data_16498_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16498
_Entry.PDB_ID 2KOB
_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 15 . 1 1 1 A 2 2 ASP H H 62 8.760 7.918 0.842 1
1 16 . 1 1 1 A 2 2 ASP HA H 62 4.810 4.815 -0.005 1
1 19 . 1 1 1 A 2 2 ASP C C 62 175.800 175.275 0.525 1
1 20 . 1 1 1 A 2 2 ASP CA C 62 54.800 53.582 1.218 1
1 21 . 1 1 1 A 2 2 ASP CB C 62 41.600 42.123 -0.523 1
1 22 . 1 1 1 A 2 2 ASP N N 62 120.900 119.128 1.772 1
1 23 . 1 1 1 A 3 3 SER H H 63 8.710 8.871 -0.161 1
1 24 . 1 1 1 A 3 3 SER HA H 63 4.970 4.818 0.152 1
1 27 . 1 1 1 A 3 3 SER C C 63 175.600 175.080 0.520 1
1 28 . 1 1 1 A 3 3 SER CA C 63 57.500 57.358 0.142 1
1 29 . 1 1 1 A 3 3 SER CB C 63 65.900 63.928 1.972 1
1 30 . 1 1 1 A 3 3 SER N N 63 116.300 120.854 -4.554 1
1 31 . 1 1 1 A 4 4 PHE H H 64 9.370 9.594 -0.224 1
1 32 . 1 1 1 A 4 4 PHE HA H 64 4.010 4.074 -0.064 1
1 39 . 1 1 1 A 4 4 PHE C C 64 176.700 177.199 -0.499 1
1 40 . 1 1 1 A 4 4 PHE CA C 64 62.200 61.603 0.597 1
1 41 . 1 1 1 A 4 4 PHE CB C 64 38.500 39.360 -0.860 1
1 46 . 1 1 1 A 4 4 PHE N N 64 121.400 122.225 -0.825 1
1 47 . 1 1 1 A 5 5 GLY H H 65 8.930 7.791 1.139 1
1 48 . 1 1 1 A 5 5 GLY HA2 H 65 2.020 2.184 -0.164 1
1 49 . 1 1 1 A 5 5 GLY HA3 H 65 3.250 2.778 0.472 1
1 50 . 1 1 1 A 5 5 GLY C C 65 175.200 174.924 0.276 1
1 51 . 1 1 1 A 5 5 GLY CA C 65 46.300 46.242 0.058 1
1 52 . 1 1 1 A 5 5 GLY N N 65 106.500 104.616 1.884 1
1 53 . 1 1 1 A 6 6 ASP H H 66 7.630 8.104 -0.474 1
1 54 . 1 1 1 A 6 6 ASP HA H 66 4.100 4.091 0.009 1
1 57 . 1 1 1 A 6 6 ASP C C 66 179.500 178.434 1.066 1
1 58 . 1 1 1 A 6 6 ASP CA C 66 57.400 56.911 0.489 1
1 59 . 1 1 1 A 6 6 ASP CB C 66 40.500 41.177 -0.677 1
1 60 . 1 1 1 A 6 6 ASP N N 66 120.500 121.046 -0.546 1
1 61 . 1 1 1 A 7 7 TRP H H 67 7.190 7.539 -0.349 1
1 62 . 1 1 1 A 7 7 TRP HA H 67 3.860 4.252 -0.392 1
1 71 . 1 1 1 A 7 7 TRP C C 67 177.200 178.268 -1.068 1
1 72 . 1 1 1 A 7 7 TRP CA C 67 61.100 59.659 1.441 1
1 73 . 1 1 1 A 7 7 TRP CB C 67 28.300 29.093 -0.793 1
1 79 . 1 1 1 A 7 7 TRP N N 67 120.700 119.371 1.329 1
1 81 . 1 1 1 A 8 8 ALA H H 68 9.040 8.372 0.668 1
1 82 . 1 1 1 A 8 8 ALA HA H 68 3.730 3.827 -0.097 1
1 86 . 1 1 1 A 8 8 ALA C C 68 179.500 179.463 0.037 1
1 87 . 1 1 1 A 8 8 ALA CA C 68 55.200 55.173 0.027 1
1 88 . 1 1 1 A 8 8 ALA CB C 68 18.600 17.982 0.618 1
1 89 . 1 1 1 A 8 8 ALA N N 68 125.700 122.523 3.177 1
1 90 . 1 1 1 A 9 9 GLU H H 69 8.060 8.088 -0.028 1
1 91 . 1 1 1 A 9 9 GLU HA H 69 4.020 4.110 -0.090 1
1 96 . 1 1 1 A 9 9 GLU C C 69 180.400 179.167 1.233 1
1 97 . 1 1 1 A 9 9 GLU CA C 69 58.800 59.231 -0.431 1
1 98 . 1 1 1 A 9 9 GLU CB C 69 28.500 29.352 -0.852 1
1 99 . 1 1 1 A 9 9 GLU N N 69 115.400 118.476 -3.076 1
1 100 . 1 1 1 A 10 10 LYS H H 70 7.740 7.716 0.024 1
1 101 . 1 1 1 A 10 10 LYS HA H 70 3.910 4.031 -0.121 1
1 110 . 1 1 1 A 10 10 LYS C C 70 179.500 178.655 0.845 1
1 111 . 1 1 1 A 10 10 LYS CA C 70 60.000 58.672 1.328 1
1 112 . 1 1 1 A 10 10 LYS CB C 70 32.400 32.446 -0.046 1
1 116 . 1 1 1 A 10 10 LYS N N 70 122.700 119.587 3.113 1
1 117 . 1 1 1 A 11 11 PHE H H 71 8.750 8.338 0.412 1
1 118 . 1 1 1 A 11 11 PHE HA H 71 4.080 4.137 -0.057 1
1 126 . 1 1 1 A 11 11 PHE C C 71 177.100 177.448 -0.348 1
1 127 . 1 1 1 A 11 11 PHE CA C 71 61.200 61.256 -0.056 1
1 128 . 1 1 1 A 11 11 PHE CB C 71 38.900 39.386 -0.486 1
1 134 . 1 1 1 A 11 11 PHE N N 71 123.500 121.169 2.331 1
1 135 . 1 1 1 A 12 12 LEU H H 72 8.400 8.904 -0.504 1
1 136 . 1 1 1 A 12 12 LEU HA H 72 3.520 3.742 -0.222 1
1 146 . 1 1 1 A 12 12 LEU C C 72 180.000 179.107 0.893 1
1 147 . 1 1 1 A 12 12 LEU CA C 72 58.200 58.135 0.065 1
1 148 . 1 1 1 A 12 12 LEU CB C 72 41.700 41.789 -0.089 1
1 152 . 1 1 1 A 12 12 LEU N N 72 121.100 119.313 1.787 1
1 153 . 1 1 1 A 13 13 LYS H H 73 7.810 8.320 -0.510 1
1 154 . 1 1 1 A 13 13 LYS HA H 73 4.080 3.968 0.112 1
1 156 . 1 1 1 A 13 13 LYS C C 73 179.300 178.457 0.843 1
1 157 . 1 1 1 A 13 13 LYS CA C 73 59.000 59.023 -0.023 1
1 158 . 1 1 1 A 13 13 LYS CB C 73 31.900 31.999 -0.099 1
1 159 . 1 1 1 A 13 13 LYS N N 73 119.400 119.983 -0.583 1
1 160 . 1 1 1 A 14 14 SER H H 74 8.210 8.131 0.079 1
1 161 . 1 1 1 A 14 14 SER HA H 74 4.210 4.050 0.160 1
1 164 . 1 1 1 A 14 14 SER C C 74 176.300 177.244 -0.944 1
1 165 . 1 1 1 A 14 14 SER CA C 74 61.400 61.517 -0.117 1
1 166 . 1 1 1 A 14 14 SER CB C 74 62.600 63.044 -0.444 1
1 167 . 1 1 1 A 14 14 SER N N 74 117.600 114.689 2.911 1
1 168 . 1 1 1 A 15 15 LYS H H 75 7.760 7.591 0.169 1
1 169 . 1 1 1 A 15 15 LYS HA H 75 4.040 3.910 0.130 1
1 178 . 1 1 1 A 15 15 LYS C C 75 178.500 179.410 -0.910 1
1 179 . 1 1 1 A 15 15 LYS CA C 75 56.500 59.271 -2.771 1
1 180 . 1 1 1 A 15 15 LYS CB C 75 30.600 31.774 -1.174 1
1 184 . 1 1 1 A 15 15 LYS N N 75 120.100 121.486 -1.386 1
1 185 . 1 1 1 A 16 16 GLU H H 76 7.680 8.087 -0.407 1
1 186 . 1 1 1 A 16 16 GLU HA H 76 4.030 4.046 -0.016 1
1 191 . 1 1 1 A 16 16 GLU C C 76 179.900 178.148 1.752 1
1 192 . 1 1 1 A 16 16 GLU CA C 76 59.200 59.322 -0.122 1
1 193 . 1 1 1 A 16 16 GLU CB C 76 29.600 29.228 0.372 1
1 195 . 1 1 1 A 16 16 GLU N N 76 119.700 119.501 0.199 1
1 196 . 1 1 1 A 17 17 ALA H H 77 8.030 8.139 -0.109 1
1 197 . 1 1 1 A 17 17 ALA HA H 77 4.200 4.097 0.103 1
1 201 . 1 1 1 A 17 17 ALA C C 77 178.900 179.202 -0.302 1
1 202 . 1 1 1 A 17 17 ALA CA C 77 54.400 53.997 0.403 1
1 203 . 1 1 1 A 17 17 ALA CB C 77 18.100 18.593 -0.493 1
1 204 . 1 1 1 A 17 17 ALA N N 77 123.000 121.207 1.793 1
1 205 . 1 1 1 A 18 18 ASP H H 78 7.860 8.028 -0.168 1
1 206 . 1 1 1 A 18 18 ASP HA H 78 4.600 4.491 0.109 1
1 209 . 1 1 1 A 18 18 ASP C C 78 177.500 176.567 0.933 1
1 210 . 1 1 1 A 18 18 ASP CA C 78 55.100 54.705 0.395 1
1 211 . 1 1 1 A 18 18 ASP CB C 78 41.400 40.934 0.466 1
1 212 . 1 1 1 A 18 18 ASP N N 78 117.700 116.284 1.416 1
1 213 . 1 1 1 A 19 19 GLY H H 79 7.910 7.668 0.242 1
1 214 . 1 1 1 A 19 19 GLY HA2 H 79 3.860 3.981 -0.121 1
1 215 . 1 1 1 A 19 19 GLY HA3 H 79 4.080 3.983 0.097 1
1 216 . 1 1 1 A 19 19 GLY C C 79 175.300 174.829 0.471 1
1 217 . 1 1 1 A 19 19 GLY CA C 79 46.200 45.765 0.435 1
1 218 . 1 1 1 A 19 19 GLY N N 79 107.100 106.622 0.478 1
1 219 . 1 1 1 A 20 20 VAL H H 80 7.150 7.423 -0.273 1
1 220 . 1 1 1 A 20 20 VAL HA H 80 4.250 4.280 -0.030 1
1 228 . 1 1 1 A 20 20 VAL C C 80 175.100 175.645 -0.545 1
1 229 . 1 1 1 A 20 20 VAL CA C 80 61.800 61.251 0.549 1
1 230 . 1 1 1 A 20 20 VAL CB C 80 32.200 32.889 -0.689 1
1 233 . 1 1 1 A 20 20 VAL N N 80 114.600 118.153 -3.553 1
1 234 . 1 1 1 A 21 21 SER H H 81 8.560 8.654 -0.094 1
1 235 . 1 1 1 A 21 21 SER HA H 81 4.390 4.450 -0.060 1
1 238 . 1 1 1 A 21 21 SER C C 81 174.600 175.688 -1.088 1
1 239 . 1 1 1 A 21 21 SER CA C 81 57.900 59.279 -1.379 1
1 240 . 1 1 1 A 21 21 SER CB C 81 64.700 63.638 1.062 1
1 241 . 1 1 1 A 21 21 SER N N 81 118.700 119.928 -1.228 1
1 242 . 1 1 1 A 22 22 VAL H H 82 8.690 8.693 -0.003 1
1 243 . 1 1 1 A 22 22 VAL HA H 82 3.700 3.649 0.051 1
1 251 . 1 1 1 A 22 22 VAL C C 82 178.000 177.260 0.740 1
1 252 . 1 1 1 A 22 22 VAL CA C 82 66.500 66.474 0.026 1
1 253 . 1 1 1 A 22 22 VAL CB C 82 31.700 31.692 0.008 1
1 256 . 1 1 1 A 22 22 VAL N N 82 122.100 124.333 -2.233 1
1 257 . 1 1 1 A 23 23 SER H H 83 8.300 8.098 0.202 1
1 258 . 1 1 1 A 23 23 SER HA H 83 4.210 4.011 0.199 1
1 261 . 1 1 1 A 23 23 SER C C 83 177.600 175.888 1.712 1
1 262 . 1 1 1 A 23 23 SER CA C 83 61.400 62.135 -0.735 1
1 263 . 1 1 1 A 23 23 SER CB C 83 62.400 62.908 -0.508 1
1 264 . 1 1 1 A 23 23 SER N N 83 113.600 115.395 -1.795 1
1 265 . 1 1 1 A 24 24 GLN H H 84 7.820 7.984 -0.164 1
1 266 . 1 1 1 A 24 24 GLN HA H 84 3.970 3.972 -0.002 1
1 273 . 1 1 1 A 24 24 GLN C C 84 178.400 177.900 0.500 1
1 274 . 1 1 1 A 24 24 GLN CA C 84 58.400 58.744 -0.344 1
1 275 . 1 1 1 A 24 24 GLN CB C 84 28.900 28.231 0.669 1
1 278 . 1 1 1 A 24 24 GLN N N 84 122.900 120.689 2.211 1
1 280 . 1 1 1 A 25 25 LEU H H 85 8.920 8.562 0.358 1
1 281 . 1 1 1 A 25 25 LEU HA H 85 4.130 4.361 -0.231 1
1 291 . 1 1 1 A 25 25 LEU C C 85 178.800 178.659 0.141 1
1 292 . 1 1 1 A 25 25 LEU CA C 85 58.300 57.877 0.423 1
1 293 . 1 1 1 A 25 25 LEU CB C 85 41.200 41.652 -0.452 1
1 297 . 1 1 1 A 25 25 LEU N N 85 122.200 121.314 0.886 1
1 298 . 1 1 1 A 26 26 ASN H H 86 8.860 8.786 0.074 1
1 299 . 1 1 1 A 26 26 ASN HA H 86 4.420 4.434 -0.014 1
1 304 . 1 1 1 A 26 26 ASN C C 86 179.000 178.307 0.693 1
1 305 . 1 1 1 A 26 26 ASN CA C 86 55.900 55.675 0.225 1
1 306 . 1 1 1 A 26 26 ASN CB C 86 37.200 37.962 -0.762 1
1 308 . 1 1 1 A 26 26 ASN N N 86 117.600 117.387 0.213 1
1 310 . 1 1 1 A 27 27 SER H H 87 7.840 7.835 0.005 1
1 311 . 1 1 1 A 27 27 SER HA H 87 4.100 3.803 0.297 1
1 314 . 1 1 1 A 27 27 SER C C 87 179.000 176.112 2.888 1
1 315 . 1 1 1 A 27 27 SER CA C 87 62.100 62.101 -0.001 1
1 316 . 1 1 1 A 27 27 SER CB C 87 62.100 62.734 -0.634 1
1 317 . 1 1 1 A 27 27 SER N N 87 118.500 117.858 0.642 1
1 318 . 1 1 1 A 28 28 TYR H H 88 8.180 7.574 0.606 1
1 319 . 1 1 1 A 28 28 TYR HA H 88 4.600 4.545 0.055 1
1 326 . 1 1 1 A 28 28 TYR C C 88 174.800 178.590 -3.790 1
1 327 . 1 1 1 A 28 28 TYR CA C 88 61.200 62.310 -1.110 1
1 328 . 1 1 1 A 28 28 TYR CB C 88 37.800 38.212 -0.412 1
1 333 . 1 1 1 A 28 28 TYR N N 88 119.300 119.874 -0.574 1
1 334 . 1 1 1 A 29 29 LYS H H 89 9.040 8.029 1.011 1
1 335 . 1 1 1 A 29 29 LYS HA H 89 3.890 4.060 -0.170 1
1 344 . 1 1 1 A 29 29 LYS C C 89 179.000 178.979 0.021 1
1 345 . 1 1 1 A 29 29 LYS CA C 89 61.300 59.484 1.816 1
1 346 . 1 1 1 A 29 29 LYS CB C 89 32.800 32.165 0.635 1
1 350 . 1 1 1 A 29 29 LYS N N 89 119.300 118.966 0.334 1
1 351 . 1 1 1 A 30 30 ASN H H 90 7.770 7.952 -0.182 1
1 352 . 1 1 1 A 30 30 ASN HA H 90 4.560 4.413 0.147 1
1 357 . 1 1 1 A 30 30 ASN C C 90 178.300 177.599 0.701 1
1 358 . 1 1 1 A 30 30 ASN CA C 90 56.200 56.212 -0.012 1
1 359 . 1 1 1 A 30 30 ASN CB C 90 38.900 38.434 0.466 1
1 361 . 1 1 1 A 30 30 ASN N N 90 117.800 118.365 -0.565 1
1 363 . 1 1 1 A 31 31 TYR H H 91 8.860 8.014 0.846 1
1 364 . 1 1 1 A 31 31 TYR HA H 91 4.910 4.570 0.340 1
1 371 . 1 1 1 A 31 31 TYR C C 91 178.300 179.053 -0.753 1
1 372 . 1 1 1 A 31 31 TYR CA C 91 59.700 60.432 -0.732 1
1 373 . 1 1 1 A 31 31 TYR CB C 91 37.500 37.714 -0.214 1
1 378 . 1 1 1 A 31 31 TYR N N 91 119.400 118.702 0.698 1
1 379 . 1 1 1 A 32 32 CYS H H 92 8.640 8.353 0.287 1
1 380 . 1 1 1 A 32 32 CYS HA H 92 4.410 4.566 -0.156 1
1 383 . 1 1 1 A 32 32 CYS C C 92 173.700 177.266 -3.566 1
1 384 . 1 1 1 A 32 32 CYS CA C 92 65.500 61.755 3.745 1
1 385 . 1 1 1 A 32 32 CYS CB C 92 28.300 27.574 0.726 1
1 386 . 1 1 1 A 32 32 CYS N N 92 113.500 119.857 -6.357 1
1 387 . 1 1 1 A 33 33 ARG H H 93 8.440 8.024 0.416 1
1 388 . 1 1 1 A 33 33 ARG HA H 93 3.740 3.860 -0.120 1
1 391 . 1 1 1 A 33 33 ARG C C 93 177.200 177.966 -0.766 1
1 392 . 1 1 1 A 33 33 ARG CA C 93 58.300 58.379 -0.079 1
1 393 . 1 1 1 A 33 33 ARG CB C 93 30.200 30.035 0.165 1
1 394 . 1 1 1 A 33 33 ARG N N 93 111.400 120.871 -9.471 1
1 395 . 1 1 1 A 34 34 ASN H H 94 8.020 8.233 -0.213 1
1 396 . 1 1 1 A 34 34 ASN HA H 94 4.980 4.645 0.335 1
1 401 . 1 1 1 A 34 34 ASN C C 94 176.700 176.999 -0.299 1
1 402 . 1 1 1 A 34 34 ASN CA C 94 53.400 54.979 -1.579 1
1 403 . 1 1 1 A 34 34 ASN CB C 94 38.000 39.284 -1.284 1
1 405 . 1 1 1 A 34 34 ASN N N 94 113.600 116.089 -2.489 1
1 407 . 1 1 1 A 35 35 HIS H H 95 7.200 7.498 -0.298 1
1 408 . 1 1 1 A 35 35 HIS HA H 95 4.470 4.421 0.049 1
1 411 . 1 1 1 A 35 35 HIS C C 95 176.600 176.280 0.320 1
1 412 . 1 1 1 A 35 35 HIS CA C 95 60.000 59.393 0.607 1
1 413 . 1 1 1 A 35 35 HIS CB C 95 30.500 31.034 -0.534 1
1 414 . 1 1 1 A 35 35 HIS N N 95 115.600 117.707 -2.107 1
1 415 . 1 1 1 A 36 36 LEU H H 96 8.170 8.218 -0.048 1
1 416 . 1 1 1 A 36 36 LEU HA H 96 4.730 4.471 0.259 1
1 426 . 1 1 1 A 36 36 LEU C C 96 176.800 177.170 -0.370 1
1 427 . 1 1 1 A 36 36 LEU CA C 96 54.400 54.594 -0.194 1
1 428 . 1 1 1 A 36 36 LEU CB C 96 40.600 41.644 -1.044 1
1 432 . 1 1 1 A 36 36 LEU N N 96 114.000 118.849 -4.849 1
1 433 . 1 1 1 A 37 37 SER H H 97 7.140 8.076 -0.936 1
1 434 . 1 1 1 A 37 37 SER HA H 97 4.730 4.321 0.409 1
1 437 . 1 1 1 A 37 37 SER CA C 97 62.700 62.932 -0.232 1
1 438 . 1 1 1 A 37 37 SER CB C 97 62.600 62.168 0.432 1
1 439 . 1 1 1 A 37 37 SER N N 97 117.200 116.717 0.483 1
1 440 . 1 1 1 A 38 38 PRO HA H 98 4.560 4.398 0.162 1
1 447 . 1 1 1 A 38 38 PRO C C 98 177.900 178.878 -0.978 1
1 448 . 1 1 1 A 38 38 PRO CA C 98 65.700 65.785 -0.085 1
1 449 . 1 1 1 A 38 38 PRO CB C 98 31.800 30.840 0.960 1
1 452 . 1 1 1 A 39 39 LEU H H 99 8.090 7.455 0.635 1
1 453 . 1 1 1 A 39 39 LEU HA H 99 4.260 4.026 0.234 1
1 463 . 1 1 1 A 39 39 LEU C C 99 178.700 178.482 0.218 1
1 464 . 1 1 1 A 39 39 LEU CA C 99 54.300 57.253 -2.953 1
1 465 . 1 1 1 A 39 39 LEU CB C 99 42.400 41.550 0.850 1
1 469 . 1 1 1 A 39 39 LEU N N 99 112.400 117.514 -5.114 1
1 470 . 1 1 1 A 40 40 TYR H H 100 8.350 8.728 -0.378 1
1 471 . 1 1 1 A 40 40 TYR HA H 100 4.170 4.472 -0.302 1
1 478 . 1 1 1 A 40 40 TYR C C 100 178.300 177.687 0.613 1
1 479 . 1 1 1 A 40 40 TYR CA C 100 63.400 61.879 1.521 1
1 480 . 1 1 1 A 40 40 TYR CB C 100 38.600 39.097 -0.497 1
1 485 . 1 1 1 A 40 40 TYR N N 100 119.400 120.694 -1.294 1
1 486 . 1 1 1 A 41 41 MET H H 101 8.640 8.259 0.381 1
1 487 . 1 1 1 A 41 41 MET HA H 101 4.260 4.567 -0.307 1
1 488 . 1 1 1 A 41 41 MET C C 101 177.000 175.870 1.130 1
1 489 . 1 1 1 A 41 41 MET CA C 101 54.600 55.473 -0.873 1
1 490 . 1 1 1 A 41 41 MET N N 101 111.800 114.989 -3.189 1
1 491 . 1 1 1 A 42 42 LYS H H 102 7.880 7.929 -0.049 1
1 492 . 1 1 1 A 42 42 LYS HA H 102 4.430 4.786 -0.356 1
1 501 . 1 1 1 A 42 42 LYS C C 102 176.300 175.459 0.841 1
1 502 . 1 1 1 A 42 42 LYS CA C 102 56.000 54.320 1.680 1
1 503 . 1 1 1 A 42 42 LYS CB C 102 33.400 33.817 -0.417 1
1 507 . 1 1 1 A 42 42 LYS N N 102 121.700 120.250 1.450 1
1 508 . 1 1 1 A 43 43 SER H H 103 9.160 8.653 0.507 1
1 509 . 1 1 1 A 43 43 SER HA H 103 4.620 4.853 -0.233 1
1 513 . 1 1 1 A 43 43 SER C C 103 176.300 175.604 0.696 1
1 514 . 1 1 1 A 43 43 SER CA C 103 58.700 56.858 1.842 1
1 515 . 1 1 1 A 43 43 SER CB C 103 63.700 64.775 -1.075 1
1 516 . 1 1 1 A 43 43 SER N N 103 118.800 116.540 2.260 1
1 517 . 1 1 1 A 44 44 LEU H H 104 8.860 9.275 -0.415 1
1 518 . 1 1 1 A 44 44 LEU HA H 104 4.130 4.165 -0.035 1
1 528 . 1 1 1 A 44 44 LEU C C 104 178.700 178.645 0.055 1
1 529 . 1 1 1 A 44 44 LEU CA C 104 58.800 57.979 0.821 1
1 530 . 1 1 1 A 44 44 LEU CB C 104 42.600 41.198 1.402 1
1 534 . 1 1 1 A 44 44 LEU N N 104 124.200 128.437 -4.237 1
1 535 . 1 1 1 A 45 45 SER H H 105 8.330 8.144 0.186 1
1 536 . 1 1 1 A 45 45 SER HA H 105 4.310 4.353 -0.043 1
1 539 . 1 1 1 A 45 45 SER C C 105 175.000 175.395 -0.395 1
1 540 . 1 1 1 A 45 45 SER CA C 105 60.100 60.454 -0.354 1
1 541 . 1 1 1 A 45 45 SER CB C 105 63.400 63.329 0.071 1
1 542 . 1 1 1 A 45 45 SER N N 105 107.700 113.565 -5.865 1
1 543 . 1 1 1 A 46 46 GLU H H 106 7.800 7.857 -0.057 1
1 544 . 1 1 1 A 46 46 GLU HA H 106 4.570 4.402 0.168 1
1 549 . 1 1 1 A 46 46 GLU C C 106 174.100 175.737 -1.637 1
1 550 . 1 1 1 A 46 46 GLU CA C 106 55.600 56.139 -0.539 1
1 551 . 1 1 1 A 46 46 GLU CB C 106 31.200 30.469 0.731 1
1 553 . 1 1 1 A 46 46 GLU N N 106 119.600 119.860 -0.260 1
1 554 . 1 1 1 A 47 47 ILE H H 107 7.100 7.298 -0.198 1
1 555 . 1 1 1 A 47 47 ILE HA H 107 4.040 4.275 -0.235 1
1 565 . 1 1 1 A 47 47 ILE C C 107 174.100 174.888 -0.788 1
1 566 . 1 1 1 A 47 47 ILE CA C 107 62.300 60.356 1.944 1
1 567 . 1 1 1 A 47 47 ILE CB C 107 38.500 39.160 -0.660 1
1 571 . 1 1 1 A 47 47 ILE N N 107 120.600 121.222 -0.622 1
1 572 . 1 1 1 A 48 48 LEU H H 108 9.180 8.863 0.317 1
1 573 . 1 1 1 A 48 48 LEU HA H 108 4.940 4.777 0.163 1
1 583 . 1 1 1 A 48 48 LEU CA C 108 51.900 52.087 -0.187 1
1 584 . 1 1 1 A 48 48 LEU CB C 108 42.000 42.527 -0.527 1
1 588 . 1 1 1 A 48 48 LEU N N 108 129.400 128.634 0.766 1
1 589 . 1 1 1 A 49 49 PRO HA H 109 3.910 4.349 -0.439 1
1 596 . 1 1 1 A 49 49 PRO C C 109 178.500 178.146 0.354 1
1 597 . 1 1 1 A 49 49 PRO CA C 109 66.600 65.189 1.411 1
1 598 . 1 1 1 A 49 49 PRO CB C 109 31.300 31.750 -0.450 1
1 601 . 1 1 1 A 50 50 ALA H H 110 8.280 8.200 0.080 1
1 602 . 1 1 1 A 50 50 ALA HA H 110 4.110 4.188 -0.078 1
1 606 . 1 1 1 A 50 50 ALA C C 110 179.700 179.599 0.101 1
1 607 . 1 1 1 A 50 50 ALA CA C 110 55.100 54.128 0.972 1
1 608 . 1 1 1 A 50 50 ALA CB C 110 19.200 18.578 0.622 1
1 609 . 1 1 1 A 50 50 ALA N N 110 116.100 119.099 -2.999 1
1 610 . 1 1 1 A 51 51 ASP H H 111 7.790 8.044 -0.254 1
1 611 . 1 1 1 A 51 51 ASP HA H 111 4.440 4.359 0.081 1
1 614 . 1 1 1 A 51 51 ASP C C 111 178.200 178.604 -0.404 1
1 615 . 1 1 1 A 51 51 ASP CA C 111 57.600 57.338 0.262 1
1 616 . 1 1 1 A 51 51 ASP CB C 111 41.800 40.909 0.891 1
1 617 . 1 1 1 A 51 51 ASP N N 111 116.500 118.539 -2.039 1
1 618 . 1 1 1 A 52 52 ILE H H 112 7.020 7.792 -0.772 1
1 619 . 1 1 1 A 52 52 ILE HA H 112 3.750 3.684 0.066 1
1 629 . 1 1 1 A 52 52 ILE C C 112 177.300 177.969 -0.669 1
1 630 . 1 1 1 A 52 52 ILE CA C 112 63.500 65.026 -1.526 1
1 631 . 1 1 1 A 52 52 ILE CB C 112 37.500 37.064 0.436 1
1 635 . 1 1 1 A 52 52 ILE N N 112 116.700 119.597 -2.897 1
1 636 . 1 1 1 A 53 53 GLN H H 113 9.150 8.022 1.128 1
1 637 . 1 1 1 A 53 53 GLN HA H 113 3.720 4.022 -0.302 1
1 644 . 1 1 1 A 53 53 GLN C C 113 177.500 177.915 -0.415 1
1 645 . 1 1 1 A 53 53 GLN CA C 113 58.200 58.630 -0.430 1
1 646 . 1 1 1 A 53 53 GLN CB C 113 30.200 28.560 1.640 1
1 649 . 1 1 1 A 53 53 GLN N N 113 121.200 121.056 0.144 1
1 651 . 1 1 1 A 54 54 SER H H 114 8.150 7.581 0.569 1
1 652 . 1 1 1 A 54 54 SER HA H 114 4.180 4.260 -0.080 1
1 655 . 1 1 1 A 54 54 SER C C 114 175.900 177.478 -1.578 1
1 656 . 1 1 1 A 54 54 SER CA C 114 62.100 61.325 0.775 1
1 657 . 1 1 1 A 54 54 SER CB C 114 62.800 62.740 0.060 1
1 658 . 1 1 1 A 54 54 SER N N 114 112.200 114.502 -2.302 1
1 659 . 1 1 1 A 55 55 ILE H H 115 6.760 7.495 -0.735 1
1 660 . 1 1 1 A 55 55 ILE HA H 115 3.860 3.732 0.128 1
1 670 . 1 1 1 A 55 55 ILE C C 115 179.200 178.115 1.085 1
1 671 . 1 1 1 A 55 55 ILE CA C 115 64.700 64.723 -0.023 1
1 672 . 1 1 1 A 55 55 ILE CB C 115 38.900 37.543 1.357 1
1 676 . 1 1 1 A 55 55 ILE N N 115 119.500 121.556 -2.056 1
1 677 . 1 1 1 A 56 56 ILE H H 116 7.750 7.980 -0.230 1
1 678 . 1 1 1 A 56 56 ILE HA H 116 3.690 3.588 0.102 1
1 688 . 1 1 1 A 56 56 ILE C C 116 176.900 178.187 -1.287 1
1 689 . 1 1 1 A 56 56 ILE CA C 116 62.800 64.842 -2.042 1
1 690 . 1 1 1 A 56 56 ILE CB C 116 36.200 37.108 -0.908 1
1 694 . 1 1 1 A 56 56 ILE N N 116 120.200 121.624 -1.424 1
1 695 . 1 1 1 A 57 57 ASN H H 117 8.690 8.056 0.634 1
1 696 . 1 1 1 A 57 57 ASN HA H 117 4.440 4.375 0.065 1
1 701 . 1 1 1 A 57 57 ASN C C 117 177.200 177.689 -0.489 1
1 702 . 1 1 1 A 57 57 ASN CA C 117 54.800 56.658 -1.858 1
1 703 . 1 1 1 A 57 57 ASN CB C 117 38.100 38.516 -0.416 1
1 705 . 1 1 1 A 57 57 ASN N N 117 117.000 120.635 -3.635 1
1 707 . 1 1 1 A 58 58 GLU H H 118 7.630 7.841 -0.211 1
1 708 . 1 1 1 A 58 58 GLU HA H 118 4.450 4.308 0.142 1
1 713 . 1 1 1 A 58 58 GLU C C 118 176.500 177.415 -0.915 1
1 714 . 1 1 1 A 58 58 GLU CA C 118 56.200 57.888 -1.688 1
1 715 . 1 1 1 A 58 58 GLU CB C 118 30.200 30.053 0.147 1
1 717 . 1 1 1 A 58 58 GLU N N 118 116.300 117.290 -0.990 1
1 718 . 1 1 1 A 59 59 THR H H 119 7.540 7.780 -0.240 1
1 719 . 1 1 1 A 59 59 THR HA H 119 4.230 4.283 -0.053 1
1 724 . 1 1 1 A 59 59 THR C C 119 174.200 174.028 0.172 1
1 725 . 1 1 1 A 59 59 THR CA C 119 63.800 63.091 0.709 1
1 726 . 1 1 1 A 59 59 THR CB C 119 68.900 68.583 0.317 1
1 728 . 1 1 1 A 59 59 THR N N 119 117.600 115.894 1.706 1
1 729 . 1 1 1 A 60 60 LYS H H 120 8.860 9.044 -0.184 1
1 730 . 1 1 1 A 60 60 LYS HA H 120 4.490 4.660 -0.170 1
1 739 . 1 1 1 A 60 60 LYS C C 120 175.800 175.101 0.699 1
1 740 . 1 1 1 A 60 60 LYS CA C 120 54.900 55.107 -0.207 1
1 741 . 1 1 1 A 60 60 LYS CB C 120 29.800 32.572 -2.772 1
1 745 . 1 1 1 A 60 60 LYS N N 120 128.500 127.297 1.203 1
1 746 . 1 1 1 A 61 61 LEU H H 121 7.150 8.259 -1.109 1
1 747 . 1 1 1 A 61 61 LEU HA H 121 4.710 4.852 -0.142 1
1 757 . 1 1 1 A 61 61 LEU C C 121 175.000 175.912 -0.912 1
1 758 . 1 1 1 A 61 61 LEU CA C 121 52.800 53.160 -0.360 1
1 759 . 1 1 1 A 61 61 LEU CB C 121 46.400 45.139 1.261 1
1 763 . 1 1 1 A 61 61 LEU N N 121 120.700 125.278 -4.578 1
1 764 . 1 1 1 A 62 62 ALA H H 122 8.000 8.479 -0.479 1
1 765 . 1 1 1 A 62 62 ALA HA H 122 4.250 4.372 -0.122 1
1 769 . 1 1 1 A 62 62 ALA CA C 122 52.100 52.152 -0.052 1
1 770 . 1 1 1 A 62 62 ALA CB C 122 19.500 19.680 -0.180 1
1 771 . 1 1 1 A 62 62 ALA N N 122 119.900 123.238 -3.338 1
1 772 . 1 1 1 A 63 63 LYS H H 123 8.770 9.064 -0.294 1
1 773 . 1 1 1 A 63 63 LYS HA H 123 3.800 3.829 -0.029 1
1 782 . 1 1 1 A 63 63 LYS C C 123 178.300 178.963 -0.663 1
1 783 . 1 1 1 A 63 63 LYS CA C 123 60.700 59.786 0.914 1
1 784 . 1 1 1 A 63 63 LYS CB C 123 32.300 32.265 0.035 1
1 788 . 1 1 1 A 63 63 LYS N N 123 121.400 120.745 0.655 1
1 789 . 1 1 1 A 64 64 ASN H H 124 9.020 8.099 0.921 1
1 790 . 1 1 1 A 64 64 ASN HA H 124 4.430 4.450 -0.020 1
1 795 . 1 1 1 A 64 64 ASN C C 124 178.300 178.176 0.124 1
1 796 . 1 1 1 A 64 64 ASN CA C 124 56.200 56.206 -0.006 1
1 797 . 1 1 1 A 64 64 ASN CB C 124 37.300 39.477 -2.177 1
1 799 . 1 1 1 A 64 64 ASN N N 124 115.000 117.956 -2.956 1
1 801 . 1 1 1 A 65 65 THR H H 125 7.620 8.004 -0.384 1
1 802 . 1 1 1 A 65 65 THR HA H 125 4.030 4.075 -0.045 1
1 807 . 1 1 1 A 65 65 THR C C 125 175.500 176.439 -0.939 1
1 808 . 1 1 1 A 65 65 THR CA C 125 66.000 67.217 -1.217 1
1 809 . 1 1 1 A 65 65 THR CB C 125 67.600 67.896 -0.296 1
1 811 . 1 1 1 A 65 65 THR N N 125 119.800 116.331 3.469 1
1 812 . 1 1 1 A 66 66 LEU H H 126 8.020 8.319 -0.299 1
1 813 . 1 1 1 A 66 66 LEU HA H 126 3.790 3.773 0.017 1
1 823 . 1 1 1 A 66 66 LEU C C 126 179.200 179.166 0.034 1
1 824 . 1 1 1 A 66 66 LEU CA C 126 58.700 58.154 0.546 1
1 825 . 1 1 1 A 66 66 LEU CB C 126 41.300 41.398 -0.098 1
1 829 . 1 1 1 A 66 66 LEU N N 126 121.200 120.914 0.286 1
1 830 . 1 1 1 A 67 67 LYS H H 127 8.380 8.099 0.281 1
1 831 . 1 1 1 A 67 67 LYS HA H 127 3.740 4.080 -0.340 1
1 840 . 1 1 1 A 67 67 LYS C C 127 178.300 179.314 -1.014 1
1 841 . 1 1 1 A 67 67 LYS CA C 127 60.100 59.404 0.696 1
1 842 . 1 1 1 A 67 67 LYS CB C 127 32.400 32.181 0.219 1
1 846 . 1 1 1 A 67 67 LYS N N 127 117.000 117.807 -0.807 1
1 847 . 1 1 1 A 68 68 ALA H H 128 7.480 8.027 -0.547 1
1 848 . 1 1 1 A 68 68 ALA HA H 128 4.210 3.969 0.241 1
1 852 . 1 1 1 A 68 68 ALA C C 128 181.200 179.903 1.297 1
1 853 . 1 1 1 A 68 68 ALA CA C 128 55.200 54.969 0.231 1
1 854 . 1 1 1 A 68 68 ALA CB C 128 18.600 17.809 0.791 1
1 855 . 1 1 1 A 68 68 ALA N N 128 122.900 121.851 1.049 1
1 856 . 1 1 1 A 69 69 ILE H H 129 8.250 7.657 0.593 1
1 857 . 1 1 1 A 69 69 ILE HA H 129 3.130 3.077 0.053 1
1 867 . 1 1 1 A 69 69 ILE C C 129 177.400 177.949 -0.549 1
1 868 . 1 1 1 A 69 69 ILE CA C 129 66.700 65.241 1.459 1
1 869 . 1 1 1 A 69 69 ILE CB C 129 37.900 37.451 0.449 1
1 873 . 1 1 1 A 69 69 ILE N N 129 122.800 118.563 4.237 1
1 874 . 1 1 1 A 70 70 ARG H H 130 8.040 7.700 0.340 1
1 875 . 1 1 1 A 70 70 ARG HA H 130 3.620 3.898 -0.278 1
1 882 . 1 1 1 A 70 70 ARG C C 130 177.800 178.731 -0.931 1
1 883 . 1 1 1 A 70 70 ARG CA C 130 60.700 59.899 0.801 1
1 884 . 1 1 1 A 70 70 ARG CB C 130 29.600 29.907 -0.307 1
1 887 . 1 1 1 A 70 70 ARG N N 130 119.700 120.432 -0.732 1
1 888 . 1 1 1 A 71 71 ASN H H 131 8.920 8.815 0.105 1
1 889 . 1 1 1 A 71 71 ASN HA H 131 4.430 4.480 -0.050 1
1 894 . 1 1 1 A 71 71 ASN C C 131 177.500 177.946 -0.446 1
1 895 . 1 1 1 A 71 71 ASN CA C 131 56.100 56.131 -0.031 1
1 896 . 1 1 1 A 71 71 ASN CB C 131 38.600 38.183 0.417 1
1 898 . 1 1 1 A 71 71 ASN N N 131 117.200 118.275 -1.075 1
1 900 . 1 1 1 A 72 72 THR H H 132 8.300 8.197 0.103 1
1 901 . 1 1 1 A 72 72 THR HA H 132 4.430 4.002 0.428 1
1 906 . 1 1 1 A 72 72 THR C C 132 175.100 176.380 -1.280 1
1 907 . 1 1 1 A 72 72 THR CA C 132 68.200 66.498 1.702 1
1 908 . 1 1 1 A 72 72 THR CB C 132 68.500 68.896 -0.396 1
1 910 . 1 1 1 A 72 72 THR N N 132 119.200 116.460 2.740 1
1 911 . 1 1 1 A 73 73 ALA H H 133 7.950 8.171 -0.221 1
1 912 . 1 1 1 A 73 73 ALA HA H 133 4.040 4.058 -0.018 1
1 916 . 1 1 1 A 73 73 ALA C C 133 178.200 179.381 -1.181 1
1 917 . 1 1 1 A 73 73 ALA CA C 133 55.900 55.487 0.413 1
1 918 . 1 1 1 A 73 73 ALA CB C 133 16.700 17.978 -1.278 1
1 919 . 1 1 1 A 73 73 ALA N N 133 120.900 123.521 -2.621 1
1 920 . 1 1 1 A 74 74 SER H H 134 8.440 8.437 0.003 1
1 921 . 1 1 1 A 74 74 SER HA H 134 4.430 4.307 0.123 1
1 924 . 1 1 1 A 74 74 SER C C 134 178.800 176.884 1.916 1
1 925 . 1 1 1 A 74 74 SER CA C 134 61.300 61.719 -0.419 1
1 926 . 1 1 1 A 74 74 SER CB C 134 62.600 62.946 -0.346 1
1 927 . 1 1 1 A 74 74 SER N N 134 110.100 113.321 -3.221 1
1 928 . 1 1 1 A 75 75 GLN H H 135 8.340 7.690 0.650 1
1 929 . 1 1 1 A 75 75 GLN HA H 135 3.880 4.036 -0.156 1
1 936 . 1 1 1 A 75 75 GLN C C 135 178.800 178.874 -0.074 1
1 937 . 1 1 1 A 75 75 GLN CA C 135 59.600 58.781 0.819 1
1 938 . 1 1 1 A 75 75 GLN CB C 135 29.900 28.247 1.653 1
1 941 . 1 1 1 A 75 75 GLN N N 135 118.100 120.675 -2.575 1
1 943 . 1 1 1 A 76 76 ILE H H 136 7.670 7.342 0.328 1
1 944 . 1 1 1 A 76 76 ILE HA H 136 3.200 3.245 -0.045 1
1 954 . 1 1 1 A 76 76 ILE C C 136 177.500 177.738 -0.238 1
1 955 . 1 1 1 A 76 76 ILE CA C 136 66.100 65.057 1.043 1
1 956 . 1 1 1 A 76 76 ILE CB C 136 37.400 37.202 0.198 1
1 960 . 1 1 1 A 76 76 ILE N N 136 122.500 120.259 2.241 1
1 961 . 1 1 1 A 77 77 PHE H H 137 7.930 8.072 -0.142 1
1 962 . 1 1 1 A 77 77 PHE HA H 137 3.890 4.144 -0.254 1
1 969 . 1 1 1 A 77 77 PHE C C 137 178.200 178.220 -0.020 1
1 970 . 1 1 1 A 77 77 PHE CA C 137 63.600 60.356 3.244 1
1 971 . 1 1 1 A 77 77 PHE CB C 137 39.300 38.423 0.877 1
1 976 . 1 1 1 A 77 77 PHE N N 137 116.100 118.167 -2.067 1
