000 119.435 3.565 2
1 207 . 1 1 A 19 19 GLY H H 19 8.270 8.389 -0.119 2
1 208 . 1 1 A 19 19 GLY HA2 H 19 3.430 3.764 -0.334 2
1 209 . 1 1 A 19 19 GLY HA3 H 19 3.430 3.771 -0.341 2
1 210 . 1 1 A 19 19 GLY C C 19 174.400 175.655 -1.255 2
1 211 . 1 1 A 19 19 GLY CA C 19 48.500 47.226 1.274 2
1 212 . 1 1 A 19 19 GLY N N 19 105.400 107.663 -2.263 2
1 213 . 1 1 A 20 20 LYS H H 20 8.250 8.347 -0.097 2
1 214 . 1 1 A 20 20 LYS HA H 20 3.710 4.061 -0.352 2
1 223 . 1 1 A 20 20 LYS C C 20 179.400 178.803 0.597 2
1 224 . 1 1 A 20 20 LYS CA C 20 59.300 59.068 0.232 2
1 225 . 1 1 A 20 20 LYS CB C 20 32.600 32.216 0.384 2
1 229 . 1 1 A 20 20 LYS N N 20 118.700 121.832 -3.132 2
1 230 . 1 1 A 21 21 ALA H H 21 7.640 7.668 -0.028 2
1 231 . 1 1 A 21 21 ALA HA H 21 3.790 4.117 -0.327 2
1 235 . 1 1 A 21 21 ALA C C 21 177.900 179.489 -1.589 2
1 236 . 1 1 A 21 21 ALA CA C 21 55.200 54.431 0.769 2
1 237 . 1 1 A 21 21 ALA CB C 21 19.200 18.431 0.769 2
1 238 . 1 1 A 21 21 ALA N N 21 121.700 121.595 0.105 2
1 239 . 1 1 A 22 22 LEU H H 22 7.330 7.922 -0.592 2
1 240 . 1 1 A 22 22 LEU HA H 22 4.140 4.249 -0.109 2
1 250 . 1 1 A 22 22 LEU C C 22 176.800 177.871 -1.071 2
1 251 . 1 1 A 22 22 LEU CA C 22 54.600 56.368 -1.768 2
1 252 . 1 1 A 22 22 LEU CB C 22 42.900 41.831 1.069 2
1 256 . 1 1 A 22 22 LEU N N 22 114.200 119.152 -4.952 2
1 257 . 1 1 A 23 23 ALA H H 23 7.160 7.752 -0.592 2
1 258 . 1 1 A 23 23 ALA HA H 23 4.720 4.328 0.392 2
1 262 . 1 1 A 23 23 ALA C C 23 176.700 177.182 -0.482 2
1 263 . 1 1 A 23 23 ALA CA C 23 53.000 52.358 0.642 2
1 264 . 1 1 A 23 23 ALA CB C 23 18.200 18.432 -0.232 2
1 265 . 1 1 A 23 23 ALA N N 23 118.200 121.091 -2.891 2
1 266 . 1 1 A 24 24 ASN H H 24 7.440 8.073 -0.633 2
1 267 . 1 1 A 24 24 ASN HA H 24 4.730 4.868 -0.138 2
1 272 . 1 1 A 24 24 ASN C C 24 174.800 175.324 -0.524 2
1 273 . 1 1 A 24 24 ASN CA C 24 53.500 53.520 -0.020 2
1 274 . 1 1 A 24 24 ASN CB C 24 41.700 39.711 1.989 2
1 275 . 1 1 A 24 24 ASN N N 24 116.800 117.925 -1.125 2
1 277 . 1 1 A 25 25 GLY H H 25 9.370 8.334 1.036 2
1 278 . 1 1 A 25 25 GLY HA2 H 25 3.650 3.978 -0.328 2
1 279 . 1 1 A 25 25 GLY HA3 H 25 4.110 3.991 0.119 2
1 280 . 1 1 A 25 25 GLY C C 25 175.300 175.301 -0.001 2
1 281 . 1 1 A 25 25 GLY CA C 25 47.600 46.017 1.583 2
1 282 . 1 1 A 25 25 GLY N N 25 114.800 109.589 5.211 2
1 283 . 1 1 A 26 26 ARG H H 26 8.050 8.346 -0.296 2
1 284 . 1 1 A 26 26 ARG HA H 26 4.150 4.093 0.057 2
1 289 . 1 1 A 26 26 ARG C C 26 179.300 178.233 1.067 2
1 290 . 1 1 A 26 26 ARG CA C 26 57.000 58.701 -1.701 2
1 291 . 1 1 A 26 26 ARG CB C 26 29.900 29.853 0.047 2
1 294 . 1 1 A 26 26 ARG N N 26 120.500 122.276 -1.776 2
1 295 . 1 1 A 27 27 ARG H H 27 7.930 7.935 -0.005 2
1 296 . 1 1 A 27 27 ARG HA H 27 3.710 4.126 -0.416 2
1 301 . 1 1 A 27 27 ARG C C 27 178.300 178.029 0.271 2
1 302 . 1 1 A 27 27 ARG CA C 27 61.000 58.229 2.771 2
1 303 . 1 1 A 27 27 ARG CB C 27 30.400 29.983 0.417 2
1 305 . 1 1 A 27 27 ARG N N 27 117.900 118.914 -1.014 2
1 306 . 1 1 A 28 28 LEU H H 28 7.640 7.894 -0.254 2
1 307 . 1 1 A 28 28 LEU HA H 28 3.950 4.045 -0.095 2
1 317 . 1 1 A 28 28 LEU C C 28 178.200 179.117 -0.917 2
1 318 . 1 1 A 28 28 LEU CA C 28 57.600 56.808 0.792 2
1 319 . 1 1 A 28 28 LEU CB C 28 41.900 41.378 0.522 2
1 323 . 1 1 A 28 28 LEU N N 28 117.600 118.984 -1.384 2
1 324 . 1 1 A 29 29 GLN H H 29 8.110 7.976 0.134 2
1 325 . 1 1 A 29 29 GLN HA H 29 3.880 4.108 -0.228 2
1 332 . 1 1 A 29 29 GLN C C 29 179.400 178.670 0.730 2
1 333 . 1 1 A 29 29 GLN CA C 29 59.100 58.698 0.402 2
1 334 . 1 1 A 29 29 GLN CB C 29 28.800 28.266 0.534 2
1 336 . 1 1 A 29 29 GLN N N 29 119.300 118.781 0.519 2
1 338 . 1 1 A 30 30 ILE H H 30 7.530 7.686 -0.156 2
1 339 . 1 1 A 30 30 ILE HA H 30 3.340 3.619 -0.279 2
1 349 . 1 1 A 30 30 ILE C C 30 176.700 178.385 -1.685 2
1 350 . 1 1 A 30 30 ILE CA C 30 65.900 65.273 0.627 2
1 351 . 1 1 A 30 30 ILE CB C 30 37.400 37.862 -0.462 2
1 355 . 1 1 A 30 30 ILE N N 30 118.600 120.741 -2.141 2
1 356 . 1 1 A 31 31 LEU H H 31 7.500 7.823 -0.323 2
1 357 . 1 1 A 31 31 LEU HA H 31 3.520 3.735 -0.215 2
1 367 . 1 1 A 31 31 LEU C C 31 177.300 178.554 -1.254 2
1 368 . 1 1 A 31 31 LEU CA C 31 58.100 57.870 0.230 2
1 369 . 1 1 A 31 31 LEU CB C 31 41.100 40.430 0.670 2
1 373 . 1 1 A 31 31 LEU N N 31 119.900 119.325 0.575 2
1 374 . 1 1 A 32 32 ASP H H 32 7.950 8.257 -0.307 2
1 375 . 1 1 A 32 32 ASP HA H 32 4.300 4.422 -0.122 2
1 378 . 1 1 A 32 32 ASP C C 32 178.300 178.400 -0.100 2
1 379 . 1 1 A 32 32 ASP CA C 32 57.400 57.601 -0.201 2
1 380 . 1 1 A 32 32 ASP CB C 32 42.400 41.954 0.446 2
1 381 . 1 1 A 32 32 ASP N N 32 116.900 119.624 -2.724 2
1 382 . 1 1 A 33 33 LEU H H 33 7.350 7.574 -0.224 2
1 383 . 1 1 A 33 33 LEU HA H 33 4.130 4.114 0.016 2
1 393 . 1 1 A 33 33 LEU C C 33 180.000 178.871 1.129 2
1 394 . 1 1 A 33 33 LEU CA C 33 57.600 57.617 -0.017 2
1 395 . 1 1 A 33 33 LEU CB C 33 42.300 41.796 0.504 2
1 399 . 1 1 A 33 33 LEU N N 33 118.600 120.222 -1.622 2
1 400 . 1 1 A 34 34 LEU H H 34 8.300 8.255 0.045 2
1 401 . 1 1 A 34 34 LEU HA H 34 4.490 4.363 0.127 2
1 411 . 1 1 A 34 34 LEU C C 34 178.900 179.154 -0.254 2
1 412 . 1 1 A 34 34 LEU CA C 34 55.800 56.800 -1.000 2
1 413 . 1 1 A 34 34 LEU CB C 34 41.300 41.340 -0.040 2
1 417 . 1 1 A 34 34 LEU N N 34 117.800 118.510 -0.710 2
1 418 . 1 1 A 35 35 ALA H H 35 8.160 7.762 0.398 2
1 419 . 1 1 A 35 35 ALA HA H 35 4.050 4.139 -0.089 2
1 423 . 1 1 A 35 35 ALA C C 35 179.000 178.603 0.397 2
1 424 . 1 1 A 35 35 ALA CA C 35 54.900 54.439 0.461 2
1 425 . 1 1 A 35 35 ALA CB C 35 17.500 18.331 -0.831 2
1 426 . 1 1 A 35 35 ALA N N 35 123.900 121.825 2.075 2
1 427 . 1 1 A 36 36 GLN H H 36 7.600 7.745 -0.145 2
1 428 . 1 1 A 36 36 GLN HA H 36 4.340 4.292 0.048 2
1 435 . 1 1 A 36 36 GLN C C 36 176.100 175.656 0.444 2
1 436 . 1 1 A 36 36 GLN CA C 36 55.800 56.025 -0.225 2
1 437 . 1 1 A 36 36 GLN CB C 36 29.000 29.109 -0.109 2
1 439 . 1 1 A 36 36 GLN N N 36 113.300 114.191 -0.891 2
1 441 . 1 1 A 37 37 GLY H H 37 7.550 7.162 0.388 2
1 442 . 1 1 A 37 37 GLY HA2 H 37 3.730 4.081 -0.351 2
1 443 . 1 1 A 37 37 GLY HA3 H 37 4.490 4.085 0.405 2
1 444 . 1 1 A 37 37 GLY C C 37 171.500 172.543 -1.043 2
1 445 . 1 1 A 37 37 GLY CA C 37 44.500 45.005 -0.505 2
1 446 . 1 1 A 37 37 GLY N N 37 108.400 106.908 1.492 2
1 447 . 1 1 A 38 38 GLU H H 38 8.120 8.514 -0.395 2
1 448 . 1 1 A 38 38 GLU HA H 38 4.820 4.794 0.026 2
1 453 . 1 1 A 38 38 GLU C C 38 177.000 175.877 1.123 2
1 454 . 1 1 A 38 38 GLU CA C 38 56.400 56.176 0.224 2
1 455 . 1 1 A 38 38 GLU CB C 38 31.200 30.533 0.667 2
1 457 . 1 1 A 38 38 GLU N N 38 119.600 119.583 0.017 2
1 458 . 1 1 A 39 39 ARG H H 39 8.580 8.792 -0.212 2
1 459 . 1 1 A 39 39 ARG HA H 39 4.970 5.062 -0.092 2
1 467 . 1 1 A 39 39 ARG C C 39 174.800 175.463 -0.663 2
1 468 . 1 1 A 39 39 ARG CA C 39 53.900 54.317 -0.417 2
1 469 . 1 1 A 39 39 ARG CB C 39 36.400 33.922 2.478 2
1 472 . 1 1 A 39 39 ARG N N 39 121.500 123.747 -2.247 2
1 474 . 1 1 A 40 40 ALA H H 40 8.910 8.803 0.107 2
1 475 . 1 1 A 40 40 ALA HA H 40 4.920 4.383 0.537 2
1 479 . 1 1 A 40 40 ALA C C 40 179.200 178.349 0.851 2