1 977 . 1 1 1 A 78 78 ARG H H 138 8.900 8.148 0.752 1
1 978 . 1 1 1 A 78 78 ARG HA H 138 3.910 3.947 -0.037 1
1 986 . 1 1 1 A 78 78 ARG C C 138 178.300 178.870 -0.570 1
1 987 . 1 1 1 A 78 78 ARG CA C 138 60.100 59.168 0.932 1
1 988 . 1 1 1 A 78 78 ARG CB C 138 29.600 29.735 -0.135 1
1 991 . 1 1 1 A 78 78 ARG N N 138 118.600 119.675 -1.075 1
1 993 . 1 1 1 A 79 79 LEU H H 139 7.730 7.860 -0.130 1
1 994 . 1 1 1 A 79 79 LEU HA H 139 4.280 4.221 0.059 1
1 1004 . 1 1 1 A 79 79 LEU C C 139 179.000 178.004 0.996 1
1 1005 . 1 1 1 A 79 79 LEU CA C 139 57.800 57.724 0.076 1
1 1006 . 1 1 1 A 79 79 LEU CB C 139 41.900 41.107 0.793 1
1 1010 . 1 1 1 A 79 79 LEU N N 139 121.900 121.232 0.668 1
1 1011 . 1 1 1 A 80 80 ALA H H 140 7.590 7.507 0.083 1
1 1012 . 1 1 1 A 80 80 ALA HA H 140 2.710 2.792 -0.082 1
1 1016 . 1 1 1 A 80 80 ALA C C 140 179.900 179.592 0.308 1
1 1017 . 1 1 1 A 80 80 ALA CA C 140 55.100 54.590 0.510 1
1 1018 . 1 1 1 A 80 80 ALA CB C 140 17.600 17.753 -0.153 1
1 1019 . 1 1 1 A 80 80 ALA N N 140 123.400 119.568 3.832 1
1 1020 . 1 1 1 A 81 81 ILE H H 141 8.910 8.232 0.678 1
1 1021 . 1 1 1 A 81 81 ILE HA H 141 4.110 3.713 0.397 1
1 1031 . 1 1 1 A 81 81 ILE C C 141 181.700 178.263 3.437 1
1 1032 . 1 1 1 A 81 81 ILE CA C 141 64.800 64.748 0.052 1
1 1033 . 1 1 1 A 81 81 ILE CB C 141 38.600 37.229 1.371 1
1 1037 . 1 1 1 A 81 81 ILE N N 141 122.400 118.161 4.239 1
1 1038 . 1 1 1 A 82 82 GLU H H 142 8.560 8.423 0.137 1
1 1039 . 1 1 1 A 82 82 GLU HA H 142 4.100 3.930 0.170 1
1 1044 . 1 1 1 A 82 82 GLU C C 142 177.700 178.408 -0.708 1
1 1045 . 1 1 1 A 82 82 GLU CA C 142 59.100 59.937 -0.837 1
1 1046 . 1 1 1 A 82 82 GLU CB C 142 29.200 29.386 -0.186 1
1 1048 . 1 1 1 A 82 82 GLU N N 142 123.200 121.201 1.999 1
1 1049 . 1 1 1 A 83 83 ASN H H 143 7.310 7.610 -0.300 1
1 1050 . 1 1 1 A 83 83 ASN HA H 143 4.750 4.786 -0.036 1
1 1055 . 1 1 1 A 83 83 ASN C C 143 173.200 174.288 -1.088 1
1 1056 . 1 1 1 A 83 83 ASN CA C 143 54.200 52.794 1.406 1
1 1057 . 1 1 1 A 83 83 ASN CB C 143 41.300 38.451 2.849 1
1 1059 . 1 1 1 A 83 83 ASN N N 143 114.900 115.022 -0.122 1
1 1061 . 1 1 1 A 84 84 ARG H H 144 8.320 7.598 0.722 1
1 1062 . 1 1 1 A 84 84 ARG HA H 144 4.120 4.017 0.103 1
1 1069 . 1 1 1 A 84 84 ARG C C 144 175.300 176.078 -0.778 1
1 1070 . 1 1 1 A 84 84 ARG CA C 144 57.100 56.853 0.247 1
1 1071 . 1 1 1 A 84 84 ARG CB C 144 26.000 26.762 -0.762 1
1 1074 . 1 1 1 A 84 84 ARG N N 144 114.400 114.989 -0.589 1
1 1075 . 1 1 1 A 85 85 ALA H H 145 8.350 7.928 0.422 1
1 1076 . 1 1 1 A 85 85 ALA HA H 145 4.320 4.178 0.142 1
1 1080 . 1 1 1 A 85 85 ALA C C 145 176.500 176.977 -0.477 1
1 1081 . 1 1 1 A 85 85 ALA CA C 145 53.400 54.731 -1.331 1
1 1082 . 1 1 1 A 85 85 ALA CB C 145 19.900 19.456 0.444 1
1 1083 . 1 1 1 A 85 85 ALA N N 145 120.600 119.847 0.753 1
1 1084 . 1 1 1 A 86 86 ILE H H 146 7.290 7.638 -0.348 1
1 1085 . 1 1 1 A 86 86 ILE HA H 146 4.400 4.570 -0.170 1
1 1095 . 1 1 1 A 86 86 ILE C C 146 173.600 174.790 -1.190 1
1 1096 . 1 1 1 A 86 86 ILE CA C 146 59.200 59.400 -0.200 1
1 1097 . 1 1 1 A 86 86 ILE CB C 146 41.600 41.188 0.412 1
1 1101 . 1 1 1 A 86 86 ILE N N 146 111.500 116.721 -5.221 1
1 1102 . 1 1 1 A 87 87 ASP H H 147 8.270 8.876 -0.606 1
1 1103 . 1 1 1 A 87 87 ASP HA H 147 4.940 4.652 0.288 1
1 1106 . 1 1 1 A 87 87 ASP C C 147 174.700 176.015 -1.315 1
1 1107 . 1 1 1 A 87 87 ASP CA C 147 53.700 54.551 -0.851 1
1 1108 . 1 1 1 A 87 87 ASP CB C 147 41.800 42.426 -0.626 1
1 1109 . 1 1 1 A 87 87 ASP N N 147 119.400 126.087 -6.687 1
1 1110 . 1 1 1 A 88 88 PHE H H 148 7.230 7.279 -0.049 1
1 1111 . 1 1 1 A 88 88 PHE HA H 148 4.690 5.008 -0.318 1
1 1119 . 1 1 1 A 88 88 PHE C C 148 171.500 172.313 -0.813 1
1 1120 . 1 1 1 A 88 88 PHE CA C 148 56.400 56.053 0.347 1
1 1121 . 1 1 1 A 88 88 PHE CB C 148 42.000 40.759 1.241 1
1 1127 . 1 1 1 A 88 88 PHE N N 148 119.700 115.893 3.807 1
1 1128 . 1 1 1 A 89 89 ASN H H 149 8.060 8.950 -0.890 1
1 1129 . 1 1 1 A 89 89 ASN HA H 149 4.490 5.063 -0.573 1
1 1134 . 1 1 1 A 89 89 ASN CA C 149 48.100 49.287 -1.187 1
1 1135 . 1 1 1 A 89 89 ASN CB C 149 39.200 39.907 -0.707 1
1 1137 . 1 1 1 A 89 89 ASN N N 149 119.700 119.501 0.199 1
1 1139 . 1 1 1 A 90 90 PRO HA H 150 3.970 4.415 -0.445 1
1 1146 . 1 1 1 A 90 90 PRO C C 150 177.700 177.650 0.050 1
1 1147 . 1 1 1 A 90 90 PRO CA C 150 63.900 64.343 -0.443 1
1 1148 . 1 1 1 A 90 90 PRO CB C 150 31.700 31.693 0.007 1
1 1151 . 1 1 1 A 91 91 ALA H H 151 7.240 7.549 -0.309 1
1 1152 . 1 1 1 A 91 91 ALA HA H 151 3.900 4.057 -0.157 1
1 1156 . 1 1 1 A 91 91 ALA C C 151 178.000 178.845 -0.845 1
1 1157 . 1 1 1 A 91 91 ALA CA C 151 53.900 54.583 -0.683 1
1 1158 . 1 1 1 A 91 91 ALA CB C 151 17.700 18.358 -0.658 1
1 1159 . 1 1 1 A 91 91 ALA N N 151 115.700 119.155 -3.455 1
1 1160 . 1 1 1 A 92 92 ASP H H 152 7.080 7.597 -0.517 1
1 1161 . 1 1 1 A 92 92 ASP HA H 152 4.220 4.520 -0.300 1
1 1164 . 1 1 1 A 92 92 ASP C C 152 176.200 177.179 -0.979 1
1 1165 . 1 1 1 A 92 92 ASP CA C 152 55.800 55.376 0.424 1
1 1166 . 1 1 1 A 92 92 ASP CB C 152 39.500 40.600 -1.100 1
1 1167 . 1 1 1 A 92 92 ASP N N 152 117.100 117.488 -0.388 1
1 1168 . 1 1 1 A 93 93 TYR H H 153 7.060 7.882 -0.822 1
1 1169 . 1 1 1 A 93 93 TYR HA H 153 4.490 4.295 0.195 1
1 1176 . 1 1 1 A 93 93 TYR C C 153 174.700 176.018 -1.318 1
1 1177 . 1 1 1 A 93 93 TYR CA C 153 57.600 59.700 -2.100 1
1 1178 . 1 1 1 A 93 93 TYR CB C 153 38.500 39.357 -0.857 1
1 1183 . 1 1 1 A 93 93 TYR N N 153 116.800 120.658 -3.858 1
1 1184 . 1 1 1 A 94 94 VAL H H 154 7.000 7.318 -0.318 1
1 1185 . 1 1 1 A 94 94 VAL HA H 154 4.040 3.749 0.291 1
1 1193 . 1 1 1 A 94 94 VAL C C 154 174.700 175.058 -0.358 1
1 1194 . 1 1 1 A 94 94 VAL CA C 154 62.100 62.857 -0.757 1
1 1195 . 1 1 1 A 94 94 VAL CB C 154 32.700 31.993 0.707 1
1 1198 . 1 1 1 A 94 94 VAL N N 154 120.600 120.457 0.143 1
1 1199 . 1 1 1 A 95 95 ARG H H 155 9.430 8.697 0.733 1
1 1200 . 1 1 1 A 95 95 ARG HA H 155 4.640 4.964 -0.324 1
1 1207 . 1 1 1 A 95 95 ARG C C 155 175.400 175.060 0.340 1
1 1208 . 1 1 1 A 95 95 ARG CA C 155 54.200 54.272 -0.072 1
1 1209 . 1 1 1 A 95 95 ARG CB C 155 32.400 33.033 -0.633 1
1 1212 . 1 1 1 A 95 95 ARG N N 155 128.200 127.750 0.450 1
1 1213 . 1 1 1 A 96 96 ILE H H 156 8.700 8.645 0.055 1
1 1214 . 1 1 1 A 96 96 ILE HA H 156 4.440 4.585 -0.145 1
1 1224 . 1 1 1 A 96 96 ILE CA C 156 56.500 58.033 -1.533 1
1 1225 . 1 1 1 A 96 96 ILE CB C 156 36.700 38.364 -1.664 1
1 1229 . 1 1 1 A 96 96 ILE N N 156 124.100 126.181 -2.081 1
1 1230 . 1 1 1 A 97 97 PRO HA H 157 4.370 4.445 -0.075 1
1 1237 . 1 1 1 A 97 97 PRO C C 157 176.000 176.182 -0.182 1
1 1238 . 1 1 1 A 97 97 PRO CA C 157 63.200 63.043 0.157 1
1 1239 . 1 1 1 A 97 97 PRO CB C 157 32.400 32.160 0.240 1
1 1242 . 1 1 1 A 98 98 LYS H H 158 8.380 8.538 -0.158 1
1 1243 . 1 1 1 A 98 98 LYS HA H 158 4.190 4.618 -0.428 1
1 1252 . 1 1 1 A 98 98 LYS C C 158 176.800 175.538 1.262 1
1 1253 . 1 1 1 A 98 98 LYS CA C 158 57.100 55.160 1.940 1
1 1254 . 1 1 1 A 98 98 LYS CB C 158 32.800 31.982 0.818 1
1 1258 . 1 1 1 A 98 98 LYS N N 158 120.800 122.626 -1.826 1
1 1259 . 1 1 1 A 99 99 ILE H H 159 7.930 8.343 -0.413 1
1 1260 . 1 1 1 A 99 99 ILE HA H 159 4.200 4.499 -0.299 1
1 1270 . 1 1 1 A 99 99 ILE C C 159 175.400 174.856 0.544 1
1 1271 . 1 1 1 A 99 99 ILE CA C 159 60.600 61.289 -0.689 1
1 1272 . 1 1 1 A 99 99 ILE CB C 159 39.100 36.307 2.793 1
1 1276 . 1 1 1 A 99 99 ILE N N 159 120.200 125.276 -5.076 1
1 1277 . 1 1 1 A 100 100 ALA H H 160 8.370 7.862 0.508 1
1 1278 . 1 1 1 A 100 100 ALA HA H 160 4.370 5.165 -0.795 1
1 1282 . 1 1 1 A 100 100 ALA C C 160 177.200 175.548 1.652 1
1 1283 . 1 1 1 A 100 100 ALA CA C 160 52.200 50.793 1.407 1
1 1284 . 1 1 1 A 100 100 ALA CB C 160 19.400 21.518 -2.118 1
1 1285 . 1 1 1 A 100 100 ALA N N 160 128.300 130.184 -1.884 1
1 1286 . 1 1 1 A 101 101 LEU H H 161 8.250 8.856 -0.606 1
1 1287 . 1 1 1 A 101 101 LEU HA H 161 4.280 4.831 -0.551 1
1 1297 . 1 1 1 A 101 101 LEU C C 161 177.200 177.247 -0.047 1
1 1298 . 1 1 1 A 101 101 LEU CA C 161 55.200 53.236 1.964 1
1 1299 . 1 1 1 A 101 101 LEU CB C 161 42.400 43.590 -1.190 1
1 1303 . 1 1 1 A 101 101 LEU N N 161 121.900 124.258 -2.358 1
1 1304 . 1 1 1 A 102 102 GLU H H 162 8.390 8.810 -0.420 1
1 1305 . 1 1 1 A 102 102 GLU HA H 162 4.230 4.034 0.196 1
1 1310 . 1 1 1 A 102 102 GLU C C 162 176.100 176.770 -0.670 1
1 1311 . 1 1 1 A 102 102 GLU CA C 162 56.400 58.963 -2.563 1
1 1312 . 1 1 1 A 102 102 GLU CB C 162 30.500 29.642 0.858 1
1 1314 . 1 1 1 A 102 102 GLU N N 162 121.300 123.839 -2.539 1
1 1315 . 1 1 1 A 103 103 HIS H H 163 8.330 7.591 0.739 1
1 1316 . 1 1 1 A 103 103 HIS HA H 163 4.590 4.671 -0.081 1
1 1319 . 1 1 1 A 103 103 HIS C C 163 176.100 175.271 0.829 1
1 1320 . 1 1 1 A 103 103 HIS CA C 163 56.000 56.692 -0.692 1
1 1321 . 1 1 1 A 103 103 HIS CB C 163 30.500 30.630 -0.130 1
1 1322 . 1 1 1 A 103 103 HIS N N 163 120.000 116.465 3.535 1
1 1323 . 1 1 1 A 107 107 HIS HA H 167 4.620 4.593 0.027 1
1 1326 . 1 1 1 A 107 107 HIS C C 167 173.900 175.929 -2.029 1
1 1327 . 1 1 1 A 107 107 HIS CA C 167 56.000 56.292 -0.292 1
1 1328 . 1 1 1 A 107 107 HIS CB C 167 30.300 29.631 0.669 1
1 15 . 2 1 1 A 2 2 ASP H H 62 8.760 9.033 -0.273 1
1 16 . 2 1 1 A 2 2 ASP HA H 62 4.810 5.026 -0.216 1
1 19 . 2 1 1 A 2 2 ASP C C 62 175.800 175.464 0.336 1
1 20 . 2 1 1 A 2 2 ASP CA C 62 54.800 53.590 1.210 1
1 21 . 2 1 1 A 2 2 ASP CB C 62 41.600 42.233 -0.633 1
1 22 . 2 1 1 A 2 2 ASP N N 62 120.900 125.692 -4.792 1
1 23 . 2 1 1 A 3 3 SER H H 63 8.710 9.270 -0.560 1
1 24 . 2 1 1 A 3 3 SER HA H 63 4.970 4.747 0.223 1
1 27 . 2 1 1 A 3 3 SER C C 63 175.600 174.964 0.636 1
1 28 . 2 1 1 A 3 3 SER CA C 63 57.500 56.593 0.907 1
1 29 . 2 1 1 A 3 3 SER CB C 63 65.900 65.056 0.844 1
1 30 . 2 1 1 A 3 3 SER N N 63 116.300 119.681 -3.381 1
1 31 . 2 1 1 A 4 4 PHE H H 64 9.370 8.891 0.479 1
1 32 . 2 1 1 A 4 4 PHE HA H 64 4.010 4.157 -0.147 1
1 39 . 2 1 1 A 4 4 PHE C C 64 176.700 177.365 -0.665 1
1 40 . 2 1 1 A 4 4 PHE CA C 64 62.200 61.524 0.676 1
1 41 . 2 1 1 A 4 4 PHE CB C 64 38.500 39.179 -0.679 1
1 46 . 2 1 1 A 4 4 PHE N N 64 121.400 125.711 -4.311 1
1 47 . 2 1 1 A 5 5 GLY H H 65 8.930 8.372 0.558 1
1 48 . 2 1 1 A 5 5 GLY HA2 H 65 2.020 2.426 -0.406 1
1 49 . 2 1 1 A 5 5 GLY HA3 H 65 3.250 2.934 0.316 1
1 50 . 2 1 1 A 5 5 GLY C C 65 175.200 175.339 -0.139 1
1 51 . 2 1 1 A 5 5 GLY CA C 65 46.300 46.520 -0.220 1
1 52 . 2 1 1 A 5 5 GLY N N 65 106.500 105.134 1.366 1
1 53 . 2 1 1 A 6 6 ASP H H 66 7.630 7.675 -0.045 1
1 54 . 2 1 1 A 6 6 ASP HA H 66 4.100 4.130 -0.030 1
1 57 . 2 1 1 A 6 6 ASP C C 66 179.500 178.762 0.738 1
1 58 . 2 1 1 A 6 6 ASP CA C 66 57.400 56.625 0.775 1
1 59 . 2 1 1 A 6 6 ASP CB C 66 40.500 40.221 0.279 1
1 60 . 2 1 1 A 6 6 ASP N N 66 120.500 121.237 -0.737 1
1 61 . 2 1 1 A 7 7 TRP H H 67 7.190 7.344 -0.154 1
1 62 . 2 1 1 A 7 7 TRP HA H 67 3.860 4.327 -0.467 1
1 71 . 2 1 1 A 7 7 TRP C C 67 177.200 178.304 -1.104 1
1 72 . 2 1 1 A 7 7 TRP CA C 67 61.100 59.241 1.859 1
1 73 . 2 1 1 A 7 7 TRP CB C 67 28.300 29.051 -0.751 1
1 79 . 2 1 1 A 7 7 TRP N N 67 120.700 120.589 0.111 1
1 81 . 2 1 1 A 8 8 ALA H H 68 9.040 8.455 0.585 1
1 82 . 2 1 1 A 8 8 ALA HA H 68 3.730 3.833 -0.103 1
1 86 . 2 1 1 A 8 8 ALA C C 68 179.500 179.680 -0.180 1
1 87 . 2 1 1 A 8 8 ALA CA C 68 55.200 55.215 -0.015 1
1 88 . 2 1 1 A 8 8 ALA CB C 68 18.600 18.177 0.423 1
1 89 . 2 1 1 A 8 8 ALA N N 68 125.700 122.689 3.011 1
1 90 . 2 1 1 A 9 9 GLU H H 69 8.060 8.105 -0.045 1
1 91 . 2 1 1 A 9 9 GLU HA H 69 4.020 4.156 -0.136 1
1 96 . 2 1 1 A 9 9 GLU C C 69 180.400 178.546 1.854 1
1 97 . 2 1 1 A 9 9 GLU CA C 69 58.800 59.031 -0.231 1
1 98 . 2 1 1 A 9 9 GLU CB C 69 28.500 29.439 -0.939 1
1 99 . 2 1 1 A 9 9 GLU N N 69 115.400 118.905 -3.505 1
1 100 . 2 1 1 A 10 10 LYS H H 70 7.740 7.998 -0.258 1
1 101 . 2 1 1 A 10 10 LYS HA H 70 3.910 4.025 -0.115 1
1 110 . 2 1 1 A 10 10 LYS C C 70 179.500 178.884 0.616 1
1 111 . 2 1 1 A 10 10 LYS CA C 70 60.000 58.885 1.115 1
1 112 . 2 1 1 A 10 10 LYS CB C 70 32.400 32.140 0.260 1
1 116 . 2 1 1 A 10 10 LYS N N 70 122.700 119.382 3.318 1
1 117 . 2 1 1 A 11 11 PHE H H 71 8.750 8.262 0.488 1
1 118 . 2 1 1 A 11 11 PHE HA H 71 4.080 4.158 -0.078 1
1 126 . 2 1 1 A 11 11 PHE C C 71 177.100 177.510 -0.410 1
1 127 . 2 1 1 A 11 11 PHE CA C 71 61.200 61.305 -0.105 1
1 128 . 2 1 1 A 11 11 PHE CB C 71 38.900 39.180 -0.280 1
1 134 . 2 1 1 A 11 11 PHE N N 71 123.500 120.550 2.950 1
1 135 . 2 1 1 A 12 12 LEU H H 72 8.400 8.380 0.020 1
1 136 . 2 1 1 A 12 12 LEU HA H 72 3.520 3.888 -0.368 1
1 146 . 2 1 1 A 12 12 LEU C C 72 180.000 179.465 0.535 1
1 147 . 2 1 1 A 12 12 LEU CA C 72 58.200 57.998 0.202 1
1 148 . 2 1 1 A 12 12 LEU CB C 72 41.700 41.644 0.056 1
1 152 . 2 1 1 A 12 12 LEU N N 72 121.100 119.731 1.369 1
1 153 . 2 1 1 A 13 13 LYS H H 73 7.810 8.576 -0.766 1
1 154 . 2 1 1 A 13 13 LYS HA H 73 4.080 3.943 0.137 1
1 156 . 2 1 1 A 13 13 LYS C C 73 179.300 179.581 -0.281 1
1 157 . 2 1 1 A 13 13 LYS CA C 73 59.000 59.059 -0.059 1
1 158 . 2 1 1 A 13 13 LYS CB C 73 31.900 31.925 -0.025 1
1 159 . 2 1 1 A 13 13 LYS N N 73 119.400 118.404 0.996 1
1 160 . 2 1 1 A 14 14 SER H H 74 8.210 8.157 0.053 1
1 161 . 2 1 1 A 14 14 SER HA H 74 4.210 3.975 0.235 1
1 164 . 2 1 1 A 14 14 SER C C 74 176.300 176.591 -0.291 1
1 165 . 2 1 1 A 14 14 SER CA C 74 61.400 62.163 -0.763 1
1 166 . 2 1 1 A 14 14 SER CB C 74 62.600 62.687 -0.087 1
1 167 . 2 1 1 A 14 14 SER N N 74 117.600 116.542 1.058 1
1 168 . 2 1 1 A 15 15 LYS H H 75 7.760 7.487 0.273 1
1 169 . 2 1 1 A 15 15 LYS HA H 75 4.040 3.982 0.058 1
1 178 . 2 1 1 A 15 15 LYS C C 75 178.500 178.674 -0.174 1
1 179 . 2 1 1 A 15 15 LYS CA C 75 56.500 59.278 -2.778 1
1 180 . 2 1 1 A 15 15 LYS CB C 75 30.600 32.056 -1.456 1
1 184 . 2 1 1 A 15 15 LYS N N 75 120.100 121.372 -1.272 1
1 185 . 2 1 1 A 16 16 GLU H H 76 7.680 8.782 -1.102 1
1 186 . 2 1 1 A 16 16 GLU HA H 76 4.030 4.043 -0.013 1
1 191 . 2 1 1 A 16 16 GLU C C 76 179.900 178.620 1.280 1
1 192 . 2 1 1 A 16 16 GLU CA C 76 59.200 59.596 -0.396 1
1 193 . 2 1 1 A 16 16 GLU CB C 76 29.600 29.313 0.287 1
1 195 . 2 1 1 A 16 16 GLU N N 76 119.700 119.791 -0.091 1
1 196 . 2 1 1 A 17 17 ALA H H 77 8.030 8.185 -0.155 1
1 197 . 2 1 1 A 17 17 ALA HA H 77 4.200 4.073 0.127 1
1 201 . 2 1 1 A 17 17 ALA C C 77 178.900 179.302 -0.402 1
1 202 . 2 1 1 A 17 17 ALA CA C 77 54.400 53.957 0.443 1
1 203 . 2 1 1 A 17 17 ALA CB C 77 18.100 18.513 -0.413 1
1 204 . 2 1 1 A 17 17 ALA N N 77 123.000 120.637 2.363 1
1 205 . 2 1 1 A 18 18 ASP H H 78 7.860 7.753 0.107 1
1 206 . 2 1 1 A 18 18 ASP HA H 78 4.600 4.431 0.169 1
1 209 . 2 1 1 A 18 18 ASP C C 78 177.500 176.182 1.318 1
1 210 . 2 1 1 A 18 18 ASP CA C 78 55.100 55.615 -0.515 1
1 211 . 2 1 1 A 18 18 ASP CB C 78 41.400 41.571 -0.171 1
1 212 . 2 1 1 A 18 18 ASP N N 78 117.700 117.538 0.162 1
1 213 . 2 1 1 A 19 19 GLY H H 79 7.910 7.638 0.272 1
1 214 . 2 1 1 A 19 19 GLY HA2 H 79 3.860 4.066 -0.206 1
1 215 . 2 1 1 A 19 19 GLY HA3 H 79 4.080 4.067 0.013 1
1 216 . 2 1 1 A 19 19 GLY C C 79 175.300 173.869 1.431 1
1 217 . 2 1 1 A 19 19 GLY CA C 79 46.200 45.645 0.555 1
1 218 . 2 1 1 A 19 19 GLY N N 79 107.100 106.170 0.930 1
1 219 . 2 1 1 A 20 20 VAL H H 80 7.150 7.987 -0.837 1
1 220 . 2 1 1 A 20 20 VAL HA H 80 4.250 4.914 -0.664 1
1 228 . 2 1 1 A 20 20 VAL C C 80 175.100 174.793 0.307 1
1 229 . 2 1 1 A 20 20 VAL CA C 80 61.800 59.471 2.329 1
1 230 . 2 1 1 A 20 20 VAL CB C 80 32.200 35.078 -2.878 1
1 233 . 2 1 1 A 20 20 VAL N N 80 114.600 114.160 0.440 1
1 234 . 2 1 1 A 21 21 SER H H 81 8.560 8.596 -0.036 1
1 235 . 2 1 1 A 21 21 SER HA H 81 4.390 4.653 -0.263 1
1 238 . 2 1 1 A 21 21 SER C C 81 174.600 175.542 -0.942 1
1 239 . 2 1 1 A 21 21 SER CA C 81 57.900 58.463 -0.563 1
1 240 . 2 1 1 A 21 21 SER CB C 81 64.700 63.819 0.881 1
1 241 . 2 1 1 A 21 21 SER N N 81 118.700 118.119 0.581 1
1 242 . 2 1 1 A 22 22 VAL H H 82 8.690 8.776 -0.086 1
1 243 . 2 1 1 A 22 22 VAL HA H 82 3.700 3.667 0.033 1
1 251 . 2 1 1 A 22 22 VAL C C 82 178.000 177.556 0.444 1
1 252 . 2 1 1 A 22 22 VAL CA C 82 66.500 66.771 -0.271 1
1 253 . 2 1 1 A 22 22 VAL CB C 82 31.700 31.699 0.001 1
1 256 . 2 1 1 A 22 22 VAL N N 82 122.100 127.147 -5.047 1
1 257 . 2 1 1 A 23 23 SER H H 83 8.300 8.196 0.104 1
1 258 . 2 1 1 A 23 23 SER HA H 83 4.210 4.077 0.133 1
1 261 . 2 1 1 A 23 23 SER C C 83 177.600 176.547 1.053 1
1 262 . 2 1 1 A 23 23 SER CA C 83 61.400 61.586 -0.186 1
1 263 . 2 1 1 A 23 23 SER CB C 83 62.400 62.298 0.102 1
1 264 . 2 1 1 A 23 23 SER N N 83 113.600 114.495 -0.895 1
1 265 . 2 1 1 A 24 24 GLN H H 84 7.820 7.925 -0.105 1
1 266 . 2 1 1 A 24 24 GLN HA H 84 3.970 3.922 0.048 1
1 273 . 2 1 1 A 24 24 GLN C C 84 178.400 178.030 0.370 1
1 274 . 2 1 1 A 24 24 GLN CA C 84 58.400 58.843 -0.443 1
1 275 . 2 1 1 A 24 24 GLN CB C 84 28.900 28.157 0.743 1
1 278 . 2 1 1 A 24 24 GLN N N 84 122.900 121.116 1.784 1
1 280 . 2 1 1 A 25 25 LEU H H 85 8.920 8.273 0.647 1
1 281 . 2 1 1 A 25 25 LEU HA H 85 4.130 4.343 -0.213 1
1 291 . 2 1 1 A 25 25 LEU C C 85 178.800 178.673 0.127 1
1 292 . 2 1 1 A 25 25 LEU CA C 85 58.300 57.834 0.466 1
1 293 . 2 1 1 A 25 25 LEU CB C 85 41.200 41.869 -0.669 1
1 297 . 2 1 1 A 25 25 LEU N N 85 122.200 121.157 1.043 1
1 298 . 2 1 1 A 26 26 ASN H H 86 8.860 8.699 0.161 1
1 299 . 2 1 1 A 26 26 ASN HA H 86 4.420 4.543 -0.123 1
1 304 . 2 1 1 A 26 26 ASN C C 86 179.000 178.379 0.621 1
1 305 . 2 1 1 A 26 26 ASN CA C 86 55.900 55.477 0.423 1
1 306 . 2 1 1 A 26 26 ASN CB C 86 37.200 38.220 -1.020 1
1 308 . 2 1 1 A 26 26 ASN N N 86 117.600 117.399 0.201 1
1 310 . 2 1 1 A 27 27 SER H H 87 7.840 7.943 -0.103 1
1 311 . 2 1 1 A 27 27 SER HA H 87 4.100 3.796 0.304 1
1 314 . 2 1 1 A 27 27 SER C C 87 179.000 176.232 2.768 1
1 315 . 2 1 1 A 27 27 SER CA C 87 62.100 62.202 -0.102 1
1 316 . 2 1 1 A 27 27 SER CB C 87 62.100 62.665 -0.565 1
1 317 . 2 1 1 A 27 27 SER N N 87 118.500 117.615 0.885 1
1 318 . 2 1 1 A 28 28 TYR H H 88 8.180 7.556 0.624 1
1 319 . 2 1 1 A 28 28 TYR HA H 88 4.600 4.547 0.053 1
1 326 . 2 1 1 A 28 28 TYR C C 88 174.800 178.131 -3.331 1
1 327 . 2 1 1 A 28 28 TYR CA C 88 61.200 61.711 -0.511 1
1 328 . 2 1 1 A 28 28 TYR CB C 88 37.800 38.009 -0.209 1
1 333 . 2 1 1 A 28 28 TYR N N 88 119.300 119.874 -0.574 1
1 334 . 2 1 1 A 29 29 LYS H H 89 9.040 8.638 0.402 1
1 335 . 2 1 1 A 29 29 LYS HA H 89 3.890 4.025 -0.135 1
1 344 . 2 1 1 A 29 29 LYS C C 89 179.000 178.836 0.164 1
1 345 . 2 1 1 A 29 29 LYS CA C 89 61.300 60.124 1.176 1
1 346 . 2 1 1 A 29 29 LYS CB C 89 32.800 32.391 0.409 1
1 350 . 2 1 1 A 29 29 LYS N N 89 119.300 122.233 -2.933 1
1 351 . 2 1 1 A 30 30 ASN H H 90 7.770 8.089 -0.319 1
1 352 . 2 1 1 A 30 30 ASN HA H 90 4.560 4.488 0.072 1
1 357 . 2 1 1 A 30 30 ASN C C 90 178.300 177.766 0.534 1
1 358 . 2 1 1 A 30 30 ASN CA C 90 56.200 56.273 -0.073 1
1 359 . 2 1 1 A 30 30 ASN CB C 90 38.900 38.422 0.478 1
1 361 . 2 1 1 A 30 30 ASN N N 90 117.800 117.431 0.369 1
1 363 . 2 1 1 A 31 31 TYR H H 91 8.860 7.353 1.507 1
1 364 . 2 1 1 A 31 31 TYR HA H 91 4.910 4.424 0.486 1
1 371 . 2 1 1 A 31 31 TYR C C 91 178.300 178.913 -0.613 1
1 372 . 2 1 1 A 31 31 TYR CA C 91 59.700 60.749 -1.049 1
1 373 . 2 1 1 A 31 31 TYR CB C 91 37.500 38.479 -0.979 1
1 378 . 2 1 1 A 31 31 TYR N N 91 119.400 118.437 0.963 1
1 379 . 2 1 1 A 32 32 CYS H H 92 8.640 8.792 -0.152 1
1 380 . 2 1 1 A 32 32 CYS HA H 92 4.410 4.293 0.117 1
1 383 . 2 1 1 A 32 32 CYS C C 92 173.700 177.377 -3.677 1
1 384 . 2 1 1 A 32 32 CYS CA C 92 65.500 63.925 1.575 1
1 385 . 2 1 1 A 32 32 CYS CB C 92 28.300 27.203 1.097 1
1 386 . 2 1 1 A 32 32 CYS N N 92 113.500 118.325 -4.825 1
1 387 . 2 1 1 A 33 33 ARG H H 93 8.440 8.253 0.187 1
1 388 . 2 1 1 A 33 33 ARG HA H 93 3.740 3.869 -0.129 1
1 391 . 2 1 1 A 33 33 ARG C C 93 177.200 178.567 -1.367 1
1 392 . 2 1 1 A 33 33 ARG CA C 93 58.300 59.185 -0.885 1
1 393 . 2 1 1 A 33 33 ARG CB C 93 30.200 30.475 -0.275 1
1 394 . 2 1 1 A 33 33 ARG N N 93 111.400 119.620 -8.220 1
1 395 . 2 1 1 A 34 34 ASN H H 94 8.020 8.099 -0.079 1
1 396 . 2 1 1 A 34 34 ASN HA H 94 4.980 4.520 0.460 1
1 401 . 2 1 1 A 34 34 ASN C C 94 176.700 177.017 -0.317 1
1 402 . 2 1 1 A 34 34 ASN CA C 94 53.400 55.504 -2.104 1
1 403 . 2 1 1 A 34 34 ASN CB C 94 38.000 38.854 -0.854 1
1 405 . 2 1 1 A 34 34 ASN N N 94 113.600 117.573 -3.973 1
1 407 . 2 1 1 A 35 35 HIS H H 95 7.200 7.666 -0.466 1
1 408 . 2 1 1 A 35 35 HIS HA H 95 4.470 4.512 -0.042 1
1 411 . 2 1 1 A 35 35 HIS C C 95 176.600 176.260 0.340 1
1 412 . 2 1 1 A 35 35 HIS CA C 95 60.000 59.454 0.546 1
1 413 . 2 1 1 A 35 35 HIS CB C 95 30.500 31.155 -0.655 1
1 414 . 2 1 1 A 35 35 HIS N N 95 115.600 117.861 -2.261 1
1 415 . 2 1 1 A 36 36 LEU H H 96 8.170 8.324 -0.154 1
1 416 . 2 1 1 A 36 36 LEU HA H 96 4.730 4.520 0.210 1
1 426 . 2 1 1 A 36 36 LEU C C 96 176.800 177.620 -0.820 1
1 427 . 2 1 1 A 36 36 LEU CA C 96 54.400 54.609 -0.209 1
1 428 . 2 1 1 A 36 36 LEU CB C 96 40.600 41.742 -1.142 1
1 432 . 2 1 1 A 36 36 LEU N N 96 114.000 119.371 -5.371 1
1 433 . 2 1 1 A 37 37 SER H H 97 7.140 8.343 -1.203 1
1 434 . 2 1 1 A 37 37 SER HA H 97 4.730 4.320 0.410 1
1 437 . 2 1 1 A 37 37 SER CA C 97 62.700 62.583 0.117 1
1 438 . 2 1 1 A 37 37 SER CB C 97 62.600 61.664 0.936 1
1 439 . 2 1 1 A 37 37 SER N N 97 117.200 116.056 1.144 1
1 440 . 2 1 1 A 38 38 PRO HA H 98 4.560 4.376 0.184 1
1 447 . 2 1 1 A 38 38 PRO C C 98 177.900 178.698 -0.798 1
1 448 . 2 1 1 A 38 38 PRO CA C 98 65.700 65.871 -0.171 1
1 449 . 2 1 1 A 38 38 PRO CB C 98 31.800 30.874 0.926 1
1 452 . 2 1 1 A 39 39 LEU H H 99 8.090 7.378 0.712 1
1 453 . 2 1 1 A 39 39 LEU HA H 99 4.260 4.011 0.249 1
1 463 . 2 1 1 A 39 39 LEU C C 99 178.700 178.483 0.217 1
1 464 . 2 1 1 A 39 39 LEU CA C 99 54.300 57.270 -2.970 1
1 465 . 2 1 1 A 39 39 LEU CB C 99 42.400 41.312 1.088 1
1 469 . 2 1 1 A 39 39 LEU N N 99 112.400 117.624 -5.224 1
1 470 . 2 1 1 A 40 40 TYR H H 100 8.350 8.631 -0.281 1
1 471 . 2 1 1 A 40 40 TYR HA H 100 4.170 4.483 -0.313 1
1 478 . 2 1 1 A 40 40 TYR C C 100 178.300 177.607 0.693 1
1 479 . 2 1 1 A 40 40 TYR CA C 100 63.400 61.879 1.521 1
1 480 . 2 1 1 A 40 40 TYR CB C 100 38.600 39.188 -0.588 1
1 485 . 2 1 1 A 40 40 TYR N N 100 119.400 120.729 -1.329 1
1 486 . 2 1 1 A 41 41 MET H H 101 8.640 8.190 0.450 1
1 487 . 2 1 1 A 41 41 MET HA H 101 4.260 4.568 -0.308 1
1 488 . 2 1 1 A 41 41 MET C C 101 177.000 175.652 1.348 1
1 489 . 2 1 1 A 41 41 MET CA C 101 54.600 55.145 -0.545 1
1 490 . 2 1 1 A 41 41 MET N N 101 111.800 115.035 -3.235 1
1 491 . 2 1 1 A 42 42 LYS H H 102 7.880 8.126 -0.246 1
1 492 . 2 1 1 A 42 42 LYS HA H 102 4.430 4.909 -0.479 1
1 501 . 2 1 1 A 42 42 LYS C C 102 176.300 176.268 0.032 1
1 502 . 2 1 1 A 42 42 LYS CA C 102 56.000 54.583 1.417 1
1 503 . 2 1 1 A 42 42 LYS CB C 102 33.400 35.117 -1.717 1
1 507 . 2 1 1 A 42 42 LYS N N 102 121.700 120.027 1.673 1
1 508 . 2 1 1 A 43 43 SER H H 103 9.160 9.545 -0.385 1
1 509 . 2 1 1 A 43 43 SER HA H 103 4.620 4.572 0.048 1
1 513 . 2 1 1 A 43 43 SER C C 103 176.300 175.354 0.946 1
1 514 . 2 1 1 A 43 43 SER CA C 103 58.700 59.204 -0.504 1
1 515 . 2 1 1 A 43 43 SER CB C 103 63.700 63.373 0.327 1
1 516 . 2 1 1 A 43 43 SER N N 103 118.800 118.785 0.015 1
1 517 . 2 1 1 A 44 44 LEU H H 104 8.860 8.836 0.024 1
1 518 . 2 1 1 A 44 44 LEU HA H 104 4.130 4.254 -0.124 1
1 528 . 2 1 1 A 44 44 LEU C C 104 178.700 178.460 0.240 1
1 529 . 2 1 1 A 44 44 LEU CA C 104 58.800 58.584 0.216 1
1 530 . 2 1 1 A 44 44 LEU CB C 104 42.600 41.544 1.056 1
1 534 . 2 1 1 A 44 44 LEU N N 104 124.200 128.746 -4.546 1
1 535 . 2 1 1 A 45 45 SER H H 105 8.330 8.179 0.151 1
1 536 . 2 1 1 A 45 45 SER HA H 105 4.310 4.457 -0.147 1
1 539 . 2 1 1 A 45 45 SER C C 105 175.000 175.240 -0.240 1
1 540 . 2 1 1 A 45 45 SER CA C 105 60.100 60.294 -0.194 1
1 541 . 2 1 1 A 45 45 SER CB C 105 63.400 63.559 -0.159 1
1 542 . 2 1 1 A 45 45 SER N N 105 107.700 114.215 -6.515 1
1 543 . 2 1 1 A 46 46 GLU H H 106 7.800 8.391 -0.591 1
1 544 . 2 1 1 A 46 46 GLU HA H 106 4.570 4.349 0.221 1
1 549 . 2 1 1 A 46 46 GLU C C 106 174.100 175.711 -1.611 1
1 550 . 2 1 1 A 46 46 GLU CA C 106 55.600 55.960 -0.360 1
1 551 . 2 1 1 A 46 46 GLU CB C 106 31.200 29.349 1.851 1
1 553 . 2 1 1 A 46 46 GLU N N 106 119.600 117.441 2.159 1
1 554 . 2 1 1 A 47 47 ILE H H 107 7.100 7.452 -0.352 1
1 555 . 2 1 1 A 47 47 ILE HA H 107 4.040 4.233 -0.193 1
1 565 . 2 1 1 A 47 47 ILE C C 107 174.100 175.582 -1.482 1
1 566 . 2 1 1 A 47 47 ILE CA C 107 62.300 60.660 1.640 1
1 567 . 2 1 1 A 47 47 ILE CB C 107 38.500 37.250 1.250 1
1 571 . 2 1 1 A 47 47 ILE N N 107 120.600 122.700 -2.100 1
1 572 . 2 1 1 A 48 48 LEU H H 108 9.180 8.574 0.606 1
1 573 . 2 1 1 A 48 48 LEU HA H 108 4.940 4.708 0.232 1
1 583 . 2 1 1 A 48 48 LEU CA C 108 51.900 53.155 -1.255 1
1 584 . 2 1 1 A 48 48 LEU CB C 108 42.000 41.753 0.247 1
1 588 . 2 1 1 A 48 48 LEU N N 108 129.400 127.995 1.405 1
1 589 . 2 1 1 A 49 49 PRO HA H 109 3.910 4.229 -0.319 1
1 596 . 2 1 1 A 49 49 PRO C C 109 178.500 178.028 0.472 1
1 597 . 2 1 1 A 49 49 PRO CA C 109 66.600 65.007 1.593 1
1 598 . 2 1 1 A 49 49 PRO CB C 109 31.300 31.750 -0.450 1
1 601 . 2 1 1 A 50 50 ALA H H 110 8.280 8.399 -0.119 1
1 602 . 2 1 1 A 50 50 ALA HA H 110 4.110 4.040 0.070 1
1 606 . 2 1 1 A 50 50 ALA C C 110 179.700 179.933 -0.233 1
1 607 . 2 1 1 A 50 50 ALA CA C 110 55.100 55.230 -0.130 1
1 608 . 2 1 1 A 50 50 ALA CB C 110 19.200 18.389 0.811 1
1 609 . 2 1 1 A 50 50 ALA N N 110 116.100 119.172 -3.072 1
1 610 . 2 1 1 A 51 51 ASP H H 111 7.790 7.901 -0.111 1
1 611 . 2 1 1 A 51 51 ASP HA H 111 4.440 4.331 0.109 1
1 614 . 2 1 1 A 51 51 ASP C C 111 178.200 178.673 -0.473 1
1 615 . 2 1 1 A 51 51 ASP CA C 111 57.600 57.206 0.394 1
1 616 . 2 1 1 A 51 51 ASP CB C 111 41.800 40.972 0.828 1
1 617 . 2 1 1 A 51 51 ASP N N 111 116.500 117.911 -1.411 1
1 618 . 2 1 1 A 52 52 ILE H H 112 7.020 7.504 -0.484 1
1 619 . 2 1 1 A 52 52 ILE HA H 112 3.750 3.664 0.086 1
1 629 . 2 1 1 A 52 52 ILE C C 112 177.300 177.858 -0.558 1
1 630 . 2 1 1 A 52 52 ILE CA C 112 63.500 64.906 -1.406 1
1 631 . 2 1 1 A 52 52 ILE CB C 112 37.500 36.959 0.541 1
1 635 . 2 1 1 A 52 52 ILE N N 112 116.700 119.821 -3.121 1
1 636 . 2 1 1 A 53 53 GLN H H 113 9.150 8.293 0.857 1
1 637 . 2 1 1 A 53 53 GLN HA H 113 3.720 3.999 -0.279 1
1 644 . 2 1 1 A 53 53 GLN C C 113 177.500 178.211 -0.711 1
1 645 . 2 1 1 A 53 53 GLN CA C 113 58.200 58.561 -0.361 1
1 646 . 2 1 1 A 53 53 GLN CB C 113 30.200 28.451 1.749 1
1 649 . 2 1 1 A 53 53 GLN N N 113 121.200 121.485 -0.285 1
1 651 . 2 1 1 A 54 54 SER H H 114 8.150 8.018 0.132 1
1 652 . 2 1 1 A 54 54 SER HA H 114 4.180 4.103 0.077 1
1 655 . 2 1 1 A 54 54 SER C C 114 175.900 175.988 -0.088 1
1 656 . 2 1 1 A 54 54 SER CA C 114 62.100 62.770 -0.670 1
1 657 . 2 1 1 A 54 54 SER CB C 114 62.800 62.850 -0.050 1
1 658 . 2 1 1 A 54 54 SER N N 114 112.200 116.913 -4.713 1
1 659 . 2 1 1 A 55 55 ILE H H 115 6.760 7.593 -0.833 1
1 660 . 2 1 1 A 55 55 ILE HA H 115 3.860 3.649 0.211 1
1 670 . 2 1 1 A 55 55 ILE C C 115 179.200 177.893 1.307 1
1 671 . 2 1 1 A 55 55 ILE CA C 115 64.700 64.926 -0.226 1
1 672 . 2 1 1 A 55 55 ILE CB C 115 38.900 38.061 0.839 1
1 676 . 2 1 1 A 55 55 ILE N N 115 119.500 120.619 -1.119 1
1 677 . 2 1 1 A 56 56 ILE H H 116 7.750 8.012 -0.262 1
1 678 . 2 1 1 A 56 56 ILE HA H 116 3.690 3.873 -0.183 1
1 688 . 2 1 1 A 56 56 ILE C C 116 176.900 178.598 -1.698 1
1 689 . 2 1 1 A 56 56 ILE CA C 116 62.800 63.799 -0.999 1
1 690 . 2 1 1 A 56 56 ILE CB C 116 36.200 37.376 -1.176 1
1 694 . 2 1 1 A 56 56 ILE N N 116 120.200 119.840 0.360 1
1 695 . 2 1 1 A 57 57 ASN H H 117 8.690 7.914 0.776 1
1 696 . 2 1 1 A 57 57 ASN HA H 117 4.440 4.489 -0.049 1
1 701 . 2 1 1 A 57 57 ASN C C 117 177.200 177.607 -0.407 1
1 702 . 2 1 1 A 57 57 ASN CA C 117 54.800 55.740 -0.940 1
1 703 . 2 1 1 A 57 57 ASN CB C 117 38.100 38.754 -0.654 1
1 705 . 2 1 1 A 57 57 ASN N N 117 117.000 120.349 -3.349 1
1 707 . 2 1 1 A 58 58 GLU H H 118 7.630 7.771 -0.141 1
1 708 . 2 1 1 A 58 58 GLU HA H 118 4.450 4.355 0.095 1
1 713 . 2 1 1 A 58 58 GLU C C 118 176.500 177.535 -1.035 1
1 714 . 2 1 1 A 58 58 GLU CA C 118 56.200 57.874 -1.674 1
1 715 . 2 1 1 A 58 58 GLU CB C 118 30.200 30.087 0.113 1
1 717 . 2 1 1 A 58 58 GLU N N 118 116.300 117.001 -0.701 1
1 718 . 2 1 1 A 59 59 THR H H 119 7.540 7.725 -0.185 1
1 719 . 2 1 1 A 59 59 THR HA H 119 4.230 4.240 -0.010 1
1 724 . 2 1 1 A 59 59 THR C C 119 174.200 174.248 -0.048 1
1 725 . 2 1 1 A 59 59 THR CA C 119 63.800 64.068 -0.268 1
1 726 . 2 1 1 A 59 59 THR CB C 119 68.900 68.974 -0.074 1
1 728 . 2 1 1 A 59 59 THR N N 119 117.600 116.392 1.208 1
1 729 . 2 1 1 A 60 60 LYS H H 120 8.860 9.065 -0.205 1
1 730 . 2 1 1 A 60 60 LYS HA H 120 4.490 4.694 -0.204 1
1 739 . 2 1 1 A 60 60 LYS C C 120 175.800 175.214 0.586 1
1 740 . 2 1 1 A 60 60 LYS CA C 120 54.900 55.039 -0.139 1
1 741 . 2 1 1 A 60 60 LYS CB C 120 29.800 32.796 -2.996 1
1 745 . 2 1 1 A 60 60 LYS N N 120 128.500 128.198 0.302 1
1 746 . 2 1 1 A 61 61 LEU H H 121 7.150 8.195 -1.045 1
1 747 . 2 1 1 A 61 61 LEU HA H 121 4.710 4.902 -0.192 1
1 757 . 2 1 1 A 61 61 LEU C C 121 175.000 176.087 -1.087 1
1 758 . 2 1 1 A 61 61 LEU CA C 121 52.800 53.341 -0.541 1
1 759 . 2 1 1 A 61 61 LEU CB C 121 46.400 43.383 3.017 1
1 763 . 2 1 1 A 61 61 LEU N N 121 120.700 126.726 -6.026 1
1 764 . 2 1 1 A 62 62 ALA H H 122 8.000 8.478 -0.478 1
1 765 . 2 1 1 A 62 62 ALA HA H 122 4.250 4.309 -0.059 1
1 769 . 2 1 1 A 62 62 ALA CA C 122 52.100 52.722 -0.622 1
1 770 . 2 1 1 A 62 62 ALA CB C 122 19.500 18.887 0.613 1
1 771 . 2 1 1 A 62 62 ALA N N 122 119.900 123.307 -3.407 1
1 772 . 2 1 1 A 63 63 LYS H H 123 8.770 8.723 0.047 1
1 773 . 2 1 1 A 63 63 LYS HA H 123 3.800 3.932 -0.132 1
1 782 . 2 1 1 A 63 63 LYS C C 123 178.300 179.110 -0.810 1
1 783 . 2 1 1 A 63 63 LYS CA C 123 60.700 59.901 0.799 1
1 784 . 2 1 1 A 63 63 LYS CB C 123 32.300 32.078 0.222 1
1 788 . 2 1 1 A 63 63 LYS N N 123 121.400 124.928 -3.528 1
1 789 . 2 1 1 A 64 64 ASN H H 124 9.020 8.171 0.849 1
1 790 . 2 1 1 A 64 64 ASN HA H 124 4.430 4.471 -0.041 1
1 795 . 2 1 1 A 64 64 ASN C C 124 178.300 177.946 0.354 1
1 796 . 2 1 1 A 64 64 ASN CA C 124 56.200 56.524 -0.324 1
1 797 . 2 1 1 A 64 64 ASN CB C 124 37.300 39.268 -1.968 1
1 799 . 2 1 1 A 64 64 ASN N N 124 115.000 118.000 -3.000 1
1 801 . 2 1 1 A 65 65 THR H H 125 7.620 7.868 -0.248 1
1 802 . 2 1 1 A 65 65 THR HA H 125 4.030 4.017 0.013 1
1 807 . 2 1 1 A 65 65 THR C C 125 175.500 176.926 -1.426 1
1 808 . 2 1 1 A 65 65 THR CA C 125 66.000 66.782 -0.782 1
1 809 . 2 1 1 A 65 65 THR CB C 125 67.600 68.256 -0.656 1
1 811 . 2 1 1 A 65 65 THR N N 125 119.800 115.969 3.831 1
1 812 . 2 1 1 A 66 66 LEU H H 126 8.020 8.410 -0.390 1
1 813 . 2 1 1 A 66 66 LEU HA H 126 3.790 3.838 -0.048 1
1 823 . 2 1 1 A 66 66 LEU C C 126 179.200 179.221 -0.021 1
1 824 . 2 1 1 A 66 66 LEU CA C 126 58.700 58.001 0.699 1
1 825 . 2 1 1 A 66 66 LEU CB C 126 41.300 41.276 0.024 1
1 829 . 2 1 1 A 66 66 LEU N N 126 121.200 121.857 -0.657 1
1 830 . 2 1 1 A 67 67 LYS H H 127 8.380 8.505 -0.125 1
1 831 . 2 1 1 A 67 67 LYS HA H 127 3.740 3.889 -0.149 1
1 840 . 2 1 1 A 67 67 LYS C C 127 178.300 179.063 -0.763 1
1 841 . 2 1 1 A 67 67 LYS CA C 127 60.100 60.048 0.052 1
1 842 . 2 1 1 A 67 67 LYS CB C 127 32.400 32.268 0.132 1
1 846 . 2 1 1 A 67 67 LYS N N 127 117.000 117.885 -0.885 1
1 847 . 2 1 1 A 68 68 ALA H H 128 7.480 7.681 -0.201 1
1 848 . 2 1 1 A 68 68 ALA HA H 128 4.210 3.980 0.230 1
1 852 . 2 1 1 A 68 68 ALA C C 128 181.200 179.887 1.313 1
1 853 . 2 1 1 A 68 68 ALA CA C 128 55.200 55.106 0.094 1
1 854 . 2 1 1 A 68 68 ALA CB C 128 18.600 17.924 0.676 1
1 855 . 2 1 1 A 68 68 ALA N N 128 122.900 121.903 0.997 1
1 856 . 2 1 1 A 69 69 ILE H H 129 8.250 7.946 0.304 1
1 857 . 2 1 1 A 69 69 ILE HA H 129 3.130 3.097 0.033 1
1 867 . 2 1 1 A 69 69 ILE C C 129 177.400 177.939 -0.539 1
1 868 . 2 1 1 A 69 69 ILE CA C 129 66.700 65.321 1.379 1
1 869 . 2 1 1 A 69 69 ILE CB C 129 37.900 37.527 0.373 1
1 873 . 2 1 1 A 69 69 ILE N N 129 122.800 117.960 4.840 1
1 874 . 2 1 1 A 70 70 ARG H H 130 8.040 7.922 0.118 1
1 875 . 2 1 1 A 70 70 ARG HA H 130 3.620 3.870 -0.250 1
1 882 . 2 1 1 A 70 70 ARG C C 130 177.800 178.851 -1.051 1
1 883 . 2 1 1 A 70 70 ARG CA C 130 60.700 59.966 0.734 1
1 884 . 2 1 1 A 70 70 ARG CB C 130 29.600 30.014 -0.414 1
1 887 . 2 1 1 A 70 70 ARG N N 130 119.700 120.469 -0.769 1
1 888 . 2 1 1 A 71 71 ASN H H 131 8.920 8.811 0.109 1
1 889 . 2 1 1 A 71 71 ASN HA H 131 4.430 4.784 -0.354 1
1 894 . 2 1 1 A 71 71 ASN C C 131 177.500 177.866 -0.366 1
1 895 . 2 1 1 A 71 71 ASN CA C 131 56.100 56.084 0.016 1
1 896 . 2 1 1 A 71 71 ASN CB C 131 38.600 37.935 0.665 1
1 898 . 2 1 1 A 71 71 ASN N N 131 117.200 117.403 -0.203 1
1 900 . 2 1 1 A 72 72 THR H H 132 8.300 8.194 0.106 1
1 901 . 2 1 1 A 72 72 THR HA H 132 4.430 3.722 0.708 1
1 906 . 2 1 1 A 72 72 THR C C 132 175.100 176.426 -1.326 1
1 907 . 2 1 1 A 72 72 THR CA C 132 68.200 65.911 2.289 1
1 908 . 2 1 1 A 72 72 THR CB C 132 68.500 68.272 0.228 1
1 910 . 2 1 1 A 72 72 THR N N 132 119.200 116.492 2.708 1
1 911 . 2 1 1 A 73 73 ALA H H 133 7.950 8.075 -0.125 1
1 912 . 2 1 1 A 73 73 ALA HA H 133 4.040 4.074 -0.034 1
1 916 . 2 1 1 A 73 73 ALA C C 133 178.200 179.810 -1.610 1
1 917 . 2 1 1 A 73 73 ALA CA C 133 55.900 55.446 0.454 1
1 918 . 2 1 1 A 73 73 ALA CB C 133 16.700 18.152 -1.452 1
1 919 . 2 1 1 A 73 73 ALA N N 133 120.900 123.699 -2.799 1
1 920 . 2 1 1 A 74 74 SER H H 134 8.440 8.305 0.135 1
1 921 . 2 1 1 A 74 74 SER HA H 134 4.430 4.284 0.146 1
1 924 . 2 1 1 A 74 74 SER C C 134 178.800 177.254 1.546 1
1 925 . 2 1 1 A 74 74 SER CA C 134 61.300 61.437 -0.137 1
1 926 . 2 1 1 A 74 74 SER CB C 134 62.600 62.528 0.072 1
1 927 . 2 1 1 A 74 74 SER N N 134 110.100 113.179 -3.079 1
1 928 . 2 1 1 A 75 75 GLN H H 135 8.340 7.253 1.087 1
1 929 . 2 1 1 A 75 75 GLN HA H 135 3.880 4.136 -0.256 1
1 936 . 2 1 1 A 75 75 GLN C C 135 178.800 179.025 -0.225 1
1 937 . 2 1 1 A 75 75 GLN CA C 135 59.600 58.663 0.937 1
1 938 . 2 1 1 A 75 75 GLN CB C 135 29.900 28.414 1.486 1
1 941 . 2 1 1 A 75 75 GLN N N 135 118.100 121.593 -3.493 1
1 943 . 2 1 1 A 76 76 ILE H H 136 7.670 7.754 -0.084 1
1 944 . 2 1 1 A 76 76 ILE HA H 136 3.200 3.551 -0.351 1
1 954 . 2 1 1 A 76 76 ILE C C 136 177.500 177.869 -0.369 1
1 955 . 2 1 1 A 76 76 ILE CA C 136 66.100 65.305 0.795 1
1 956 . 2 1 1 A 76 76 ILE CB C 136 37.400 37.379 0.021 1
1 960 . 2 1 1 A 76 76 ILE N N 136 122.500 120.663 1.837 1
1 961 . 2 1 1 A 77 77 PHE H H 137 7.930 8.106 -0.176 1
1 962 . 2 1 1 A 77 77 PHE HA H 137 3.890 4.081 -0.191 1
1 969 . 2 1 1 A 77 77 PHE C C 137 178.200 179.003 -0.803 1
1 970 . 2 1 1 A 77 77 PHE CA C 137 63.600 60.187 3.413 1
1 971 . 2 1 1 A 77 77 PHE CB C 137 39.300 38.712 0.588 1
1 976 . 2 1 1 A 77 77 PHE N N 137 116.100 118.803 -2.703 1
1 977 . 2 1 1 A 78 78 ARG H H 138 8.900 7.979 0.921 1
1 978 . 2 1 1 A 78 78 ARG HA H 138 3.910 4.111 -0.201 1
1 986 . 2 1 1 A 78 78 ARG C C 138 178.300 178.520 -0.220 1
1 987 . 2 1 1 A 78 78 ARG CA C 138 60.100 58.541 1.559 1
1 988 . 2 1 1 A 78 78 ARG CB C 138 29.600 29.651 -0.051 1
1 991 . 2 1 1 A 78 78 ARG N N 138 118.600 118.802 -0.202 1
1 993 . 2 1 1 A 79 79 LEU H H 139 7.730 7.844 -0.114 1
1 994 . 2 1 1 A 79 79 LEU HA H 139 4.280 4.071 0.209 1
1 1004 . 2 1 1 A 79 79 LEU C C 139 179.000 178.281 0.719 1
1 1005 . 2 1 1 A 79 79 LEU CA C 139 57.800 57.286 0.514 1
1 1006 . 2 1 1 A 79 79 LEU CB C 139 41.900 41.234 0.666 1
1 1010 . 2 1 1 A 79 79 LEU N N 139 121.900 122.694 -0.794 1
1 1011 . 2 1 1 A 80 80 ALA H H 140 7.590 7.155 0.435 1
1 1012 . 2 1 1 A 80 80 ALA HA H 140 2.710 2.753 -0.043 1
1 1016 . 2 1 1 A 80 80 ALA C C 140 179.900 179.674 0.226 1
1 1017 . 2 1 1 A 80 80 ALA CA C 140 55.100 54.283 0.817 1
1 1018 . 2 1 1 A 80 80 ALA CB C 140 17.600 17.329 0.271 1
1 1019 . 2 1 1 A 80 80 ALA N N 140 123.400 120.430 2.970 1
1 1020 . 2 1 1 A 81 81 ILE H H 141 8.910 7.738 1.172 1
1 1021 . 2 1 1 A 81 81 ILE HA H 141 4.110 3.869 0.241 1
1 1031 . 2 1 1 A 81 81 ILE C C 141 181.700 178.174 3.526 1
1 1032 . 2 1 1 A 81 81 ILE CA C 141 64.800 65.299 -0.499 1
1 1033 . 2 1 1 A 81 81 ILE CB C 141 38.600 37.726 0.874 1
1 1037 . 2 1 1 A 81 81 ILE N N 141 122.400 118.727 3.673 1
1 1038 . 2 1 1 A 82 82 GLU H H 142 8.560 8.813 -0.253 1
1 1039 . 2 1 1 A 82 82 GLU HA H 142 4.100 4.213 -0.113 1
1 1044 . 2 1 1 A 82 82 GLU C C 142 177.700 176.939 0.761 1
1 1045 . 2 1 1 A 82 82 GLU CA C 142 59.100 58.027 1.073 1
1 1046 . 2 1 1 A 82 82 GLU CB C 142 29.200 28.414 0.786 1
1 1048 . 2 1 1 A 82 82 GLU N N 142 123.200 119.698 3.502 1
1 1049 . 2 1 1 A 83 83 ASN H H 143 7.310 7.569 -0.259 1
1 1050 . 2 1 1 A 83 83 ASN HA H 143 4.750 4.909 -0.159 1
1 1055 . 2 1 1 A 83 83 ASN C C 143 173.200 174.259 -1.059 1
1 1056 . 2 1 1 A 83 83 ASN CA C 143 54.200 52.877 1.323 1
1 1057 . 2 1 1 A 83 83 ASN CB C 143 41.300 38.897 2.403 1
1 1059 . 2 1 1 A 83 83 ASN N N 143 114.900 117.397 -2.497 1
1 1061 . 2 1 1 A 84 84 ARG H H 144 8.320 8.212 0.108 1
1 1062 . 2 1 1 A 84 84 ARG HA H 144 4.120 4.063 0.057 1
1 1069 . 2 1 1 A 84 84 ARG C C 144 175.300 176.008 -0.708 1
1 1070 . 2 1 1 A 84 84 ARG CA C 144 57.100 57.029 0.071 1
1 1071 . 2 1 1 A 84 84 ARG CB C 144 26.000 26.920 -0.920 1
1 1074 . 2 1 1 A 84 84 ARG N N 144 114.400 115.161 -0.761 1
1 1075 . 2 1 1 A 85 85 ALA H H 145 8.350 8.173 0.177 1
1 1076 . 2 1 1 A 85 85 ALA HA H 145 4.320 4.307 0.013 1
1 1080 . 2 1 1 A 85 85 ALA C C 145 176.500 177.368 -0.868 1
1 1081 . 2 1 1 A 85 85 ALA CA C 145 53.400 54.078 -0.678 1
1 1082 . 2 1 1 A 85 85 ALA CB C 145 19.900 19.647 0.253 1
1 1083 . 2 1 1 A 85 85 ALA N N 145 120.600 119.638 0.962 1
1 1084 . 2 1 1 A 86 86 ILE H H 146 7.290 7.682 -0.392 1
1 1085 . 2 1 1 A 86 86 ILE HA H 146 4.400 4.741 -0.341 1
1 1095 . 2 1 1 A 86 86 ILE C C 146 173.600 174.313 -0.713 1
1 1096 . 2 1 1 A 86 86 ILE CA C 146 59.200 59.618 -0.418 1
1 1097 . 2 1 1 A 86 86 ILE CB C 146 41.600 41.924 -0.324 1
1 1101 . 2 1 1 A 86 86 ILE N N 146 111.500 115.907 -4.407 1
1 1102 . 2 1 1 A 87 87 ASP H H 147 8.270 8.948 -0.678 1
1 1103 . 2 1 1 A 87 87 ASP HA H 147 4.940 4.902 0.038 1
1 1106 . 2 1 1 A 87 87 ASP C C 147 174.700 175.559 -0.859 1
1 1107 . 2 1 1 A 87 87 ASP CA C 147 53.700 53.430 0.270 1
1 1108 . 2 1 1 A 87 87 ASP CB C 147 41.800 41.554 0.246 1
1 1109 . 2 1 1 A 87 87 ASP N N 147 119.400 127.200 -7.800 1
1 1110 . 2 1 1 A 88 88 PHE H H 148 7.230 7.650 -0.420 1
1 1111 . 2 1 1 A 88 88 PHE HA H 148 4.690 4.842 -0.152 1
1 1119 . 2 1 1 A 88 88 PHE C C 148 171.500 172.788 -1.288 1
1 1120 . 2 1 1 A 88 88 PHE CA C 148 56.400 57.278 -0.878 1
1 1121 . 2 1 1 A 88 88 PHE CB C 148 42.000 42.617 -0.617 1
1 1127 . 2 1 1 A 88 88 PHE N N 148 119.700 119.201 0.499 1
1 1128 . 2 1 1 A 89 89 ASN H H 149 8.060 8.233 -0.173 1
1 1129 . 2 1 1 A 89 89 ASN HA H 149 4.490 5.097 -0.607 1
1 1134 . 2 1 1 A 89 89 ASN CA C 149 48.100 49.329 -1.229 1
1 1135 . 2 1 1 A 89 89 ASN CB C 149 39.200 39.718 -0.518 1
1 1137 . 2 1 1 A 89 89 ASN N N 149 119.700 125.463 -5.763 1
1 1139 . 2 1 1 A 90 90 PRO HA H 150 3.970 4.313 -0.343 1
1 1146 . 2 1 1 A 90 90 PRO C C 150 177.700 177.908 -0.208 1
1 1147 . 2 1 1 A 90 90 PRO CA C 150 63.900 64.609 -0.709 1
1 1148 . 2 1 1 A 90 90 PRO CB C 150 31.700 31.672 0.028 1
1 1151 . 2 1 1 A 91 91 ALA H H 151 7.240 7.197 0.043 1
1 1152 . 2 1 1 A 91 91 ALA HA H 151 3.900 3.976 -0.076 1
1 1156 . 2 1 1 A 91 91 ALA C C 151 178.000 179.294 -1.294 1
1 1157 . 2 1 1 A 91 91 ALA CA C 151 53.900 54.444 -0.544 1
1 1158 . 2 1 1 A 91 91 ALA CB C 151 17.700 18.237 -0.537 1
1 1159 . 2 1 1 A 91 91 ALA N N 151 115.700 118.687 -2.987 1
1 1160 . 2 1 1 A 92 92 ASP H H 152 7.080 8.138 -1.058 1
1 1161 . 2 1 1 A 92 92 ASP HA H 152 4.220 4.359 -0.139 1
1 1164 . 2 1 1 A 92 92 ASP C C 152 176.200 176.169 0.031 1
1 1165 . 2 1 1 A 92 92 ASP CA C 152 55.800 55.263 0.537 1
1 1166 . 2 1 1 A 92 92 ASP CB C 152 39.500 38.941 0.559 1
1 1167 . 2 1 1 A 92 92 ASP N N 152 117.100 117.071 0.029 1
1 1168 . 2 1 1 A 93 93 TYR H H 153 7.060 7.370 -0.310 1
1 1169 . 2 1 1 A 93 93 TYR HA H 153 4.490 4.526 -0.036 1
1 1176 . 2 1 1 A 93 93 TYR C C 153 174.700 175.451 -0.751 1
1 1177 . 2 1 1 A 93 93 TYR CA C 153 57.600 58.639 -1.039 1
1 1178 . 2 1 1 A 93 93 TYR CB C 153 38.500 38.605 -0.105 1
1 1183 . 2 1 1 A 93 93 TYR N N 153 116.800 118.197 -1.397 1
1 1184 . 2 1 1 A 94 94 VAL H H 154 7.000 7.180 -0.180 1
1 1185 . 2 1 1 A 94 94 VAL HA H 154 4.040 4.063 -0.023 1
1 1193 . 2 1 1 A 94 94 VAL C C 154 174.700 175.008 -0.308 1
1 1194 . 2 1 1 A 94 94 VAL CA C 154 62.100 62.423 -0.323 1
1 1195 . 2 1 1 A 94 94 VAL CB C 154 32.700 32.449 0.251 1
1 1198 . 2 1 1 A 94 94 VAL N N 154 120.600 120.687 -0.087 1
1 1199 . 2 1 1 A 95 95 ARG H H 155 9.430 9.036 0.394 1
1 1200 . 2 1 1 A 95 95 ARG HA H 155 4.640 4.985 -0.345 1
1 1207 . 2 1 1 A 95 95 ARG C C 155 175.400 175.185 0.215 1
1 1208 . 2 1 1 A 95 95 ARG CA C 155 54.200 54.555 -0.355 1
1 1209 . 2 1 1 A 95 95 ARG CB C 155 32.400 32.603 -0.203 1
1 1212 . 2 1 1 A 95 95 ARG N N 155 128.200 127.638 0.562 1
1 1213 . 2 1 1 A 96 96 ILE H H 156 8.700 8.696 0.004 1
1 1214 . 2 1 1 A 96 96 ILE HA H 156 4.440 4.538 -0.098 1
1 1224 . 2 1 1 A 96 96 ILE CA C 156 56.500 58.298 -1.798 1
1 1225 . 2 1 1 A 96 96 ILE CB C 156 36.700 37.431 -0.731 1
1 1229 . 2 1 1 A 96 96 ILE N N 156 124.100 126.194 -2.094 1
1 1230 . 2 1 1 A 97 97 PRO HA H 157 4.370 4.285 0.085 1
1 1237 . 2 1 1 A 97 97 PRO C C 157 176.000 176.938 -0.938 1
1 1238 . 2 1 1 A 97 97 PRO CA C 157 63.200 63.905 -0.705 1
1 1239 . 2 1 1 A 97 97 PRO CB C 157 32.400 31.661 0.739 1
1 1242 . 2 1 1 A 98 98 LYS H H 158 8.380 8.602 -0.222 1
1 1243 . 2 1 1 A 98 98 LYS HA H 158 4.190 3.866 0.324 1
1 1252 . 2 1 1 A 98 98 LYS C C 158 176.800 175.733 1.067 1
1 1253 . 2 1 1 A 98 98 LYS CA C 158 57.100 58.127 -1.027 1
1 1254 . 2 1 1 A 98 98 LYS CB C 158 32.800 30.026 2.774 1
1 1258 . 2 1 1 A 98 98 LYS N N 158 120.800 115.851 4.949 1
1 1259 . 2 1 1 A 99 99 ILE H H 159 7.930 8.579 -0.649 1
1 1260 . 2 1 1 A 99 99 ILE HA H 159 4.200 4.251 -0.051 1
1 1270 . 2 1 1 A 99 99 ILE C C 159 175.400 175.793 -0.393 1
1 1271 . 2 1 1 A 99 99 ILE CA C 159 60.600 60.814 -0.214 1
1 1272 . 2 1 1 A 99 99 ILE CB C 159 39.100 38.483 0.617 1
1 1276 . 2 1 1 A 99 99 ILE N N 159 120.200 120.284 -0.084 1
1 1277 . 2 1 1 A 100 100 ALA H H 160 8.370 8.880 -0.510 1
1 1278 . 2 1 1 A 100 100 ALA HA H 160 4.370 4.839 -0.469 1
1 1282 . 2 1 1 A 100 100 ALA C C 160 177.200 176.051 1.149 1
1 1283 . 2 1 1 A 100 100 ALA CA C 160 52.200 50.674 1.526 1
1 1284 . 2 1 1 A 100 100 ALA CB C 160 19.400 22.549 -3.149 1
1 1285 . 2 1 1 A 100 100 ALA N N 160 128.300 129.505 -1.205 1
1 1286 . 2 1 1 A 101 101 LEU H H 161 8.250 8.282 -0.032 1
1 1287 . 2 1 1 A 101 101 LEU HA H 161 4.280 4.556 -0.276 1
1 1297 . 2 1 1 A 101 101 LEU C C 161 177.200 176.283 0.917 1
1 1298 . 2 1 1 A 101 101 LEU CA C 161 55.200 53.889 1.311 1
1 1299 . 2 1 1 A 101 101 LEU CB C 161 42.400 43.332 -0.932 1
1 1303 . 2 1 1 A 101 101 LEU N N 161 121.900 119.548 2.352 1
1 1304 . 2 1 1 A 102 102 GLU H H 162 8.390 8.900 -0.510 1
1 1305 . 2 1 1 A 102 102 GLU HA H 162 4.230 4.222 0.008 1
1 1310 . 2 1 1 A 102 102 GLU C C 162 176.100 175.918 0.182 1
1 1311 . 2 1 1 A 102 102 GLU CA C 162 56.400 58.629 -2.229 1
1 1312 . 2 1 1 A 102 102 GLU CB C 162 30.500 28.410 2.090 1
1 1314 . 2 1 1 A 102 102 GLU N N 162 121.300 117.372 3.928 1
1 1315 . 2 1 1 A 103 103 HIS H H 163 8.330 8.292 0.038 1
1 1316 . 2 1 1 A 103 103 HIS HA H 163 4.590 5.601 -1.011 1
1 1319 . 2 1 1 A 103 103 HIS C C 163 176.100 175.169 0.931 1
1 1320 . 2 1 1 A 103 103 HIS CA C 163 56.000 54.109 1.891 1
1 1321 . 2 1 1 A 103 103 HIS CB C 163 30.500 31.773 -1.273 1
1 1322 . 2 1 1 A 103 103 HIS N N 163 120.000 116.496 3.504 1
1 1323 . 2 1 1 A 107 107 HIS HA H 167 4.620 4.460 0.160 1
1 1326 . 2 1 1 A 107 107 HIS C C 167 173.900 173.373 0.527 1
1 1327 . 2 1 1 A 107 107 HIS CA C 167 56.000 55.672 0.328 1
1 1328 . 2 1 1 A 107 107 HIS CB C 167 30.300 33.208 -2.908 1
1 15 . 3 1 1 A 2 2 ASP H H 62 8.760 8.110 0.650 1
1 16 . 3 1 1 A 2 2 ASP HA H 62 4.810 4.428 0.382 1
1 19 . 3 1 1 A 2 2 ASP C C 62 175.800 175.612 0.188 1
1 20 . 3 1 1 A 2 2 ASP CA C 62 54.800 55.389 -0.589 1
1 21 . 3 1 1 A 2 2 ASP CB C 62 41.600 39.497 2.103 1
1 22 . 3 1 1 A 2 2 ASP N N 62 120.900 118.713 2.187 1
1 23 . 3 1 1 A 3 3 SER H H 63 8.710 8.334 0.376 1
1 24 . 3 1 1 A 3 3 SER HA H 63 4.970 4.752 0.218 1
1 27 . 3 1 1 A 3 3 SER C C 63 175.600 175.360 0.240 1
1 28 . 3 1 1 A 3 3 SER CA C 63 57.500 58.531 -1.031 1
1 29 . 3 1 1 A 3 3 SER CB C 63 65.900 64.538 1.362 1
1 30 . 3 1 1 A 3 3 SER N N 63 116.300 114.741 1.559 1
1 31 . 3 1 1 A 4 4 PHE H H 64 9.370 9.742 -0.372 1
1 32 . 3 1 1 A 4 4 PHE HA H 64 4.010 4.086 -0.076 1
1 39 . 3 1 1 A 4 4 PHE C C 64 176.700 177.639 -0.939 1
1 40 . 3 1 1 A 4 4 PHE CA C 64 62.200 61.607 0.593 1
1 41 . 3 1 1 A 4 4 PHE CB C 64 38.500 39.416 -0.916 1
1 46 . 3 1 1 A 4 4 PHE N N 64 121.400 124.991 -3.591 1
1 47 . 3 1 1 A 5 5 GLY H H 65 8.930 8.307 0.623 1
1 48 . 3 1 1 A 5 5 GLY HA2 H 65 2.020 2.430 -0.410 1
1 49 . 3 1 1 A 5 5 GLY HA3 H 65 3.250 3.089 0.161 1
1 50 . 3 1 1 A 5 5 GLY C C 65 175.200 174.725 0.475 1
1 51 . 3 1 1 A 5 5 GLY CA C 65 46.300 45.980 0.320 1
1 52 . 3 1 1 A 5 5 GLY N N 65 106.500 105.722 0.778 1
1 53 . 3 1 1 A 6 6 ASP H H 66 7.630 7.824 -0.194 1
1 54 . 3 1 1 A 6 6 ASP HA H 66 4.100 4.231 -0.131 1
1 57 . 3 1 1 A 6 6 ASP C C 66 179.500 178.609 0.891 1
1 58 . 3 1 1 A 6 6 ASP CA C 66 57.400 56.675 0.725 1
1 59 . 3 1 1 A 6 6 ASP CB C 66 40.500 41.143 -0.643 1
1 60 . 3 1 1 A 6 6 ASP N N 66 120.500 121.114 -0.614 1
1 61 . 3 1 1 A 7 7 TRP H H 67 7.190 8.298 -1.108 1
1 62 . 3 1 1 A 7 7 TRP HA H 67 3.860 4.250 -0.390 1
1 71 . 3 1 1 A 7 7 TRP C C 67 177.200 178.295 -1.095 1
1 72 . 3 1 1 A 7 7 TRP CA C 67 61.100 60.028 1.072 1
1 73 . 3 1 1 A 7 7 TRP CB C 67 28.300 29.142 -0.842 1
1 79 . 3 1 1 A 7 7 TRP N N 67 120.700 120.199 0.501 1
1 81 . 3 1 1 A 8 8 ALA H H 68 9.040 8.351 0.689 1
1 82 . 3 1 1 A 8 8 ALA HA H 68 3.730 3.809 -0.079 1
1 86 . 3 1 1 A 8 8 ALA C C 68 179.500 179.635 -0.135 1
1 87 . 3 1 1 A 8 8 ALA CA C 68 55.200 55.168 0.032 1
1 88 . 3 1 1 A 8 8 ALA CB C 68 18.600 17.874 0.726 1
1 89 . 3 1 1 A 8 8 ALA N N 68 125.700 122.359 3.341 1
1 90 . 3 1 1 A 9 9 GLU H H 69 8.060 7.795 0.265 1
1 91 . 3 1 1 A 9 9 GLU HA H 69 4.020 4.073 -0.053 1
1 96 . 3 1 1 A 9 9 GLU C C 69 180.400 178.594 1.806 1
1 97 . 3 1 1 A 9 9 GLU CA C 69 58.800 59.334 -0.534 1
1 98 . 3 1 1 A 9 9 GLU CB C 69 28.500 29.243 -0.743 1
1 99 . 3 1 1 A 9 9 GLU N N 69 115.400 118.568 -3.168 1
1 100 . 3 1 1 A 10 10 LYS H H 70 7.740 7.666 0.074 1
1 101 . 3 1 1 A 10 10 LYS HA H 70 3.910 3.995 -0.085 1
1 110 . 3 1 1 A 10 10 LYS C C 70 179.500 179.007 0.493 1
1 111 . 3 1 1 A 10 10 LYS CA C 70 60.000 59.476 0.524 1
1 112 . 3 1 1 A 10 10 LYS CB C 70 32.400 32.150 0.250 1
1 116 . 3 1 1 A 10 10 LYS N N 70 122.700 119.147 3.553 1
1 117 . 3 1 1 A 11 11 PHE H H 71 8.750 8.169 0.581 1
1 118 . 3 1 1 A 11 11 PHE HA H 71 4.080 4.155 -0.075 1
1 126 . 3 1 1 A 11 11 PHE C C 71 177.100 177.487 -0.387 1
1 127 . 3 1 1 A 11 11 PHE CA C 71 61.200 61.249 -0.049 1
1 128 . 3 1 1 A 11 11 PHE CB C 71 38.900 39.283 -0.383 1
1 134 . 3 1 1 A 11 11 PHE N N 71 123.500 120.498 3.002 1
1 135 . 3 1 1 A 12 12 LEU H H 72 8.400 8.903 -0.503 1
1 136 . 3 1 1 A 12 12 LEU HA H 72 3.520 3.711 -0.191 1
1 146 . 3 1 1 A 12 12 LEU C C 72 180.000 179.272 0.728 1
1 147 . 3 1 1 A 12 12 LEU CA C 72 58.200 57.890 0.310 1
1 148 . 3 1 1 A 12 12 LEU CB C 72 41.700 41.495 0.205 1
1 152 . 3 1 1 A 12 12 LEU N N 72 121.100 119.561 1.539 1
1 153 . 3 1 1 A 13 13 LYS H H 73 7.810 8.246 -0.436 1
1 154 . 3 1 1 A 13 13 LYS HA H 73 4.080 4.008 0.072 1
1 156 . 3 1 1 A 13 13 LYS C C 73 179.300 178.499 0.801 1
1 157 . 3 1 1 A 13 13 LYS CA C 73 59.000 58.798 0.202 1
1 158 . 3 1 1 A 13 13 LYS CB C 73 31.900 31.996 -0.096 1
1 159 . 3 1 1 A 13 13 LYS N N 73 119.400 120.248 -0.848 1
1 160 . 3 1 1 A 14 14 SER H H 74 8.210 7.767 0.443 1
1 161 . 3 1 1 A 14 14 SER HA H 74 4.210 4.133 0.077 1
1 164 . 3 1 1 A 14 14 SER C C 74 176.300 176.864 -0.564 1
1 165 . 3 1 1 A 14 14 SER CA C 74 61.400 61.166 0.234 1
1 166 . 3 1 1 A 14 14 SER CB C 74 62.600 62.739 -0.139 1
1 167 . 3 1 1 A 14 14 SER N N 74 117.600 114.759 2.841 1
1 168 . 3 1 1 A 15 15 LYS H H 75 7.760 7.879 -0.119 1
1 169 . 3 1 1 A 15 15 LYS HA H 75 4.040 3.803 0.237 1
1 178 . 3 1 1 A 15 15 LYS C C 75 178.500 178.231 0.269 1
1 179 . 3 1 1 A 15 15 LYS CA C 75 56.500 59.126 -2.626 1
1 180 . 3 1 1 A 15 15 LYS CB C 75 30.600 31.414 -0.814 1
1 184 . 3 1 1 A 15 15 LYS N N 75 120.100 121.004 -0.904 1
1 185 . 3 1 1 A 16 16 GLU H H 76 7.680 8.474 -0.794 1
1 186 . 3 1 1 A 16 16 GLU HA H 76 4.030 4.002 0.028 1
1 191 . 3 1 1 A 16 16 GLU C C 76 179.900 178.712 1.188 1
1 192 . 3 1 1 A 16 16 GLU CA C 76 59.200 59.690 -0.490 1
1 193 . 3 1 1 A 16 16 GLU CB C 76 29.600 29.235 0.365 1
1 195 . 3 1 1 A 16 16 GLU N N 76 119.700 118.796 0.904 1
1 196 . 3 1 1 A 17 17 ALA H H 77 8.030 7.746 0.284 1
1 197 . 3 1 1 A 17 17 ALA HA H 77 4.200 4.041 0.159 1
1 201 . 3 1 1 A 17 17 ALA C C 77 178.900 179.762 -0.862 1
1 202 . 3 1 1 A 17 17 ALA CA C 77 54.400 54.711 -0.311 1
1 203 . 3 1 1 A 17 17 ALA CB C 77 18.100 18.198 -0.098 1
1 204 . 3 1 1 A 17 17 ALA N N 77 123.000 121.155 1.845 1
1 205 . 3 1 1 A 18 18 ASP H H 78 7.860 8.174 -0.314 1
1 206 . 3 1 1 A 18 18 ASP HA H 78 4.600 4.551 0.049 1
1 209 . 3 1 1 A 18 18 ASP C C 78 177.500 176.274 1.226 1
1 210 . 3 1 1 A 18 18 ASP CA C 78 55.100 54.731 0.369 1
1 211 . 3 1 1 A 18 18 ASP CB C 78 41.400 41.176 0.224 1
1 212 . 3 1 1 A 18 18 ASP N N 78 117.700 116.250 1.450 1
1 213 . 3 1 1 A 19 19 GLY H H 79 7.910 7.635 0.275 1
1 214 . 3 1 1 A 19 19 GLY HA2 H 79 3.860 3.984 -0.124 1
1 215 . 3 1 1 A 19 19 GLY HA3 H 79 4.080 3.986 0.094 1
1 216 . 3 1 1 A 19 19 GLY C C 79 175.300 174.678 0.622 1
1 217 . 3 1 1 A 19 19 GLY CA C 79 46.200 46.234 -0.034 1
1 218 . 3 1 1 A 19 19 GLY N N 79 107.100 107.310 -0.210 1
1 219 . 3 1 1 A 20 20 VAL H H 80 7.150 7.796 -0.646 1
1 220 . 3 1 1 A 20 20 VAL HA H 80 4.250 4.554 -0.304 1
1 228 . 3 1 1 A 20 20 VAL C C 80 175.100 175.818 -0.718 1
1 229 . 3 1 1 A 20 20 VAL CA C 80 61.800 60.194 1.606 1
1 230 . 3 1 1 A 20 20 VAL CB C 80 32.200 33.629 -1.429 1
1 233 . 3 1 1 A 20 20 VAL N N 80 114.600 115.975 -1.375 1
1 234 . 3 1 1 A 21 21 SER H H 81 8.560 8.141 0.419 1
1 235 . 3 1 1 A 21 21 SER HA H 81 4.390 4.459 -0.069 1
1 238 . 3 1 1 A 21 21 SER C C 81 174.600 175.160 -0.560 1
1 239 . 3 1 1 A 21 21 SER CA C 81 57.900 58.875 -0.975 1
1 240 . 3 1 1 A 21 21 SER CB C 81 64.700 63.910 0.790 1
1 241 . 3 1 1 A 21 21 SER N N 81 118.700 119.682 -0.982 1
1 242 . 3 1 1 A 22 22 VAL H H 82 8.690 8.554 0.136 1
1 243 . 3 1 1 A 22 22 VAL HA H 82 3.700 3.856 -0.156 1
1 251 . 3 1 1 A 22 22 VAL C C 82 178.000 177.727 0.273 1
1 252 . 3 1 1 A 22 22 VAL CA C 82 66.500 65.348 1.152 1
1 253 . 3 1 1 A 22 22 VAL CB C 82 31.700 31.614 0.086 1
1 256 . 3 1 1 A 22 22 VAL N N 82 122.100 126.246 -4.146 1
1 257 . 3 1 1 A 23 23 SER H H 83 8.300 8.095 0.205 1
1 258 . 3 1 1 A 23 23 SER HA H 83 4.210 4.263 -0.053 1
1 261 . 3 1 1 A 23 23 SER C C 83 177.600 176.282 1.318 1
1 262 . 3 1 1 A 23 23 SER CA C 83 61.400 61.431 -0.031 1
1 263 . 3 1 1 A 23 23 SER CB C 83 62.400 63.170 -0.770 1
1 264 . 3 1 1 A 23 23 SER N N 83 113.600 117.957 -4.357 1
1 265 . 3 1 1 A 24 24 GLN H H 84 7.820 7.986 -0.166 1
1 266 . 3 1 1 A 24 24 GLN HA H 84 3.970 3.972 -0.002 1
1 273 . 3 1 1 A 24 24 GLN C C 84 178.400 177.799 0.601 1