1 480 . 1 1 A 40 40 ALA CA C 40 51.100 51.815 -0.715 2
1 481 . 1 1 A 40 40 ALA CB C 40 19.200 19.195 0.005 2
1 482 . 1 1 A 40 40 ALA N N 40 125.100 125.678 -0.578 2
1 483 . 1 1 A 41 41 VAL H H 41 8.420 8.566 -0.146 2
1 484 . 1 1 A 41 41 VAL HA H 41 3.430 3.593 -0.163 2
1 492 . 1 1 A 41 41 VAL C C 41 176.800 177.227 -0.427 2
1 493 . 1 1 A 41 41 VAL CA C 41 67.600 66.807 0.793 2
1 494 . 1 1 A 41 41 VAL CB C 41 31.600 31.750 -0.150 2
1 497 . 1 1 A 41 41 VAL N N 41 120.900 120.860 0.040 2
1 498 . 1 1 A 42 42 GLU H H 42 9.640 8.340 1.300 2
1 499 . 1 1 A 42 42 GLU HA H 42 3.880 3.957 -0.077 2
1 504 . 1 1 A 42 42 GLU C C 42 178.300 178.750 -0.450 2
1 505 . 1 1 A 42 42 GLU CA C 42 60.600 59.465 1.135 2
1 506 . 1 1 A 42 42 GLU CB C 42 28.300 29.452 -1.152 2
1 508 . 1 1 A 42 42 GLU N N 42 119.000 119.639 -0.639 2
1 509 . 1 1 A 43 43 ALA H H 43 6.870 7.709 -0.839 2
1 510 . 1 1 A 43 43 ALA HA H 43 4.290 4.064 0.226 2
1 514 . 1 1 A 43 43 ALA C C 43 180.700 179.774 0.926 2
1 515 . 1 1 A 43 43 ALA CA C 43 54.100 55.057 -0.957 2
1 516 . 1 1 A 43 43 ALA CB C 43 19.100 18.250 0.850 2
1 517 . 1 1 A 43 43 ALA N N 43 120.500 121.900 -1.400 2
1 518 . 1 1 A 44 44 ILE H H 44 7.970 8.061 -0.091 2
1 519 . 1 1 A 44 44 ILE HA H 44 3.470 3.612 -0.142 2
1 529 . 1 1 A 44 44 ILE C C 44 178.300 177.960 0.340 2
1 530 . 1 1 A 44 44 ILE CA C 44 64.700 65.517 -0.817 2
1 531 . 1 1 A 44 44 ILE CB C 44 38.100 37.980 0.120 2
1 535 . 1 1 A 44 44 ILE N N 44 120.500 119.073 1.427 2
1 536 . 1 1 A 45 45 ALA H H 45 8.460 8.350 0.110 2
1 537 . 1 1 A 45 45 ALA HA H 45 3.720 4.038 -0.318 2
1 541 . 1 1 A 45 45 ALA C C 45 178.500 179.757 -1.257 2
1 542 . 1 1 A 45 45 ALA CA C 45 56.200 55.284 0.916 2
1 543 . 1 1 A 45 45 ALA CB C 45 17.400 18.415 -1.015 2
1 544 . 1 1 A 45 45 ALA N N 45 124.500 122.157 2.343 2
1 545 . 1 1 A 46 46 THR H H 46 8.080 8.101 -0.021 2
1 546 . 1 1 A 46 46 THR HA H 46 3.900 3.851 0.049 2
1 551 . 1 1 A 46 46 THR C C 46 177.200 176.567 0.633 2
1 552 . 1 1 A 46 46 THR CA C 46 66.400 66.867 -0.467 2
1 553 . 1 1 A 46 46 THR CB C 46 68.800 68.706 0.095 2
1 555 . 1 1 A 46 46 THR N N 46 112.400 114.089 -1.689 2
1 556 . 1 1 A 47 47 ALA H H 47 7.930 8.186 -0.256 2
1 557 . 1 1 A 47 47 ALA HA H 47 4.200 4.137 0.063 2
1 561 . 1 1 A 47 47 ALA C C 47 179.200 179.442 -0.242 2
1 562 . 1 1 A 47 47 ALA CA C 47 54.800 55.120 -0.320 2
1 563 . 1 1 A 47 47 ALA CB C 47 19.800 18.202 1.598 2
1 564 . 1 1 A 47 47 ALA N N 47 121.400 123.973 -2.573 2
1 565 . 1 1 A 48 48 THR H H 48 7.560 7.600 -0.040 2
1 566 . 1 1 A 48 48 THR HA H 48 4.390 4.433 -0.043 2
1 571 . 1 1 A 48 48 THR C C 48 175.700 175.811 -0.111 2
1 572 . 1 1 A 48 48 THR CA C 48 61.800 62.658 -0.858 2
1 573 . 1 1 A 48 48 THR CB C 48 71.000 70.404 0.596 2
1 575 . 1 1 A 48 48 THR N N 48 103.500 106.865 -3.365 2
1 576 . 1 1 A 49 49 GLY H H 49 7.820 8.353 -0.533 2
1 577 . 1 1 A 49 49 GLY HA2 H 49 3.870 3.932 -0.062 2
1 578 . 1 1 A 49 49 GLY HA3 H 49 4.100 3.933 0.167 2
1 579 . 1 1 A 49 49 GLY C C 49 174.400 174.006 0.394 2
1 580 . 1 1 A 49 49 GLY CA C 49 46.300 46.141 0.159 2
1 581 . 1 1 A 49 49 GLY N N 49 111.100 112.198 -1.098 2
1 582 . 1 1 A 50 50 MET H H 50 7.930 8.004 -0.074 2
1 583 . 1 1 A 50 50 MET HA H 50 4.540 4.897 -0.357 2
1 591 . 1 1 A 50 50 MET C C 50 174.800 174.971 -0.171 2
1 592 . 1 1 A 50 50 MET CA C 50 55.100 54.238 0.862 2
1 593 . 1 1 A 50 50 MET CB C 50 37.200 36.376 0.824 2
1 596 . 1 1 A 50 50 MET N N 50 119.300 118.490 0.810 2
1 597 . 1 1 A 51 51 ASN H H 51 8.040 8.716 -0.676 2
1 598 . 1 1 A 51 51 ASN HA H 51 4.580 4.880 -0.300 2