1 274 . 3 1 1 A 24 24 GLN CA C 84 58.400 58.601 -0.201 1
1 275 . 3 1 1 A 24 24 GLN CB C 84 28.900 28.393 0.507 1
1 278 . 3 1 1 A 24 24 GLN N N 84 122.900 122.099 0.801 1
1 280 . 3 1 1 A 25 25 LEU H H 85 8.920 8.045 0.875 1
1 281 . 3 1 1 A 25 25 LEU HA H 85 4.130 4.282 -0.152 1
1 291 . 3 1 1 A 25 25 LEU C C 85 178.800 178.941 -0.141 1
1 292 . 3 1 1 A 25 25 LEU CA C 85 58.300 57.820 0.480 1
1 293 . 3 1 1 A 25 25 LEU CB C 85 41.200 42.059 -0.859 1
1 297 . 3 1 1 A 25 25 LEU N N 85 122.200 121.301 0.899 1
1 298 . 3 1 1 A 26 26 ASN H H 86 8.860 8.183 0.677 1
1 299 . 3 1 1 A 26 26 ASN HA H 86 4.420 4.438 -0.018 1
1 304 . 3 1 1 A 26 26 ASN C C 86 179.000 177.832 1.168 1
1 305 . 3 1 1 A 26 26 ASN CA C 86 55.900 56.096 -0.196 1
1 306 . 3 1 1 A 26 26 ASN CB C 86 37.200 37.682 -0.482 1
1 308 . 3 1 1 A 26 26 ASN N N 86 117.600 117.857 -0.257 1
1 310 . 3 1 1 A 27 27 SER H H 87 7.840 8.128 -0.288 1
1 311 . 3 1 1 A 27 27 SER HA H 87 4.100 4.040 0.060 1
1 314 . 3 1 1 A 27 27 SER C C 87 179.000 176.319 2.681 1
1 315 . 3 1 1 A 27 27 SER CA C 87 62.100 60.916 1.184 1
1 316 . 3 1 1 A 27 27 SER CB C 87 62.100 62.458 -0.358 1
1 317 . 3 1 1 A 27 27 SER N N 87 118.500 114.371 4.129 1
1 318 . 3 1 1 A 28 28 TYR H H 88 8.180 7.108 1.072 1
1 319 . 3 1 1 A 28 28 TYR HA H 88 4.600 4.445 0.155 1
1 326 . 3 1 1 A 28 28 TYR C C 88 174.800 178.584 -3.784 1
1 327 . 3 1 1 A 28 28 TYR CA C 88 61.200 61.688 -0.488 1
1 328 . 3 1 1 A 28 28 TYR CB C 88 37.800 38.062 -0.262 1
1 333 . 3 1 1 A 28 28 TYR N N 88 119.300 119.742 -0.442 1
1 334 . 3 1 1 A 29 29 LYS H H 89 9.040 7.947 1.093 1
1 335 . 3 1 1 A 29 29 LYS HA H 89 3.890 4.109 -0.219 1
1 344 . 3 1 1 A 29 29 LYS C C 89 179.000 179.771 -0.771 1
1 345 . 3 1 1 A 29 29 LYS CA C 89 61.300 59.210 2.090 1
1 346 . 3 1 1 A 29 29 LYS CB C 89 32.800 31.904 0.896 1
1 350 . 3 1 1 A 29 29 LYS N N 89 119.300 120.123 -0.823 1
1 351 . 3 1 1 A 30 30 ASN H H 90 7.770 8.025 -0.255 1
1 352 . 3 1 1 A 30 30 ASN HA H 90 4.560 4.342 0.218 1
1 357 . 3 1 1 A 30 30 ASN C C 90 178.300 177.761 0.539 1
1 358 . 3 1 1 A 30 30 ASN CA C 90 56.200 56.486 -0.286 1
1 359 . 3 1 1 A 30 30 ASN CB C 90 38.900 37.727 1.173 1
1 361 . 3 1 1 A 30 30 ASN N N 90 117.800 117.749 0.051 1
1 363 . 3 1 1 A 31 31 TYR H H 91 8.860 7.336 1.524 1
1 364 . 3 1 1 A 31 31 TYR HA H 91 4.910 4.550 0.360 1
1 371 . 3 1 1 A 31 31 TYR C C 91 178.300 178.482 -0.182 1
1 372 . 3 1 1 A 31 31 TYR CA C 91 59.700 60.819 -1.119 1
1 373 . 3 1 1 A 31 31 TYR CB C 91 37.500 39.047 -1.547 1
1 378 . 3 1 1 A 31 31 TYR N N 91 119.400 118.561 0.839 1
1 379 . 3 1 1 A 32 32 CYS H H 92 8.640 8.735 -0.095 1
1 380 . 3 1 1 A 32 32 CYS HA H 92 4.410 4.317 0.093 1
1 383 . 3 1 1 A 32 32 CYS C C 92 173.700 177.471 -3.771 1
1 384 . 3 1 1 A 32 32 CYS CA C 92 65.500 62.748 2.752 1
1 385 . 3 1 1 A 32 32 CYS CB C 92 28.300 27.085 1.215 1
1 386 . 3 1 1 A 32 32 CYS N N 92 113.500 119.434 -5.934 1
1 387 . 3 1 1 A 33 33 ARG H H 93 8.440 8.356 0.084 1
1 388 . 3 1 1 A 33 33 ARG HA H 93 3.740 4.072 -0.332 1
1 391 . 3 1 1 A 33 33 ARG C C 93 177.200 178.173 -0.973 1
1 392 . 3 1 1 A 33 33 ARG CA C 93 58.300 59.021 -0.721 1
1 393 . 3 1 1 A 33 33 ARG CB C 93 30.200 29.624 0.576 1
1 394 . 3 1 1 A 33 33 ARG N N 93 111.400 121.534 -10.134 1
1 395 . 3 1 1 A 34 34 ASN H H 94 8.020 8.187 -0.167 1
1 396 . 3 1 1 A 34 34 ASN HA H 94 4.980 4.773 0.207 1
1 401 . 3 1 1 A 34 34 ASN C C 94 176.700 177.317 -0.617 1
1 402 . 3 1 1 A 34 34 ASN CA C 94 53.400 54.976 -1.576 1
1 403 . 3 1 1 A 34 34 ASN CB C 94 38.000 39.205 -1.205 1
1 405 . 3 1 1 A 34 34 ASN N N 94 113.600 117.492 -3.892 1
1 407 . 3 1 1 A 35 35 HIS H H 95 7.200 7.930 -0.730 1
1 408 . 3 1 1 A 35 35 HIS HA H 95 4.470 4.602 -0.132 1
1 411 . 3 1 1 A 35 35 HIS C C 95 176.600 176.504 0.096 1
1 412 . 3 1 1 A 35 35 HIS CA C 95 60.000 58.171 1.829 1
1 413 . 3 1 1 A 35 35 HIS CB C 95 30.500 30.681 -0.181 1
1 414 . 3 1 1 A 35 35 HIS N N 95 115.600 115.913 -0.313 1
1 415 . 3 1 1 A 36 36 LEU H H 96 8.170 7.624 0.546 1
1 416 . 3 1 1 A 36 36 LEU HA H 96 4.730 4.671 0.059 1
1 426 . 3 1 1 A 36 36 LEU C C 96 176.800 177.243 -0.443 1
1 427 . 3 1 1 A 36 36 LEU CA C 96 54.400 54.753 -0.353 1
1 428 . 3 1 1 A 36 36 LEU CB C 96 40.600 42.709 -2.109 1
1 432 . 3 1 1 A 36 36 LEU N N 96 114.000 118.501 -4.501 1
1 433 . 3 1 1 A 37 37 SER H H 97 7.140 8.426 -1.286 1
1 434 . 3 1 1 A 37 37 SER HA H 97 4.730 4.355 0.375 1
1 437 . 3 1 1 A 37 37 SER CA C 97 62.700 62.724 -0.024 1
1 438 . 3 1 1 A 37 37 SER CB C 97 62.600 61.965 0.635 1
1 439 . 3 1 1 A 37 37 SER N N 97 117.200 116.152 1.048 1
1 440 . 3 1 1 A 38 38 PRO HA H 98 4.560 4.441 0.119 1
1 447 . 3 1 1 A 38 38 PRO C C 98 177.900 177.991 -0.091 1
1 448 . 3 1 1 A 38 38 PRO CA C 98 65.700 65.375 0.325 1
1 449 . 3 1 1 A 38 38 PRO CB C 98 31.800 31.121 0.679 1
1 452 . 3 1 1 A 39 39 LEU H H 99 8.090 7.901 0.189 1
1 453 . 3 1 1 A 39 39 LEU HA H 99 4.260 4.243 0.017 1
1 463 . 3 1 1 A 39 39 LEU C C 99 178.700 178.510 0.190 1
1 464 . 3 1 1 A 39 39 LEU CA C 99 54.300 56.767 -2.467 1
1 465 . 3 1 1 A 39 39 LEU CB C 99 42.400 42.303 0.097 1
1 469 . 3 1 1 A 39 39 LEU N N 99 112.400 117.079 -4.679 1
1 470 . 3 1 1 A 40 40 TYR H H 100 8.350 8.419 -0.069 1
1 471 . 3 1 1 A 40 40 TYR HA H 100 4.170 4.259 -0.089 1
1 478 . 3 1 1 A 40 40 TYR C C 100 178.300 177.690 0.610 1
1 479 . 3 1 1 A 40 40 TYR CA C 100 63.400 62.057 1.343 1
1 480 . 3 1 1 A 40 40 TYR CB C 100 38.600 39.021 -0.421 1
1 485 . 3 1 1 A 40 40 TYR N N 100 119.400 121.148 -1.748 1
1 486 . 3 1 1 A 41 41 MET H H 101 8.640 8.293 0.347 1
1 487 . 3 1 1 A 41 41 MET HA H 101 4.260 4.580 -0.320 1
1 488 . 3 1 1 A 41 41 MET C C 101 177.000 175.605 1.395 1
1 489 . 3 1 1 A 41 41 MET CA C 101 54.600 54.886 -0.286 1
1 490 . 3 1 1 A 41 41 MET N N 101 111.800 115.229 -3.429 1
1 491 . 3 1 1 A 42 42 LYS H H 102 7.880 7.729 0.151 1
1 492 . 3 1 1 A 42 42 LYS HA H 102 4.430 4.850 -0.420 1
1 501 . 3 1 1 A 42 42 LYS C C 102 176.300 176.007 0.293 1
1 502 . 3 1 1 A 42 42 LYS CA C 102 56.000 54.378 1.622 1
1 503 . 3 1 1 A 42 42 LYS CB C 102 33.400 34.202 -0.802 1
1 507 . 3 1 1 A 42 42 LYS N N 102 121.700 120.263 1.437 1
1 508 . 3 1 1 A 43 43 SER H H 103 9.160 9.177 -0.017 1
1 509 . 3 1 1 A 43 43 SER HA H 103 4.620 4.688 -0.068 1
1 513 . 3 1 1 A 43 43 SER C C 103 176.300 176.008 0.292 1
1 514 . 3 1 1 A 43 43 SER CA C 103 58.700 59.248 -0.548 1
1 515 . 3 1 1 A 43 43 SER CB C 103 63.700 63.502 0.198 1
1 516 . 3 1 1 A 43 43 SER N N 103 118.800 117.845 0.955 1
1 517 . 3 1 1 A 44 44 LEU H H 104 8.860 8.636 0.224 1
1 518 . 3 1 1 A 44 44 LEU HA H 104 4.130 4.264 -0.134 1
1 528 . 3 1 1 A 44 44 LEU C C 104 178.700 177.792 0.908 1
1 529 . 3 1 1 A 44 44 LEU CA C 104 58.800 57.427 1.373 1
1 530 . 3 1 1 A 44 44 LEU CB C 104 42.600 42.061 0.539 1
1 534 . 3 1 1 A 44 44 LEU N N 104 124.200 125.339 -1.139 1
1 535 . 3 1 1 A 45 45 SER H H 105 8.330 7.944 0.386 1
1 536 . 3 1 1 A 45 45 SER HA H 105 4.310 4.437 -0.127 1
1 539 . 3 1 1 A 45 45 SER C C 105 175.000 175.779 -0.779 1
1 540 . 3 1 1 A 45 45 SER CA C 105 60.100 60.348 -0.248 1
1 541 . 3 1 1 A 45 45 SER CB C 105 63.400 63.382 0.018 1
1 542 . 3 1 1 A 45 45 SER N N 105 107.700 113.852 -6.152 1
1 543 . 3 1 1 A 46 46 GLU H H 106 7.800 8.154 -0.354 1
1 544 . 3 1 1 A 46 46 GLU HA H 106 4.570 4.333 0.237 1
1 549 . 3 1 1 A 46 46 GLU C C 106 174.100 176.598 -2.498 1
1 550 . 3 1 1 A 46 46 GLU CA C 106 55.600 57.057 -1.457 1
1 551 . 3 1 1 A 46 46 GLU CB C 106 31.200 29.234 1.966 1
1 553 . 3 1 1 A 46 46 GLU N N 106 119.600 117.699 1.901 1
1 554 . 3 1 1 A 47 47 ILE H H 107 7.100 7.423 -0.323 1
1 555 . 3 1 1 A 47 47 ILE HA H 107 4.040 4.005 0.035 1
1 565 . 3 1 1 A 47 47 ILE C C 107 174.100 175.354 -1.254 1
1 566 . 3 1 1 A 47 47 ILE CA C 107 62.300 62.228 0.072 1
1 567 . 3 1 1 A 47 47 ILE CB C 107 38.500 37.982 0.518 1
1 571 . 3 1 1 A 47 47 ILE N N 107 120.600 123.412 -2.812 1
1 572 . 3 1 1 A 48 48 LEU H H 108 9.180 8.814 0.366 1
1 573 . 3 1 1 A 48 48 LEU HA H 108 4.940 4.746 0.194 1
1 583 . 3 1 1 A 48 48 LEU CA C 108 51.900 51.491 0.409 1
1 584 . 3 1 1 A 48 48 LEU CB C 108 42.000 42.289 -0.289 1
1 588 . 3 1 1 A 48 48 LEU N N 108 129.400 128.111 1.289 1
1 589 . 3 1 1 A 49 49 PRO HA H 109 3.910 4.257 -0.347 1
1 596 . 3 1 1 A 49 49 PRO C C 109 178.500 178.079 0.421 1
1 597 . 3 1 1 A 49 49 PRO CA C 109 66.600 65.124 1.476 1
1 598 . 3 1 1 A 49 49 PRO CB C 109 31.300 31.717 -0.417 1
1 601 . 3 1 1 A 50 50 ALA H H 110 8.280 8.138 0.142 1
1 602 . 3 1 1 A 50 50 ALA HA H 110 4.110 4.059 0.051 1
1 606 . 3 1 1 A 50 50 ALA C C 110 179.700 179.746 -0.046 1
1 607 . 3 1 1 A 50 50 ALA CA C 110 55.100 54.959 0.141 1
1 608 . 3 1 1 A 50 50 ALA CB C 110 19.200 18.348 0.852 1
1 609 . 3 1 1 A 50 50 ALA N N 110 116.100 119.203 -3.103 1
1 610 . 3 1 1 A 51 51 ASP H H 111 7.790 8.006 -0.216 1
1 611 . 3 1 1 A 51 51 ASP HA H 111 4.440 4.347 0.093 1
1 614 . 3 1 1 A 51 51 ASP C C 111 178.200 178.484 -0.284 1
1 615 . 3 1 1 A 51 51 ASP CA C 111 57.600 57.618 -0.018 1
1 616 . 3 1 1 A 51 51 ASP CB C 111 41.800 41.299 0.501 1
1 617 . 3 1 1 A 51 51 ASP N N 111 116.500 118.245 -1.745 1
1 618 . 3 1 1 A 52 52 ILE H H 112 7.020 7.846 -0.826 1
1 619 . 3 1 1 A 52 52 ILE HA H 112 3.750 3.700 0.050 1
1 629 . 3 1 1 A 52 52 ILE C C 112 177.300 177.752 -0.452 1
1 630 . 3 1 1 A 52 52 ILE CA C 112 63.500 65.086 -1.586 1
1 631 . 3 1 1 A 52 52 ILE CB C 112 37.500 37.228 0.272 1
1 635 . 3 1 1 A 52 52 ILE N N 112 116.700 119.380 -2.680 1
1 636 . 3 1 1 A 53 53 GLN H H 113 9.150 8.246 0.904 1
1 637 . 3 1 1 A 53 53 GLN HA H 113 3.720 3.968 -0.248 1
1 644 . 3 1 1 A 53 53 GLN C C 113 177.500 178.089 -0.589 1
1 645 . 3 1 1 A 53 53 GLN CA C 113 58.200 58.782 -0.582 1
1 646 . 3 1 1 A 53 53 GLN CB C 113 30.200 28.718 1.482 1
1 649 . 3 1 1 A 53 53 GLN N N 113 121.200 121.128 0.072 1
1 651 . 3 1 1 A 54 54 SER H H 114 8.150 8.084 0.066 1
1 652 . 3 1 1 A 54 54 SER HA H 114 4.180 4.136 0.044 1
1 655 . 3 1 1 A 54 54 SER C C 114 175.900 176.389 -0.489 1
1 656 . 3 1 1 A 54 54 SER CA C 114 62.100 62.566 -0.466 1
1 657 . 3 1 1 A 54 54 SER CB C 114 62.800 62.833 -0.033 1
1 658 . 3 1 1 A 54 54 SER N N 114 112.200 116.641 -4.441 1
1 659 . 3 1 1 A 55 55 ILE H H 115 6.760 7.608 -0.848 1
1 660 . 3 1 1 A 55 55 ILE HA H 115 3.860 3.671 0.189 1
1 670 . 3 1 1 A 55 55 ILE C C 115 179.200 178.347 0.853 1
1 671 . 3 1 1 A 55 55 ILE CA C 115 64.700 64.810 -0.110 1
1 672 . 3 1 1 A 55 55 ILE CB C 115 38.900 37.968 0.932 1
1 676 . 3 1 1 A 55 55 ILE N N 115 119.500 120.709 -1.209 1
1 677 . 3 1 1 A 56 56 ILE H H 116 7.750 8.429 -0.679 1
1 678 . 3 1 1 A 56 56 ILE HA H 116 3.690 3.546 0.144 1
1 688 . 3 1 1 A 56 56 ILE C C 116 176.900 178.103 -1.203 1
1 689 . 3 1 1 A 56 56 ILE CA C 116 62.800 65.292 -2.492 1
1 690 . 3 1 1 A 56 56 ILE CB C 116 36.200 37.556 -1.356 1
1 694 . 3 1 1 A 56 56 ILE N N 116 120.200 120.295 -0.095 1
1 695 . 3 1 1 A 57 57 ASN H H 117 8.690 8.709 -0.019 1
1 696 . 3 1 1 A 57 57 ASN HA H 117 4.440 4.503 -0.063 1
1 701 . 3 1 1 A 57 57 ASN C C 117 177.200 176.897 0.303 1
1 702 . 3 1 1 A 57 57 ASN CA C 117 54.800 56.626 -1.826 1
1 703 . 3 1 1 A 57 57 ASN CB C 117 38.100 39.301 -1.201 1
1 705 . 3 1 1 A 57 57 ASN N N 117 117.000 119.206 -2.206 1
1 707 . 3 1 1 A 58 58 GLU H H 118 7.630 7.624 0.006 1
1 708 . 3 1 1 A 58 58 GLU HA H 118 4.450 4.429 0.021 1
1 713 . 3 1 1 A 58 58 GLU C C 118 176.500 176.152 0.348 1
1 714 . 3 1 1 A 58 58 GLU CA C 118 56.200 56.334 -0.134 1
1 715 . 3 1 1 A 58 58 GLU CB C 118 30.200 30.509 -0.309 1
1 717 . 3 1 1 A 58 58 GLU N N 118 116.300 116.312 -0.012 1
1 718 . 3 1 1 A 59 59 THR H H 119 7.540 7.489 0.051 1
1 719 . 3 1 1 A 59 59 THR HA H 119 4.230 4.456 -0.226 1
1 724 . 3 1 1 A 59 59 THR C C 119 174.200 173.658 0.542 1
1 725 . 3 1 1 A 59 59 THR CA C 119 63.800 62.327 1.473 1
1 726 . 3 1 1 A 59 59 THR CB C 119 68.900 68.889 0.011 1
1 728 . 3 1 1 A 59 59 THR N N 119 117.600 116.362 1.238 1
1 729 . 3 1 1 A 60 60 LYS H H 120 8.860 9.000 -0.140 1
1 730 . 3 1 1 A 60 60 LYS HA H 120 4.490 4.581 -0.091 1
1 739 . 3 1 1 A 60 60 LYS C C 120 175.800 174.874 0.926 1
1 740 . 3 1 1 A 60 60 LYS CA C 120 54.900 55.444 -0.544 1
1 741 . 3 1 1 A 60 60 LYS CB C 120 29.800 31.630 -1.830 1
1 745 . 3 1 1 A 60 60 LYS N N 120 128.500 128.045 0.455 1
1 746 . 3 1 1 A 61 61 LEU H H 121 7.150 7.994 -0.844 1
1 747 . 3 1 1 A 61 61 LEU HA H 121 4.710 4.904 -0.194 1
1 757 . 3 1 1 A 61 61 LEU C C 121 175.000 176.212 -1.212 1
1 758 . 3 1 1 A 61 61 LEU CA C 121 52.800 53.225 -0.425 1
1 759 . 3 1 1 A 61 61 LEU CB C 121 46.400 44.484 1.916 1
1 763 . 3 1 1 A 61 61 LEU N N 121 120.700 124.651 -3.951 1
1 764 . 3 1 1 A 62 62 ALA H H 122 8.000 8.572 -0.572 1
1 765 . 3 1 1 A 62 62 ALA HA H 122 4.250 4.410 -0.160 1
1 769 . 3 1 1 A 62 62 ALA CA C 122 52.100 52.423 -0.323 1
1 770 . 3 1 1 A 62 62 ALA CB C 122 19.500 19.244 0.256 1
1 771 . 3 1 1 A 62 62 ALA N N 122 119.900 123.242 -3.342 1
1 772 . 3 1 1 A 63 63 LYS H H 123 8.770 8.706 0.064 1
1 773 . 3 1 1 A 63 63 LYS HA H 123 3.800 4.031 -0.231 1
1 782 . 3 1 1 A 63 63 LYS C C 123 178.300 178.401 -0.101 1
1 783 . 3 1 1 A 63 63 LYS CA C 123 60.700 59.131 1.569 1
1 784 . 3 1 1 A 63 63 LYS CB C 123 32.300 31.970 0.330 1
1 788 . 3 1 1 A 63 63 LYS N N 123 121.400 121.365 0.035 1
1 789 . 3 1 1 A 64 64 ASN H H 124 9.020 8.028 0.992 1
1 790 . 3 1 1 A 64 64 ASN HA H 124 4.430 4.528 -0.098 1
1 795 . 3 1 1 A 64 64 ASN C C 124 178.300 178.017 0.283 1
1 796 . 3 1 1 A 64 64 ASN CA C 124 56.200 56.141 0.059 1
1 797 . 3 1 1 A 64 64 ASN CB C 124 37.300 38.203 -0.903 1
1 799 . 3 1 1 A 64 64 ASN N N 124 115.000 118.360 -3.360 1
1 801 . 3 1 1 A 65 65 THR H H 125 7.620 7.856 -0.236 1
1 802 . 3 1 1 A 65 65 THR HA H 125 4.030 4.084 -0.054 1
1 807 . 3 1 1 A 65 65 THR C C 125 175.500 176.646 -1.146 1
1 808 . 3 1 1 A 65 65 THR CA C 125 66.000 67.131 -1.131 1
1 809 . 3 1 1 A 65 65 THR CB C 125 67.600 67.785 -0.185 1
1 811 . 3 1 1 A 65 65 THR N N 125 119.800 117.676 2.124 1
1 812 . 3 1 1 A 66 66 LEU H H 126 8.020 8.190 -0.170 1
1 813 . 3 1 1 A 66 66 LEU HA H 126 3.790 3.792 -0.002 1
1 823 . 3 1 1 A 66 66 LEU C C 126 179.200 179.032 0.168 1
1 824 . 3 1 1 A 66 66 LEU CA C 126 58.700 58.168 0.532 1
1 825 . 3 1 1 A 66 66 LEU CB C 126 41.300 41.446 -0.146 1
1 829 . 3 1 1 A 66 66 LEU N N 126 121.200 121.258 -0.058 1
1 830 . 3 1 1 A 67 67 LYS H H 127 8.380 8.074 0.306 1
1 831 . 3 1 1 A 67 67 LYS HA H 127 3.740 4.091 -0.351 1
1 840 . 3 1 1 A 67 67 LYS C C 127 178.300 179.171 -0.871 1
1 841 . 3 1 1 A 67 67 LYS CA C 127 60.100 59.318 0.782 1
1 842 . 3 1 1 A 67 67 LYS CB C 127 32.400 32.142 0.258 1
1 846 . 3 1 1 A 67 67 LYS N N 127 117.000 117.901 -0.901 1
1 847 . 3 1 1 A 68 68 ALA H H 128 7.480 7.864 -0.384 1
1 848 . 3 1 1 A 68 68 ALA HA H 128 4.210 4.021 0.189 1
1 852 . 3 1 1 A 68 68 ALA C C 128 181.200 179.529 1.671 1
1 853 . 3 1 1 A 68 68 ALA CA C 128 55.200 54.614 0.586 1
1 854 . 3 1 1 A 68 68 ALA CB C 128 18.600 18.361 0.239 1
1 855 . 3 1 1 A 68 68 ALA N N 128 122.900 122.066 0.834 1
1 856 . 3 1 1 A 69 69 ILE H H 129 8.250 7.681 0.569 1
1 857 . 3 1 1 A 69 69 ILE HA H 129 3.130 3.113 0.017 1
1 867 . 3 1 1 A 69 69 ILE C C 129 177.400 177.910 -0.510 1
1 868 . 3 1 1 A 69 69 ILE CA C 129 66.700 64.989 1.711 1
1 869 . 3 1 1 A 69 69 ILE CB C 129 37.900 37.774 0.126 1
1 873 . 3 1 1 A 69 69 ILE N N 129 122.800 118.124 4.676 1
1 874 . 3 1 1 A 70 70 ARG H H 130 8.040 7.672 0.368 1
1 875 . 3 1 1 A 70 70 ARG HA H 130 3.620 3.906 -0.286 1
1 882 . 3 1 1 A 70 70 ARG C C 130 177.800 178.871 -1.071 1
1 883 . 3 1 1 A 70 70 ARG CA C 130 60.700 59.906 0.794 1
1 884 . 3 1 1 A 70 70 ARG CB C 130 29.600 29.936 -0.336 1
1 887 . 3 1 1 A 70 70 ARG N N 130 119.700 120.768 -1.068 1
1 888 . 3 1 1 A 71 71 ASN H H 131 8.920 8.564 0.356 1
1 889 . 3 1 1 A 71 71 ASN HA H 131 4.430 4.505 -0.075 1
1 894 . 3 1 1 A 71 71 ASN C C 131 177.500 178.050 -0.550 1
1 895 . 3 1 1 A 71 71 ASN CA C 131 56.100 56.191 -0.091 1
1 896 . 3 1 1 A 71 71 ASN CB C 131 38.600 38.808 -0.208 1
1 898 . 3 1 1 A 71 71 ASN N N 131 117.200 117.882 -0.682 1
1 900 . 3 1 1 A 72 72 THR H H 132 8.300 8.425 -0.125 1
1 901 . 3 1 1 A 72 72 THR HA H 132 4.430 3.778 0.652 1
1 906 . 3 1 1 A 72 72 THR C C 132 175.100 176.761 -1.661 1
1 907 . 3 1 1 A 72 72 THR CA C 132 68.200 66.455 1.745 1
1 908 . 3 1 1 A 72 72 THR CB C 132 68.500 68.822 -0.322 1
1 910 . 3 1 1 A 72 72 THR N N 132 119.200 115.270 3.930 1
1 911 . 3 1 1 A 73 73 ALA H H 133 7.950 8.187 -0.237 1
1 912 . 3 1 1 A 73 73 ALA HA H 133 4.040 3.997 0.043 1
1 916 . 3 1 1 A 73 73 ALA C C 133 178.200 179.729 -1.529 1
1 917 . 3 1 1 A 73 73 ALA CA C 133 55.900 55.294 0.606 1
1 918 . 3 1 1 A 73 73 ALA CB C 133 16.700 18.143 -1.443 1
1 919 . 3 1 1 A 73 73 ALA N N 133 120.900 123.568 -2.668 1
1 920 . 3 1 1 A 74 74 SER H H 134 8.440 8.363 0.077 1
1 921 . 3 1 1 A 74 74 SER HA H 134 4.430 4.339 0.091 1
1 924 . 3 1 1 A 74 74 SER C C 134 178.800 177.037 1.763 1
1 925 . 3 1 1 A 74 74 SER CA C 134 61.300 61.481 -0.181 1
1 926 . 3 1 1 A 74 74 SER CB C 134 62.600 62.491 0.109 1
1 927 . 3 1 1 A 74 74 SER N N 134 110.100 112.988 -2.888 1
1 928 . 3 1 1 A 75 75 GLN H H 135 8.340 6.928 1.412 1
1 929 . 3 1 1 A 75 75 GLN HA H 135 3.880 4.154 -0.274 1
1 936 . 3 1 1 A 75 75 GLN C C 135 178.800 178.253 0.547 1
1 937 . 3 1 1 A 75 75 GLN CA C 135 59.600 58.227 1.373 1
1 938 . 3 1 1 A 75 75 GLN CB C 135 29.900 27.992 1.908 1
1 941 . 3 1 1 A 75 75 GLN N N 135 118.100 121.226 -3.126 1
1 943 . 3 1 1 A 76 76 ILE H H 136 7.670 7.301 0.369 1
1 944 . 3 1 1 A 76 76 ILE HA H 136 3.200 3.325 -0.125 1
1 954 . 3 1 1 A 76 76 ILE C C 136 177.500 177.928 -0.428 1
1 955 . 3 1 1 A 76 76 ILE CA C 136 66.100 64.980 1.120 1
1 956 . 3 1 1 A 76 76 ILE CB C 136 37.400 37.233 0.167 1
1 960 . 3 1 1 A 76 76 ILE N N 136 122.500 120.459 2.041 1
1 961 . 3 1 1 A 77 77 PHE H H 137 7.930 7.814 0.116 1
1 962 . 3 1 1 A 77 77 PHE HA H 137 3.890 4.163 -0.273 1
1 969 . 3 1 1 A 77 77 PHE C C 137 178.200 179.045 -0.845 1
1 970 . 3 1 1 A 77 77 PHE CA C 137 63.600 60.588 3.012 1
1 971 . 3 1 1 A 77 77 PHE CB C 137 39.300 38.536 0.764 1
1 976 . 3 1 1 A 77 77 PHE N N 137 116.100 118.827 -2.727 1
1 977 . 3 1 1 A 78 78 ARG H H 138 8.900 8.043 0.857 1
1 978 . 3 1 1 A 78 78 ARG HA H 138 3.910 4.112 -0.202 1
1 986 . 3 1 1 A 78 78 ARG C C 138 178.300 178.435 -0.135 1
1 987 . 3 1 1 A 78 78 ARG CA C 138 60.100 58.718 1.382 1
1 988 . 3 1 1 A 78 78 ARG CB C 138 29.600 29.643 -0.043 1
1 991 . 3 1 1 A 78 78 ARG N N 138 118.600 118.790 -0.190 1
1 993 . 3 1 1 A 79 79 LEU H H 139 7.730 7.775 -0.045 1
1 994 . 3 1 1 A 79 79 LEU HA H 139 4.280 4.145 0.135 1
1 1004 . 3 1 1 A 79 79 LEU C C 139 179.000 178.494 0.506 1
1 1005 . 3 1 1 A 79 79 LEU CA C 139 57.800 57.453 0.347 1
1 1006 . 3 1 1 A 79 79 LEU CB C 139 41.900 41.422 0.478 1
1 1010 . 3 1 1 A 79 79 LEU N N 139 121.900 122.740 -0.840 1
1 1011 . 3 1 1 A 80 80 ALA H H 140 7.590 7.149 0.441 1
1 1012 . 3 1 1 A 80 80 ALA HA H 140 2.710 3.032 -0.322 1
1 1016 . 3 1 1 A 80 80 ALA C C 140 179.900 179.997 -0.097 1
1 1017 . 3 1 1 A 80 80 ALA CA C 140 55.100 54.331 0.769 1
1 1018 . 3 1 1 A 80 80 ALA CB C 140 17.600 17.577 0.023 1
1 1019 . 3 1 1 A 80 80 ALA N N 140 123.400 120.445 2.955 1
1 1020 . 3 1 1 A 81 81 ILE H H 141 8.910 7.707 1.203 1
1 1021 . 3 1 1 A 81 81 ILE HA H 141 4.110 4.228 -0.118 1
1 1031 . 3 1 1 A 81 81 ILE C C 141 181.700 178.181 3.519 1
1 1032 . 3 1 1 A 81 81 ILE CA C 141 64.800 65.412 -0.612 1
1 1033 . 3 1 1 A 81 81 ILE CB C 141 38.600 37.873 0.727 1
1 1037 . 3 1 1 A 81 81 ILE N N 141 122.400 118.819 3.581 1
1 1038 . 3 1 1 A 82 82 GLU H H 142 8.560 9.081 -0.521 1
1 1039 . 3 1 1 A 82 82 GLU HA H 142 4.100 4.181 -0.081 1
1 1044 . 3 1 1 A 82 82 GLU C C 142 177.700 177.325 0.375 1
1 1045 . 3 1 1 A 82 82 GLU CA C 142 59.100 58.226 0.874 1
1 1046 . 3 1 1 A 82 82 GLU CB C 142 29.200 27.601 1.599 1
1 1048 . 3 1 1 A 82 82 GLU N N 142 123.200 119.952 3.248 1
1 1049 . 3 1 1 A 83 83 ASN H H 143 7.310 7.852 -0.542 1
1 1050 . 3 1 1 A 83 83 ASN HA H 143 4.750 4.903 -0.153 1
1 1055 . 3 1 1 A 83 83 ASN C C 143 173.200 174.348 -1.148 1
1 1056 . 3 1 1 A 83 83 ASN CA C 143 54.200 52.828 1.372 1
1 1057 . 3 1 1 A 83 83 ASN CB C 143 41.300 38.931 2.369 1
1 1059 . 3 1 1 A 83 83 ASN N N 143 114.900 117.171 -2.271 1
1 1061 . 3 1 1 A 84 84 ARG H H 144 8.320 8.070 0.250 1
1 1062 . 3 1 1 A 84 84 ARG HA H 144 4.120 4.052 0.068 1
1 1069 . 3 1 1 A 84 84 ARG C C 144 175.300 175.875 -0.575 1
1 1070 . 3 1 1 A 84 84 ARG CA C 144 57.100 57.075 0.025 1
1 1071 . 3 1 1 A 84 84 ARG CB C 144 26.000 26.978 -0.978 1
1 1074 . 3 1 1 A 84 84 ARG N N 144 114.400 115.111 -0.711 1
1 1075 . 3 1 1 A 85 85 ALA H H 145 8.350 8.064 0.286 1
1 1076 . 3 1 1 A 85 85 ALA HA H 145 4.320 4.234 0.086 1
1 1080 . 3 1 1 A 85 85 ALA C C 145 176.500 177.483 -0.983 1
1 1081 . 3 1 1 A 85 85 ALA CA C 145 53.400 54.135 -0.735 1
1 1082 . 3 1 1 A 85 85 ALA CB C 145 19.900 19.677 0.223 1
1 1083 . 3 1 1 A 85 85 ALA N N 145 120.600 119.813 0.787 1
1 1084 . 3 1 1 A 86 86 ILE H H 146 7.290 7.208 0.082 1
1 1085 . 3 1 1 A 86 86 ILE HA H 146 4.400 4.640 -0.240 1
1 1095 . 3 1 1 A 86 86 ILE C C 146 173.600 174.200 -0.600 1
1 1096 . 3 1 1 A 86 86 ILE CA C 146 59.200 60.131 -0.931 1
1 1097 . 3 1 1 A 86 86 ILE CB C 146 41.600 41.804 -0.204 1
1 1101 . 3 1 1 A 86 86 ILE N N 146 111.500 115.949 -4.449 1
1 1102 . 3 1 1 A 87 87 ASP H H 147 8.270 8.715 -0.445 1
1 1103 . 3 1 1 A 87 87 ASP HA H 147 4.940 4.843 0.097 1
1 1106 . 3 1 1 A 87 87 ASP C C 147 174.700 175.393 -0.693 1
1 1107 . 3 1 1 A 87 87 ASP CA C 147 53.700 53.218 0.482 1
1 1108 . 3 1 1 A 87 87 ASP CB C 147 41.800 40.992 0.808 1
1 1109 . 3 1 1 A 87 87 ASP N N 147 119.400 126.521 -7.121 1
1 1110 . 3 1 1 A 88 88 PHE H H 148 7.230 7.703 -0.473 1
1 1111 . 3 1 1 A 88 88 PHE HA H 148 4.690 4.913 -0.223 1
1 1119 . 3 1 1 A 88 88 PHE C C 148 171.500 173.184 -1.684 1
1 1120 . 3 1 1 A 88 88 PHE CA C 148 56.400 56.646 -0.246 1
1 1121 . 3 1 1 A 88 88 PHE CB C 148 42.000 42.375 -0.375 1
1 1127 . 3 1 1 A 88 88 PHE N N 148 119.700 120.052 -0.352 1
1 1128 . 3 1 1 A 89 89 ASN H H 149 8.060 8.232 -0.172 1
1 1129 . 3 1 1 A 89 89 ASN HA H 149 4.490 4.856 -0.366 1
1 1134 . 3 1 1 A 89 89 ASN CA C 149 48.100 48.534 -0.434 1
1 1135 . 3 1 1 A 89 89 ASN CB C 149 39.200 39.501 -0.301 1
1 1137 . 3 1 1 A 89 89 ASN N N 149 119.700 125.856 -6.156 1
1 1139 . 3 1 1 A 90 90 PRO HA H 150 3.970 4.363 -0.393 1
1 1146 . 3 1 1 A 90 90 PRO C C 150 177.700 177.100 0.600 1
1 1147 . 3 1 1 A 90 90 PRO CA C 150 63.900 63.967 -0.067 1
1 1148 . 3 1 1 A 90 90 PRO CB C 150 31.700 31.688 0.012 1
1 1151 . 3 1 1 A 91 91 ALA H H 151 7.240 7.485 -0.245 1
1 1152 . 3 1 1 A 91 91 ALA HA H 151 3.900 4.076 -0.176 1
1 1156 . 3 1 1 A 91 91 ALA C C 151 178.000 179.345 -1.345 1
1 1157 . 3 1 1 A 91 91 ALA CA C 151 53.900 54.024 -0.124 1
1 1158 . 3 1 1 A 91 91 ALA CB C 151 17.700 18.477 -0.777 1
1 1159 . 3 1 1 A 91 91 ALA N N 151 115.700 119.752 -4.052 1
1 1160 . 3 1 1 A 92 92 ASP H H 152 7.080 7.762 -0.682 1
1 1161 . 3 1 1 A 92 92 ASP HA H 152 4.220 4.231 -0.011 1
1 1164 . 3 1 1 A 92 92 ASP C C 152 176.200 176.955 -0.755 1
1 1165 . 3 1 1 A 92 92 ASP CA C 152 55.800 56.350 -0.550 1
1 1166 . 3 1 1 A 92 92 ASP CB C 152 39.500 40.216 -0.716 1
1 1167 . 3 1 1 A 92 92 ASP N N 152 117.100 119.574 -2.474 1
1 1168 . 3 1 1 A 93 93 TYR H H 153 7.060 7.396 -0.336 1
1 1169 . 3 1 1 A 93 93 TYR HA H 153 4.490 4.574 -0.084 1
1 1176 . 3 1 1 A 93 93 TYR C C 153 174.700 175.387 -0.687 1
1 1177 . 3 1 1 A 93 93 TYR CA C 153 57.600 58.578 -0.978 1
1 1178 . 3 1 1 A 93 93 TYR CB C 153 38.500 38.686 -0.186 1
1 1183 . 3 1 1 A 93 93 TYR N N 153 116.800 116.678 0.122 1
1 1184 . 3 1 1 A 94 94 VAL H H 154 7.000 7.067 -0.067 1
1 1185 . 3 1 1 A 94 94 VAL HA H 154 4.040 4.215 -0.175 1
1 1193 . 3 1 1 A 94 94 VAL C C 154 174.700 175.000 -0.300 1
1 1194 . 3 1 1 A 94 94 VAL CA C 154 62.100 62.388 -0.288 1
1 1195 . 3 1 1 A 94 94 VAL CB C 154 32.700 31.641 1.059 1
1 1198 . 3 1 1 A 94 94 VAL N N 154 120.600 120.911 -0.311 1
1 1199 . 3 1 1 A 95 95 ARG H H 155 9.430 8.721 0.709 1
1 1200 . 3 1 1 A 95 95 ARG HA H 155 4.640 4.652 -0.012 1
1 1207 . 3 1 1 A 95 95 ARG C C 155 175.400 175.634 -0.234 1
1 1208 . 3 1 1 A 95 95 ARG CA C 155 54.200 56.066 -1.866 1
1 1209 . 3 1 1 A 95 95 ARG CB C 155 32.400 30.767 1.633 1
1 1212 . 3 1 1 A 95 95 ARG N N 155 128.200 127.938 0.262 1
1 1213 . 3 1 1 A 96 96 ILE H H 156 8.700 8.505 0.195 1
1 1214 . 3 1 1 A 96 96 ILE HA H 156 4.440 4.588 -0.148 1
1 1224 . 3 1 1 A 96 96 ILE CA C 156 56.500 57.688 -1.188 1
1 1225 . 3 1 1 A 96 96 ILE CB C 156 36.700 38.242 -1.542 1
1 1229 . 3 1 1 A 96 96 ILE N N 156 124.100 127.861 -3.761 1
1 1230 . 3 1 1 A 97 97 PRO HA H 157 4.370 4.717 -0.347 1
1 1237 . 3 1 1 A 97 97 PRO C C 157 176.000 177.179 -1.179 1
1 1238 . 3 1 1 A 97 97 PRO CA C 157 63.200 62.726 0.474 1
1 1239 . 3 1 1 A 97 97 PRO CB C 157 32.400 32.082 0.318 1
1 1242 . 3 1 1 A 98 98 LYS H H 158 8.380 8.909 -0.529 1
1 1243 . 3 1 1 A 98 98 LYS HA H 158 4.190 4.398 -0.208 1
1 1252 . 3 1 1 A 98 98 LYS C C 158 176.800 176.744 0.056 1
1 1253 . 3 1 1 A 98 98 LYS CA C 158 57.100 55.851 1.249 1
1 1254 . 3 1 1 A 98 98 LYS CB C 158 32.800 32.343 0.457 1
1 1258 . 3 1 1 A 98 98 LYS N N 158 120.800 121.545 -0.745 1
1 1259 . 3 1 1 A 99 99 ILE H H 159 7.930 7.959 -0.029 1
1 1260 . 3 1 1 A 99 99 ILE HA H 159 4.200 3.788 0.412 1
1 1270 . 3 1 1 A 99 99 ILE C C 159 175.400 174.666 0.734 1
1 1271 . 3 1 1 A 99 99 ILE CA C 159 60.600 64.140 -3.540 1
1 1272 . 3 1 1 A 99 99 ILE CB C 159 39.100 36.119 2.981 1
1 1276 . 3 1 1 A 99 99 ILE N N 159 120.200 116.423 3.777 1
1 1277 . 3 1 1 A 100 100 ALA H H 160 8.370 8.245 0.125 1
1 1278 . 3 1 1 A 100 100 ALA HA H 160 4.370 4.682 -0.312 1
1 1282 . 3 1 1 A 100 100 ALA C C 160 177.200 176.346 0.854 1
1 1283 . 3 1 1 A 100 100 ALA CA C 160 52.200 50.397 1.803 1
1 1284 . 3 1 1 A 100 100 ALA CB C 160 19.400 22.380 -2.980 1
1 1285 . 3 1 1 A 100 100 ALA N N 160 128.300 120.790 7.510 1
1 1286 . 3 1 1 A 101 101 LEU H H 161 8.250 8.661 -0.411 1
1 1287 . 3 1 1 A 101 101 LEU HA H 161 4.280 3.901 0.379 1
1 1297 . 3 1 1 A 101 101 LEU C C 161 177.200 175.608 1.592 1
1 1298 . 3 1 1 A 101 101 LEU CA C 161 55.200 55.830 -0.630 1
1 1299 . 3 1 1 A 101 101 LEU CB C 161 42.400 40.395 2.005 1
1 1303 . 3 1 1 A 101 101 LEU N N 161 121.900 116.271 5.629 1
1 1304 . 3 1 1 A 102 102 GLU H H 162 8.390 7.874 0.516 1
1 1305 . 3 1 1 A 102 102 GLU HA H 162 4.230 4.392 -0.162 1
1 1310 . 3 1 1 A 102 102 GLU C C 162 176.100 175.828 0.272 1
1 1311 . 3 1 1 A 102 102 GLU CA C 162 56.400 55.826 0.574 1
1 1312 . 3 1 1 A 102 102 GLU CB C 162 30.500 30.491 0.009 1
1 1314 . 3 1 1 A 102 102 GLU N N 162 121.300 117.188 4.112 1
1 1315 . 3 1 1 A 103 103 HIS H H 163 8.330 8.908 -0.578 1
1 1316 . 3 1 1 A 103 103 HIS HA H 163 4.590 4.859 -0.269 1
1 1319 . 3 1 1 A 103 103 HIS C C 163 176.100 173.992 2.108 1
1 1320 . 3 1 1 A 103 103 HIS CA C 163 56.000 54.244 1.756 1
1 1321 . 3 1 1 A 103 103 HIS CB C 163 30.500 29.783 0.717 1
1 1322 . 3 1 1 A 103 103 HIS N N 163 120.000 122.401 -2.401 1
1 1323 . 3 1 1 A 107 107 HIS HA H 167 4.620 5.051 -0.431 1
1 1326 . 3 1 1 A 107 107 HIS C C 167 173.900 171.980 1.920 1
1 1327 . 3 1 1 A 107 107 HIS CA C 167 56.000 54.208 1.792 1
1 1328 . 3 1 1 A 107 107 HIS CB C 167 30.300 32.227 -1.927 1
1 15 . 4 1 1 A 2 2 ASP H H 62 8.760 8.676 0.084 1
1 16 . 4 1 1 A 2 2 ASP HA H 62 4.810 4.758 0.052 1
1 19 . 4 1 1 A 2 2 ASP C C 62 175.800 175.461 0.339 1
1 20 . 4 1 1 A 2 2 ASP CA C 62 54.800 53.987 0.813 1
1 21 . 4 1 1 A 2 2 ASP CB C 62 41.600 42.181 -0.581 1
1 22 . 4 1 1 A 2 2 ASP N N 62 120.900 120.703 0.197 1
1 23 . 4 1 1 A 3 3 SER H H 63 8.710 8.194 0.516 1
1 24 . 4 1 1 A 3 3 SER HA H 63 4.970 5.087 -0.117 1
1 27 . 4 1 1 A 3 3 SER C C 63 175.600 175.043 0.557 1
1 28 . 4 1 1 A 3 3 SER CA C 63 57.500 55.604 1.896 1
1 29 . 4 1 1 A 3 3 SER CB C 63 65.900 65.186 0.714 1
1 30 . 4 1 1 A 3 3 SER N N 63 116.300 115.137 1.163 1
1 31 . 4 1 1 A 4 4 PHE H H 64 9.370 9.048 0.322 1
1 32 . 4 1 1 A 4 4 PHE HA H 64 4.010 4.172 -0.162 1
1 39 . 4 1 1 A 4 4 PHE C C 64 176.700 177.456 -0.756 1
1 40 . 4 1 1 A 4 4 PHE CA C 64 62.200 61.634 0.566 1
1 41 . 4 1 1 A 4 4 PHE CB C 64 38.500 39.493 -0.993 1
1 46 . 4 1 1 A 4 4 PHE N N 64 121.400 127.785 -6.385 1
1 47 . 4 1 1 A 5 5 GLY H H 65 8.930 7.817 1.113 1
1 48 . 4 1 1 A 5 5 GLY HA2 H 65 2.020 2.738 -0.718 1
1 49 . 4 1 1 A 5 5 GLY HA3 H 65 3.250 2.959 0.291 1
1 50 . 4 1 1 A 5 5 GLY C C 65 175.200 175.111 0.089 1
1 51 . 4 1 1 A 5 5 GLY CA C 65 46.300 46.502 -0.202 1
1 52 . 4 1 1 A 5 5 GLY N N 65 106.500 104.495 2.005 1
1 53 . 4 1 1 A 6 6 ASP H H 66 7.630 7.977 -0.347 1
1 54 . 4 1 1 A 6 6 ASP HA H 66 4.100 4.224 -0.124 1
1 57 . 4 1 1 A 6 6 ASP C C 66 179.500 178.443 1.057 1
1 58 . 4 1 1 A 6 6 ASP CA C 66 57.400 56.735 0.665 1
1 59 . 4 1 1 A 6 6 ASP CB C 66 40.500 40.814 -0.314 1
1 60 . 4 1 1 A 6 6 ASP N N 66 120.500 121.162 -0.662 1
1 61 . 4 1 1 A 7 7 TRP H H 67 7.190 7.393 -0.203 1
1 62 . 4 1 1 A 7 7 TRP HA H 67 3.860 4.309 -0.449 1
1 71 . 4 1 1 A 7 7 TRP C C 67 177.200 178.427 -1.227 1
1 72 . 4 1 1 A 7 7 TRP CA C 67 61.100 59.516 1.584 1
1 73 . 4 1 1 A 7 7 TRP CB C 67 28.300 29.086 -0.786 1
1 79 . 4 1 1 A 7 7 TRP N N 67 120.700 119.911 0.789 1
1 81 . 4 1 1 A 8 8 ALA H H 68 9.040 8.286 0.754 1
1 82 . 4 1 1 A 8 8 ALA HA H 68 3.730 3.908 -0.178 1
1 86 . 4 1 1 A 8 8 ALA C C 68 179.500 179.087 0.413 1
1 87 . 4 1 1 A 8 8 ALA CA C 68 55.200 55.228 -0.028 1
1 88 . 4 1 1 A 8 8 ALA CB C 68 18.600 17.999 0.601 1
1 89 . 4 1 1 A 8 8 ALA N N 68 125.700 122.586 3.114 1
1 90 . 4 1 1 A 9 9 GLU H H 69 8.060 8.195 -0.135 1
1 91 . 4 1 1 A 9 9 GLU HA H 69 4.020 4.061 -0.041 1
1 96 . 4 1 1 A 9 9 GLU C C 69 180.400 179.526 0.874 1
1 97 . 4 1 1 A 9 9 GLU CA C 69 58.800 59.853 -1.053 1
1 98 . 4 1 1 A 9 9 GLU CB C 69 28.500 29.062 -0.562 1
1 99 . 4 1 1 A 9 9 GLU N N 69 115.400 118.290 -2.890 1
1 100 . 4 1 1 A 10 10 LYS H H 70 7.740 7.843 -0.103 1
1 101 . 4 1 1 A 10 10 LYS HA H 70 3.910 4.152 -0.242 1
1 110 . 4 1 1 A 10 10 LYS C C 70 179.500 178.933 0.567 1
1 111 . 4 1 1 A 10 10 LYS CA C 70 60.000 58.529 1.471 1
1 112 . 4 1 1 A 10 10 LYS CB C 70 32.400 32.050 0.350 1
1 116 . 4 1 1 A 10 10 LYS N N 70 122.700 119.129 3.571 1
1 117 . 4 1 1 A 11 11 PHE H H 71 8.750 8.449 0.301 1
1 118 . 4 1 1 A 11 11 PHE HA H 71 4.080 4.257 -0.177 1
1 126 . 4 1 1 A 11 11 PHE C C 71 177.100 176.904 0.196 1
1 127 . 4 1 1 A 11 11 PHE CA C 71 61.200 61.313 -0.113 1
1 128 . 4 1 1 A 11 11 PHE CB C 71 38.900 39.105 -0.205 1
1 134 . 4 1 1 A 11 11 PHE N N 71 123.500 122.745 0.755 1
1 135 . 4 1 1 A 12 12 LEU H H 72 8.400 8.737 -0.337 1
1 136 . 4 1 1 A 12 12 LEU HA H 72 3.520 3.687 -0.167 1
1 146 . 4 1 1 A 12 12 LEU C C 72 180.000 179.218 0.782 1
1 147 . 4 1 1 A 12 12 LEU CA C 72 58.200 57.652 0.548 1
1 148 . 4 1 1 A 12 12 LEU CB C 72 41.700 41.362 0.338 1
1 152 . 4 1 1 A 12 12 LEU N N 72 121.100 119.098 2.002 1
1 153 . 4 1 1 A 13 13 LYS H H 73 7.810 8.213 -0.403 1
1 154 . 4 1 1 A 13 13 LYS HA H 73 4.080 3.971 0.109 1
1 156 . 4 1 1 A 13 13 LYS C C 73 179.300 179.018 0.282 1
1 157 . 4 1 1 A 13 13 LYS CA C 73 59.000 59.583 -0.583 1
1 158 . 4 1 1 A 13 13 LYS CB C 73 31.900 32.164 -0.264 1
1 159 . 4 1 1 A 13 13 LYS N N 73 119.400 121.409 -2.009 1
1 160 . 4 1 1 A 14 14 SER H H 74 8.210 8.398 -0.188 1
1 161 . 4 1 1 A 14 14 SER HA H 74 4.210 4.171 0.039 1
1 164 . 4 1 1 A 14 14 SER C C 74 176.300 177.292 -0.992 1
1 165 . 4 1 1 A 14 14 SER CA C 74 61.400 61.086 0.314 1
1 166 . 4 1 1 A 14 14 SER CB C 74 62.600 62.151 0.449 1
1 167 . 4 1 1 A 14 14 SER N N 74 117.600 115.551 2.049 1
1 168 . 4 1 1 A 15 15 LYS H H 75 7.760 7.237 0.523 1
1 169 . 4 1 1 A 15 15 LYS HA H 75 4.040 4.018 0.022 1
1 178 . 4 1 1 A 15 15 LYS C C 75 178.500 179.133 -0.633 1
1 179 . 4 1 1 A 15 15 LYS CA C 75 56.500 59.212 -2.712 1
1 180 . 4 1 1 A 15 15 LYS CB C 75 30.600 32.035 -1.435 1
1 184 . 4 1 1 A 15 15 LYS N N 75 120.100 122.483 -2.383 1
1 185 . 4 1 1 A 16 16 GLU H H 76 7.680 8.332 -0.652 1
1 186 . 4 1 1 A 16 16 GLU HA H 76 4.030 4.010 0.020 1
1 191 . 4 1 1 A 16 16 GLU C C 76 179.900 178.258 1.642 1
1 192 . 4 1 1 A 16 16 GLU CA C 76 59.200 59.391 -0.191 1
1 193 . 4 1 1 A 16 16 GLU CB C 76 29.600 29.117 0.483 1
1 195 . 4 1 1 A 16 16 GLU N N 76 119.700 119.661 0.039 1
1 196 . 4 1 1 A 17 17 ALA H H 77 8.030 7.989 0.041 1
1 197 . 4 1 1 A 17 17 ALA HA H 77 4.200 4.167 0.033 1
1 201 . 4 1 1 A 17 17 ALA C C 77 178.900 179.421 -0.521 1
1 202 . 4 1 1 A 17 17 ALA CA C 77 54.400 53.190 1.210 1
1 203 . 4 1 1 A 17 17 ALA CB C 77 18.100 18.701 -0.601 1
1 204 . 4 1 1 A 17 17 ALA N N 77 123.000 120.704 2.296 1
1 205 . 4 1 1 A 18 18 ASP H H 78 7.860 7.839 0.021 1
1 206 . 4 1 1 A 18 18 ASP HA H 78 4.600 4.561 0.039 1
1 209 . 4 1 1 A 18 18 ASP C C 78 177.500 176.191 1.309 1
1 210 . 4 1 1 A 18 18 ASP CA C 78 55.100 55.184 -0.084 1
1 211 . 4 1 1 A 18 18 ASP CB C 78 41.400 41.555 -0.155 1
1 212 . 4 1 1 A 18 18 ASP N N 78 117.700 117.678 0.022 1
1 213 . 4 1 1 A 19 19 GLY H H 79 7.910 7.805 0.105 1
1 214 . 4 1 1 A 19 19 GLY HA2 H 79 3.860 4.052 -0.192 1
1 215 . 4 1 1 A 19 19 GLY HA3 H 79 4.080 4.054 0.026 1
1 216 . 4 1 1 A 19 19 GLY C C 79 175.300 174.867 0.433 1
1 217 . 4 1 1 A 19 19 GLY CA C 79 46.200 44.941 1.259 1
1 218 . 4 1 1 A 19 19 GLY N N 79 107.100 106.985 0.115 1
1 219 . 4 1 1 A 20 20 VAL H H 80 7.150 7.337 -0.187 1
1 220 . 4 1 1 A 20 20 VAL HA H 80 4.250 4.210 0.040 1
1 228 . 4 1 1 A 20 20 VAL C C 80 175.100 175.394 -0.294 1
1 229 . 4 1 1 A 20 20 VAL CA C 80 61.800 61.694 0.106 1
1 230 . 4 1 1 A 20 20 VAL CB C 80 32.200 32.726 -0.526 1
1 233 . 4 1 1 A 20 20 VAL N N 80 114.600 119.739 -5.139 1
1 234 . 4 1 1 A 21 21 SER H H 81 8.560 8.550 0.010 1
1 235 . 4 1 1 A 21 21 SER HA H 81 4.390 4.428 -0.038 1
1 238 . 4 1 1 A 21 21 SER C C 81 174.600 175.443 -0.843 1
1 239 . 4 1 1 A 21 21 SER CA C 81 57.900 58.574 -0.674 1
1 240 . 4 1 1 A 21 21 SER CB C 81 64.700 63.557 1.143 1
1 241 . 4 1 1 A 21 21 SER N N 81 118.700 118.844 -0.144 1
1 242 . 4 1 1 A 22 22 VAL H H 82 8.690 8.530 0.160 1
1 243 . 4 1 1 A 22 22 VAL HA H 82 3.700 3.854 -0.154 1
1 251 . 4 1 1 A 22 22 VAL C C 82 178.000 177.142 0.858 1
1 252 . 4 1 1 A 22 22 VAL CA C 82 66.500 64.991 1.509 1
1 253 . 4 1 1 A 22 22 VAL CB C 82 31.700 31.878 -0.178 1
1 256 . 4 1 1 A 22 22 VAL N N 82 122.100 127.762 -5.662 1
1 257 . 4 1 1 A 23 23 SER H H 83 8.300 7.553 0.747 1
1 258 . 4 1 1 A 23 23 SER HA H 83 4.210 4.105 0.105 1
1 261 . 4 1 1 A 23 23 SER C C 83 177.600 177.274 0.326 1
1 262 . 4 1 1 A 23 23 SER CA C 83 61.400 61.361 0.039 1
1 263 . 4 1 1 A 23 23 SER CB C 83 62.400 62.740 -0.340 1
1 264 . 4 1 1 A 23 23 SER N N 83 113.600 117.163 -3.563 1
1 265 . 4 1 1 A 24 24 GLN H H 84 7.820 8.075 -0.255 1
1 266 . 4 1 1 A 24 24 GLN HA H 84 3.970 3.842 0.128 1
1 273 . 4 1 1 A 24 24 GLN C C 84 178.400 177.896 0.504 1
1 274 . 4 1 1 A 24 24 GLN CA C 84 58.400 58.709 -0.309 1
1 275 . 4 1 1 A 24 24 GLN CB C 84 28.900 28.034 0.866 1
1 278 . 4 1 1 A 24 24 GLN N N 84 122.900 120.713 2.187 1
1 280 . 4 1 1 A 25 25 LEU H H 85 8.920 8.366 0.554 1
1 281 . 4 1 1 A 25 25 LEU HA H 85 4.130 4.204 -0.074 1
1 291 . 4 1 1 A 25 25 LEU C C 85 178.800 178.646 0.154 1
1 292 . 4 1 1 A 25 25 LEU CA C 85 58.300 57.720 0.580 1
1 293 . 4 1 1 A 25 25 LEU CB C 85 41.200 41.587 -0.387 1
1 297 . 4 1 1 A 25 25 LEU N N 85 122.200 121.368 0.832 1
1 298 . 4 1 1 A 26 26 ASN H H 86 8.860 8.673 0.187 1
1 299 . 4 1 1 A 26 26 ASN HA H 86 4.420 4.361 0.059 1
1 304 . 4 1 1 A 26 26 ASN C C 86 179.000 177.974 1.026 1
1 305 . 4 1 1 A 26 26 ASN CA C 86 55.900 56.318 -0.418 1
1 306 . 4 1 1 A 26 26 ASN CB C 86 37.200 37.867 -0.667 1
1 308 . 4 1 1 A 26 26 ASN N N 86 117.600 117.213 0.387 1
1 310 . 4 1 1 A 27 27 SER H H 87 7.840 7.794 0.046 1
1 311 . 4 1 1 A 27 27 SER HA H 87 4.100 3.834 0.266 1
1 314 . 4 1 1 A 27 27 SER C C 87 179.000 176.638 2.362 1
1 315 . 4 1 1 A 27 27 SER CA C 87 62.100 60.964 1.136 1
1 316 . 4 1 1 A 27 27 SER CB C 87 62.100 62.794 -0.694 1
1 317 . 4 1 1 A 27 27 SER N N 87 118.500 115.068 3.432 1
1 318 . 4 1 1 A 28 28 TYR H H 88 8.180 7.824 0.356 1
1 319 . 4 1 1 A 28 28 TYR HA H 88 4.600 4.327 0.273 1
1 326 . 4 1 1 A 28 28 TYR C C 88 174.800 178.576 -3.776 1
1 327 . 4 1 1 A 28 28 TYR CA C 88 61.200 62.093 -0.893 1
1 328 . 4 1 1 A 28 28 TYR CB C 88 37.800 38.140 -0.340 1
1 333 . 4 1 1 A 28 28 TYR N N 88 119.300 119.021 0.279 1
1 334 . 4 1 1 A 29 29 LYS H H 89 9.040 8.413 0.627 1
1 335 . 4 1 1 A 29 29 LYS HA H 89 3.890 4.054 -0.164 1
1 344 . 4 1 1 A 29 29 LYS C C 89 179.000 178.904 0.096 1
1 345 . 4 1 1 A 29 29 LYS CA C 89 61.300 59.386 1.914 1
1 346 . 4 1 1 A 29 29 LYS CB C 89 32.800 31.953 0.847 1
1 350 . 4 1 1 A 29 29 LYS N N 89 119.300 118.872 0.428 1
1 351 . 4 1 1 A 30 30 ASN H H 90 7.770 7.948 -0.178 1
1 352 . 4 1 1 A 30 30 ASN HA H 90 4.560 4.485 0.075 1
1 357 . 4 1 1 A 30 30 ASN C C 90 178.300 177.717 0.583 1
1 358 . 4 1 1 A 30 30 ASN CA C 90 56.200 56.285 -0.085 1
1 359 . 4 1 1 A 30 30 ASN CB C 90 38.900 38.627 0.273 1
1 361 . 4 1 1 A 30 30 ASN N N 90 117.800 117.829 -0.029 1
1 363 . 4 1 1 A 31 31 TYR H H 91 8.860 7.720 1.140 1
1 364 . 4 1 1 A 31 31 TYR HA H 91 4.910 4.412 0.498 1
1 371 . 4 1 1 A 31 31 TYR C C 91 178.300 178.808 -0.508 1
1 372 . 4 1 1 A 31 31 TYR CA C 91 59.700 60.797 -1.097 1
1 373 . 4 1 1 A 31 31 TYR CB C 91 37.500 37.448 0.052 1
1 378 . 4 1 1 A 31 31 TYR N N 91 119.400 118.436 0.964 1
1 379 . 4 1 1 A 32 32 CYS H H 92 8.640 8.235 0.405 1
1 380 . 4 1 1 A 32 32 CYS HA H 92 4.410 4.366 0.044 1
1 383 . 4 1 1 A 32 32 CYS C C 92 173.700 177.125 -3.425 1
1 384 . 4 1 1 A 32 32 CYS CA C 92 65.500 63.684 1.816 1
1 385 . 4 1 1 A 32 32 CYS CB C 92 28.300 28.183 0.117 1
1 386 . 4 1 1 A 32 32 CYS N N 92 113.500 118.276 -4.776 1
1 387 . 4 1 1 A 33 33 ARG H H 93 8.440 8.242 0.198 1
1 388 . 4 1 1 A 33 33 ARG HA H 93 3.740 3.769 -0.029 1
1 391 . 4 1 1 A 33 33 ARG C C 93 177.200 177.796 -0.596 1
1 392 . 4 1 1 A 33 33 ARG CA C 93 58.300 58.680 -0.380 1
1 393 . 4 1 1 A 33 33 ARG CB C 93 30.200 29.675 0.525 1
1 394 . 4 1 1 A 33 33 ARG N N 93 111.400 120.929 -9.529 1
1 395 . 4 1 1 A 34 34 ASN H H 94 8.020 8.150 -0.130 1
1 396 . 4 1 1 A 34 34 ASN HA H 94 4.980 4.801 0.179 1
1 401 . 4 1 1 A 34 34 ASN C C 94 176.700 177.329 -0.629 1
1 402 . 4 1 1 A 34 34 ASN CA C 94 53.400 54.783 -1.383 1
1 403 . 4 1 1 A 34 34 ASN CB C 94 38.000 40.088 -2.088 1
1 405 . 4 1 1 A 34 34 ASN N N 94 113.600 115.560 -1.960 1
1 407 . 4 1 1 A 35 35 HIS H H 95 7.200 7.912 -0.712 1
1 408 . 4 1 1 A 35 35 HIS HA H 95 4.470 4.357 0.113 1
1 411 . 4 1 1 A 35 35 HIS C C 95 176.600 176.536 0.064 1
1 412 . 4 1 1 A 35 35 HIS CA C 95 60.000 59.026 0.974 1
1 413 . 4 1 1 A 35 35 HIS CB C 95 30.500 30.447 0.053 1
1 414 . 4 1 1 A 35 35 HIS N N 95 115.600 119.622 -4.022 1
1 415 . 4 1 1 A 36 36 LEU H H 96 8.170 7.837 0.333 1
1 416 . 4 1 1 A 36 36 LEU HA H 96 4.730 4.631 0.099 1
1 426 . 4 1 1 A 36 36 LEU C C 96 176.800 177.324 -0.524 1
1 427 . 4 1 1 A 36 36 LEU CA C 96 54.400 54.660 -0.260 1
1 428 . 4 1 1 A 36 36 LEU CB C 96 40.600 41.700 -1.100 1
1 432 . 4 1 1 A 36 36 LEU N N 96 114.000 119.067 -5.067 1
1 433 . 4 1 1 A 37 37 SER H H 97 7.140 8.338 -1.198 1
1 434 . 4 1 1 A 37 37 SER HA H 97 4.730 4.323 0.407 1
1 437 . 4 1 1 A 37 37 SER CA C 97 62.700 62.871 -0.171 1
1 438 . 4 1 1 A 37 37 SER CB C 97 62.600 61.509 1.091 1
1 439 . 4 1 1 A 37 37 SER N N 97 117.200 116.111 1.089 1
1 440 . 4 1 1 A 38 38 PRO HA H 98 4.560 4.352 0.208 1
1 447 . 4 1 1 A 38 38 PRO C C 98 177.900 179.184 -1.284 1
1 448 . 4 1 1 A 38 38 PRO CA C 98 65.700 66.035 -0.335 1
1 449 . 4 1 1 A 38 38 PRO CB C 98 31.800 30.894 0.906 1
1 452 . 4 1 1 A 39 39 LEU H H 99 8.090 7.653 0.437 1
1 453 . 4 1 1 A 39 39 LEU HA H 99 4.260 4.038 0.222 1
1 463 . 4 1 1 A 39 39 LEU C C 99 178.700 178.642 0.058 1
1 464 . 4 1 1 A 39 39 LEU CA C 99 54.300 57.414 -3.114 1
1 465 . 4 1 1 A 39 39 LEU CB C 99 42.400 41.634 0.766 1
1 469 . 4 1 1 A 39 39 LEU N N 99 112.400 117.126 -4.726 1
1 470 . 4 1 1 A 40 40 TYR H H 100 8.350 8.909 -0.559 1
1 471 . 4 1 1 A 40 40 TYR HA H 100 4.170 4.438 -0.268 1
1 478 . 4 1 1 A 40 40 TYR C C 100 178.300 176.939 1.361 1
1 479 . 4 1 1 A 40 40 TYR CA C 100 63.400 61.971 1.429 1
1 480 . 4 1 1 A 40 40 TYR CB C 100 38.600 39.234 -0.634 1
1 485 . 4 1 1 A 40 40 TYR N N 100 119.400 121.044 -1.644 1
1 486 . 4 1 1 A 41 41 MET H H 101 8.640 7.606 1.034 1
1 487 . 4 1 1 A 41 41 MET HA H 101 4.260 4.734 -0.474 1
1 488 . 4 1 1 A 41 41 MET C C 101 177.000 175.633 1.367 1
1 489 . 4 1 1 A 41 41 MET CA C 101 54.600 54.389 0.211 1
1 490 . 4 1 1 A 41 41 MET N N 101 111.800 116.108 -4.308 1
1 491 . 4 1 1 A 42 42 LYS H H 102 7.880 7.774 0.106 1
1 492 . 4 1 1 A 42 42 LYS HA H 102 4.430 4.730 -0.300 1
1 501 . 4 1 1 A 42 42 LYS C C 102 176.300 176.458 -0.158 1
1 502 . 4 1 1 A 42 42 LYS CA C 102 56.000 54.247 1.753 1
1 503 . 4 1 1 A 42 42 LYS CB C 102 33.400 33.669 -0.269 1
1 507 . 4 1 1 A 42 42 LYS N N 102 121.700 119.688 2.012 1
1 508 . 4 1 1 A 43 43 SER H H 103 9.160 8.989 0.171 1
1 509 . 4 1 1 A 43 43 SER HA H 103 4.620 4.517 0.103 1
1 513 . 4 1 1 A 43 43 SER C C 103 176.300 175.520 0.780 1
1 514 . 4 1 1 A 43 43 SER CA C 103 58.700 59.632 -0.932 1
1 515 . 4 1 1 A 43 43 SER CB C 103 63.700 63.272 0.428 1
1 516 . 4 1 1 A 43 43 SER N N 103 118.800 117.649 1.151 1
1 517 . 4 1 1 A 44 44 LEU H H 104 8.860 9.015 -0.155 1
1 518 . 4 1 1 A 44 44 LEU HA H 104 4.130 4.264 -0.134 1
1 528 . 4 1 1 A 44 44 LEU C C 104 178.700 178.883 -0.183 1
1 529 . 4 1 1 A 44 44 LEU CA C 104 58.800 58.721 0.079 1
1 530 . 4 1 1 A 44 44 LEU CB C 104 42.600 41.484 1.116 1
1 534 . 4 1 1 A 44 44 LEU N N 104 124.200 128.863 -4.663 1
1 535 . 4 1 1 A 45 45 SER H H 105 8.330 8.209 0.121 1
1 536 . 4 1 1 A 45 45 SER HA H 105 4.310 4.460 -0.150 1
1 539 . 4 1 1 A 45 45 SER C C 105 175.000 175.246 -0.246 1
1 540 . 4 1 1 A 45 45 SER CA C 105 60.100 60.122 -0.022 1
1 541 . 4 1 1 A 45 45 SER CB C 105 63.400 63.420 -0.020 1
1 542 . 4 1 1 A 45 45 SER N N 105 107.700 116.384 -8.684 1
1 543 . 4 1 1 A 46 46 GLU H H 106 7.800 8.213 -0.413 1
1 544 . 4 1 1 A 46 46 GLU HA H 106 4.570 4.284 0.286 1
1 549 . 4 1 1 A 46 46 GLU C C 106 174.100 176.768 -2.668 1
1 550 . 4 1 1 A 46 46 GLU CA C 106 55.600 57.821 -2.221 1
1 551 . 4 1 1 A 46 46 GLU CB C 106 31.200 29.631 1.569 1
1 553 . 4 1 1 A 46 46 GLU N N 106 119.600 116.965 2.635 1
1 554 . 4 1 1 A 47 47 ILE H H 107 7.100 7.380 -0.280 1
1 555 . 4 1 1 A 47 47 ILE HA H 107 4.040 3.998 0.042 1
1 565 . 4 1 1 A 47 47 ILE C C 107 174.100 175.492 -1.392 1
1 566 . 4 1 1 A 47 47 ILE CA C 107 62.300 62.388 -0.088 1
1 567 . 4 1 1 A 47 47 ILE CB C 107 38.500 37.964 0.536 1
1 571 . 4 1 1 A 47 47 ILE N N 107 120.600 123.231 -2.631 1
1 572 . 4 1 1 A 48 48 LEU H H 108 9.180 8.239 0.941 1
1 573 . 4 1 1 A 48 48 LEU HA H 108 4.940 4.886 0.054 1
1 583 . 4 1 1 A 48 48 LEU CA C 108 51.900 51.225 0.675 1
1 584 . 4 1 1 A 48 48 LEU CB C 108 42.000 43.255 -1.255 1
1 588 . 4 1 1 A 48 48 LEU N N 108 129.400 125.597 3.803 1
1 589 . 4 1 1 A 49 49 PRO HA H 109 3.910 4.279 -0.369 1
1 596 . 4 1 1 A 49 49 PRO C C 109 178.500 178.046 0.454 1
1 597 . 4 1 1 A 49 49 PRO CA C 109 66.600 65.409 1.191 1
1 598 . 4 1 1 A 49 49 PRO CB C 109 31.300 31.706 -0.406 1
1 601 . 4 1 1 A 50 50 ALA H H 110 8.280 8.552 -0.272 1
1 602 . 4 1 1 A 50 50 ALA HA H 110 4.110 4.020 0.090 1
1 606 . 4 1 1 A 50 50 ALA C C 110 179.700 179.639 0.061 1
1 607 . 4 1 1 A 50 50 ALA CA C 110 55.100 55.444 -0.344 1
1 608 . 4 1 1 A 50 50 ALA CB C 110 19.200 18.596 0.604 1
1 609 . 4 1 1 A 50 50 ALA N N 110 116.100 118.840 -2.740 1
1 610 . 4 1 1 A 51 51 ASP H H 111 7.790 7.787 0.003 1
1 611 . 4 1 1 A 51 51 ASP HA H 111 4.440 4.354 0.086 1
1 614 . 4 1 1 A 51 51 ASP C C 111 178.200 178.569 -0.369 1
1 615 . 4 1 1 A 51 51 ASP CA C 111 57.600 57.604 -0.004 1
1 616 . 4 1 1 A 51 51 ASP CB C 111 41.800 41.245 0.555 1
1 617 . 4 1 1 A 51 51 ASP N N 111 116.500 118.072 -1.572 1
1 618 . 4 1 1 A 52 52 ILE H H 112 7.020 7.508 -0.488 1
1 619 . 4 1 1 A 52 52 ILE HA H 112 3.750 3.704 0.046 1
1 629 . 4 1 1 A 52 52 ILE C C 112 177.300 177.835 -0.535 1
1 630 . 4 1 1 A 52 52 ILE CA C 112 63.500 64.991 -1.491 1
1 631 . 4 1 1 A 52 52 ILE CB C 112 37.500 36.948 0.552 1
1 635 . 4 1 1 A 52 52 ILE N N 112 116.700 119.511 -2.811 1
1 636 . 4 1 1 A 53 53 GLN H H 113 9.150 8.619 0.531 1
1 637 . 4 1 1 A 53 53 GLN HA H 113 3.720 4.006 -0.286 1
1 644 . 4 1 1 A 53 53 GLN C C 113 177.500 177.835 -0.335 1
1 645 . 4 1 1 A 53 53 GLN CA C 113 58.200 58.719 -0.519 1
1 646 . 4 1 1 A 53 53 GLN CB C 113 30.200 28.328 1.872 1
1 649 . 4 1 1 A 53 53 GLN N N 113 121.200 121.546 -0.346 1
1 651 . 4 1 1 A 54 54 SER H H 114 8.150 7.865 0.285 1
1 652 . 4 1 1 A 54 54 SER HA H 114 4.180 4.241 -0.061 1
1 655 . 4 1 1 A 54 54 SER C C 114 175.900 177.558 -1.658 1
1 656 . 4 1 1 A 54 54 SER CA C 114 62.100 61.631 0.469 1
1 657 . 4 1 1 A 54 54 SER CB C 114 62.800 62.910 -0.110 1
1 658 . 4 1 1 A 54 54 SER N N 114 112.200 114.501 -2.301 1
1 659 . 4 1 1 A 55 55 ILE H H 115 6.760 7.530 -0.770 1
1 660 . 4 1 1 A 55 55 ILE HA H 115 3.860 3.789 0.071 1
1 670 . 4 1 1 A 55 55 ILE C C 115 179.200 178.591 0.609 1
1 671 . 4 1 1 A 55 55 ILE CA C 115 64.700 64.751 -0.051 1
1 672 . 4 1 1 A 55 55 ILE CB C 115 38.900 37.786 1.114 1
1 676 . 4 1 1 A 55 55 ILE N N 115 119.500 121.122 -1.622 1
1 677 . 4 1 1 A 56 56 ILE H H 116 7.750 7.877 -0.127 1
1 678 . 4 1 1 A 56 56 ILE HA H 116 3.690 3.577 0.113 1
1 688 . 4 1 1 A 56 56 ILE C C 116 176.900 178.012 -1.112 1
1 689 . 4 1 1 A 56 56 ILE CA C 116 62.800 65.132 -2.332 1
1 690 . 4 1 1 A 56 56 ILE CB C 116 36.200 37.314 -1.114 1
1 694 . 4 1 1 A 56 56 ILE N N 116 120.200 121.780 -1.580 1
1 695 . 4 1 1 A 57 57 ASN H H 117 8.690 8.196 0.494 1
1 696 . 4 1 1 A 57 57 ASN HA H 117 4.440 4.441 -0.001 1
1 701 . 4 1 1 A 57 57 ASN C C 117 177.200 177.249 -0.049 1
1 702 . 4 1 1 A 57 57 ASN CA C 117 54.800 56.467 -1.667 1
1 703 . 4 1 1 A 57 57 ASN CB C 117 38.100 38.510 -0.410 1
1 705 . 4 1 1 A 57 57 ASN N N 117 117.000 120.042 -3.042 1
1 707 . 4 1 1 A 58 58 GLU H H 118 7.630 8.096 -0.466 1
1 708 . 4 1 1 A 58 58 GLU HA H 118 4.450 4.334 0.116 1
1 713 . 4 1 1 A 58 58 GLU C C 118 176.500 177.240 -0.740 1
1 714 . 4 1 1 A 58 58 GLU CA C 118 56.200 57.923 -1.723 1
1 715 . 4 1 1 A 58 58 GLU CB C 118 30.200 30.501 -0.301 1
1 717 . 4 1 1 A 58 58 GLU N N 118 116.300 116.741 -0.441 1
1 718 . 4 1 1 A 59 59 THR H H 119 7.540 7.674 -0.134 1
1 719 . 4 1 1 A 59 59 THR HA H 119 4.230 4.346 -0.116 1
1 724 . 4 1 1 A 59 59 THR C C 119 174.200 174.397 -0.197 1
1 725 . 4 1 1 A 59 59 THR CA C 119 63.800 63.408 0.392 1
1 726 . 4 1 1 A 59 59 THR CB C 119 68.900 69.498 -0.598 1
1 728 . 4 1 1 A 59 59 THR N N 119 117.600 116.905 0.695 1
1 729 . 4 1 1 A 60 60 LYS H H 120 8.860 8.935 -0.075 1
1 730 . 4 1 1 A 60 60 LYS HA H 120 4.490 4.629 -0.139 1
1 739 . 4 1 1 A 60 60 LYS C C 120 175.800 175.514 0.286 1
1 740 . 4 1 1 A 60 60 LYS CA C 120 54.900 55.175 -0.275 1
1 741 . 4 1 1 A 60 60 LYS CB C 120 29.800 32.459 -2.659 1
1 745 . 4 1 1 A 60 60 LYS N N 120 128.500 127.150 1.350 1
1 746 . 4 1 1 A 61 61 LEU H H 121 7.150 8.294 -1.144 1
1 747 . 4 1 1 A 61 61 LEU HA H 121 4.710 4.907 -0.197 1
1 757 . 4 1 1 A 61 61 LEU C C 121 175.000 176.070 -1.070 1
1 758 . 4 1 1 A 61 61 LEU CA C 121 52.800 53.203 -0.403 1
1 759 . 4 1 1 A 61 61 LEU CB C 121 46.400 44.396 2.004 1
1 763 . 4 1 1 A 61 61 LEU N N 121 120.700 126.223 -5.523 1
1 764 . 4 1 1 A 62 62 ALA H H 122 8.000 8.518 -0.518 1
1 765 . 4 1 1 A 62 62 ALA HA H 122 4.250 4.349 -0.099 1
1 769 . 4 1 1 A 62 62 ALA CA C 122 52.100 52.581 -0.481 1
1 770 . 4 1 1 A 62 62 ALA CB C 122 19.500 18.909 0.591 1
1 771 . 4 1 1 A 62 62 ALA N N 122 119.900 123.235 -3.335 1
1 772 . 4 1 1 A 63 63 LYS H H 123 8.770 8.910 -0.140 1
1 773 . 4 1 1 A 63 63 LYS HA H 123 3.800 3.946 -0.146 1
1 782 . 4 1 1 A 63 63 LYS C C 123 178.300 178.548 -0.248 1
1 783 . 4 1 1 A 63 63 LYS CA C 123 60.700 59.753 0.947 1
1 784 . 4 1 1 A 63 63 LYS CB C 123 32.300 32.040 0.260 1
1 788 . 4 1 1 A 63 63 LYS N N 123 121.400 124.669 -3.269 1
1 789 . 4 1 1 A 64 64 ASN H H 124 9.020 7.980 1.040 1
1 790 . 4 1 1 A 64 64 ASN HA H 124 4.430 4.539 -0.109 1
1 795 . 4 1 1 A 64 64 ASN C C 124 178.300 178.001 0.299 1
1 796 . 4 1 1 A 64 64 ASN CA C 124 56.200 56.128 0.072 1
1 797 . 4 1 1 A 64 64 ASN CB C 124 37.300 38.081 -0.781 1
1 799 . 4 1 1 A 64 64 ASN N N 124 115.000 117.997 -2.997 1
1 801 . 4 1 1 A 65 65 THR H H 125 7.620 8.048 -0.428 1
1 802 . 4 1 1 A 65 65 THR HA H 125 4.030 3.984 0.046 1
1 807 . 4 1 1 A 65 65 THR C C 125 175.500 176.595 -1.095 1
1 808 . 4 1 1 A 65 65 THR CA C 125 66.000 66.926 -0.926 1
1 809 . 4 1 1 A 65 65 THR CB C 125 67.600 67.798 -0.198 1
1 811 . 4 1 1 A 65 65 THR N N 125 119.800 117.676 2.124 1
1 812 . 4 1 1 A 66 66 LEU H H 126 8.020 8.404 -0.384 1
1 813 . 4 1 1 A 66 66 LEU HA H 126 3.790 3.770 0.020 1
1 823 . 4 1 1 A 66 66 LEU C C 126 179.200 179.824 -0.624 1
1 824 . 4 1 1 A 66 66 LEU CA C 126 58.700 58.244 0.456 1
1 825 . 4 1 1 A 66 66 LEU CB C 126 41.300 41.649 -0.349 1
1 829 . 4 1 1 A 66 66 LEU N N 126 121.200 121.262 -0.062 1
1 830 . 4 1 1 A 67 67 LYS H H 127 8.380 7.912 0.468 1
1 831 . 4 1 1 A 67 67 LYS HA H 127 3.740 4.069 -0.329 1
1 840 . 4 1 1 A 67 67 LYS C C 127 178.300 178.693 -0.393 1
1 841 . 4 1 1 A 67 67 LYS CA C 127 60.100 58.653 1.447 1
1 842 . 4 1 1 A 67 67 LYS CB C 127 32.400 31.422 0.978 1
1 846 . 4 1 1 A 67 67 LYS N N 127 117.000 118.144 -1.144 1
1 847 . 4 1 1 A 68 68 ALA H H 128 7.480 7.933 -0.453 1
1 848 . 4 1 1 A 68 68 ALA HA H 128 4.210 4.082 0.128 1
1 852 . 4 1 1 A 68 68 ALA C C 128 181.200 180.156 1.044 1
1 853 . 4 1 1 A 68 68 ALA CA C 128 55.200 54.870 0.330 1
1 854 . 4 1 1 A 68 68 ALA CB C 128 18.600 18.120 0.480 1
1 855 . 4 1 1 A 68 68 ALA N N 128 122.900 122.127 0.773 1
1 856 . 4 1 1 A 69 69 ILE H H 129 8.250 7.811 0.439 1
1 857 . 4 1 1 A 69 69 ILE HA H 129 3.130 3.563 -0.433 1
1 867 . 4 1 1 A 69 69 ILE C C 129 177.400 178.565 -1.165 1
1 868 . 4 1 1 A 69 69 ILE CA C 129 66.700 64.738 1.962 1
1 869 . 4 1 1 A 69 69 ILE CB C 129 37.900 36.918 0.982 1
1 873 . 4 1 1 A 69 69 ILE N N 129 122.800 118.748 4.052 1
1 874 . 4 1 1 A 70 70 ARG H H 130 8.040 7.931 0.109 1
1 875 . 4 1 1 A 70 70 ARG HA H 130 3.620 4.009 -0.389 1
1 882 . 4 1 1 A 70 70 ARG C C 130 177.800 179.079 -1.279 1
1 883 . 4 1 1 A 70 70 ARG CA C 130 60.700 59.701 0.999 1
1 884 . 4 1 1 A 70 70 ARG CB C 130 29.600 30.275 -0.675 1
1 887 . 4 1 1 A 70 70 ARG N N 130 119.700 121.242 -1.542 1
1 888 . 4 1 1 A 71 71 ASN H H 131 8.920 8.541 0.379 1
1 889 . 4 1 1 A 71 71 ASN HA H 131 4.430 4.424 0.006 1
1 894 . 4 1 1 A 71 71 ASN C C 131 177.500 177.806 -0.306 1
1 895 . 4 1 1 A 71 71 ASN CA C 131 56.100 56.705 -0.605 1
1 896 . 4 1 1 A 71 71 ASN CB C 131 38.600 39.617 -1.017 1
1 898 . 4 1 1 A 71 71 ASN N N 131 117.200 118.682 -1.482 1
1 900 . 4 1 1 A 72 72 THR H H 132 8.300 8.490 -0.190 1
1 901 . 4 1 1 A 72 72 THR HA H 132 4.430 3.842 0.588 1
1 906 . 4 1 1 A 72 72 THR C C 132 175.100 176.586 -1.486 1
1 907 . 4 1 1 A 72 72 THR CA C 132 68.200 66.493 1.707 1
1 908 . 4 1 1 A 72 72 THR CB C 132 68.500 68.819 -0.319 1
1 910 . 4 1 1 A 72 72 THR N N 132 119.200 115.391 3.809 1
1 911 . 4 1 1 A 73 73 ALA H H 133 7.950 8.076 -0.126 1
1 912 . 4 1 1 A 73 73 ALA HA H 133 4.040 3.988 0.052 1
1 916 . 4 1 1 A 73 73 ALA C C 133 178.200 179.684 -1.484 1
1 917 . 4 1 1 A 73 73 ALA CA C 133 55.900 55.323 0.577 1
1 918 . 4 1 1 A 73 73 ALA CB C 133 16.700 18.132 -1.432 1
1 919 . 4 1 1 A 73 73 ALA N N 133 120.900 123.701 -2.801 1
1 920 . 4 1 1 A 74 74 SER H H 134 8.440 8.305 0.135 1