1 601 . 1 1 A 51 51 ASN C C 51 176.100 176.841 -0.741 2
1 602 . 1 1 A 51 51 ASN CA C 51 52.800 52.770 0.030 2
1 603 . 1 1 A 51 51 ASN CB C 51 41.100 39.596 1.504 2
1 604 . 1 1 A 51 51 ASN N N 51 118.000 119.167 -1.167 2
1 605 . 1 1 A 52 52 LEU H H 52 8.560 8.789 -0.229 2
1 606 . 1 1 A 52 52 LEU HA H 52 3.760 3.927 -0.167 2
1 616 . 1 1 A 52 52 LEU C C 52 179.600 178.780 0.820 2
1 617 . 1 1 A 52 52 LEU CA C 52 59.000 57.835 1.165 2
1 618 . 1 1 A 52 52 LEU CB C 52 41.800 41.430 0.370 2
1 622 . 1 1 A 52 52 LEU N N 52 120.600 124.046 -3.446 2
1 623 . 1 1 A 53 53 THR H H 53 8.230 8.040 0.191 2
1 624 . 1 1 A 53 53 THR HA H 53 3.880 3.987 -0.107 2
1 629 . 1 1 A 53 53 THR C C 53 176.900 176.958 -0.058 2
1 630 . 1 1 A 53 53 THR CA C 53 66.500 66.128 0.372 2
1 631 . 1 1 A 53 53 THR CB C 53 68.400 68.278 0.122 2
1 633 . 1 1 A 53 53 THR N N 53 115.800 113.153 2.647 2
1 634 . 1 1 A 54 54 THR H H 54 8.420 8.112 0.308 2
1 635 . 1 1 A 54 54 THR HA H 54 3.880 3.840 0.040 2
1 640 . 1 1 A 54 54 THR C C 54 177.300 176.249 1.051 2
1 641 . 1 1 A 54 54 THR CA C 54 66.600 66.612 -0.011 2
1 642 . 1 1 A 54 54 THR CB C 54 66.600 68.624 -2.024 2
1 644 . 1 1 A 54 54 THR N N 54 122.300 116.949 5.351 2
1 645 . 1 1 A 55 55 ALA H H 55 8.860 8.534 0.326 2
1 646 . 1 1 A 55 55 ALA HA H 55 4.020 3.933 0.086 2
1 650 . 1 1 A 55 55 ALA C C 55 179.000 179.383 -0.383 2
1 651 . 1 1 A 55 55 ALA CA C 55 56.100 55.327 0.773 2
1 652 . 1 1 A 55 55 ALA CB C 55 17.000 18.104 -1.104 2
1 653 . 1 1 A 55 55 ALA N N 55 125.600 123.566 2.034 2
1 654 . 1 1 A 56 56 SER H H 56 8.440 8.377 0.063 2
1 655 . 1 1 A 56 56 SER HA H 56 3.920 3.988 -0.068 2
1 658 . 1 1 A 56 56 SER C C 56 176.400 176.870 -0.470 2
1 659 . 1 1 A 56 56 SER CA C 56 62.600 61.404 1.196 2
1 660 . 1 1 A 56 56 SER CB C 56 62.700 62.650 0.050 2
1 661 . 1 1 A 56 56 SER N N 56 112.700 112.969 -0.269 2
1 662 . 1 1 A 57 57 ALA H H 57 8.090 8.022 0.068 2
1 663 . 1 1 A 57 57 ALA HA H 57 4.130 3.987 0.143 2
1 667 . 1 1 A 57 57 ALA C C 57 181.200 179.797 1.403 2
1 668 . 1 1 A 57 57 ALA CA C 57 55.200 55.267 -0.067 2
1 669 . 1 1 A 57 57 ALA CB C 57 17.900 18.124 -0.224 2
1 670 . 1 1 A 57 57 ALA N N 57 124.000 123.615 0.385 2
1 671 . 1 1 A 58 58 ASN H H 58 7.970 7.892 0.078 2
1 672 . 1 1 A 58 58 ASN HA H 58 4.480 4.488 -0.008 2
1 677 . 1 1 A 58 58 ASN C C 58 177.500 178.183 -0.683 2
1 678 . 1 1 A 58 58 ASN CA C 58 56.900 56.253 0.647 2
1 679 . 1 1 A 58 58 ASN CB C 58 39.800 38.119 1.681 2
1 680 . 1 1 A 58 58 ASN N N 58 117.600 117.082 0.518 2
1 682 . 1 1 A 59 59 LEU H H 59 8.530 8.564 -0.034 2
1 683 . 1 1 A 59 59 LEU HA H 59 3.710 3.798 -0.088 2
1 693 . 1 1 A 59 59 LEU C C 59 178.400 179.124 -0.724 2
1 694 . 1 1 A 59 59 LEU CA C 59 58.600 57.741 0.859 2
1 695 . 1 1 A 59 59 LEU CB C 59 40.500 40.741 -0.241 2
1 699 . 1 1 A 59 59 LEU N N 59 122.600 121.178 1.422 2
1 700 . 1 1 A 60 60 GLN H H 60 8.200 8.334 -0.134 2
1 701 . 1 1 A 60 60 GLN HA H 60 4.020 4.049 -0.029 2
1 708 . 1 1 A 60 60 GLN C C 60 178.700 178.100 0.600 2
1 709 . 1 1 A 60 60 GLN CA C 60 58.800 58.923 -0.123 2
1 710 . 1 1 A 60 60 GLN CB C 60 27.700 28.547 -0.847 2
1 712 . 1 1 A 60 60 GLN N N 60 118.900 118.695 0.205 2
1 714 . 1 1 A 61 61 ALA H H 61 7.580 7.662 -0.082 2
1 715 . 1 1 A 61 61 ALA HA H 61 4.230 4.103 0.127 2
1 719 . 1 1 A 61 61 ALA C C 61 181.300 180.092 1.208 2
1 720 . 1 1 A 61 61 ALA CA C 61 55.100 54.992 0.108 2
1 721 . 1 1 A 61 61 ALA CB C 61 17.600 18.210 -0.610 2
1 722 . 1 1 A 61 61 ALA N N 61 122.200 122.463 -0.263 2