1 921 . 4 1 1 A 74 74 SER HA H 134 4.430 4.386 0.044 1
1 924 . 4 1 1 A 74 74 SER C C 134 178.800 177.277 1.523 1
1 925 . 4 1 1 A 74 74 SER CA C 134 61.300 61.256 0.044 1
1 926 . 4 1 1 A 74 74 SER CB C 134 62.600 63.038 -0.438 1
1 927 . 4 1 1 A 74 74 SER N N 134 110.100 113.343 -3.243 1
1 928 . 4 1 1 A 75 75 GLN H H 135 8.340 7.688 0.652 1
1 929 . 4 1 1 A 75 75 GLN HA H 135 3.880 3.969 -0.089 1
1 936 . 4 1 1 A 75 75 GLN C C 135 178.800 178.769 0.031 1
1 937 . 4 1 1 A 75 75 GLN CA C 135 59.600 58.779 0.821 1
1 938 . 4 1 1 A 75 75 GLN CB C 135 29.900 28.045 1.855 1
1 941 . 4 1 1 A 75 75 GLN N N 135 118.100 121.177 -3.077 1
1 943 . 4 1 1 A 76 76 ILE H H 136 7.670 7.163 0.507 1
1 944 . 4 1 1 A 76 76 ILE HA H 136 3.200 3.287 -0.087 1
1 954 . 4 1 1 A 76 76 ILE C C 136 177.500 177.877 -0.377 1
1 955 . 4 1 1 A 76 76 ILE CA C 136 66.100 65.007 1.093 1
1 956 . 4 1 1 A 76 76 ILE CB C 136 37.400 37.179 0.221 1
1 960 . 4 1 1 A 76 76 ILE N N 136 122.500 119.969 2.531 1
1 961 . 4 1 1 A 77 77 PHE H H 137 7.930 7.812 0.118 1
1 962 . 4 1 1 A 77 77 PHE HA H 137 3.890 4.231 -0.341 1
1 969 . 4 1 1 A 77 77 PHE C C 137 178.200 178.178 0.022 1
1 970 . 4 1 1 A 77 77 PHE CA C 137 63.600 60.785 2.815 1
1 971 . 4 1 1 A 77 77 PHE CB C 137 39.300 38.436 0.864 1
1 976 . 4 1 1 A 77 77 PHE N N 137 116.100 118.821 -2.721 1
1 977 . 4 1 1 A 78 78 ARG H H 138 8.900 8.417 0.483 1
1 978 . 4 1 1 A 78 78 ARG HA H 138 3.910 3.891 0.019 1
1 986 . 4 1 1 A 78 78 ARG C C 138 178.300 178.716 -0.416 1
1 987 . 4 1 1 A 78 78 ARG CA C 138 60.100 59.341 0.759 1
1 988 . 4 1 1 A 78 78 ARG CB C 138 29.600 29.823 -0.223 1
1 991 . 4 1 1 A 78 78 ARG N N 138 118.600 119.102 -0.502 1
1 993 . 4 1 1 A 79 79 LEU H H 139 7.730 8.049 -0.319 1
1 994 . 4 1 1 A 79 79 LEU HA H 139 4.280 4.085 0.195 1
1 1004 . 4 1 1 A 79 79 LEU C C 139 179.000 178.191 0.809 1
1 1005 . 4 1 1 A 79 79 LEU CA C 139 57.800 57.641 0.159 1
1 1006 . 4 1 1 A 79 79 LEU CB C 139 41.900 41.105 0.795 1
1 1010 . 4 1 1 A 79 79 LEU N N 139 121.900 121.514 0.386 1
1 1011 . 4 1 1 A 80 80 ALA H H 140 7.590 7.384 0.206 1
1 1012 . 4 1 1 A 80 80 ALA HA H 140 2.710 2.659 0.051 1
1 1016 . 4 1 1 A 80 80 ALA C C 140 179.900 179.668 0.232 1
1 1017 . 4 1 1 A 80 80 ALA CA C 140 55.100 54.467 0.633 1
1 1018 . 4 1 1 A 80 80 ALA CB C 140 17.600 17.546 0.054 1
1 1019 . 4 1 1 A 80 80 ALA N N 140 123.400 120.217 3.183 1
1 1020 . 4 1 1 A 81 81 ILE H H 141 8.910 8.018 0.892 1
1 1021 . 4 1 1 A 81 81 ILE HA H 141 4.110 3.751 0.359 1
1 1031 . 4 1 1 A 81 81 ILE C C 141 181.700 177.741 3.959 1
1 1032 . 4 1 1 A 81 81 ILE CA C 141 64.800 64.956 -0.156 1
1 1033 . 4 1 1 A 81 81 ILE CB C 141 38.600 37.572 1.028 1
1 1037 . 4 1 1 A 81 81 ILE N N 141 122.400 118.047 4.353 1
1 1038 . 4 1 1 A 82 82 GLU H H 142 8.560 8.337 0.223 1
1 1039 . 4 1 1 A 82 82 GLU HA H 142 4.100 4.038 0.062 1
1 1044 . 4 1 1 A 82 82 GLU C C 142 177.700 178.092 -0.392 1
1 1045 . 4 1 1 A 82 82 GLU CA C 142 59.100 59.806 -0.706 1
1 1046 . 4 1 1 A 82 82 GLU CB C 142 29.200 29.323 -0.123 1
1 1048 . 4 1 1 A 82 82 GLU N N 142 123.200 120.690 2.510 1
1 1049 . 4 1 1 A 83 83 ASN H H 143 7.310 7.319 -0.009 1
1 1050 . 4 1 1 A 83 83 ASN HA H 143 4.750 4.856 -0.106 1
1 1055 . 4 1 1 A 83 83 ASN C C 143 173.200 174.220 -1.020 1
1 1056 . 4 1 1 A 83 83 ASN CA C 143 54.200 52.676 1.524 1
1 1057 . 4 1 1 A 83 83 ASN CB C 143 41.300 38.660 2.640 1
1 1059 . 4 1 1 A 83 83 ASN N N 143 114.900 115.097 -0.197 1
1 1061 . 4 1 1 A 84 84 ARG H H 144 8.320 7.967 0.353 1
1 1062 . 4 1 1 A 84 84 ARG HA H 144 4.120 4.001 0.119 1
1 1069 . 4 1 1 A 84 84 ARG C C 144 175.300 175.850 -0.550 1
1 1070 . 4 1 1 A 84 84 ARG CA C 144 57.100 57.003 0.097 1
1 1071 . 4 1 1 A 84 84 ARG CB C 144 26.000 26.827 -0.827 1
1 1074 . 4 1 1 A 84 84 ARG N N 144 114.400 115.040 -0.640 1
1 1075 . 4 1 1 A 85 85 ALA H H 145 8.350 8.441 -0.091 1
1 1076 . 4 1 1 A 85 85 ALA HA H 145 4.320 4.358 -0.038 1
1 1080 . 4 1 1 A 85 85 ALA C C 145 176.500 177.057 -0.557 1
1 1081 . 4 1 1 A 85 85 ALA CA C 145 53.400 52.771 0.629 1
1 1082 . 4 1 1 A 85 85 ALA CB C 145 19.900 20.065 -0.165 1
1 1083 . 4 1 1 A 85 85 ALA N N 145 120.600 118.829 1.771 1
1 1084 . 4 1 1 A 86 86 ILE H H 146 7.290 7.529 -0.239 1
1 1085 . 4 1 1 A 86 86 ILE HA H 146 4.400 4.579 -0.179 1
1 1095 . 4 1 1 A 86 86 ILE C C 146 173.600 173.745 -0.145 1
1 1096 . 4 1 1 A 86 86 ILE CA C 146 59.200 60.064 -0.864 1
1 1097 . 4 1 1 A 86 86 ILE CB C 146 41.600 40.914 0.686 1
1 1101 . 4 1 1 A 86 86 ILE N N 146 111.500 116.249 -4.749 1
1 1102 . 4 1 1 A 87 87 ASP H H 147 8.270 9.081 -0.811 1
1 1103 . 4 1 1 A 87 87 ASP HA H 147 4.940 4.930 0.010 1
1 1106 . 4 1 1 A 87 87 ASP C C 147 174.700 175.375 -0.675 1
1 1107 . 4 1 1 A 87 87 ASP CA C 147 53.700 53.300 0.400 1
1 1108 . 4 1 1 A 87 87 ASP CB C 147 41.800 41.436 0.364 1
1 1109 . 4 1 1 A 87 87 ASP N N 147 119.400 128.290 -8.890 1
1 1110 . 4 1 1 A 88 88 PHE H H 148 7.230 7.638 -0.408 1
1 1111 . 4 1 1 A 88 88 PHE HA H 148 4.690 4.839 -0.149 1
1 1119 . 4 1 1 A 88 88 PHE C C 148 171.500 172.766 -1.266 1
1 1120 . 4 1 1 A 88 88 PHE CA C 148 56.400 57.154 -0.754 1
1 1121 . 4 1 1 A 88 88 PHE CB C 148 42.000 42.677 -0.677 1
1 1127 . 4 1 1 A 88 88 PHE N N 148 119.700 120.366 -0.666 1
1 1128 . 4 1 1 A 89 89 ASN H H 149 8.060 8.336 -0.276 1
1 1129 . 4 1 1 A 89 89 ASN HA H 149 4.490 4.929 -0.439 1
1 1134 . 4 1 1 A 89 89 ASN CA C 149 48.100 48.897 -0.797 1
1 1135 . 4 1 1 A 89 89 ASN CB C 149 39.200 39.744 -0.544 1
1 1137 . 4 1 1 A 89 89 ASN N N 149 119.700 125.248 -5.548 1
1 1139 . 4 1 1 A 90 90 PRO HA H 150 3.970 4.285 -0.315 1
1 1146 . 4 1 1 A 90 90 PRO C C 150 177.700 177.947 -0.247 1
1 1147 . 4 1 1 A 90 90 PRO CA C 150 63.900 64.798 -0.898 1
1 1148 . 4 1 1 A 90 90 PRO CB C 150 31.700 31.769 -0.069 1
1 1151 . 4 1 1 A 91 91 ALA H H 151 7.240 7.403 -0.163 1
1 1152 . 4 1 1 A 91 91 ALA HA H 151 3.900 4.130 -0.230 1
1 1156 . 4 1 1 A 91 91 ALA C C 151 178.000 179.520 -1.520 1
1 1157 . 4 1 1 A 91 91 ALA CA C 151 53.900 54.096 -0.196 1
1 1158 . 4 1 1 A 91 91 ALA CB C 151 17.700 18.474 -0.774 1
1 1159 . 4 1 1 A 91 91 ALA N N 151 115.700 119.121 -3.421 1
1 1160 . 4 1 1 A 92 92 ASP H H 152 7.080 7.793 -0.713 1
1 1161 . 4 1 1 A 92 92 ASP HA H 152 4.220 4.224 -0.004 1
1 1164 . 4 1 1 A 92 92 ASP C C 152 176.200 176.948 -0.748 1
1 1165 . 4 1 1 A 92 92 ASP CA C 152 55.800 56.779 -0.979 1
1 1166 . 4 1 1 A 92 92 ASP CB C 152 39.500 40.226 -0.726 1
1 1167 . 4 1 1 A 92 92 ASP N N 152 117.100 119.450 -2.350 1
1 1168 . 4 1 1 A 93 93 TYR H H 153 7.060 7.328 -0.268 1
1 1169 . 4 1 1 A 93 93 TYR HA H 153 4.490 4.488 0.002 1
1 1176 . 4 1 1 A 93 93 TYR C C 153 174.700 175.881 -1.181 1
1 1177 . 4 1 1 A 93 93 TYR CA C 153 57.600 58.781 -1.181 1
1 1178 . 4 1 1 A 93 93 TYR CB C 153 38.500 38.380 0.120 1
1 1183 . 4 1 1 A 93 93 TYR N N 153 116.800 116.573 0.227 1
1 1184 . 4 1 1 A 94 94 VAL H H 154 7.000 7.055 -0.055 1
1 1185 . 4 1 1 A 94 94 VAL HA H 154 4.040 4.182 -0.142 1
1 1193 . 4 1 1 A 94 94 VAL C C 154 174.700 175.838 -1.138 1
1 1194 . 4 1 1 A 94 94 VAL CA C 154 62.100 62.639 -0.539 1
1 1195 . 4 1 1 A 94 94 VAL CB C 154 32.700 32.279 0.421 1
1 1198 . 4 1 1 A 94 94 VAL N N 154 120.600 120.734 -0.134 1
1 1199 . 4 1 1 A 95 95 ARG H H 155 9.430 8.358 1.072 1
1 1200 . 4 1 1 A 95 95 ARG HA H 155 4.640 4.401 0.239 1
1 1207 . 4 1 1 A 95 95 ARG C C 155 175.400 175.761 -0.361 1
1 1208 . 4 1 1 A 95 95 ARG CA C 155 54.200 56.013 -1.813 1
1 1209 . 4 1 1 A 95 95 ARG CB C 155 32.400 30.622 1.778 1
1 1212 . 4 1 1 A 95 95 ARG N N 155 128.200 125.624 2.576 1
1 1213 . 4 1 1 A 96 96 ILE H H 156 8.700 8.670 0.030 1
1 1214 . 4 1 1 A 96 96 ILE HA H 156 4.440 4.578 -0.138 1
1 1224 . 4 1 1 A 96 96 ILE CA C 156 56.500 57.241 -0.741 1
1 1225 . 4 1 1 A 96 96 ILE CB C 156 36.700 41.235 -4.535 1
1 1229 . 4 1 1 A 96 96 ILE N N 156 124.100 123.684 0.416 1
1 1230 . 4 1 1 A 97 97 PRO HA H 157 4.370 4.659 -0.289 1
1 1237 . 4 1 1 A 97 97 PRO C C 157 176.000 176.429 -0.429 1
1 1238 . 4 1 1 A 97 97 PRO CA C 157 63.200 62.695 0.505 1
1 1239 . 4 1 1 A 97 97 PRO CB C 157 32.400 31.859 0.541 1
1 1242 . 4 1 1 A 98 98 LYS H H 158 8.380 8.322 0.058 1
1 1243 . 4 1 1 A 98 98 LYS HA H 158 4.190 4.577 -0.387 1
1 1252 . 4 1 1 A 98 98 LYS C C 158 176.800 176.179 0.621 1
1 1253 . 4 1 1 A 98 98 LYS CA C 158 57.100 55.595 1.505 1
1 1254 . 4 1 1 A 98 98 LYS CB C 158 32.800 33.127 -0.327 1
1 1258 . 4 1 1 A 98 98 LYS N N 158 120.800 116.276 4.524 1
1 1259 . 4 1 1 A 99 99 ILE H H 159 7.930 7.404 0.526 1
1 1260 . 4 1 1 A 99 99 ILE HA H 159 4.200 3.957 0.243 1
1 1270 . 4 1 1 A 99 99 ILE C C 159 175.400 175.170 0.230 1
1 1271 . 4 1 1 A 99 99 ILE CA C 159 60.600 60.761 -0.161 1
1 1272 . 4 1 1 A 99 99 ILE CB C 159 39.100 37.557 1.543 1
1 1276 . 4 1 1 A 99 99 ILE N N 159 120.200 121.737 -1.537 1
1 1277 . 4 1 1 A 100 100 ALA H H 160 8.370 8.477 -0.107 1
1 1278 . 4 1 1 A 100 100 ALA HA H 160 4.370 5.020 -0.650 1
1 1282 . 4 1 1 A 100 100 ALA C C 160 177.200 176.438 0.762 1
1 1283 . 4 1 1 A 100 100 ALA CA C 160 52.200 49.980 2.220 1
1 1284 . 4 1 1 A 100 100 ALA CB C 160 19.400 23.301 -3.901 1
1 1285 . 4 1 1 A 100 100 ALA N N 160 128.300 130.074 -1.774 1
1 1286 . 4 1 1 A 101 101 LEU H H 161 8.250 8.242 0.008 1
1 1287 . 4 1 1 A 101 101 LEU HA H 161 4.280 4.678 -0.398 1
1 1297 . 4 1 1 A 101 101 LEU C C 161 177.200 177.086 0.114 1
1 1298 . 4 1 1 A 101 101 LEU CA C 161 55.200 54.181 1.019 1
1 1299 . 4 1 1 A 101 101 LEU CB C 161 42.400 42.084 0.316 1
1 1303 . 4 1 1 A 101 101 LEU N N 161 121.900 120.400 1.500 1
1 1304 . 4 1 1 A 102 102 GLU H H 162 8.390 7.667 0.723 1
1 1305 . 4 1 1 A 102 102 GLU HA H 162 4.230 4.736 -0.506 1
1 1310 . 4 1 1 A 102 102 GLU C C 162 176.100 176.231 -0.131 1
1 1311 . 4 1 1 A 102 102 GLU CA C 162 56.400 54.739 1.661 1
1 1312 . 4 1 1 A 102 102 GLU CB C 162 30.500 31.229 -0.729 1
1 1314 . 4 1 1 A 102 102 GLU N N 162 121.300 119.367 1.933 1
1 1315 . 4 1 1 A 103 103 HIS H H 163 8.330 8.909 -0.579 1
1 1316 . 4 1 1 A 103 103 HIS HA H 163 4.590 4.704 -0.114 1
1 1319 . 4 1 1 A 103 103 HIS C C 163 176.100 175.078 1.022 1
1 1320 . 4 1 1 A 103 103 HIS CA C 163 56.000 55.835 0.165 1
1 1321 . 4 1 1 A 103 103 HIS CB C 163 30.500 28.947 1.553 1
1 1322 . 4 1 1 A 103 103 HIS N N 163 120.000 118.846 1.154 1
1 1323 . 4 1 1 A 107 107 HIS HA H 167 4.620 4.702 -0.082 1
1 1326 . 4 1 1 A 107 107 HIS C C 167 173.900 175.268 -1.368 1
1 1327 . 4 1 1 A 107 107 HIS CA C 167 56.000 56.392 -0.392 1
1 1328 . 4 1 1 A 107 107 HIS CB C 167 30.300 30.405 -0.105 1
1 15 . 5 1 1 A 2 2 ASP H H 62 8.760 7.925 0.835 1
1 16 . 5 1 1 A 2 2 ASP HA H 62 4.810 4.804 0.006 1
1 19 . 5 1 1 A 2 2 ASP C C 62 175.800 176.176 -0.376 1
1 20 . 5 1 1 A 2 2 ASP CA C 62 54.800 52.680 2.120 1
1 21 . 5 1 1 A 2 2 ASP CB C 62 41.600 42.550 -0.950 1
1 22 . 5 1 1 A 2 2 ASP N N 62 120.900 116.839 4.061 1
1 23 . 5 1 1 A 3 3 SER H H 63 8.710 8.686 0.024 1
1 24 . 5 1 1 A 3 3 SER HA H 63 4.970 5.119 -0.149 1
1 27 . 5 1 1 A 3 3 SER C C 63 175.600 175.380 0.220 1
1 28 . 5 1 1 A 3 3 SER CA C 63 57.500 56.268 1.232 1
1 29 . 5 1 1 A 3 3 SER CB C 63 65.900 66.585 -0.685 1
1 30 . 5 1 1 A 3 3 SER N N 63 116.300 113.645 2.655 1
1 31 . 5 1 1 A 4 4 PHE H H 64 9.370 9.209 0.161 1
1 32 . 5 1 1 A 4 4 PHE HA H 64 4.010 4.223 -0.213 1
1 39 . 5 1 1 A 4 4 PHE C C 64 176.700 177.486 -0.786 1
1 40 . 5 1 1 A 4 4 PHE CA C 64 62.200 61.588 0.612 1
1 41 . 5 1 1 A 4 4 PHE CB C 64 38.500 39.329 -0.829 1
1 46 . 5 1 1 A 4 4 PHE N N 64 121.400 122.019 -0.619 1
1 47 . 5 1 1 A 5 5 GLY H H 65 8.930 8.290 0.640 1
1 48 . 5 1 1 A 5 5 GLY HA2 H 65 2.020 2.577 -0.557 1
1 49 . 5 1 1 A 5 5 GLY HA3 H 65 3.250 2.962 0.288 1
1 50 . 5 1 1 A 5 5 GLY C C 65 175.200 175.607 -0.407 1
1 51 . 5 1 1 A 5 5 GLY CA C 65 46.300 46.615 -0.315 1
1 52 . 5 1 1 A 5 5 GLY N N 65 106.500 105.352 1.148 1
1 53 . 5 1 1 A 6 6 ASP H H 66 7.630 7.299 0.331 1
1 54 . 5 1 1 A 6 6 ASP HA H 66 4.100 4.194 -0.094 1
1 57 . 5 1 1 A 6 6 ASP C C 66 179.500 178.704 0.796 1
1 58 . 5 1 1 A 6 6 ASP CA C 66 57.400 56.735 0.665 1
1 59 . 5 1 1 A 6 6 ASP CB C 66 40.500 40.370 0.130 1
1 60 . 5 1 1 A 6 6 ASP N N 66 120.500 121.369 -0.869 1
1 61 . 5 1 1 A 7 7 TRP H H 67 7.190 7.641 -0.451 1
1 62 . 5 1 1 A 7 7 TRP HA H 67 3.860 4.223 -0.363 1
1 71 . 5 1 1 A 7 7 TRP C C 67 177.200 178.229 -1.029 1
1 72 . 5 1 1 A 7 7 TRP CA C 67 61.100 59.839 1.261 1
1 73 . 5 1 1 A 7 7 TRP CB C 67 28.300 29.059 -0.759 1
1 79 . 5 1 1 A 7 7 TRP N N 67 120.700 120.291 0.409 1
1 81 . 5 1 1 A 8 8 ALA H H 68 9.040 8.322 0.718 1
1 82 . 5 1 1 A 8 8 ALA HA H 68 3.730 3.835 -0.105 1
1 86 . 5 1 1 A 8 8 ALA C C 68 179.500 180.230 -0.730 1
1 87 . 5 1 1 A 8 8 ALA CA C 68 55.200 55.230 -0.030 1
1 88 . 5 1 1 A 8 8 ALA CB C 68 18.600 17.955 0.645 1
1 89 . 5 1 1 A 8 8 ALA N N 68 125.700 122.464 3.236 1
1 90 . 5 1 1 A 9 9 GLU H H 69 8.060 7.987 0.073 1
1 91 . 5 1 1 A 9 9 GLU HA H 69 4.020 4.038 -0.018 1
1 96 . 5 1 1 A 9 9 GLU C C 69 180.400 179.363 1.037 1
1 97 . 5 1 1 A 9 9 GLU CA C 69 58.800 59.587 -0.787 1
1 98 . 5 1 1 A 9 9 GLU CB C 69 28.500 29.565 -1.065 1
1 99 . 5 1 1 A 9 9 GLU N N 69 115.400 117.902 -2.502 1
1 100 . 5 1 1 A 10 10 LYS H H 70 7.740 7.789 -0.049 1
1 101 . 5 1 1 A 10 10 LYS HA H 70 3.910 4.040 -0.130 1
1 110 . 5 1 1 A 10 10 LYS C C 70 179.500 178.519 0.981 1
1 111 . 5 1 1 A 10 10 LYS CA C 70 60.000 58.523 1.477 1
1 112 . 5 1 1 A 10 10 LYS CB C 70 32.400 32.190 0.210 1
1 116 . 5 1 1 A 10 10 LYS N N 70 122.700 119.587 3.113 1
1 117 . 5 1 1 A 11 11 PHE H H 71 8.750 8.523 0.227 1
1 118 . 5 1 1 A 11 11 PHE HA H 71 4.080 4.324 -0.244 1
1 126 . 5 1 1 A 11 11 PHE C C 71 177.100 177.094 0.006 1
1 127 . 5 1 1 A 11 11 PHE CA C 71 61.200 61.269 -0.069 1
1 128 . 5 1 1 A 11 11 PHE CB C 71 38.900 39.195 -0.295 1
1 134 . 5 1 1 A 11 11 PHE N N 71 123.500 121.924 1.576 1
1 135 . 5 1 1 A 12 12 LEU H H 72 8.400 8.751 -0.351 1
1 136 . 5 1 1 A 12 12 LEU HA H 72 3.520 3.583 -0.063 1
1 146 . 5 1 1 A 12 12 LEU C C 72 180.000 178.940 1.060 1
1 147 . 5 1 1 A 12 12 LEU CA C 72 58.200 57.970 0.230 1
1 148 . 5 1 1 A 12 12 LEU CB C 72 41.700 41.450 0.250 1
1 152 . 5 1 1 A 12 12 LEU N N 72 121.100 119.110 1.990 1
1 153 . 5 1 1 A 13 13 LYS H H 73 7.810 7.793 0.017 1
1 154 . 5 1 1 A 13 13 LYS HA H 73 4.080 4.006 0.074 1
1 156 . 5 1 1 A 13 13 LYS C C 73 179.300 178.519 0.781 1
1 157 . 5 1 1 A 13 13 LYS CA C 73 59.000 58.559 0.441 1
1 158 . 5 1 1 A 13 13 LYS CB C 73 31.900 31.624 0.276 1
1 159 . 5 1 1 A 13 13 LYS N N 73 119.400 120.308 -0.908 1
1 160 . 5 1 1 A 14 14 SER H H 74 8.210 8.001 0.209 1
1 161 . 5 1 1 A 14 14 SER HA H 74 4.210 4.209 0.001 1
1 164 . 5 1 1 A 14 14 SER C C 74 176.300 177.423 -1.123 1
1 165 . 5 1 1 A 14 14 SER CA C 74 61.400 61.013 0.387 1
1 166 . 5 1 1 A 14 14 SER CB C 74 62.600 62.429 0.171 1
1 167 . 5 1 1 A 14 14 SER N N 74 117.600 115.225 2.375 1
1 168 . 5 1 1 A 15 15 LYS H H 75 7.760 7.113 0.647 1
1 169 . 5 1 1 A 15 15 LYS HA H 75 4.040 3.971 0.069 1
1 178 . 5 1 1 A 15 15 LYS C C 75 178.500 179.487 -0.987 1
1 179 . 5 1 1 A 15 15 LYS CA C 75 56.500 58.878 -2.378 1
1 180 . 5 1 1 A 15 15 LYS CB C 75 30.600 32.120 -1.520 1
1 184 . 5 1 1 A 15 15 LYS N N 75 120.100 122.319 -2.219 1
1 185 . 5 1 1 A 16 16 GLU H H 76 7.680 8.262 -0.582 1
1 186 . 5 1 1 A 16 16 GLU HA H 76 4.030 4.020 0.010 1
1 191 . 5 1 1 A 16 16 GLU C C 76 179.900 178.532 1.368 1
1 192 . 5 1 1 A 16 16 GLU CA C 76 59.200 59.296 -0.096 1
1 193 . 5 1 1 A 16 16 GLU CB C 76 29.600 29.022 0.578 1
1 195 . 5 1 1 A 16 16 GLU N N 76 119.700 118.122 1.578 1
1 196 . 5 1 1 A 17 17 ALA H H 77 8.030 7.853 0.177 1
1 197 . 5 1 1 A 17 17 ALA HA H 77 4.200 4.071 0.129 1
1 201 . 5 1 1 A 17 17 ALA C C 77 178.900 179.318 -0.418 1
1 202 . 5 1 1 A 17 17 ALA CA C 77 54.400 54.922 -0.522 1
1 203 . 5 1 1 A 17 17 ALA CB C 77 18.100 18.231 -0.131 1
1 204 . 5 1 1 A 17 17 ALA N N 77 123.000 122.391 0.609 1
1 205 . 5 1 1 A 18 18 ASP H H 78 7.860 7.826 0.034 1
1 206 . 5 1 1 A 18 18 ASP HA H 78 4.600 4.388 0.212 1
1 209 . 5 1 1 A 18 18 ASP C C 78 177.500 176.323 1.177 1
1 210 . 5 1 1 A 18 18 ASP CA C 78 55.100 55.683 -0.583 1
1 211 . 5 1 1 A 18 18 ASP CB C 78 41.400 41.313 0.087 1
1 212 . 5 1 1 A 18 18 ASP N N 78 117.700 117.821 -0.121 1
1 213 . 5 1 1 A 19 19 GLY H H 79 7.910 7.590 0.320 1
1 214 . 5 1 1 A 19 19 GLY HA2 H 79 3.860 4.060 -0.200 1
1 215 . 5 1 1 A 19 19 GLY HA3 H 79 4.080 4.063 0.017 1
1 216 . 5 1 1 A 19 19 GLY C C 79 175.300 174.364 0.936 1
1 217 . 5 1 1 A 19 19 GLY CA C 79 46.200 45.239 0.961 1
1 218 . 5 1 1 A 19 19 GLY N N 79 107.100 106.354 0.746 1
1 219 . 5 1 1 A 20 20 VAL H H 80 7.150 7.230 -0.080 1
1 220 . 5 1 1 A 20 20 VAL HA H 80 4.250 4.841 -0.591 1
1 228 . 5 1 1 A 20 20 VAL C C 80 175.100 175.626 -0.526 1
1 229 . 5 1 1 A 20 20 VAL CA C 80 61.800 59.952 1.848 1
1 230 . 5 1 1 A 20 20 VAL CB C 80 32.200 34.076 -1.876 1
1 233 . 5 1 1 A 20 20 VAL N N 80 114.600 116.661 -2.061 1
1 234 . 5 1 1 A 21 21 SER H H 81 8.560 8.629 -0.069 1
1 235 . 5 1 1 A 21 21 SER HA H 81 4.390 4.538 -0.148 1
1 238 . 5 1 1 A 21 21 SER C C 81 174.600 175.181 -0.581 1
1 239 . 5 1 1 A 21 21 SER CA C 81 57.900 58.782 -0.882 1
1 240 . 5 1 1 A 21 21 SER CB C 81 64.700 63.806 0.894 1
1 241 . 5 1 1 A 21 21 SER N N 81 118.700 119.999 -1.299 1
1 242 . 5 1 1 A 22 22 VAL H H 82 8.690 8.559 0.131 1
1 243 . 5 1 1 A 22 22 VAL HA H 82 3.700 3.929 -0.229 1
1 251 . 5 1 1 A 22 22 VAL C C 82 178.000 177.816 0.184 1
1 252 . 5 1 1 A 22 22 VAL CA C 82 66.500 65.106 1.394 1
1 253 . 5 1 1 A 22 22 VAL CB C 82 31.700 31.748 -0.048 1
1 256 . 5 1 1 A 22 22 VAL N N 82 122.100 126.550 -4.450 1
1 257 . 5 1 1 A 23 23 SER H H 83 8.300 8.126 0.174 1
1 258 . 5 1 1 A 23 23 SER HA H 83 4.210 4.208 0.002 1
1 261 . 5 1 1 A 23 23 SER C C 83 177.600 175.872 1.728 1
1 262 . 5 1 1 A 23 23 SER CA C 83 61.400 62.050 -0.650 1
1 263 . 5 1 1 A 23 23 SER CB C 83 62.400 62.878 -0.478 1
1 264 . 5 1 1 A 23 23 SER N N 83 113.600 118.560 -4.960 1
1 265 . 5 1 1 A 24 24 GLN H H 84 7.820 8.032 -0.212 1
1 266 . 5 1 1 A 24 24 GLN HA H 84 3.970 4.011 -0.041 1
1 273 . 5 1 1 A 24 24 GLN C C 84 178.400 178.046 0.354 1
1 274 . 5 1 1 A 24 24 GLN CA C 84 58.400 58.741 -0.341 1
1 275 . 5 1 1 A 24 24 GLN CB C 84 28.900 28.268 0.632 1
1 278 . 5 1 1 A 24 24 GLN N N 84 122.900 120.971 1.929 1
1 280 . 5 1 1 A 25 25 LEU H H 85 8.920 8.402 0.518 1
1 281 . 5 1 1 A 25 25 LEU HA H 85 4.130 4.380 -0.250 1
1 291 . 5 1 1 A 25 25 LEU C C 85 178.800 178.768 0.032 1
1 292 . 5 1 1 A 25 25 LEU CA C 85 58.300 57.812 0.488 1
1 293 . 5 1 1 A 25 25 LEU CB C 85 41.200 41.853 -0.653 1
1 297 . 5 1 1 A 25 25 LEU N N 85 122.200 121.340 0.860 1
1 298 . 5 1 1 A 26 26 ASN H H 86 8.860 8.947 -0.087 1
1 299 . 5 1 1 A 26 26 ASN HA H 86 4.420 4.394 0.026 1
1 304 . 5 1 1 A 26 26 ASN C C 86 179.000 178.206 0.794 1
1 305 . 5 1 1 A 26 26 ASN CA C 86 55.900 56.545 -0.645 1
1 306 . 5 1 1 A 26 26 ASN CB C 86 37.200 38.041 -0.841 1
1 308 . 5 1 1 A 26 26 ASN N N 86 117.600 117.283 0.317 1
1 310 . 5 1 1 A 27 27 SER H H 87 7.840 7.899 -0.059 1
1 311 . 5 1 1 A 27 27 SER HA H 87 4.100 3.948 0.152 1
1 314 . 5 1 1 A 27 27 SER C C 87 179.000 176.265 2.735 1
1 315 . 5 1 1 A 27 27 SER CA C 87 62.100 62.167 -0.067 1
1 316 . 5 1 1 A 27 27 SER CB C 87 62.100 62.883 -0.783 1
1 317 . 5 1 1 A 27 27 SER N N 87 118.500 116.338 2.162 1
1 318 . 5 1 1 A 28 28 TYR H H 88 8.180 7.861 0.319 1
1 319 . 5 1 1 A 28 28 TYR HA H 88 4.600 4.554 0.046 1
1 326 . 5 1 1 A 28 28 TYR C C 88 174.800 178.036 -3.236 1
1 327 . 5 1 1 A 28 28 TYR CA C 88 61.200 61.952 -0.752 1
1 328 . 5 1 1 A 28 28 TYR CB C 88 37.800 38.295 -0.495 1
1 333 . 5 1 1 A 28 28 TYR N N 88 119.300 119.966 -0.666 1
1 334 . 5 1 1 A 29 29 LYS H H 89 9.040 8.558 0.482 1
1 335 . 5 1 1 A 29 29 LYS HA H 89 3.890 4.102 -0.212 1
1 344 . 5 1 1 A 29 29 LYS C C 89 179.000 178.344 0.656 1
1 345 . 5 1 1 A 29 29 LYS CA C 89 61.300 59.794 1.506 1
1 346 . 5 1 1 A 29 29 LYS CB C 89 32.800 31.911 0.889 1
1 350 . 5 1 1 A 29 29 LYS N N 89 119.300 121.598 -2.298 1
1 351 . 5 1 1 A 30 30 ASN H H 90 7.770 8.276 -0.506 1
1 352 . 5 1 1 A 30 30 ASN HA H 90 4.560 4.417 0.143 1
1 357 . 5 1 1 A 30 30 ASN C C 90 178.300 177.498 0.802 1
1 358 . 5 1 1 A 30 30 ASN CA C 90 56.200 56.303 -0.103 1
1 359 . 5 1 1 A 30 30 ASN CB C 90 38.900 39.065 -0.165 1
1 361 . 5 1 1 A 30 30 ASN N N 90 117.800 117.182 0.618 1
1 363 . 5 1 1 A 31 31 TYR H H 91 8.860 7.842 1.018 1
1 364 . 5 1 1 A 31 31 TYR HA H 91 4.910 4.516 0.394 1
1 371 . 5 1 1 A 31 31 TYR C C 91 178.300 178.539 -0.239 1
1 372 . 5 1 1 A 31 31 TYR CA C 91 59.700 60.966 -1.266 1
1 373 . 5 1 1 A 31 31 TYR CB C 91 37.500 37.948 -0.448 1
1 378 . 5 1 1 A 31 31 TYR N N 91 119.400 118.383 1.017 1
1 379 . 5 1 1 A 32 32 CYS H H 92 8.640 8.384 0.256 1
1 380 . 5 1 1 A 32 32 CYS HA H 92 4.410 4.270 0.140 1
1 383 . 5 1 1 A 32 32 CYS C C 92 173.700 177.261 -3.561 1
1 384 . 5 1 1 A 32 32 CYS CA C 92 65.500 62.779 2.721 1
1 385 . 5 1 1 A 32 32 CYS CB C 92 28.300 26.572 1.728 1
1 386 . 5 1 1 A 32 32 CYS N N 92 113.500 118.997 -5.497 1
1 387 . 5 1 1 A 33 33 ARG H H 93 8.440 8.594 -0.154 1
1 388 . 5 1 1 A 33 33 ARG HA H 93 3.740 3.952 -0.212 1
1 391 . 5 1 1 A 33 33 ARG C C 93 177.200 177.871 -0.671 1
1 392 . 5 1 1 A 33 33 ARG CA C 93 58.300 58.894 -0.594 1
1 393 . 5 1 1 A 33 33 ARG CB C 93 30.200 30.048 0.152 1
1 394 . 5 1 1 A 33 33 ARG N N 93 111.400 121.170 -9.770 1
1 395 . 5 1 1 A 34 34 ASN H H 94 8.020 7.906 0.114 1
1 396 . 5 1 1 A 34 34 ASN HA H 94 4.980 4.798 0.182 1
1 401 . 5 1 1 A 34 34 ASN C C 94 176.700 176.962 -0.262 1
1 402 . 5 1 1 A 34 34 ASN CA C 94 53.400 54.794 -1.394 1
1 403 . 5 1 1 A 34 34 ASN CB C 94 38.000 39.551 -1.551 1
1 405 . 5 1 1 A 34 34 ASN N N 94 113.600 115.513 -1.913 1
1 407 . 5 1 1 A 35 35 HIS H H 95 7.200 8.118 -0.918 1
1 408 . 5 1 1 A 35 35 HIS HA H 95 4.470 4.436 0.034 1
1 411 . 5 1 1 A 35 35 HIS C C 95 176.600 176.177 0.423 1
1 412 . 5 1 1 A 35 35 HIS CA C 95 60.000 60.136 -0.136 1
1 413 . 5 1 1 A 35 35 HIS CB C 95 30.500 30.852 -0.352 1
1 414 . 5 1 1 A 35 35 HIS N N 95 115.600 117.647 -2.047 1
1 415 . 5 1 1 A 36 36 LEU H H 96 8.170 8.561 -0.391 1
1 416 . 5 1 1 A 36 36 LEU HA H 96 4.730 4.456 0.274 1
1 426 . 5 1 1 A 36 36 LEU C C 96 176.800 177.189 -0.389 1
1 427 . 5 1 1 A 36 36 LEU CA C 96 54.400 54.599 -0.199 1
1 428 . 5 1 1 A 36 36 LEU CB C 96 40.600 41.527 -0.927 1
1 432 . 5 1 1 A 36 36 LEU N N 96 114.000 119.191 -5.191 1
1 433 . 5 1 1 A 37 37 SER H H 97 7.140 8.034 -0.894 1
1 434 . 5 1 1 A 37 37 SER HA H 97 4.730 4.336 0.394 1
1 437 . 5 1 1 A 37 37 SER CA C 97 62.700 62.935 -0.235 1
1 438 . 5 1 1 A 37 37 SER CB C 97 62.600 62.147 0.453 1
1 439 . 5 1 1 A 37 37 SER N N 97 117.200 116.598 0.602 1
1 440 . 5 1 1 A 38 38 PRO HA H 98 4.560 4.386 0.174 1
1 447 . 5 1 1 A 38 38 PRO C C 98 177.900 179.175 -1.275 1
1 448 . 5 1 1 A 38 38 PRO CA C 98 65.700 65.815 -0.115 1
1 449 . 5 1 1 A 38 38 PRO CB C 98 31.800 30.812 0.988 1
1 452 . 5 1 1 A 39 39 LEU H H 99 8.090 7.450 0.640 1
1 453 . 5 1 1 A 39 39 LEU HA H 99 4.260 3.988 0.272 1
1 463 . 5 1 1 A 39 39 LEU C C 99 178.700 178.490 0.210 1
1 464 . 5 1 1 A 39 39 LEU CA C 99 54.300 57.356 -3.056 1
1 465 . 5 1 1 A 39 39 LEU CB C 99 42.400 41.248 1.152 1
1 469 . 5 1 1 A 39 39 LEU N N 99 112.400 117.549 -5.149 1
1 470 . 5 1 1 A 40 40 TYR H H 100 8.350 8.948 -0.598 1
1 471 . 5 1 1 A 40 40 TYR HA H 100 4.170 4.424 -0.254 1
1 478 . 5 1 1 A 40 40 TYR C C 100 178.300 176.884 1.416 1
1 479 . 5 1 1 A 40 40 TYR CA C 100 63.400 62.154 1.246 1
1 480 . 5 1 1 A 40 40 TYR CB C 100 38.600 39.221 -0.621 1
1 485 . 5 1 1 A 40 40 TYR N N 100 119.400 121.178 -1.778 1
1 486 . 5 1 1 A 41 41 MET H H 101 8.640 7.923 0.717 1
1 487 . 5 1 1 A 41 41 MET HA H 101 4.260 4.745 -0.485 1
1 488 . 5 1 1 A 41 41 MET C C 101 177.000 176.201 0.799 1
1 489 . 5 1 1 A 41 41 MET CA C 101 54.600 54.538 0.062 1
1 490 . 5 1 1 A 41 41 MET N N 101 111.800 116.176 -4.376 1
1 491 . 5 1 1 A 42 42 LYS H H 102 7.880 8.005 -0.125 1
1 492 . 5 1 1 A 42 42 LYS HA H 102 4.430 4.815 -0.385 1
1 501 . 5 1 1 A 42 42 LYS C C 102 176.300 175.191 1.109 1
1 502 . 5 1 1 A 42 42 LYS CA C 102 56.000 54.369 1.631 1
1 503 . 5 1 1 A 42 42 LYS CB C 102 33.400 34.190 -0.790 1
1 507 . 5 1 1 A 42 42 LYS N N 102 121.700 118.950 2.750 1
1 508 . 5 1 1 A 43 43 SER H H 103 9.160 8.578 0.582 1
1 509 . 5 1 1 A 43 43 SER HA H 103 4.620 4.921 -0.301 1
1 513 . 5 1 1 A 43 43 SER C C 103 176.300 175.478 0.822 1
1 514 . 5 1 1 A 43 43 SER CA C 103 58.700 56.320 2.380 1
1 515 . 5 1 1 A 43 43 SER CB C 103 63.700 65.254 -1.554 1
1 516 . 5 1 1 A 43 43 SER N N 103 118.800 116.707 2.093 1
1 517 . 5 1 1 A 44 44 LEU H H 104 8.860 9.100 -0.240 1
1 518 . 5 1 1 A 44 44 LEU HA H 104 4.130 4.226 -0.096 1
1 528 . 5 1 1 A 44 44 LEU C C 104 178.700 178.400 0.300 1
1 529 . 5 1 1 A 44 44 LEU CA C 104 58.800 58.042 0.758 1
1 530 . 5 1 1 A 44 44 LEU CB C 104 42.600 41.919 0.681 1
1 534 . 5 1 1 A 44 44 LEU N N 104 124.200 128.155 -3.955 1
1 535 . 5 1 1 A 45 45 SER H H 105 8.330 8.250 0.080 1
1 536 . 5 1 1 A 45 45 SER HA H 105 4.310 4.434 -0.124 1
1 539 . 5 1 1 A 45 45 SER C C 105 175.000 175.071 -0.071 1
1 540 . 5 1 1 A 45 45 SER CA C 105 60.100 59.619 0.481 1
1 541 . 5 1 1 A 45 45 SER CB C 105 63.400 62.846 0.554 1
1 542 . 5 1 1 A 45 45 SER N N 105 107.700 113.167 -5.467 1
1 543 . 5 1 1 A 46 46 GLU H H 106 7.800 7.813 -0.013 1
1 544 . 5 1 1 A 46 46 GLU HA H 106 4.570 4.376 0.194 1
1 549 . 5 1 1 A 46 46 GLU C C 106 174.100 176.268 -2.168 1
1 550 . 5 1 1 A 46 46 GLU CA C 106 55.600 56.113 -0.513 1
1 551 . 5 1 1 A 46 46 GLU CB C 106 31.200 30.475 0.725 1
1 553 . 5 1 1 A 46 46 GLU N N 106 119.600 119.055 0.545 1
1 554 . 5 1 1 A 47 47 ILE H H 107 7.100 7.119 -0.019 1
1 555 . 5 1 1 A 47 47 ILE HA H 107 4.040 4.123 -0.083 1
1 565 . 5 1 1 A 47 47 ILE C C 107 174.100 175.256 -1.156 1
1 566 . 5 1 1 A 47 47 ILE CA C 107 62.300 60.783 1.517 1