1 723 . 1 1 A 62 62 LEU H H 62 7.830 8.140 -0.310 2
1 724 . 1 1 A 62 62 LEU HA H 62 3.980 4.014 -0.034 2
1 734 . 1 1 A 62 62 LEU C C 62 178.500 179.136 -0.636 2
1 735 . 1 1 A 62 62 LEU CA C 62 58.100 57.351 0.749 2
1 736 . 1 1 A 62 62 LEU CB C 62 43.300 41.353 1.947 2
1 739 . 1 1 A 62 62 LEU N N 62 119.000 118.584 0.416 2
1 740 . 1 1 A 63 63 LYS H H 63 8.580 8.184 0.396 2
1 741 . 1 1 A 63 63 LYS HA H 63 4.130 4.184 -0.054 2
1 750 . 1 1 A 63 63 LYS C C 63 180.500 179.103 1.397 2
1 751 . 1 1 A 63 63 LYS CA C 63 59.700 58.986 0.714 2
1 752 . 1 1 A 63 63 LYS CB C 63 32.600 32.171 0.429 2
1 756 . 1 1 A 63 63 LYS N N 63 123.400 121.436 1.964 2
1 757 . 1 1 A 64 64 SER H H 64 8.640 8.328 0.312 2
1 758 . 1 1 A 64 64 SER HA H 64 4.300 4.265 0.035 2
1 761 . 1 1 A 64 64 SER C C 64 175.000 176.760 -1.760 2
1 762 . 1 1 A 64 64 SER CA C 64 61.400 61.842 -0.441 2
1 763 . 1 1 A 64 64 SER CB C 64 63.000 62.678 0.322 2
1 764 . 1 1 A 64 64 SER N N 64 117.700 116.479 1.221 2
1 765 . 1 1 A 65 65 GLY H H 65 7.280 7.841 -0.562 2
1 766 . 1 1 A 65 65 GLY HA2 H 65 3.240 3.940 -0.700 2
1 767 . 1 1 A 65 65 GLY HA3 H 65 3.980 3.941 0.039 2
1 768 . 1 1 A 65 65 GLY C C 65 171.300 174.861 -3.561 2
1 769 . 1 1 A 65 65 GLY CA C 65 45.100 45.831 -0.731 2
1 770 . 1 1 A 65 65 GLY N N 65 104.400 108.757 -4.357 2
1 771 . 1 1 A 66 66 GLY H H 66 7.730 7.684 0.046 2
1 772 . 1 1 A 66 66 GLY HA2 H 66 3.650 4.014 -0.364 2
1 773 . 1 1 A 66 66 GLY HA3 H 66 3.750 4.017 -0.267 2
1 774 . 1 1 A 66 66 GLY C C 66 173.700 174.986 -1.286 2
1 775 . 1 1 A 66 66 GLY CA C 66 45.400 45.732 -0.332 2
1 776 . 1 1 A 66 66 GLY N N 66 104.700 108.044 -3.344 2
1 777 . 1 1 A 67 67 LEU H H 67 7.520 8.128 -0.608 2
1 778 . 1 1 A 67 67 LEU HA H 67 4.310 4.250 0.060 2
1 788 . 1 1 A 67 67 LEU C C 67 177.700 176.597 1.103 2
1 789 . 1 1 A 67 67 LEU CA C 67 55.500 55.947 -0.447 2
1 790 . 1 1 A 67 67 LEU CB C 67 42.400 42.418 -0.018 2
1 794 . 1 1 A 67 67 LEU N N 67 110.600 118.349 -7.748 2
1 795 . 1 1 A 68 68 VAL H H 68 6.890 7.361 -0.471 2
1 796 . 1 1 A 68 68 VAL HA H 68 5.190 5.019 0.171 2
1 804 . 1 1 A 68 68 VAL C C 68 173.700 174.628 -0.928 2
1 805 . 1 1 A 68 68 VAL CA C 68 57.400 58.752 -1.352 2
1 806 . 1 1 A 68 68 VAL CB C 68 36.400 35.294 1.106 2
1 809 . 1 1 A 68 68 VAL N N 68 106.400 112.561 -6.161 2
1 810 . 1 1 A 69 69 GLU H H 69 8.880 9.201 -0.321 2
1 811 . 1 1 A 69 69 GLU HA H 69 4.660 4.955 -0.295 2
1 816 . 1 1 A 69 69 GLU C C 69 173.300 174.809 -1.509 2
1 817 . 1 1 A 69 69 GLU CA C 69 54.300 54.640 -0.340 2
1 818 . 1 1 A 69 69 GLU CB C 69 34.100 33.318 0.782 2
1 820 . 1 1 A 69 69 GLU N N 69 120.400 121.335 -0.935 2
1 821 . 1 1 A 70 70 ALA H H 70 8.730 8.736 -0.006 2
1 822 . 1 1 A 70 70 ALA HA H 70 4.990 4.895 0.095 2
1 826 . 1 1 A 70 70 ALA C C 70 176.500 175.352 1.148 2
1 827 . 1 1 A 70 70 ALA CA C 70 50.000 50.104 -0.104 2
1 828 . 1 1 A 70 70 ALA CB C 70 22.300 21.395 0.905 2
1 829 . 1 1 A 70 70 ALA N N 70 122.800 122.096 0.704 2
1 830 . 1 1 A 71 71 ARG H H 71 8.670 9.200 -0.530 2
1 831 . 1 1 A 71 71 ARG HA H 71 4.630 4.859 -0.229 2
1 843 . 1 1 A 71 71 ARG C C 71 173.500 174.764 -1.264 2
1 844 . 1 1 A 71 71 ARG CA C 71 54.600 54.537 0.063 2
1 845 . 1 1 A 71 71 ARG CB C 71 33.600 32.503 1.097 2
1 849 . 1 1 A 71 71 ARG N N 71 120.100 123.091 -2.991 2
1 851 . 1 1 A 72 72 ARG H H 72 8.780 8.755 0.025 2
1 852 . 1 1 A 72 72 ARG HA H 72 5.100 4.831 0.269 2
1 859 . 1 1 A 72 72 ARG C C 72 176.000 175.092 0.908 2
1 860 . 1 1 A 72 72 ARG CA C 72 54.900 55.637 -0.737 2
1 861 . 1 1 A 72 72 ARG CB C 72 32.500 31.175 1.325 2
1 864 . 1 1 A 72 72 ARG N N 72 123.600 125.936 -2.337 2
1 865 . 1 1 A 73 73 GLU H H 73 8.720 8.963 -0.243 2
1 866 . 1 1 A 73 73 GLU HA H 73 4.510 4.678 -0.168 2
1 871 . 1 1 A 73 73 GLU C C 73 175.900 176.685 -0.785 2
1 872 . 1 1 A 73 73 GLU CA C 73 55.700 55.303 0.397 2
1 873 . 1 1 A 73 73 GLU CB C 73 31.800 31.078 0.722 2
1 875 . 1 1 A 73 73 GLU N N 73 126.800 125.467 1.333 2
1 876 . 1 1 A 74 74 GLY H H 74 9.190 8.930 0.260 2
1 877 . 1 1 A 74 74 GLY HA2 H 74 3.700 3.880 -0.180 2
1 878 . 1 1 A 74 74 GLY HA3 H 74 4.170 3.896 0.274 2
1 879 . 1 1 A 74 74 GLY C C 74 175.400 174.824 0.576 2
1 880 . 1 1 A 74 74 GLY CA C 74 47.100 47.246 -0.146 2
1 881 . 1 1 A 74 74 GLY N N 74 118.500 116.439 2.061 2
1 882 . 1 1 A 75 75 THR H H 75 8.780 8.625 0.155 2
1 883 . 1 1 A 75 75 THR HA H 75 4.290 4.436 -0.146 2
1 888 . 1 1 A 75 75 THR C C 75 174.600 174.084 0.516 2
1 889 . 1 1 A 75 75 THR CA C 75 62.000 62.429 -0.429 2
1 890 . 1 1 A 75 75 THR CB C 75 69.000 69.826 -0.826 2
1 892 . 1 1 A 75 75 THR N N 75 118.000 120.195 -2.195 2
1 893 . 1 1 A 76 76 ARG H H 76 8.030 7.613 0.417 2
1 894 . 1 1 A 76 76 ARG HA H 76 4.610 4.836 -0.226 2
1 901 . 1 1 A 76 76 ARG C C 76 174.800 174.845 -0.045 2
1 902 . 1 1 A 76 76 ARG CA C 76 55.500 54.612 0.888 2
1 903 . 1 1 A 76 76 ARG CB C 76 32.700 32.682 0.018 2
1 906 . 1 1 A 76 76 ARG N N 76 122.600 120.919 1.681 2
1 907 . 1 1 A 77 77 GLN H H 77 8.580 8.594 -0.014 2
1 908 . 1 1 A 77 77 GLN HA H 77 4.910 4.977 -0.067 2
1 915 . 1 1 A 77 77 GLN C C 77 173.900 174.302 -0.402 2
1 916 . 1 1 A 77 77 GLN CA C 77 54.700 54.456 0.244 2
1 917 . 1 1 A 77 77 GLN CB C 77 31.800 30.789 1.011 2
1 919 . 1 1 A 77 77 GLN N N 77 121.900 121.682 0.218 2
1 921 . 1 1 A 78 78 TYR H H 78 8.890 9.427 -0.537 2
1 922 . 1 1 A 78 78 TYR HA H 78 4.750 5.326 -0.576 2
1 929 . 1 1 A 78 78 TYR C C 78 175.600 174.540 1.060 2
1 930 . 1 1 A 78 78 TYR CA C 78 57.000 56.299 0.701 2
1 931 . 1 1 A 78 78 TYR CB C 78 41.400 40.464 0.936 2
1 936 . 1 1 A 78 78 TYR N N 78 121.800 124.697 -2.896 2
1 937 . 1 1 A 79 79 TYR H H 79 9.010 9.571 -0.561 2
1 938 . 1 1 A 79 79 TYR HA H 79 5.410 5.440 -0.030 2
1 945 . 1 1 A 79 79 TYR C C 79 173.100 175.074 -1.974 2
1 946 . 1 1 A 79 79 TYR CA C 79 57.300 56.983 0.317 2
1 947 . 1 1 A 79 79 TYR CB C 79 43.300 41.486 1.814 2
1 952 . 1 1 A 79 79 TYR N N 79 122.500 122.406 0.094 2
1 953 . 1 1 A 80 80 ARG H H 80 8.720 8.829 -0.110 2
1 954 . 1 1 A 80 80 ARG HA H 80 5.120 4.891 0.229 2
1 962 . 1 1 A 80 80 ARG C C 80 175.500 174.856 0.644 2
1 963 . 1 1 A 80 80 ARG CA C 80 53.200 54.505 -1.305 2
1 964 . 1 1 A 80 80 ARG CB C 80 33.900 34.161 -0.261 2
1 967 . 1 1 A 80 80 ARG N N 80 114.500 121.204 -6.704 2
1 969 . 1 1 A 81 81 ILE H H 81 9.300 8.705 0.595 2
1 970 . 1 1 A 81 81 ILE HA H 81 4.150 4.160 -0.010 2
1 980 . 1 1 A 81 81 ILE C C 81 177.800 177.111 0.689 2
1 981 . 1 1 A 81 81 ILE CA C 81 62.300 62.143 0.157 2
1 982 . 1 1 A 81 81 ILE CB C 81 37.800 37.761 0.039 2
1 986 . 1 1 A 81 81 ILE N N 81 122.100 124.201 -2.101 2
1 987 . 1 1 A 82 82 ALA H H 82 7.930 8.688 -0.758 2
1 988 . 1 1 A 82 82 ALA HA H 82 3.930 4.139 -0.209 2
1 992 . 1 1 A 82 82 ALA C C 82 176.300 177.166 -0.866 2
1 993 . 1 1 A 82 82 ALA CA C 82 54.200 54.776 -0.576 2
1 994 . 1 1 A 82 82 ALA CB C 82 18.500 19.271 -0.771 2
1 995 . 1 1 A 82 82 ALA N N 82 127.200 128.727 -1.527 2
1 996 . 1 1 A 83 83 GLY H H 83 6.980 7.586 -0.606 2
1 997 . 1 1 A 83 83 GLY HA2 H 83 4.090 4.090 0.000 2
1 998 . 1 1 A 83 83 GLY HA3 H 83 4.440 4.092 0.348 2
1 999 . 1 1 A 83 83 GLY C C 83 173.600 174.848 -1.248 2