1 567 . 5 1 1 A 47 47 ILE CB C 107 38.500 38.463 0.037 1
1 571 . 5 1 1 A 47 47 ILE N N 107 120.600 121.181 -0.581 1
1 572 . 5 1 1 A 48 48 LEU H H 108 9.180 8.882 0.298 1
1 573 . 5 1 1 A 48 48 LEU HA H 108 4.940 4.711 0.229 1
1 583 . 5 1 1 A 48 48 LEU CA C 108 51.900 51.804 0.096 1
1 584 . 5 1 1 A 48 48 LEU CB C 108 42.000 42.076 -0.076 1
1 588 . 5 1 1 A 48 48 LEU N N 108 129.400 128.510 0.890 1
1 589 . 5 1 1 A 49 49 PRO HA H 109 3.910 4.304 -0.394 1
1 596 . 5 1 1 A 49 49 PRO C C 109 178.500 177.784 0.716 1
1 597 . 5 1 1 A 49 49 PRO CA C 109 66.600 65.048 1.552 1
1 598 . 5 1 1 A 49 49 PRO CB C 109 31.300 31.835 -0.535 1
1 601 . 5 1 1 A 50 50 ALA H H 110 8.280 8.371 -0.091 1
1 602 . 5 1 1 A 50 50 ALA HA H 110 4.110 4.065 0.045 1
1 606 . 5 1 1 A 50 50 ALA C C 110 179.700 179.903 -0.203 1
1 607 . 5 1 1 A 50 50 ALA CA C 110 55.100 54.996 0.104 1
1 608 . 5 1 1 A 50 50 ALA CB C 110 19.200 18.304 0.896 1
1 609 . 5 1 1 A 50 50 ALA N N 110 116.100 119.401 -3.301 1
1 610 . 5 1 1 A 51 51 ASP H H 111 7.790 7.869 -0.079 1
1 611 . 5 1 1 A 51 51 ASP HA H 111 4.440 4.365 0.075 1
1 614 . 5 1 1 A 51 51 ASP C C 111 178.200 178.655 -0.455 1
1 615 . 5 1 1 A 51 51 ASP CA C 111 57.600 57.508 0.092 1
1 616 . 5 1 1 A 51 51 ASP CB C 111 41.800 41.130 0.670 1
1 617 . 5 1 1 A 51 51 ASP N N 111 116.500 118.013 -1.513 1
1 618 . 5 1 1 A 52 52 ILE H H 112 7.020 7.490 -0.470 1
1 619 . 5 1 1 A 52 52 ILE HA H 112 3.750 3.681 0.069 1
1 629 . 5 1 1 A 52 52 ILE C C 112 177.300 177.840 -0.540 1
1 630 . 5 1 1 A 52 52 ILE CA C 112 63.500 65.052 -1.552 1
1 631 . 5 1 1 A 52 52 ILE CB C 112 37.500 37.204 0.296 1
1 635 . 5 1 1 A 52 52 ILE N N 112 116.700 119.769 -3.069 1
1 636 . 5 1 1 A 53 53 GLN H H 113 9.150 8.272 0.878 1
1 637 . 5 1 1 A 53 53 GLN HA H 113 3.720 3.950 -0.230 1
1 644 . 5 1 1 A 53 53 GLN C C 113 177.500 178.163 -0.663 1
1 645 . 5 1 1 A 53 53 GLN CA C 113 58.200 58.774 -0.574 1
1 646 . 5 1 1 A 53 53 GLN CB C 113 30.200 28.445 1.755 1
1 649 . 5 1 1 A 53 53 GLN N N 113 121.200 121.455 -0.255 1
1 651 . 5 1 1 A 54 54 SER H H 114 8.150 8.191 -0.041 1
1 652 . 5 1 1 A 54 54 SER HA H 114 4.180 4.110 0.070 1
1 655 . 5 1 1 A 54 54 SER C C 114 175.900 175.872 0.028 1
1 656 . 5 1 1 A 54 54 SER CA C 114 62.100 62.716 -0.616 1
1 657 . 5 1 1 A 54 54 SER CB C 114 62.800 62.967 -0.167 1
1 658 . 5 1 1 A 54 54 SER N N 114 112.200 116.353 -4.153 1
1 659 . 5 1 1 A 55 55 ILE H H 115 6.760 7.561 -0.801 1
1 660 . 5 1 1 A 55 55 ILE HA H 115 3.860 3.697 0.163 1
1 670 . 5 1 1 A 55 55 ILE C C 115 179.200 178.348 0.852 1
1 671 . 5 1 1 A 55 55 ILE CA C 115 64.700 65.178 -0.478 1
1 672 . 5 1 1 A 55 55 ILE CB C 115 38.900 38.004 0.896 1
1 676 . 5 1 1 A 55 55 ILE N N 115 119.500 120.762 -1.262 1
1 677 . 5 1 1 A 56 56 ILE H H 116 7.750 8.217 -0.467 1
1 678 . 5 1 1 A 56 56 ILE HA H 116 3.690 3.547 0.143 1
1 688 . 5 1 1 A 56 56 ILE C C 116 176.900 178.178 -1.278 1
1 689 . 5 1 1 A 56 56 ILE CA C 116 62.800 65.321 -2.521 1
1 690 . 5 1 1 A 56 56 ILE CB C 116 36.200 37.788 -1.588 1
1 694 . 5 1 1 A 56 56 ILE N N 116 120.200 120.303 -0.103 1
1 695 . 5 1 1 A 57 57 ASN H H 117 8.690 8.547 0.143 1
1 696 . 5 1 1 A 57 57 ASN HA H 117 4.440 4.421 0.019 1
1 701 . 5 1 1 A 57 57 ASN C C 117 177.200 177.207 -0.007 1
1 702 . 5 1 1 A 57 57 ASN CA C 117 54.800 56.672 -1.872 1
1 703 . 5 1 1 A 57 57 ASN CB C 117 38.100 38.552 -0.452 1
1 705 . 5 1 1 A 57 57 ASN N N 117 117.000 119.310 -2.310 1
1 707 . 5 1 1 A 58 58 GLU H H 118 7.630 7.884 -0.254 1
1 708 . 5 1 1 A 58 58 GLU HA H 118 4.450 4.359 0.091 1
1 713 . 5 1 1 A 58 58 GLU C C 118 176.500 176.929 -0.429 1
1 714 . 5 1 1 A 58 58 GLU CA C 118 56.200 57.429 -1.229 1
1 715 . 5 1 1 A 58 58 GLU CB C 118 30.200 30.205 -0.005 1
1 717 . 5 1 1 A 58 58 GLU N N 118 116.300 116.674 -0.374 1
1 718 . 5 1 1 A 59 59 THR H H 119 7.540 7.569 -0.029 1
1 719 . 5 1 1 A 59 59 THR HA H 119 4.230 4.311 -0.081 1
1 724 . 5 1 1 A 59 59 THR C C 119 174.200 174.884 -0.684 1
1 725 . 5 1 1 A 59 59 THR CA C 119 63.800 64.076 -0.276 1
1 726 . 5 1 1 A 59 59 THR CB C 119 68.900 69.403 -0.503 1
1 728 . 5 1 1 A 59 59 THR N N 119 117.600 115.994 1.606 1
1 729 . 5 1 1 A 60 60 LYS H H 120 8.860 8.659 0.201 1
1 730 . 5 1 1 A 60 60 LYS HA H 120 4.490 4.513 -0.023 1
1 739 . 5 1 1 A 60 60 LYS C C 120 175.800 175.708 0.092 1
1 740 . 5 1 1 A 60 60 LYS CA C 120 54.900 55.374 -0.474 1
1 741 . 5 1 1 A 60 60 LYS CB C 120 29.800 32.371 -2.571 1
1 745 . 5 1 1 A 60 60 LYS N N 120 128.500 125.032 3.468 1
1 746 . 5 1 1 A 61 61 LEU H H 121 7.150 7.457 -0.307 1
1 747 . 5 1 1 A 61 61 LEU HA H 121 4.710 4.753 -0.043 1
1 757 . 5 1 1 A 61 61 LEU C C 121 175.000 176.457 -1.457 1
1 758 . 5 1 1 A 61 61 LEU CA C 121 52.800 53.658 -0.858 1
1 759 . 5 1 1 A 61 61 LEU CB C 121 46.400 42.871 3.529 1
1 763 . 5 1 1 A 61 61 LEU N N 121 120.700 121.924 -1.224 1
1 764 . 5 1 1 A 62 62 ALA H H 122 8.000 8.571 -0.571 1
1 765 . 5 1 1 A 62 62 ALA HA H 122 4.250 4.420 -0.170 1
1 769 . 5 1 1 A 62 62 ALA CA C 122 52.100 51.908 0.192 1
1 770 . 5 1 1 A 62 62 ALA CB C 122 19.500 19.759 -0.259 1
1 771 . 5 1 1 A 62 62 ALA N N 122 119.900 122.875 -2.975 1
1 772 . 5 1 1 A 63 63 LYS H H 123 8.770 9.051 -0.281 1
1 773 . 5 1 1 A 63 63 LYS HA H 123 3.800 3.911 -0.111 1
1 782 . 5 1 1 A 63 63 LYS C C 123 178.300 179.100 -0.800 1
1 783 . 5 1 1 A 63 63 LYS CA C 123 60.700 59.719 0.981 1
1 784 . 5 1 1 A 63 63 LYS CB C 123 32.300 32.018 0.282 1
1 788 . 5 1 1 A 63 63 LYS N N 123 121.400 120.437 0.963 1
1 789 . 5 1 1 A 64 64 ASN H H 124 9.020 8.015 1.005 1
1 790 . 5 1 1 A 64 64 ASN HA H 124 4.430 4.510 -0.080 1
1 795 . 5 1 1 A 64 64 ASN C C 124 178.300 177.979 0.321 1
1 796 . 5 1 1 A 64 64 ASN CA C 124 56.200 56.305 -0.105 1
1 797 . 5 1 1 A 64 64 ASN CB C 124 37.300 38.772 -1.472 1
1 799 . 5 1 1 A 64 64 ASN N N 124 115.000 117.914 -2.914 1
1 801 . 5 1 1 A 65 65 THR H H 125 7.620 8.061 -0.441 1
1 802 . 5 1 1 A 65 65 THR HA H 125 4.030 3.974 0.056 1
1 807 . 5 1 1 A 65 65 THR C C 125 175.500 176.937 -1.437 1
1 808 . 5 1 1 A 65 65 THR CA C 125 66.000 66.983 -0.983 1
1 809 . 5 1 1 A 65 65 THR CB C 125 67.600 67.916 -0.316 1
1 811 . 5 1 1 A 65 65 THR N N 125 119.800 116.415 3.385 1
1 812 . 5 1 1 A 66 66 LEU H H 126 8.020 8.306 -0.286 1
1 813 . 5 1 1 A 66 66 LEU HA H 126 3.790 3.814 -0.024 1
1 823 . 5 1 1 A 66 66 LEU C C 126 179.200 179.249 -0.049 1
1 824 . 5 1 1 A 66 66 LEU CA C 126 58.700 57.976 0.724 1
1 825 . 5 1 1 A 66 66 LEU CB C 126 41.300 41.184 0.116 1
1 829 . 5 1 1 A 66 66 LEU N N 126 121.200 121.519 -0.319 1
1 830 . 5 1 1 A 67 67 LYS H H 127 8.380 8.466 -0.086 1
1 831 . 5 1 1 A 67 67 LYS HA H 127 3.740 3.927 -0.187 1
1 840 . 5 1 1 A 67 67 LYS C C 127 178.300 179.544 -1.244 1
1 841 . 5 1 1 A 67 67 LYS CA C 127 60.100 59.880 0.220 1
1 842 . 5 1 1 A 67 67 LYS CB C 127 32.400 32.162 0.238 1
1 846 . 5 1 1 A 67 67 LYS N N 127 117.000 117.938 -0.938 1
1 847 . 5 1 1 A 68 68 ALA H H 128 7.480 7.798 -0.318 1
1 848 . 5 1 1 A 68 68 ALA HA H 128 4.210 3.977 0.233 1
1 852 . 5 1 1 A 68 68 ALA C C 128 181.200 180.089 1.111 1
1 853 . 5 1 1 A 68 68 ALA CA C 128 55.200 54.910 0.290 1
1 854 . 5 1 1 A 68 68 ALA CB C 128 18.600 18.116 0.484 1
1 855 . 5 1 1 A 68 68 ALA N N 128 122.900 121.748 1.152 1
1 856 . 5 1 1 A 69 69 ILE H H 129 8.250 7.259 0.991 1
1 857 . 5 1 1 A 69 69 ILE HA H 129 3.130 3.285 -0.155 1
1 867 . 5 1 1 A 69 69 ILE C C 129 177.400 177.716 -0.316 1
1 868 . 5 1 1 A 69 69 ILE CA C 129 66.700 65.156 1.544 1
1 869 . 5 1 1 A 69 69 ILE CB C 129 37.900 37.398 0.502 1
1 873 . 5 1 1 A 69 69 ILE N N 129 122.800 118.628 4.172 1
1 874 . 5 1 1 A 70 70 ARG H H 130 8.040 7.829 0.211 1
1 875 . 5 1 1 A 70 70 ARG HA H 130 3.620 3.871 -0.251 1
1 882 . 5 1 1 A 70 70 ARG C C 130 177.800 178.455 -0.655 1
1 883 . 5 1 1 A 70 70 ARG CA C 130 60.700 59.829 0.871 1
1 884 . 5 1 1 A 70 70 ARG CB C 130 29.600 29.785 -0.185 1
1 887 . 5 1 1 A 70 70 ARG N N 130 119.700 120.546 -0.846 1
1 888 . 5 1 1 A 71 71 ASN H H 131 8.920 8.598 0.322 1
1 889 . 5 1 1 A 71 71 ASN HA H 131 4.430 4.448 -0.018 1
1 894 . 5 1 1 A 71 71 ASN C C 131 177.500 177.756 -0.256 1
1 895 . 5 1 1 A 71 71 ASN CA C 131 56.100 56.692 -0.592 1
1 896 . 5 1 1 A 71 71 ASN CB C 131 38.600 39.576 -0.976 1
1 898 . 5 1 1 A 71 71 ASN N N 131 117.200 118.129 -0.929 1
1 900 . 5 1 1 A 72 72 THR H H 132 8.300 8.434 -0.134 1
1 901 . 5 1 1 A 72 72 THR HA H 132 4.430 3.967 0.463 1
1 906 . 5 1 1 A 72 72 THR C C 132 175.100 176.360 -1.260 1
1 907 . 5 1 1 A 72 72 THR CA C 132 68.200 66.528 1.672 1
1 908 . 5 1 1 A 72 72 THR CB C 132 68.500 68.920 -0.420 1
1 910 . 5 1 1 A 72 72 THR N N 132 119.200 115.376 3.824 1
1 911 . 5 1 1 A 73 73 ALA H H 133 7.950 8.238 -0.288 1
1 912 . 5 1 1 A 73 73 ALA HA H 133 4.040 3.983 0.057 1
1 916 . 5 1 1 A 73 73 ALA C C 133 178.200 178.940 -0.740 1
1 917 . 5 1 1 A 73 73 ALA CA C 133 55.900 55.391 0.509 1
1 918 . 5 1 1 A 73 73 ALA CB C 133 16.700 18.053 -1.353 1
1 919 . 5 1 1 A 73 73 ALA N N 133 120.900 123.592 -2.692 1
1 920 . 5 1 1 A 74 74 SER H H 134 8.440 8.652 -0.212 1
1 921 . 5 1 1 A 74 74 SER HA H 134 4.430 4.305 0.125 1
1 924 . 5 1 1 A 74 74 SER C C 134 178.800 177.267 1.533 1
1 925 . 5 1 1 A 74 74 SER CA C 134 61.300 61.125 0.175 1
1 926 . 5 1 1 A 74 74 SER CB C 134 62.600 63.047 -0.447 1
1 927 . 5 1 1 A 74 74 SER N N 134 110.100 113.249 -3.149 1
1 928 . 5 1 1 A 75 75 GLN H H 135 8.340 7.681 0.659 1
1 929 . 5 1 1 A 75 75 GLN HA H 135 3.880 4.037 -0.157 1
1 936 . 5 1 1 A 75 75 GLN C C 135 178.800 178.900 -0.100 1
1 937 . 5 1 1 A 75 75 GLN CA C 135 59.600 58.899 0.701 1
1 938 . 5 1 1 A 75 75 GLN CB C 135 29.900 28.222 1.678 1
1 941 . 5 1 1 A 75 75 GLN N N 135 118.100 121.233 -3.133 1
1 943 . 5 1 1 A 76 76 ILE H H 136 7.670 7.174 0.496 1
1 944 . 5 1 1 A 76 76 ILE HA H 136 3.200 3.340 -0.140 1
1 954 . 5 1 1 A 76 76 ILE C C 136 177.500 177.903 -0.403 1
1 955 . 5 1 1 A 76 76 ILE CA C 136 66.100 64.941 1.159 1
1 956 . 5 1 1 A 76 76 ILE CB C 136 37.400 37.269 0.131 1
1 960 . 5 1 1 A 76 76 ILE N N 136 122.500 120.119 2.381 1
1 961 . 5 1 1 A 77 77 PHE H H 137 7.930 8.124 -0.194 1
1 962 . 5 1 1 A 77 77 PHE HA H 137 3.890 4.206 -0.316 1
1 969 . 5 1 1 A 77 77 PHE C C 137 178.200 178.168 0.032 1
1 970 . 5 1 1 A 77 77 PHE CA C 137 63.600 61.073 2.527 1
1 971 . 5 1 1 A 77 77 PHE CB C 137 39.300 38.475 0.825 1
1 976 . 5 1 1 A 77 77 PHE N N 137 116.100 119.085 -2.985 1
1 977 . 5 1 1 A 78 78 ARG H H 138 8.900 8.281 0.619 1
1 978 . 5 1 1 A 78 78 ARG HA H 138 3.910 3.895 0.015 1
1 986 . 5 1 1 A 78 78 ARG C C 138 178.300 178.825 -0.525 1
1 987 . 5 1 1 A 78 78 ARG CA C 138 60.100 59.166 0.934 1
1 988 . 5 1 1 A 78 78 ARG CB C 138 29.600 29.724 -0.124 1
1 991 . 5 1 1 A 78 78 ARG N N 138 118.600 118.921 -0.321 1
1 993 . 5 1 1 A 79 79 LEU H H 139 7.730 7.891 -0.161 1
1 994 . 5 1 1 A 79 79 LEU HA H 139 4.280 4.082 0.198 1
1 1004 . 5 1 1 A 79 79 LEU C C 139 179.000 178.193 0.807 1
1 1005 . 5 1 1 A 79 79 LEU CA C 139 57.800 57.841 -0.041 1
1 1006 . 5 1 1 A 79 79 LEU CB C 139 41.900 41.194 0.706 1
1 1010 . 5 1 1 A 79 79 LEU N N 139 121.900 121.215 0.685 1
1 1011 . 5 1 1 A 80 80 ALA H H 140 7.590 7.565 0.025 1
1 1012 . 5 1 1 A 80 80 ALA HA H 140 2.710 2.384 0.326 1
1 1016 . 5 1 1 A 80 80 ALA C C 140 179.900 179.785 0.115 1
1 1017 . 5 1 1 A 80 80 ALA CA C 140 55.100 54.251 0.849 1
1 1018 . 5 1 1 A 80 80 ALA CB C 140 17.600 17.313 0.287 1
1 1019 . 5 1 1 A 80 80 ALA N N 140 123.400 119.595 3.805 1
1 1020 . 5 1 1 A 81 81 ILE H H 141 8.910 7.854 1.056 1
1 1021 . 5 1 1 A 81 81 ILE HA H 141 4.110 3.832 0.278 1
1 1031 . 5 1 1 A 81 81 ILE C C 141 181.700 177.437 4.263 1
1 1032 . 5 1 1 A 81 81 ILE CA C 141 64.800 65.225 -0.425 1
1 1033 . 5 1 1 A 81 81 ILE CB C 141 38.600 37.624 0.976 1
1 1037 . 5 1 1 A 81 81 ILE N N 141 122.400 118.746 3.654 1
1 1038 . 5 1 1 A 82 82 GLU H H 142 8.560 8.641 -0.081 1
1 1039 . 5 1 1 A 82 82 GLU HA H 142 4.100 4.067 0.033 1
1 1044 . 5 1 1 A 82 82 GLU C C 142 177.700 178.148 -0.448 1
1 1045 . 5 1 1 A 82 82 GLU CA C 142 59.100 59.765 -0.665 1
1 1046 . 5 1 1 A 82 82 GLU CB C 142 29.200 29.151 0.049 1
1 1048 . 5 1 1 A 82 82 GLU N N 142 123.200 120.521 2.679 1
1 1049 . 5 1 1 A 83 83 ASN H H 143 7.310 7.512 -0.202 1
1 1050 . 5 1 1 A 83 83 ASN HA H 143 4.750 4.903 -0.153 1
1 1055 . 5 1 1 A 83 83 ASN C C 143 173.200 174.314 -1.114 1
1 1056 . 5 1 1 A 83 83 ASN CA C 143 54.200 52.866 1.334 1
1 1057 . 5 1 1 A 83 83 ASN CB C 143 41.300 38.906 2.394 1
1 1059 . 5 1 1 A 83 83 ASN N N 143 114.900 115.352 -0.452 1
1 1061 . 5 1 1 A 84 84 ARG H H 144 8.320 8.083 0.237 1
1 1062 . 5 1 1 A 84 84 ARG HA H 144 4.120 4.003 0.117 1
1 1069 . 5 1 1 A 84 84 ARG C C 144 175.300 176.049 -0.749 1
1 1070 . 5 1 1 A 84 84 ARG CA C 144 57.100 56.961 0.139 1
1 1071 . 5 1 1 A 84 84 ARG CB C 144 26.000 26.922 -0.922 1
1 1074 . 5 1 1 A 84 84 ARG N N 144 114.400 115.172 -0.772 1
1 1075 . 5 1 1 A 85 85 ALA H H 145 8.350 8.250 0.100 1
1 1076 . 5 1 1 A 85 85 ALA HA H 145 4.320 4.299 0.021 1
1 1080 . 5 1 1 A 85 85 ALA C C 145 176.500 177.348 -0.848 1
1 1081 . 5 1 1 A 85 85 ALA CA C 145 53.400 53.791 -0.391 1
1 1082 . 5 1 1 A 85 85 ALA CB C 145 19.900 19.394 0.506 1
1 1083 . 5 1 1 A 85 85 ALA N N 145 120.600 119.224 1.376 1
1 1084 . 5 1 1 A 86 86 ILE H H 146 7.290 7.599 -0.309 1
1 1085 . 5 1 1 A 86 86 ILE HA H 146 4.400 4.680 -0.280 1
1 1095 . 5 1 1 A 86 86 ILE C C 146 173.600 173.991 -0.391 1
1 1096 . 5 1 1 A 86 86 ILE CA C 146 59.200 59.839 -0.639 1
1 1097 . 5 1 1 A 86 86 ILE CB C 146 41.600 41.947 -0.347 1
1 1101 . 5 1 1 A 86 86 ILE N N 146 111.500 115.706 -4.206 1
1 1102 . 5 1 1 A 87 87 ASP H H 147 8.270 8.857 -0.587 1
1 1103 . 5 1 1 A 87 87 ASP HA H 147 4.940 4.926 0.014 1
1 1106 . 5 1 1 A 87 87 ASP C C 147 174.700 175.340 -0.640 1
1 1107 . 5 1 1 A 87 87 ASP CA C 147 53.700 53.183 0.517 1
1 1108 . 5 1 1 A 87 87 ASP CB C 147 41.800 41.371 0.429 1
1 1109 . 5 1 1 A 87 87 ASP N N 147 119.400 128.415 -9.015 1
1 1110 . 5 1 1 A 88 88 PHE H H 148 7.230 7.576 -0.346 1
1 1111 . 5 1 1 A 88 88 PHE HA H 148 4.690 4.772 -0.082 1
1 1119 . 5 1 1 A 88 88 PHE C C 148 171.500 172.660 -1.160 1
1 1120 . 5 1 1 A 88 88 PHE CA C 148 56.400 57.456 -1.056 1
1 1121 . 5 1 1 A 88 88 PHE CB C 148 42.000 42.573 -0.573 1
1 1127 . 5 1 1 A 88 88 PHE N N 148 119.700 119.746 -0.046 1
1 1128 . 5 1 1 A 89 89 ASN H H 149 8.060 8.128 -0.068 1
1 1129 . 5 1 1 A 89 89 ASN HA H 149 4.490 4.833 -0.343 1
1 1134 . 5 1 1 A 89 89 ASN CA C 149 48.100 48.597 -0.497 1
1 1135 . 5 1 1 A 89 89 ASN CB C 149 39.200 39.625 -0.425 1
1 1137 . 5 1 1 A 89 89 ASN N N 149 119.700 125.370 -5.670 1
1 1139 . 5 1 1 A 90 90 PRO HA H 150 3.970 4.281 -0.311 1
1 1146 . 5 1 1 A 90 90 PRO C C 150 177.700 176.965 0.735 1
1 1147 . 5 1 1 A 90 90 PRO CA C 150 63.900 64.043 -0.143 1
1 1148 . 5 1 1 A 90 90 PRO CB C 150 31.700 31.554 0.146 1
1 1151 . 5 1 1 A 91 91 ALA H H 151 7.240 7.602 -0.362 1
1 1152 . 5 1 1 A 91 91 ALA HA H 151 3.900 4.158 -0.258 1
1 1156 . 5 1 1 A 91 91 ALA C C 151 178.000 179.012 -1.012 1
1 1157 . 5 1 1 A 91 91 ALA CA C 151 53.900 53.903 -0.003 1
1 1158 . 5 1 1 A 91 91 ALA CB C 151 17.700 18.580 -0.880 1
1 1159 . 5 1 1 A 91 91 ALA N N 151 115.700 119.178 -3.478 1
1 1160 . 5 1 1 A 92 92 ASP H H 152 7.080 7.816 -0.736 1
1 1161 . 5 1 1 A 92 92 ASP HA H 152 4.220 4.219 0.001 1
1 1164 . 5 1 1 A 92 92 ASP C C 152 176.200 177.010 -0.810 1
1 1165 . 5 1 1 A 92 92 ASP CA C 152 55.800 56.814 -1.014 1
1 1166 . 5 1 1 A 92 92 ASP CB C 152 39.500 40.255 -0.755 1
1 1167 . 5 1 1 A 92 92 ASP N N 152 117.100 119.223 -2.123 1
1 1168 . 5 1 1 A 93 93 TYR H H 153 7.060 7.306 -0.246 1
1 1169 . 5 1 1 A 93 93 TYR HA H 153 4.490 4.602 -0.112 1
1 1176 . 5 1 1 A 93 93 TYR C C 153 174.700 175.535 -0.835 1
1 1177 . 5 1 1 A 93 93 TYR CA C 153 57.600 58.096 -0.496 1
1 1178 . 5 1 1 A 93 93 TYR CB C 153 38.500 38.684 -0.184 1
1 1183 . 5 1 1 A 93 93 TYR N N 153 116.800 116.667 0.133 1
1 1184 . 5 1 1 A 94 94 VAL H H 154 7.000 7.110 -0.110 1
1 1185 . 5 1 1 A 94 94 VAL HA H 154 4.040 4.424 -0.384 1
1 1193 . 5 1 1 A 94 94 VAL C C 154 174.700 174.977 -0.277 1
1 1194 . 5 1 1 A 94 94 VAL CA C 154 62.100 60.905 1.195 1
1 1195 . 5 1 1 A 94 94 VAL CB C 154 32.700 32.934 -0.234 1
1 1198 . 5 1 1 A 94 94 VAL N N 154 120.600 120.789 -0.189 1
1 1199 . 5 1 1 A 95 95 ARG H H 155 9.430 8.387 1.043 1
1 1200 . 5 1 1 A 95 95 ARG HA H 155 4.640 4.694 -0.054 1
1 1207 . 5 1 1 A 95 95 ARG C C 155 175.400 175.796 -0.396 1
1 1208 . 5 1 1 A 95 95 ARG CA C 155 54.200 55.436 -1.236 1
1 1209 . 5 1 1 A 95 95 ARG CB C 155 32.400 31.374 1.026 1
1 1212 . 5 1 1 A 95 95 ARG N N 155 128.200 127.518 0.682 1
1 1213 . 5 1 1 A 96 96 ILE H H 156 8.700 8.603 0.097 1
1 1214 . 5 1 1 A 96 96 ILE HA H 156 4.440 4.615 -0.175 1
1 1224 . 5 1 1 A 96 96 ILE CA C 156 56.500 57.971 -1.471 1
1 1225 . 5 1 1 A 96 96 ILE CB C 156 36.700 38.384 -1.684 1
1 1229 . 5 1 1 A 96 96 ILE N N 156 124.100 123.670 0.430 1
1 1230 . 5 1 1 A 97 97 PRO HA H 157 4.370 4.642 -0.272 1
1 1237 . 5 1 1 A 97 97 PRO C C 157 176.000 176.410 -0.410 1
1 1238 . 5 1 1 A 97 97 PRO CA C 157 63.200 62.957 0.243 1
1 1239 . 5 1 1 A 97 97 PRO CB C 157 32.400 32.047 0.353 1
1 1242 . 5 1 1 A 98 98 LYS H H 158 8.380 8.602 -0.222 1
1 1243 . 5 1 1 A 98 98 LYS HA H 158 4.190 4.477 -0.287 1
1 1252 . 5 1 1 A 98 98 LYS C C 158 176.800 175.422 1.378 1
1 1253 . 5 1 1 A 98 98 LYS CA C 158 57.100 55.512 1.588 1
1 1254 . 5 1 1 A 98 98 LYS CB C 158 32.800 30.971 1.829 1
1 1258 . 5 1 1 A 98 98 LYS N N 158 120.800 121.960 -1.160 1
1 1259 . 5 1 1 A 99 99 ILE H H 159 7.930 8.085 -0.155 1
1 1260 . 5 1 1 A 99 99 ILE HA H 159 4.200 4.341 -0.141 1
1 1270 . 5 1 1 A 99 99 ILE C C 159 175.400 176.253 -0.853 1
1 1271 . 5 1 1 A 99 99 ILE CA C 159 60.600 60.716 -0.116 1
1 1272 . 5 1 1 A 99 99 ILE CB C 159 39.100 37.293 1.807 1
1 1276 . 5 1 1 A 99 99 ILE N N 159 120.200 124.974 -4.774 1
1 1277 . 5 1 1 A 100 100 ALA H H 160 8.370 8.536 -0.166 1
1 1278 . 5 1 1 A 100 100 ALA HA H 160 4.370 4.798 -0.428 1
1 1282 . 5 1 1 A 100 100 ALA C C 160 177.200 178.234 -1.034 1
1 1283 . 5 1 1 A 100 100 ALA CA C 160 52.200 50.927 1.273 1
1 1284 . 5 1 1 A 100 100 ALA CB C 160 19.400 19.668 -0.268 1
1 1285 . 5 1 1 A 100 100 ALA N N 160 128.300 130.856 -2.556 1
1 1286 . 5 1 1 A 101 101 LEU H H 161 8.250 7.942 0.308 1
1 1287 . 5 1 1 A 101 101 LEU HA H 161 4.280 4.104 0.176 1
1 1297 . 5 1 1 A 101 101 LEU C C 161 177.200 179.315 -2.115 1
1 1298 . 5 1 1 A 101 101 LEU CA C 161 55.200 57.566 -2.366 1
1 1299 . 5 1 1 A 101 101 LEU CB C 161 42.400 41.641 0.759 1
1 1303 . 5 1 1 A 101 101 LEU N N 161 121.900 120.458 1.442 1
1 1304 . 5 1 1 A 102 102 GLU H H 162 8.390 8.124 0.266 1
1 1305 . 5 1 1 A 102 102 GLU HA H 162 4.230 4.148 0.082 1
1 1310 . 5 1 1 A 102 102 GLU C C 162 176.100 176.837 -0.737 1
1 1311 . 5 1 1 A 102 102 GLU CA C 162 56.400 58.661 -2.261 1
1 1312 . 5 1 1 A 102 102 GLU CB C 162 30.500 30.517 -0.017 1
1 1314 . 5 1 1 A 102 102 GLU N N 162 121.300 119.535 1.765 1
1 1315 . 5 1 1 A 103 103 HIS H H 163 8.330 7.819 0.511 1
1 1316 . 5 1 1 A 103 103 HIS HA H 163 4.590 4.367 0.223 1
1 1319 . 5 1 1 A 103 103 HIS C C 163 176.100 174.796 1.304 1
1 1320 . 5 1 1 A 103 103 HIS CA C 163 56.000 57.304 -1.304 1
1 1321 . 5 1 1 A 103 103 HIS CB C 163 30.500 29.916 0.584 1
1 1322 . 5 1 1 A 103 103 HIS N N 163 120.000 117.657 2.343 1
1 1323 . 5 1 1 A 107 107 HIS HA H 167 4.620 5.059 -0.439 1
1 1326 . 5 1 1 A 107 107 HIS C C 167 173.900 173.667 0.233 1
1 1327 . 5 1 1 A 107 107 HIS CA C 167 56.000 54.453 1.547 1
1 1328 . 5 1 1 A 107 107 HIS CB C 167 30.300 33.244 -2.944 1
1 15 . 6 1 1 A 2 2 ASP H H 62 8.760 8.782 -0.022 1
1 16 . 6 1 1 A 2 2 ASP HA H 62 4.810 4.088 0.722 1
1 19 . 6 1 1 A 2 2 ASP C C 62 175.800 175.421 0.379 1
1 20 . 6 1 1 A 2 2 ASP CA C 62 54.800 54.731 0.069 1
1 21 . 6 1 1 A 2 2 ASP CB C 62 41.600 39.569 2.031 1
1 22 . 6 1 1 A 2 2 ASP N N 62 120.900 117.941 2.959 1
1 23 . 6 1 1 A 3 3 SER H H 63 8.710 8.023 0.687 1
1 24 . 6 1 1 A 3 3 SER HA H 63 4.970 4.975 -0.005 1
1 27 . 6 1 1 A 3 3 SER C C 63 175.600 175.090 0.510 1
1 28 . 6 1 1 A 3 3 SER CA C 63 57.500 57.147 0.353 1
1 29 . 6 1 1 A 3 3 SER CB C 63 65.900 65.698 0.202 1
1 30 . 6 1 1 A 3 3 SER N N 63 116.300 114.427 1.873 1
1 31 . 6 1 1 A 4 4 PHE H H 64 9.370 9.321 0.049 1
1 32 . 6 1 1 A 4 4 PHE HA H 64 4.010 4.324 -0.314 1
1 39 . 6 1 1 A 4 4 PHE C C 64 176.700 177.414 -0.714 1
1 40 . 6 1 1 A 4 4 PHE CA C 64 62.200 61.690 0.510 1
1 41 . 6 1 1 A 4 4 PHE CB C 64 38.500 39.490 -0.990 1
1 46 . 6 1 1 A 4 4 PHE N N 64 121.400 122.259 -0.859 1
1 47 . 6 1 1 A 5 5 GLY H H 65 8.930 8.050 0.880 1
1 48 . 6 1 1 A 5 5 GLY HA2 H 65 2.020 2.267 -0.247 1
1 49 . 6 1 1 A 5 5 GLY HA3 H 65 3.250 2.652 0.598 1
1 50 . 6 1 1 A 5 5 GLY C C 65 175.200 175.036 0.164 1
1 51 . 6 1 1 A 5 5 GLY CA C 65 46.300 46.380 -0.080 1
1 52 . 6 1 1 A 5 5 GLY N N 65 106.500 104.832 1.668 1
1 53 . 6 1 1 A 6 6 ASP H H 66 7.630 8.166 -0.536 1
1 54 . 6 1 1 A 6 6 ASP HA H 66 4.100 4.209 -0.109 1
1 57 . 6 1 1 A 6 6 ASP C C 66 179.500 178.603 0.897 1
1 58 . 6 1 1 A 6 6 ASP CA C 66 57.400 56.918 0.482 1
1 59 . 6 1 1 A 6 6 ASP CB C 66 40.500 40.998 -0.498 1
1 60 . 6 1 1 A 6 6 ASP N N 66 120.500 120.702 -0.202 1
1 61 . 6 1 1 A 7 7 TRP H H 67 7.190 7.987 -0.797 1
1 62 . 6 1 1 A 7 7 TRP HA H 67 3.860 4.392 -0.532 1
1 71 . 6 1 1 A 7 7 TRP C C 67 177.200 178.745 -1.545 1
1 72 . 6 1 1 A 7 7 TRP CA C 67 61.100 60.151 0.949 1
1 73 . 6 1 1 A 7 7 TRP CB C 67 28.300 28.866 -0.566 1
1 79 . 6 1 1 A 7 7 TRP N N 67 120.700 120.356 0.344 1
1 81 . 6 1 1 A 8 8 ALA H H 68 9.040 8.333 0.707 1
1 82 . 6 1 1 A 8 8 ALA HA H 68 3.730 3.871 -0.141 1
1 86 . 6 1 1 A 8 8 ALA C C 68 179.500 179.815 -0.315 1
1 87 . 6 1 1 A 8 8 ALA CA C 68 55.200 55.230 -0.030 1
1 88 . 6 1 1 A 8 8 ALA CB C 68 18.600 17.918 0.682 1
1 89 . 6 1 1 A 8 8 ALA N N 68 125.700 121.962 3.738 1
1 90 . 6 1 1 A 9 9 GLU H H 69 8.060 8.023 0.037 1
1 91 . 6 1 1 A 9 9 GLU HA H 69 4.020 4.022 -0.002 1
1 96 . 6 1 1 A 9 9 GLU C C 69 180.400 179.361 1.039 1
1 97 . 6 1 1 A 9 9 GLU CA C 69 58.800 59.517 -0.717 1
1 98 . 6 1 1 A 9 9 GLU CB C 69 28.500 29.529 -1.029 1
1 99 . 6 1 1 A 9 9 GLU N N 69 115.400 117.933 -2.533 1
1 100 . 6 1 1 A 10 10 LYS H H 70 7.740 8.147 -0.407 1
1 101 . 6 1 1 A 10 10 LYS HA H 70 3.910 4.092 -0.182 1
1 110 . 6 1 1 A 10 10 LYS C C 70 179.500 179.136 0.364 1
1 111 . 6 1 1 A 10 10 LYS CA C 70 60.000 58.448 1.552 1
1 112 . 6 1 1 A 10 10 LYS CB C 70 32.400 31.923 0.477 1
1 116 . 6 1 1 A 10 10 LYS N N 70 122.700 119.390 3.310 1
1 117 . 6 1 1 A 11 11 PHE H H 71 8.750 8.490 0.260 1
1 118 . 6 1 1 A 11 11 PHE HA H 71 4.080 4.276 -0.196 1
1 126 . 6 1 1 A 11 11 PHE C C 71 177.100 176.839 0.261 1
1 127 . 6 1 1 A 11 11 PHE CA C 71 61.200 61.233 -0.033 1
1 128 . 6 1 1 A 11 11 PHE CB C 71 38.900 39.021 -0.121 1
1 134 . 6 1 1 A 11 11 PHE N N 71 123.500 122.372 1.128 1
1 135 . 6 1 1 A 12 12 LEU H H 72 8.400 8.629 -0.229 1
1 136 . 6 1 1 A 12 12 LEU HA H 72 3.520 3.694 -0.174 1
1 146 . 6 1 1 A 12 12 LEU C C 72 180.000 179.133 0.867 1
1 147 . 6 1 1 A 12 12 LEU CA C 72 58.200 57.716 0.484 1
1 148 . 6 1 1 A 12 12 LEU CB C 72 41.700 41.305 0.395 1
1 152 . 6 1 1 A 12 12 LEU N N 72 121.100 118.731 2.369 1
1 153 . 6 1 1 A 13 13 LYS H H 73 7.810 8.123 -0.313 1
1 154 . 6 1 1 A 13 13 LYS HA H 73 4.080 3.905 0.175 1
1 156 . 6 1 1 A 13 13 LYS C C 73 179.300 178.561 0.739 1
1 157 . 6 1 1 A 13 13 LYS CA C 73 59.000 59.611 -0.611 1
1 158 . 6 1 1 A 13 13 LYS CB C 73 31.900 32.165 -0.265 1
1 159 . 6 1 1 A 13 13 LYS N N 73 119.400 121.098 -1.698 1
1 160 . 6 1 1 A 14 14 SER H H 74 8.210 8.051 0.159 1
1 161 . 6 1 1 A 14 14 SER HA H 74 4.210 4.113 0.097 1
1 164 . 6 1 1 A 14 14 SER C C 74 176.300 176.620 -0.320 1
1 165 . 6 1 1 A 14 14 SER CA C 74 61.400 61.219 0.181 1
1 166 . 6 1 1 A 14 14 SER CB C 74 62.600 62.485 0.115 1
1 167 . 6 1 1 A 14 14 SER N N 74 117.600 115.595 2.005 1
1 168 . 6 1 1 A 15 15 LYS H H 75 7.760 7.749 0.011 1
1 169 . 6 1 1 A 15 15 LYS HA H 75 4.040 3.786 0.254 1
1 178 . 6 1 1 A 15 15 LYS C C 75 178.500 177.996 0.504 1
1 179 . 6 1 1 A 15 15 LYS CA C 75 56.500 58.619 -2.119 1
1 180 . 6 1 1 A 15 15 LYS CB C 75 30.600 31.409 -0.809 1
1 184 . 6 1 1 A 15 15 LYS N N 75 120.100 121.851 -1.751 1
1 185 . 6 1 1 A 16 16 GLU H H 76 7.680 7.646 0.034 1
1 186 . 6 1 1 A 16 16 GLU HA H 76 4.030 4.022 0.008 1
1 191 . 6 1 1 A 16 16 GLU C C 76 179.900 178.591 1.309 1
1 192 . 6 1 1 A 16 16 GLU CA C 76 59.200 59.039 0.161 1
1 193 . 6 1 1 A 16 16 GLU CB C 76 29.600 29.311 0.289 1
1 195 . 6 1 1 A 16 16 GLU N N 76 119.700 118.541 1.159 1
1 196 . 6 1 1 A 17 17 ALA H H 77 8.030 7.720 0.310 1
1 197 . 6 1 1 A 17 17 ALA HA H 77 4.200 4.024 0.176 1
1 201 . 6 1 1 A 17 17 ALA C C 77 178.900 179.637 -0.737 1
1 202 . 6 1 1 A 17 17 ALA CA C 77 54.400 54.764 -0.364 1
1 203 . 6 1 1 A 17 17 ALA CB C 77 18.100 18.371 -0.271 1
1 204 . 6 1 1 A 17 17 ALA N N 77 123.000 121.530 1.470 1
1 205 . 6 1 1 A 18 18 ASP H H 78 7.860 8.150 -0.290 1
1 206 . 6 1 1 A 18 18 ASP HA H 78 4.600 4.439 0.161 1
1 209 . 6 1 1 A 18 18 ASP C C 78 177.500 176.163 1.337 1
1 210 . 6 1 1 A 18 18 ASP CA C 78 55.100 54.531 0.569 1
1 211 . 6 1 1 A 18 18 ASP CB C 78 41.400 40.475 0.925 1
1 212 . 6 1 1 A 18 18 ASP N N 78 117.700 116.842 0.858 1
1 213 . 6 1 1 A 19 19 GLY H H 79 7.910 7.473 0.437 1
1 214 . 6 1 1 A 19 19 GLY HA2 H 79 3.860 3.997 -0.137 1
1 215 . 6 1 1 A 19 19 GLY HA3 H 79 4.080 4.001 0.079 1
1 216 . 6 1 1 A 19 19 GLY C C 79 175.300 175.058 0.242 1
1 217 . 6 1 1 A 19 19 GLY CA C 79 46.200 45.229 0.971 1
1 218 . 6 1 1 A 19 19 GLY N N 79 107.100 106.768 0.332 1
1 219 . 6 1 1 A 20 20 VAL H H 80 7.150 7.243 -0.093 1
1 220 . 6 1 1 A 20 20 VAL HA H 80 4.250 4.209 0.041 1
1 228 . 6 1 1 A 20 20 VAL C C 80 175.100 175.543 -0.443 1
1 229 . 6 1 1 A 20 20 VAL CA C 80 61.800 61.658 0.142 1
1 230 . 6 1 1 A 20 20 VAL CB C 80 32.200 32.526 -0.326 1