1 1000 . 1 1 A 83 83 GLY CA C 83 45.200 44.981 0.219 2
1 1001 . 1 1 A 83 83 GLY N N 83 101.800 103.840 -2.039 2
1 1002 . 1 1 A 84 84 GLU H H 84 8.930 8.943 -0.013 2
1 1003 . 1 1 A 84 84 GLU HA H 84 4.120 4.020 0.100 2
1 1008 . 1 1 A 84 84 GLU C C 84 178.300 177.979 0.321 2
1 1009 . 1 1 A 84 84 GLU CA C 84 58.900 59.085 -0.185 2
1 1010 . 1 1 A 84 84 GLU CB C 84 29.400 29.318 0.082 2
1 1012 . 1 1 A 84 84 GLU N N 84 120.300 120.190 0.110 2
1 1013 . 1 1 A 85 85 ASP H H 85 8.950 8.228 0.722 2
1 1014 . 1 1 A 85 85 ASP HA H 85 4.310 4.386 -0.076 2
1 1017 . 1 1 A 85 85 ASP C C 85 178.000 178.769 -0.769 2
1 1018 . 1 1 A 85 85 ASP CA C 85 57.100 57.146 -0.046 2
1 1019 . 1 1 A 85 85 ASP CB C 85 38.900 40.574 -1.674 2
1 1020 . 1 1 A 85 85 ASP N N 85 119.400 119.708 -0.308 2
1 1021 . 1 1 A 86 86 VAL H H 86 7.620 8.000 -0.380 2
1 1022 . 1 1 A 86 86 VAL HA H 86 3.480 3.599 -0.120 2
1 1030 . 1 1 A 86 86 VAL C C 86 177.400 177.984 -0.584 2
1 1031 . 1 1 A 86 86 VAL CA C 86 66.800 66.408 0.392 2
1 1032 . 1 1 A 86 86 VAL CB C 86 31.300 31.510 -0.210 2
1 1035 . 1 1 A 86 86 VAL N N 86 121.600 120.380 1.220 2
1 1036 . 1 1 A 87 87 ALA H H 87 7.520 8.119 -0.599 2
1 1037 . 1 1 A 87 87 ALA HA H 87 4.110 4.018 0.092 2
1 1041 . 1 1 A 87 87 ALA C C 87 181.200 179.830 1.370 2
1 1042 . 1 1 A 87 87 ALA CA C 87 55.800 55.725 0.075 2
1 1043 . 1 1 A 87 87 ALA CB C 87 17.600 18.371 -0.771 2
1 1044 . 1 1 A 87 87 ALA N N 87 122.700 121.981 0.719 2
1 1045 . 1 1 A 88 88 ARG H H 88 8.380 8.377 0.003 2
1 1046 . 1 1 A 88 88 ARG HA H 88 4.090 4.071 0.019 2
1 1054 . 1 1 A 88 88 ARG C C 88 179.100 178.904 0.196 2
1 1055 . 1 1 A 88 88 ARG CA C 88 59.600 58.860 0.740 2
1 1056 . 1 1 A 88 88 ARG CB C 88 30.500 29.936 0.564 2
1 1059 . 1 1 A 88 88 ARG N N 88 119.200 118.113 1.087 2
1 1061 . 1 1 A 89 89 LEU H H 89 8.480 7.833 0.647 2
1 1062 . 1 1 A 89 89 LEU HA H 89 4.040 4.055 -0.015 2
1 1071 . 1 1 A 89 89 LEU C C 89 177.200 178.636 -1.436 2
1 1072 . 1 1 A 89 89 LEU CA C 89 58.300 57.985 0.315 2
1 1073 . 1 1 A 89 89 LEU CB C 89 41.300 41.946 -0.646 2
1 1076 . 1 1 A 89 89 LEU N N 89 123.300 121.826 1.474 2
1 1077 . 1 1 A 90 90 PHE H H 90 8.890 8.492 0.399 2
1 1078 . 1 1 A 90 90 PHE HA H 90 4.380 4.009 0.371 2
1 1086 . 1 1 A 90 90 PHE C C 90 177.500 177.946 -0.446 2
1 1087 . 1 1 A 90 90 PHE CA C 90 59.400 62.222 -2.822 2
1 1088 . 1 1 A 90 90 PHE CB C 90 38.600 38.975 -0.375 2
1 1094 . 1 1 A 90 90 PHE N N 90 119.400 119.440 -0.040 2
1 1095 . 1 1 A 91 91 ALA H H 91 7.920 8.334 -0.414 2
1 1096 . 1 1 A 91 91 ALA HA H 91 3.940 3.962 -0.022 2
1 1100 . 1 1 A 91 91 ALA C C 91 180.200 179.809 0.391 2
1 1101 . 1 1 A 91 91 ALA CA C 91 55.100 55.227 -0.127 2
1 1102 . 1 1 A 91 91 ALA CB C 91 18.000 17.985 0.015 2
1 1103 . 1 1 A 91 91 ALA N N 91 120.500 121.353 -0.853 2
1 1104 . 1 1 A 92 92 LEU H H 92 8.190 8.398 -0.208 2
1 1105 . 1 1 A 92 92 LEU HA H 92 4.300 4.038 0.262 2
1 1115 . 1 1 A 92 92 LEU C C 92 178.900 178.319 0.581 2
1 1116 . 1 1 A 92 92 LEU CA C 92 57.500 57.920 -0.420 2
1 1117 . 1 1 A 92 92 LEU CB C 92 42.100 41.667 0.433 2
1 1121 . 1 1 A 92 92 LEU N N 92 120.200 119.635 0.565 2
1 1122 . 1 1 A 93 93 VAL H H 93 8.890 8.066 0.824 2
1 1123 . 1 1 A 93 93 VAL HA H 93 3.810 3.726 0.084 2
1 1131 . 1 1 A 93 93 VAL C C 93 176.900 177.615 -0.715 2
1 1132 . 1 1 A 93 93 VAL CA C 93 66.000 65.271 0.729 2
1 1133 . 1 1 A 93 93 VAL CB C 93 31.200 31.195 0.005 2
1 1136 . 1 1 A 93 93 VAL N N 93 117.100 117.543 -0.443 2
1 1137 . 1 1 A 94 94 GLN H H 94 6.920 7.568 -0.648 2
1 1138 . 1 1 A 94 94 GLN HA H 94 3.790 3.804 -0.014 2
1 1145 . 1 1 A 94 94 GLN C C 94 177.400 178.389 -0.989 2
1 1146 . 1 1 A 94 94 GLN CA C 94 60.000 58.707 1.293 2
1 1147 . 1 1 A 94 94 GLN CB C 94 30.300 28.081 2.219 2
1 1149 . 1 1 A 94 94 GLN N N 94 117.800 120.691 -2.891 2
1 1151 . 1 1 A 95 95 VAL H H 95 7.420 7.840 -0.420 2
1 1152 . 1 1 A 95 95 VAL HA H 95 3.760 3.563 0.197 2
1 1160 . 1 1 A 95 95 VAL C C 95 178.300 178.105 0.195 2
1 1161 . 1 1 A 95 95 VAL CA C 95 66.600 66.422 0.178 2
1 1162 . 1 1 A 95 95 VAL CB C 95 31.900 31.518 0.382 2
1 1165 . 1 1 A 95 95 VAL N N 95 121.500 119.818 1.682 2
1 1166 . 1 1 A 96 96 VAL H H 96 8.340 8.240 0.100 2
1 1167 . 1 1 A 96 96 VAL HA H 96 3.810 3.545 0.265 2
1 1175 . 1 1 A 96 96 VAL C C 96 178.400 177.968 0.432 2
1 1176 . 1 1 A 96 96 VAL CA C 96 66.100 66.177 -0.077 2
1 1177 . 1 1 A 96 96 VAL CB C 96 32.200 31.426 0.774 2
1 1180 . 1 1 A 96 96 VAL N N 96 120.000 120.013 -0.013 2
1 1181 . 1 1 A 97 97 ALA H H 97 8.140 8.020 0.120 2
1 1182 . 1 1 A 97 97 ALA HA H 97 4.010 4.010 -0.000 2
1 1186 . 1 1 A 97 97 ALA C C 97 178.800 178.817 -0.017 2
1 1187 . 1 1 A 97 97 ALA CA C 97 54.900 55.395 -0.495 2
1 1188 . 1 1 A 97 97 ALA CB C 97 19.900 18.276 1.624 2
1 1189 . 1 1 A 97 97 ALA N N 97 121.400 122.194 -0.794 2
1 1190 . 1 1 A 98 98 ASP H H 98 8.170 8.402 -0.232 2
1 1191 . 1 1 A 98 98 ASP HA H 98 4.320 4.309 0.011 2
1 1194 . 1 1 A 98 98 ASP C C 98 178.100 178.432 -0.332 2
1 1195 . 1 1 A 98 98 ASP CA C 98 57.100 57.591 -0.491 2
1 1196 . 1 1 A 98 98 ASP CB C 98 41.800 41.632 0.168 2
1 1197 . 1 1 A 98 98 ASP N N 98 118.500 118.486 0.014 2
1 1198 . 1 1 A 99 99 GLU H H 99 8.220 8.319 -0.099 2
1 1199 . 1 1 A 99 99 GLU HA H 99 4.000 4.102 -0.102 2
1 1204 . 1 1 A 99 99 GLU C C 99 178.300 178.307 -0.007 2
1 1205 . 1 1 A 99 99 GLU CA C 99 58.300 58.762 -0.462 2
1 1206 . 1 1 A 99 99 GLU CB C 99 29.800 29.329 0.471 2
1 1208 . 1 1 A 99 99 GLU N N 99 116.600 118.495 -1.895 2
1 1209 . 1 1 A 100 100 HIS H H 100 7.980 7.647 0.333 2
1 1210 . 1 1 A 100 100 HIS HA H 100 4.600 4.427 0.173 2
1 1214 . 1 1 A 100 100 HIS C C 100 175.900 177.042 -1.142 2
1 1215 . 1 1 A 100 100 HIS CA C 100 57.500 58.230 -0.730 2
1 1216 . 1 1 A 100 100 HIS CB C 100 30.800 30.087 0.713 2
1 1218 . 1 1 A 100 100 HIS N N 100 114.000 117.831 -3.831 2
1 1219 . 1 1 A 101 101 LEU H H 101 7.920 7.843 0.077 2
1 1220 . 1 1 A 101 101 LEU HA H 101 4.370 4.048 0.322 2
1 1230 . 1 1 A 101 101 LEU C C 101 177.700 177.271 0.429 2
1 1231 . 1 1 A 101 101 LEU CA C 101 55.900 56.770 -0.870 2
1 1232 . 1 1 A 101 101 LEU CB C 101 42.100 42.131 -0.031 2
1 1236 . 1 1 A 101 101 LEU N N 101 118.500 120.036 -1.536 2
1 1237 . 1 1 A 102 102 GLU H H 102 8.100 7.847 0.253 2
1 1238 . 1 1 A 102 102 GLU HA H 102 4.160 4.298 -0.138 2
1 1243 . 1 1 A 102 102 GLU C C 102 176.700 176.080 0.620 2
1 1244 . 1 1 A 102 102 GLU CA C 102 57.000 56.986 0.014 2
1 1245 . 1 1 A 102 102 GLU CB C 102 29.900 29.675 0.225 2
1 1247 . 1 1 A 102 102 GLU N N 102 119.100 118.472 0.628 2
1 1248 . 1 1 A 103 103 HIS H H 103 8.010 8.299 -0.289 2
1 1249 . 1 1 A 103 103 HIS HA H 103 4.520 4.627 -0.107 2
1 1252 . 1 1 A 103 103 HIS CA C 103 56.100 56.135 -0.035 2
1 1253 . 1 1 A 103 103 HIS CB C 103 29.700 29.918 -0.218 2
1 1254 . 1 1 A 103 103 HIS N N 103 117.300 121.570 -4.270 2
1 1255 . 1 1 A 107 107 HIS HA H 107 4.560 4.672 -0.112 2
1 1258 . 1 1 A 107 107 HIS C C 107 173.900 174.067 -0.167 2
1 1259 . 1 1 A 107 107 HIS CA C 107 55.900 55.879 0.021 2
1 1260 . 1 1 A 107 107 HIS CB C 107 30.200 30.899 -0.699 2
stop_
save_