1 233 . 6 1 1 A 20 20 VAL N N 80 114.600 119.769 -5.169 1
1 234 . 6 1 1 A 21 21 SER H H 81 8.560 8.894 -0.334 1
1 235 . 6 1 1 A 21 21 SER HA H 81 4.390 4.502 -0.112 1
1 238 . 6 1 1 A 21 21 SER C C 81 174.600 175.886 -1.286 1
1 239 . 6 1 1 A 21 21 SER CA C 81 57.900 58.531 -0.631 1
1 240 . 6 1 1 A 21 21 SER CB C 81 64.700 64.282 0.418 1
1 241 . 6 1 1 A 21 21 SER N N 81 118.700 119.947 -1.247 1
1 242 . 6 1 1 A 22 22 VAL H H 82 8.690 8.791 -0.101 1
1 243 . 6 1 1 A 22 22 VAL HA H 82 3.700 3.665 0.035 1
1 251 . 6 1 1 A 22 22 VAL C C 82 178.000 177.282 0.718 1
1 252 . 6 1 1 A 22 22 VAL CA C 82 66.500 66.884 -0.384 1
1 253 . 6 1 1 A 22 22 VAL CB C 82 31.700 31.888 -0.188 1
1 256 . 6 1 1 A 22 22 VAL N N 82 122.100 124.054 -1.954 1
1 257 . 6 1 1 A 23 23 SER H H 83 8.300 8.091 0.209 1
1 258 . 6 1 1 A 23 23 SER HA H 83 4.210 4.143 0.067 1
1 261 . 6 1 1 A 23 23 SER C C 83 177.600 176.190 1.410 1
1 262 . 6 1 1 A 23 23 SER CA C 83 61.400 62.402 -1.002 1
1 263 . 6 1 1 A 23 23 SER CB C 83 62.400 62.749 -0.349 1
1 264 . 6 1 1 A 23 23 SER N N 83 113.600 114.657 -1.057 1
1 265 . 6 1 1 A 24 24 GLN H H 84 7.820 7.977 -0.157 1
1 266 . 6 1 1 A 24 24 GLN HA H 84 3.970 4.029 -0.059 1
1 273 . 6 1 1 A 24 24 GLN C C 84 178.400 178.420 -0.020 1
1 274 . 6 1 1 A 24 24 GLN CA C 84 58.400 58.790 -0.390 1
1 275 . 6 1 1 A 24 24 GLN CB C 84 28.900 28.610 0.290 1
1 278 . 6 1 1 A 24 24 GLN N N 84 122.900 121.349 1.551 1
1 280 . 6 1 1 A 25 25 LEU H H 85 8.920 8.128 0.792 1
1 281 . 6 1 1 A 25 25 LEU HA H 85 4.130 4.426 -0.296 1
1 291 . 6 1 1 A 25 25 LEU C C 85 178.800 178.226 0.574 1
1 292 . 6 1 1 A 25 25 LEU CA C 85 58.300 57.614 0.686 1
1 293 . 6 1 1 A 25 25 LEU CB C 85 41.200 41.380 -0.180 1
1 297 . 6 1 1 A 25 25 LEU N N 85 122.200 121.028 1.172 1
1 298 . 6 1 1 A 26 26 ASN H H 86 8.860 8.769 0.091 1
1 299 . 6 1 1 A 26 26 ASN HA H 86 4.420 4.371 0.049 1
1 304 . 6 1 1 A 26 26 ASN C C 86 179.000 177.477 1.523 1
1 305 . 6 1 1 A 26 26 ASN CA C 86 55.900 56.997 -1.097 1
1 306 . 6 1 1 A 26 26 ASN CB C 86 37.200 39.468 -2.268 1
1 308 . 6 1 1 A 26 26 ASN N N 86 117.600 118.459 -0.859 1
1 310 . 6 1 1 A 27 27 SER H H 87 7.840 7.718 0.122 1
1 311 . 6 1 1 A 27 27 SER HA H 87 4.100 3.880 0.220 1
1 314 . 6 1 1 A 27 27 SER C C 87 179.000 176.597 2.403 1
1 315 . 6 1 1 A 27 27 SER CA C 87 62.100 60.695 1.405 1
1 316 . 6 1 1 A 27 27 SER CB C 87 62.100 62.230 -0.130 1
1 317 . 6 1 1 A 27 27 SER N N 87 118.500 113.721 4.779 1
1 318 . 6 1 1 A 28 28 TYR H H 88 8.180 7.666 0.514 1
1 319 . 6 1 1 A 28 28 TYR HA H 88 4.600 4.255 0.345 1
1 326 . 6 1 1 A 28 28 TYR C C 88 174.800 178.528 -3.728 1
1 327 . 6 1 1 A 28 28 TYR CA C 88 61.200 61.970 -0.770 1
1 328 . 6 1 1 A 28 28 TYR CB C 88 37.800 38.111 -0.311 1
1 333 . 6 1 1 A 28 28 TYR N N 88 119.300 119.306 -0.006 1
1 334 . 6 1 1 A 29 29 LYS H H 89 9.040 8.371 0.669 1
1 335 . 6 1 1 A 29 29 LYS HA H 89 3.890 4.056 -0.166 1
1 344 . 6 1 1 A 29 29 LYS C C 89 179.000 178.708 0.292 1
1 345 . 6 1 1 A 29 29 LYS CA C 89 61.300 59.336 1.964 1
1 346 . 6 1 1 A 29 29 LYS CB C 89 32.800 32.234 0.566 1
1 350 . 6 1 1 A 29 29 LYS N N 89 119.300 118.850 0.450 1
1 351 . 6 1 1 A 30 30 ASN H H 90 7.770 8.044 -0.274 1
1 352 . 6 1 1 A 30 30 ASN HA H 90 4.560 4.401 0.159 1
1 357 . 6 1 1 A 30 30 ASN C C 90 178.300 177.357 0.943 1
1 358 . 6 1 1 A 30 30 ASN CA C 90 56.200 56.469 -0.269 1
1 359 . 6 1 1 A 30 30 ASN CB C 90 38.900 39.534 -0.634 1
1 361 . 6 1 1 A 30 30 ASN N N 90 117.800 118.229 -0.429 1
1 363 . 6 1 1 A 31 31 TYR H H 91 8.860 8.172 0.688 1
1 364 . 6 1 1 A 31 31 TYR HA H 91 4.910 4.486 0.424 1
1 371 . 6 1 1 A 31 31 TYR C C 91 178.300 178.732 -0.432 1
1 372 . 6 1 1 A 31 31 TYR CA C 91 59.700 60.769 -1.069 1
1 373 . 6 1 1 A 31 31 TYR CB C 91 37.500 38.111 -0.611 1
1 378 . 6 1 1 A 31 31 TYR N N 91 119.400 117.890 1.510 1
1 379 . 6 1 1 A 32 32 CYS H H 92 8.640 8.470 0.170 1
1 380 . 6 1 1 A 32 32 CYS HA H 92 4.410 4.340 0.070 1
1 383 . 6 1 1 A 32 32 CYS C C 92 173.700 177.301 -3.601 1
1 384 . 6 1 1 A 32 32 CYS CA C 92 65.500 64.028 1.472 1
1 385 . 6 1 1 A 32 32 CYS CB C 92 28.300 27.385 0.915 1
1 386 . 6 1 1 A 32 32 CYS N N 92 113.500 118.335 -4.835 1
1 387 . 6 1 1 A 33 33 ARG H H 93 8.440 8.314 0.126 1
1 388 . 6 1 1 A 33 33 ARG HA H 93 3.740 4.016 -0.276 1
1 391 . 6 1 1 A 33 33 ARG C C 93 177.200 177.315 -0.115 1
1 392 . 6 1 1 A 33 33 ARG CA C 93 58.300 58.364 -0.064 1
1 393 . 6 1 1 A 33 33 ARG CB C 93 30.200 30.237 -0.037 1
1 394 . 6 1 1 A 33 33 ARG N N 93 111.400 119.757 -8.357 1
1 395 . 6 1 1 A 34 34 ASN H H 94 8.020 8.091 -0.071 1
1 396 . 6 1 1 A 34 34 ASN HA H 94 4.980 4.878 0.102 1
1 401 . 6 1 1 A 34 34 ASN C C 94 176.700 177.109 -0.409 1
1 402 . 6 1 1 A 34 34 ASN CA C 94 53.400 54.769 -1.369 1
1 403 . 6 1 1 A 34 34 ASN CB C 94 38.000 39.691 -1.691 1
1 405 . 6 1 1 A 34 34 ASN N N 94 113.600 114.868 -1.268 1
1 407 . 6 1 1 A 35 35 HIS H H 95 7.200 7.772 -0.572 1
1 408 . 6 1 1 A 35 35 HIS HA H 95 4.470 4.327 0.143 1
1 411 . 6 1 1 A 35 35 HIS C C 95 176.600 176.349 0.251 1
1 412 . 6 1 1 A 35 35 HIS CA C 95 60.000 58.811 1.189 1
1 413 . 6 1 1 A 35 35 HIS CB C 95 30.500 29.975 0.525 1
1 414 . 6 1 1 A 35 35 HIS N N 95 115.600 119.338 -3.738 1
1 415 . 6 1 1 A 36 36 LEU H H 96 8.170 8.034 0.136 1
1 416 . 6 1 1 A 36 36 LEU HA H 96 4.730 4.492 0.238 1
1 426 . 6 1 1 A 36 36 LEU C C 96 176.800 177.300 -0.500 1
1 427 . 6 1 1 A 36 36 LEU CA C 96 54.400 54.766 -0.366 1
1 428 . 6 1 1 A 36 36 LEU CB C 96 40.600 42.021 -1.421 1
1 432 . 6 1 1 A 36 36 LEU N N 96 114.000 118.622 -4.622 1
1 433 . 6 1 1 A 37 37 SER H H 97 7.140 7.815 -0.675 1
1 434 . 6 1 1 A 37 37 SER HA H 97 4.730 4.367 0.363 1
1 437 . 6 1 1 A 37 37 SER CA C 97 62.700 62.964 -0.264 1
1 438 . 6 1 1 A 37 37 SER CB C 97 62.600 62.147 0.453 1
1 439 . 6 1 1 A 37 37 SER N N 97 117.200 116.600 0.600 1
1 440 . 6 1 1 A 38 38 PRO HA H 98 4.560 4.396 0.164 1
1 447 . 6 1 1 A 38 38 PRO C C 98 177.900 178.546 -0.646 1
1 448 . 6 1 1 A 38 38 PRO CA C 98 65.700 65.597 0.103 1
1 449 . 6 1 1 A 38 38 PRO CB C 98 31.800 30.902 0.898 1
1 452 . 6 1 1 A 39 39 LEU H H 99 8.090 7.635 0.455 1
1 453 . 6 1 1 A 39 39 LEU HA H 99 4.260 4.120 0.140 1
1 463 . 6 1 1 A 39 39 LEU C C 99 178.700 178.346 0.354 1
1 464 . 6 1 1 A 39 39 LEU CA C 99 54.300 57.249 -2.949 1
1 465 . 6 1 1 A 39 39 LEU CB C 99 42.400 41.854 0.546 1
1 469 . 6 1 1 A 39 39 LEU N N 99 112.400 117.123 -4.723 1
1 470 . 6 1 1 A 40 40 TYR H H 100 8.350 8.759 -0.409 1
1 471 . 6 1 1 A 40 40 TYR HA H 100 4.170 4.426 -0.256 1
1 478 . 6 1 1 A 40 40 TYR C C 100 178.300 178.715 -0.415 1
1 479 . 6 1 1 A 40 40 TYR CA C 100 63.400 62.067 1.333 1
1 480 . 6 1 1 A 40 40 TYR CB C 100 38.600 39.056 -0.456 1
1 485 . 6 1 1 A 40 40 TYR N N 100 119.400 120.572 -1.172 1
1 486 . 6 1 1 A 41 41 MET H H 101 8.640 7.819 0.821 1
1 487 . 6 1 1 A 41 41 MET HA H 101 4.260 4.489 -0.229 1
1 488 . 6 1 1 A 41 41 MET C C 101 177.000 176.380 0.620 1
1 489 . 6 1 1 A 41 41 MET CA C 101 54.600 57.774 -3.174 1
1 490 . 6 1 1 A 41 41 MET N N 101 111.800 117.979 -6.179 1
1 491 . 6 1 1 A 42 42 LYS H H 102 7.880 7.601 0.279 1
1 492 . 6 1 1 A 42 42 LYS HA H 102 4.430 4.342 0.088 1
1 501 . 6 1 1 A 42 42 LYS C C 102 176.300 176.521 -0.221 1
1 502 . 6 1 1 A 42 42 LYS CA C 102 56.000 56.159 -0.159 1
1 503 . 6 1 1 A 42 42 LYS CB C 102 33.400 32.968 0.432 1
1 507 . 6 1 1 A 42 42 LYS N N 102 121.700 120.862 0.838 1
1 508 . 6 1 1 A 43 43 SER H H 103 9.160 9.525 -0.365 1
1 509 . 6 1 1 A 43 43 SER HA H 103 4.620 4.591 0.029 1
1 513 . 6 1 1 A 43 43 SER C C 103 176.300 175.582 0.718 1
1 514 . 6 1 1 A 43 43 SER CA C 103 58.700 58.562 0.138 1
1 515 . 6 1 1 A 43 43 SER CB C 103 63.700 64.186 -0.486 1
1 516 . 6 1 1 A 43 43 SER N N 103 118.800 118.730 0.070 1
1 517 . 6 1 1 A 44 44 LEU H H 104 8.860 8.540 0.320 1
1 518 . 6 1 1 A 44 44 LEU HA H 104 4.130 4.309 -0.179 1
1 528 . 6 1 1 A 44 44 LEU C C 104 178.700 178.048 0.652 1
1 529 . 6 1 1 A 44 44 LEU CA C 104 58.800 58.594 0.206 1
1 530 . 6 1 1 A 44 44 LEU CB C 104 42.600 41.608 0.992 1
1 534 . 6 1 1 A 44 44 LEU N N 104 124.200 128.365 -4.165 1
1 535 . 6 1 1 A 45 45 SER H H 105 8.330 8.044 0.286 1
1 536 . 6 1 1 A 45 45 SER HA H 105 4.310 4.380 -0.070 1
1 539 . 6 1 1 A 45 45 SER C C 105 175.000 175.098 -0.098 1
1 540 . 6 1 1 A 45 45 SER CA C 105 60.100 59.697 0.403 1
1 541 . 6 1 1 A 45 45 SER CB C 105 63.400 63.630 -0.230 1
1 542 . 6 1 1 A 45 45 SER N N 105 107.700 114.188 -6.488 1
1 543 . 6 1 1 A 46 46 GLU H H 106 7.800 8.151 -0.351 1
1 544 . 6 1 1 A 46 46 GLU HA H 106 4.570 4.378 0.192 1
1 549 . 6 1 1 A 46 46 GLU C C 106 174.100 175.794 -1.694 1
1 550 . 6 1 1 A 46 46 GLU CA C 106 55.600 56.391 -0.791 1
1 551 . 6 1 1 A 46 46 GLU CB C 106 31.200 30.089 1.111 1
1 553 . 6 1 1 A 46 46 GLU N N 106 119.600 119.420 0.180 1
1 554 . 6 1 1 A 47 47 ILE H H 107 7.100 7.574 -0.474 1
1 555 . 6 1 1 A 47 47 ILE HA H 107 4.040 4.311 -0.271 1
1 565 . 6 1 1 A 47 47 ILE C C 107 174.100 174.701 -0.601 1
1 566 . 6 1 1 A 47 47 ILE CA C 107 62.300 60.149 2.151 1
1 567 . 6 1 1 A 47 47 ILE CB C 107 38.500 38.513 -0.013 1
1 571 . 6 1 1 A 47 47 ILE N N 107 120.600 121.291 -0.691 1
1 572 . 6 1 1 A 48 48 LEU H H 108 9.180 8.909 0.271 1
1 573 . 6 1 1 A 48 48 LEU HA H 108 4.940 4.670 0.270 1
1 583 . 6 1 1 A 48 48 LEU CA C 108 51.900 52.497 -0.597 1
1 584 . 6 1 1 A 48 48 LEU CB C 108 42.000 42.099 -0.099 1
1 588 . 6 1 1 A 48 48 LEU N N 108 129.400 128.661 0.739 1
1 589 . 6 1 1 A 49 49 PRO HA H 109 3.910 4.332 -0.422 1
1 596 . 6 1 1 A 49 49 PRO C C 109 178.500 178.070 0.430 1
1 597 . 6 1 1 A 49 49 PRO CA C 109 66.600 64.753 1.847 1
1 598 . 6 1 1 A 49 49 PRO CB C 109 31.300 31.875 -0.575 1
1 601 . 6 1 1 A 50 50 ALA H H 110 8.280 8.149 0.131 1
1 602 . 6 1 1 A 50 50 ALA HA H 110 4.110 4.055 0.055 1
1 606 . 6 1 1 A 50 50 ALA C C 110 179.700 179.789 -0.089 1
1 607 . 6 1 1 A 50 50 ALA CA C 110 55.100 55.223 -0.123 1
1 608 . 6 1 1 A 50 50 ALA CB C 110 19.200 18.279 0.921 1
1 609 . 6 1 1 A 50 50 ALA N N 110 116.100 119.088 -2.988 1
1 610 . 6 1 1 A 51 51 ASP H H 111 7.790 8.230 -0.440 1
1 611 . 6 1 1 A 51 51 ASP HA H 111 4.440 4.304 0.136 1
1 614 . 6 1 1 A 51 51 ASP C C 111 178.200 178.878 -0.678 1
1 615 . 6 1 1 A 51 51 ASP CA C 111 57.600 57.356 0.244 1
1 616 . 6 1 1 A 51 51 ASP CB C 111 41.800 40.797 1.003 1
1 617 . 6 1 1 A 51 51 ASP N N 111 116.500 119.205 -2.705 1
1 618 . 6 1 1 A 52 52 ILE H H 112 7.020 7.571 -0.551 1
1 619 . 6 1 1 A 52 52 ILE HA H 112 3.750 3.579 0.171 1
1 629 . 6 1 1 A 52 52 ILE C C 112 177.300 177.878 -0.578 1
1 630 . 6 1 1 A 52 52 ILE CA C 112 63.500 65.385 -1.885 1
1 631 . 6 1 1 A 52 52 ILE CB C 112 37.500 37.943 -0.443 1
1 635 . 6 1 1 A 52 52 ILE N N 112 116.700 120.474 -3.774 1
1 636 . 6 1 1 A 53 53 GLN H H 113 9.150 7.969 1.181 1
1 637 . 6 1 1 A 53 53 GLN HA H 113 3.720 3.984 -0.264 1
1 644 . 6 1 1 A 53 53 GLN C C 113 177.500 177.775 -0.275 1
1 645 . 6 1 1 A 53 53 GLN CA C 113 58.200 58.640 -0.440 1
1 646 . 6 1 1 A 53 53 GLN CB C 113 30.200 28.521 1.679 1
1 649 . 6 1 1 A 53 53 GLN N N 113 121.200 120.834 0.366 1
1 651 . 6 1 1 A 54 54 SER H H 114 8.150 8.016 0.134 1
1 652 . 6 1 1 A 54 54 SER HA H 114 4.180 4.184 -0.004 1
1 655 . 6 1 1 A 54 54 SER C C 114 175.900 177.401 -1.501 1
1 656 . 6 1 1 A 54 54 SER CA C 114 62.100 61.877 0.223 1
1 657 . 6 1 1 A 54 54 SER CB C 114 62.800 63.824 -1.024 1
1 658 . 6 1 1 A 54 54 SER N N 114 112.200 114.163 -1.963 1
1 659 . 6 1 1 A 55 55 ILE H H 115 6.760 7.532 -0.772 1
1 660 . 6 1 1 A 55 55 ILE HA H 115 3.860 3.646 0.214 1
1 670 . 6 1 1 A 55 55 ILE C C 115 179.200 178.250 0.950 1
1 671 . 6 1 1 A 55 55 ILE CA C 115 64.700 65.099 -0.399 1
1 672 . 6 1 1 A 55 55 ILE CB C 115 38.900 37.763 1.137 1
1 676 . 6 1 1 A 55 55 ILE N N 115 119.500 120.504 -1.004 1
1 677 . 6 1 1 A 56 56 ILE H H 116 7.750 8.394 -0.644 1
1 678 . 6 1 1 A 56 56 ILE HA H 116 3.690 3.600 0.090 1
1 688 . 6 1 1 A 56 56 ILE C C 116 176.900 178.198 -1.298 1
1 689 . 6 1 1 A 56 56 ILE CA C 116 62.800 65.476 -2.676 1
1 690 . 6 1 1 A 56 56 ILE CB C 116 36.200 38.029 -1.829 1
1 694 . 6 1 1 A 56 56 ILE N N 116 120.200 120.577 -0.377 1
1 695 . 6 1 1 A 57 57 ASN H H 117 8.690 8.706 -0.016 1
1 696 . 6 1 1 A 57 57 ASN HA H 117 4.440 4.430 0.010 1
1 701 . 6 1 1 A 57 57 ASN C C 117 177.200 177.095 0.105 1
1 702 . 6 1 1 A 57 57 ASN CA C 117 54.800 56.756 -1.956 1
1 703 . 6 1 1 A 57 57 ASN CB C 117 38.100 39.782 -1.682 1
1 705 . 6 1 1 A 57 57 ASN N N 117 117.000 119.011 -2.011 1
1 707 . 6 1 1 A 58 58 GLU H H 118 7.630 7.989 -0.359 1
1 708 . 6 1 1 A 58 58 GLU HA H 118 4.450 4.330 0.120 1
1 713 . 6 1 1 A 58 58 GLU C C 118 176.500 176.464 0.036 1
1 714 . 6 1 1 A 58 58 GLU CA C 118 56.200 56.676 -0.476 1
1 715 . 6 1 1 A 58 58 GLU CB C 118 30.200 29.265 0.935 1
1 717 . 6 1 1 A 58 58 GLU N N 118 116.300 115.043 1.257 1
1 718 . 6 1 1 A 59 59 THR H H 119 7.540 7.393 0.147 1
1 719 . 6 1 1 A 59 59 THR HA H 119 4.230 4.373 -0.143 1
1 724 . 6 1 1 A 59 59 THR C C 119 174.200 174.489 -0.289 1
1 725 . 6 1 1 A 59 59 THR CA C 119 63.800 63.795 0.005 1
1 726 . 6 1 1 A 59 59 THR CB C 119 68.900 69.818 -0.918 1
1 728 . 6 1 1 A 59 59 THR N N 119 117.600 117.372 0.228 1
1 729 . 6 1 1 A 60 60 LYS H H 120 8.860 8.564 0.296 1
1 730 . 6 1 1 A 60 60 LYS HA H 120 4.490 4.670 -0.180 1
1 739 . 6 1 1 A 60 60 LYS C C 120 175.800 175.339 0.461 1
1 740 . 6 1 1 A 60 60 LYS CA C 120 54.900 55.399 -0.499 1
1 741 . 6 1 1 A 60 60 LYS CB C 120 29.800 32.131 -2.331 1
1 745 . 6 1 1 A 60 60 LYS N N 120 128.500 127.350 1.150 1
1 746 . 6 1 1 A 61 61 LEU H H 121 7.150 8.482 -1.332 1
1 747 . 6 1 1 A 61 61 LEU HA H 121 4.710 4.967 -0.257 1
1 757 . 6 1 1 A 61 61 LEU C C 121 175.000 175.997 -0.997 1
1 758 . 6 1 1 A 61 61 LEU CA C 121 52.800 53.248 -0.448 1
1 759 . 6 1 1 A 61 61 LEU CB C 121 46.400 45.487 0.913 1
1 763 . 6 1 1 A 61 61 LEU N N 121 120.700 125.881 -5.181 1
1 764 . 6 1 1 A 62 62 ALA H H 122 8.000 8.574 -0.574 1
1 765 . 6 1 1 A 62 62 ALA HA H 122 4.250 4.400 -0.150 1
1 769 . 6 1 1 A 62 62 ALA CA C 122 52.100 52.033 0.067 1
1 770 . 6 1 1 A 62 62 ALA CB C 122 19.500 19.566 -0.066 1
1 771 . 6 1 1 A 62 62 ALA N N 122 119.900 123.771 -3.871 1
1 772 . 6 1 1 A 63 63 LYS H H 123 8.770 8.838 -0.068 1
1 773 . 6 1 1 A 63 63 LYS HA H 123 3.800 4.011 -0.211 1
1 782 . 6 1 1 A 63 63 LYS C C 123 178.300 178.708 -0.408 1
1 783 . 6 1 1 A 63 63 LYS CA C 123 60.700 59.174 1.526 1
1 784 . 6 1 1 A 63 63 LYS CB C 123 32.300 31.984 0.316 1
1 788 . 6 1 1 A 63 63 LYS N N 123 121.400 120.798 0.602 1
1 789 . 6 1 1 A 64 64 ASN H H 124 9.020 7.960 1.060 1
1 790 . 6 1 1 A 64 64 ASN HA H 124 4.430 4.477 -0.047 1
1 795 . 6 1 1 A 64 64 ASN C C 124 178.300 177.869 0.431 1
1 796 . 6 1 1 A 64 64 ASN CA C 124 56.200 56.490 -0.290 1
1 797 . 6 1 1 A 64 64 ASN CB C 124 37.300 39.157 -1.857 1
1 799 . 6 1 1 A 64 64 ASN N N 124 115.000 118.342 -3.342 1
1 801 . 6 1 1 A 65 65 THR H H 125 7.620 8.041 -0.421 1
1 802 . 6 1 1 A 65 65 THR HA H 125 4.030 4.022 0.008 1
1 807 . 6 1 1 A 65 65 THR C C 125 175.500 176.435 -0.935 1
1 808 . 6 1 1 A 65 65 THR CA C 125 66.000 67.326 -1.326 1
1 809 . 6 1 1 A 65 65 THR CB C 125 67.600 67.917 -0.317 1
1 811 . 6 1 1 A 65 65 THR N N 125 119.800 116.390 3.410 1
1 812 . 6 1 1 A 66 66 LEU H H 126 8.020 8.619 -0.599 1
1 813 . 6 1 1 A 66 66 LEU HA H 126 3.790 3.724 0.066 1
1 823 . 6 1 1 A 66 66 LEU C C 126 179.200 179.266 -0.066 1
1 824 . 6 1 1 A 66 66 LEU CA C 126 58.700 58.127 0.573 1
1 825 . 6 1 1 A 66 66 LEU CB C 126 41.300 41.592 -0.292 1
1 829 . 6 1 1 A 66 66 LEU N N 126 121.200 120.830 0.370 1
1 830 . 6 1 1 A 67 67 LYS H H 127 8.380 8.036 0.344 1
1 831 . 6 1 1 A 67 67 LYS HA H 127 3.740 4.059 -0.319 1
1 840 . 6 1 1 A 67 67 LYS C C 127 178.300 179.312 -1.012 1
1 841 . 6 1 1 A 67 67 LYS CA C 127 60.100 59.363 0.737 1
1 842 . 6 1 1 A 67 67 LYS CB C 127 32.400 32.100 0.300 1
1 846 . 6 1 1 A 67 67 LYS N N 127 117.000 117.654 -0.654 1
1 847 . 6 1 1 A 68 68 ALA H H 128 7.480 8.006 -0.526 1
1 848 . 6 1 1 A 68 68 ALA HA H 128 4.210 4.040 0.170 1
1 852 . 6 1 1 A 68 68 ALA C C 128 181.200 179.789 1.411 1
1 853 . 6 1 1 A 68 68 ALA CA C 128 55.200 55.024 0.176 1
1 854 . 6 1 1 A 68 68 ALA CB C 128 18.600 17.986 0.614 1
1 855 . 6 1 1 A 68 68 ALA N N 128 122.900 121.883 1.017 1
1 856 . 6 1 1 A 69 69 ILE H H 129 8.250 7.575 0.675 1
1 857 . 6 1 1 A 69 69 ILE HA H 129 3.130 3.113 0.017 1
1 867 . 6 1 1 A 69 69 ILE C C 129 177.400 177.813 -0.413 1
1 868 . 6 1 1 A 69 69 ILE CA C 129 66.700 65.216 1.484 1
1 869 . 6 1 1 A 69 69 ILE CB C 129 37.900 37.204 0.696 1
1 873 . 6 1 1 A 69 69 ILE N N 129 122.800 118.342 4.458 1
1 874 . 6 1 1 A 70 70 ARG H H 130 8.040 7.727 0.313 1
1 875 . 6 1 1 A 70 70 ARG HA H 130 3.620 3.918 -0.298 1
1 882 . 6 1 1 A 70 70 ARG C C 130 177.800 179.048 -1.248 1
1 883 . 6 1 1 A 70 70 ARG CA C 130 60.700 59.889 0.811 1
1 884 . 6 1 1 A 70 70 ARG CB C 130 29.600 29.893 -0.293 1
1 887 . 6 1 1 A 70 70 ARG N N 130 119.700 120.803 -1.103 1
1 888 . 6 1 1 A 71 71 ASN H H 131 8.920 8.807 0.113 1
1 889 . 6 1 1 A 71 71 ASN HA H 131 4.430 4.784 -0.354 1
1 894 . 6 1 1 A 71 71 ASN C C 131 177.500 177.854 -0.354 1
1 895 . 6 1 1 A 71 71 ASN CA C 131 56.100 56.239 -0.139 1
1 896 . 6 1 1 A 71 71 ASN CB C 131 38.600 37.765 0.835 1
1 898 . 6 1 1 A 71 71 ASN N N 131 117.200 117.983 -0.783 1
1 900 . 6 1 1 A 72 72 THR H H 132 8.300 8.116 0.184 1
1 901 . 6 1 1 A 72 72 THR HA H 132 4.430 3.994 0.436 1
1 906 . 6 1 1 A 72 72 THR C C 132 175.100 176.285 -1.185 1
1 907 . 6 1 1 A 72 72 THR CA C 132 68.200 66.322 1.878 1
1 908 . 6 1 1 A 72 72 THR CB C 132 68.500 68.693 -0.193 1
1 910 . 6 1 1 A 72 72 THR N N 132 119.200 117.624 1.576 1
1 911 . 6 1 1 A 73 73 ALA H H 133 7.950 8.221 -0.271 1
1 912 . 6 1 1 A 73 73 ALA HA H 133 4.040 3.931 0.109 1
1 916 . 6 1 1 A 73 73 ALA C C 133 178.200 179.428 -1.228 1
1 917 . 6 1 1 A 73 73 ALA CA C 133 55.900 55.358 0.542 1
1 918 . 6 1 1 A 73 73 ALA CB C 133 16.700 18.072 -1.372 1
1 919 . 6 1 1 A 73 73 ALA N N 133 120.900 123.743 -2.843 1
1 920 . 6 1 1 A 74 74 SER H H 134 8.440 8.614 -0.174 1
1 921 . 6 1 1 A 74 74 SER HA H 134 4.430 4.422 0.008 1
1 924 . 6 1 1 A 74 74 SER C C 134 178.800 177.359 1.441 1
1 925 . 6 1 1 A 74 74 SER CA C 134 61.300 61.565 -0.265 1
1 926 . 6 1 1 A 74 74 SER CB C 134 62.600 62.492 0.108 1
1 927 . 6 1 1 A 74 74 SER N N 134 110.100 113.090 -2.990 1
1 928 . 6 1 1 A 75 75 GLN H H 135 8.340 7.548 0.792 1
1 929 . 6 1 1 A 75 75 GLN HA H 135 3.880 4.049 -0.169 1
1 936 . 6 1 1 A 75 75 GLN C C 135 178.800 178.705 0.095 1
1 937 . 6 1 1 A 75 75 GLN CA C 135 59.600 58.952 0.648 1
1 938 . 6 1 1 A 75 75 GLN CB C 135 29.900 28.131 1.769 1
1 941 . 6 1 1 A 75 75 GLN N N 135 118.100 121.659 -3.559 1
1 943 . 6 1 1 A 76 76 ILE H H 136 7.670 7.230 0.440 1
1 944 . 6 1 1 A 76 76 ILE HA H 136 3.200 3.366 -0.166 1
1 954 . 6 1 1 A 76 76 ILE C C 136 177.500 177.615 -0.115 1
1 955 . 6 1 1 A 76 76 ILE CA C 136 66.100 64.982 1.118 1
1 956 . 6 1 1 A 76 76 ILE CB C 136 37.400 37.318 0.082 1
1 960 . 6 1 1 A 76 76 ILE N N 136 122.500 120.125 2.375 1
1 961 . 6 1 1 A 77 77 PHE H H 137 7.930 7.638 0.292 1
1 962 . 6 1 1 A 77 77 PHE HA H 137 3.890 3.965 -0.075 1
1 969 . 6 1 1 A 77 77 PHE C C 137 178.200 178.288 -0.088 1
1 970 . 6 1 1 A 77 77 PHE CA C 137 63.600 60.282 3.318 1
1 971 . 6 1 1 A 77 77 PHE CB C 137 39.300 38.557 0.743 1
1 976 . 6 1 1 A 77 77 PHE N N 137 116.100 118.935 -2.835 1
1 977 . 6 1 1 A 78 78 ARG H H 138 8.900 8.496 0.404 1
1 978 . 6 1 1 A 78 78 ARG HA H 138 3.910 3.925 -0.015 1
1 986 . 6 1 1 A 78 78 ARG C C 138 178.300 178.889 -0.589 1
1 987 . 6 1 1 A 78 78 ARG CA C 138 60.100 59.187 0.913 1
1 988 . 6 1 1 A 78 78 ARG CB C 138 29.600 29.699 -0.099 1
1 991 . 6 1 1 A 78 78 ARG N N 138 118.600 119.595 -0.995 1
1 993 . 6 1 1 A 79 79 LEU H H 139 7.730 8.010 -0.280 1
1 994 . 6 1 1 A 79 79 LEU HA H 139 4.280 4.088 0.192 1
1 1004 . 6 1 1 A 79 79 LEU C C 139 179.000 178.313 0.687 1
1 1005 . 6 1 1 A 79 79 LEU CA C 139 57.800 57.818 -0.018 1
1 1006 . 6 1 1 A 79 79 LEU CB C 139 41.900 41.185 0.715 1
1 1010 . 6 1 1 A 79 79 LEU N N 139 121.900 121.414 0.486 1
1 1011 . 6 1 1 A 80 80 ALA H H 140 7.590 7.570 0.020 1
1 1012 . 6 1 1 A 80 80 ALA HA H 140 2.710 3.059 -0.349 1
1 1016 . 6 1 1 A 80 80 ALA C C 140 179.900 180.077 -0.177 1
1 1017 . 6 1 1 A 80 80 ALA CA C 140 55.100 54.676 0.424 1
1 1018 . 6 1 1 A 80 80 ALA CB C 140 17.600 17.546 0.054 1
1 1019 . 6 1 1 A 80 80 ALA N N 140 123.400 119.854 3.546 1
1 1020 . 6 1 1 A 81 81 ILE H H 141 8.910 8.063 0.847 1
1 1021 . 6 1 1 A 81 81 ILE HA H 141 4.110 3.691 0.419 1
1 1031 . 6 1 1 A 81 81 ILE C C 141 181.700 177.603 4.097 1
1 1032 . 6 1 1 A 81 81 ILE CA C 141 64.800 65.454 -0.654 1
1 1033 . 6 1 1 A 81 81 ILE CB C 141 38.600 37.780 0.820 1
1 1037 . 6 1 1 A 81 81 ILE N N 141 122.400 118.880 3.520 1
1 1038 . 6 1 1 A 82 82 GLU H H 142 8.560 8.697 -0.137 1
1 1039 . 6 1 1 A 82 82 GLU HA H 142 4.100 4.043 0.057 1
1 1044 . 6 1 1 A 82 82 GLU C C 142 177.700 178.333 -0.633 1
1 1045 . 6 1 1 A 82 82 GLU CA C 142 59.100 59.920 -0.820 1
1 1046 . 6 1 1 A 82 82 GLU CB C 142 29.200 29.448 -0.248 1
1 1048 . 6 1 1 A 82 82 GLU N N 142 123.200 119.909 3.291 1
1 1049 . 6 1 1 A 83 83 ASN H H 143 7.310 7.988 -0.678 1
1 1050 . 6 1 1 A 83 83 ASN HA H 143 4.750 4.931 -0.181 1
1 1055 . 6 1 1 A 83 83 ASN C C 143 173.200 174.378 -1.178 1
1 1056 . 6 1 1 A 83 83 ASN CA C 143 54.200 53.004 1.196 1
1 1057 . 6 1 1 A 83 83 ASN CB C 143 41.300 38.873 2.427 1
1 1059 . 6 1 1 A 83 83 ASN N N 143 114.900 115.358 -0.458 1
1 1061 . 6 1 1 A 84 84 ARG H H 144 8.320 8.059 0.261 1
1 1062 . 6 1 1 A 84 84 ARG HA H 144 4.120 4.061 0.059 1
1 1069 . 6 1 1 A 84 84 ARG C C 144 175.300 175.807 -0.507 1
1 1070 . 6 1 1 A 84 84 ARG CA C 144 57.100 57.100 0.000 1
1 1071 . 6 1 1 A 84 84 ARG CB C 144 26.000 26.976 -0.976 1
1 1074 . 6 1 1 A 84 84 ARG N N 144 114.400 114.985 -0.585 1
1 1075 . 6 1 1 A 85 85 ALA H H 145 8.350 8.484 -0.134 1
1 1076 . 6 1 1 A 85 85 ALA HA H 145 4.320 4.371 -0.051 1
1 1080 . 6 1 1 A 85 85 ALA C C 145 176.500 177.252 -0.752 1
1 1081 . 6 1 1 A 85 85 ALA CA C 145 53.400 53.279 0.121 1
1 1082 . 6 1 1 A 85 85 ALA CB C 145 19.900 19.809 0.091 1
1 1083 . 6 1 1 A 85 85 ALA N N 145 120.600 119.440 1.160 1
1 1084 . 6 1 1 A 86 86 ILE H H 146 7.290 7.643 -0.353 1
1 1085 . 6 1 1 A 86 86 ILE HA H 146 4.400 4.712 -0.312 1
1 1095 . 6 1 1 A 86 86 ILE C C 146 173.600 173.717 -0.117 1
1 1096 . 6 1 1 A 86 86 ILE CA C 146 59.200 59.677 -0.477 1
1 1097 . 6 1 1 A 86 86 ILE CB C 146 41.600 41.750 -0.150 1
1 1101 . 6 1 1 A 86 86 ILE N N 146 111.500 115.586 -4.086 1
1 1102 . 6 1 1 A 87 87 ASP H H 147 8.270 8.859 -0.589 1
1 1103 . 6 1 1 A 87 87 ASP HA H 147 4.940 4.977 -0.037 1
1 1106 . 6 1 1 A 87 87 ASP C C 147 174.700 174.925 -0.225 1
1 1107 . 6 1 1 A 87 87 ASP CA C 147 53.700 54.160 -0.460 1
1 1108 . 6 1 1 A 87 87 ASP CB C 147 41.800 41.856 -0.056 1
1 1109 . 6 1 1 A 87 87 ASP N N 147 119.400 125.179 -5.779 1
1 1110 . 6 1 1 A 88 88 PHE H H 148 7.230 7.607 -0.377 1
1 1111 . 6 1 1 A 88 88 PHE HA H 148 4.690 4.818 -0.128 1
1 1119 . 6 1 1 A 88 88 PHE C C 148 171.500 172.766 -1.266 1
1 1120 . 6 1 1 A 88 88 PHE CA C 148 56.400 57.236 -0.836 1
1 1121 . 6 1 1 A 88 88 PHE CB C 148 42.000 42.718 -0.718 1
1 1127 . 6 1 1 A 88 88 PHE N N 148 119.700 120.634 -0.934 1
1 1128 . 6 1 1 A 89 89 ASN H H 149 8.060 8.320 -0.260 1
1 1129 . 6 1 1 A 89 89 ASN HA H 149 4.490 4.982 -0.492 1
1 1134 . 6 1 1 A 89 89 ASN CA C 149 48.100 48.931 -0.831 1
1 1135 . 6 1 1 A 89 89 ASN CB C 149 39.200 39.766 -0.566 1
1 1137 . 6 1 1 A 89 89 ASN N N 149 119.700 125.304 -5.604 1
1 1139 . 6 1 1 A 90 90 PRO HA H 150 3.970 4.338 -0.368 1
1 1146 . 6 1 1 A 90 90 PRO C C 150 177.700 178.103 -0.403 1
1 1147 . 6 1 1 A 90 90 PRO CA C 150 63.900 64.906 -1.006 1
1 1148 . 6 1 1 A 90 90 PRO CB C 150 31.700 31.558 0.142 1
1 1151 . 6 1 1 A 91 91 ALA H H 151 7.240 7.621 -0.381 1
1 1152 . 6 1 1 A 91 91 ALA HA H 151 3.900 4.211 -0.311 1
1 1156 . 6 1 1 A 91 91 ALA C C 151 178.000 179.594 -1.594 1
1 1157 . 6 1 1 A 91 91 ALA CA C 151 53.900 54.218 -0.318 1
1 1158 . 6 1 1 A 91 91 ALA CB C 151 17.700 18.618 -0.918 1
1 1159 . 6 1 1 A 91 91 ALA N N 151 115.700 119.161 -3.461 1
1 1160 . 6 1 1 A 92 92 ASP H H 152 7.080 7.981 -0.901 1
1 1161 . 6 1 1 A 92 92 ASP HA H 152 4.220 4.261 -0.041 1
1 1164 . 6 1 1 A 92 92 ASP C C 152 176.200 176.933 -0.733 1
1 1165 . 6 1 1 A 92 92 ASP CA C 152 55.800 56.591 -0.791 1
1 1166 . 6 1 1 A 92 92 ASP CB C 152 39.500 40.308 -0.808 1
1 1167 . 6 1 1 A 92 92 ASP N N 152 117.100 119.722 -2.622 1
1 1168 . 6 1 1 A 93 93 TYR H H 153 7.060 7.502 -0.442 1
1 1169 . 6 1 1 A 93 93 TYR HA H 153 4.490 4.540 -0.050 1
1 1176 . 6 1 1 A 93 93 TYR C C 153 174.700 175.764 -1.064 1
1 1177 . 6 1 1 A 93 93 TYR CA C 153 57.600 58.385 -0.785 1
1 1178 . 6 1 1 A 93 93 TYR CB C 153 38.500 38.559 -0.059 1
1 1183 . 6 1 1 A 93 93 TYR N N 153 116.800 116.625 0.175 1
1 1184 . 6 1 1 A 94 94 VAL H H 154 7.000 7.032 -0.032 1
1 1185 . 6 1 1 A 94 94 VAL HA H 154 4.040 4.030 0.010 1
1 1193 . 6 1 1 A 94 94 VAL C C 154 174.700 175.087 -0.387 1
1 1194 . 6 1 1 A 94 94 VAL CA C 154 62.100 62.639 -0.539 1
1 1195 . 6 1 1 A 94 94 VAL CB C 154 32.700 32.365 0.335 1
1 1198 . 6 1 1 A 94 94 VAL N N 154 120.600 121.122 -0.522 1
1 1199 . 6 1 1 A 95 95 ARG H H 155 9.430 8.631 0.799 1
1 1200 . 6 1 1 A 95 95 ARG HA H 155 4.640 4.622 0.018 1
1 1207 . 6 1 1 A 95 95 ARG C C 155 175.400 174.534 0.866 1
1 1208 . 6 1 1 A 95 95 ARG CA C 155 54.200 55.621 -1.421 1
1 1209 . 6 1 1 A 95 95 ARG CB C 155 32.400 31.629 0.771 1
1 1212 . 6 1 1 A 95 95 ARG N N 155 128.200 127.030 1.170 1
1 1213 . 6 1 1 A 96 96 ILE H H 156 8.700 8.846 -0.146 1
1 1214 . 6 1 1 A 96 96 ILE HA H 156 4.440 4.776 -0.336 1
1 1224 . 6 1 1 A 96 96 ILE CA C 156 56.500 57.647 -1.147 1
1 1225 . 6 1 1 A 96 96 ILE CB C 156 36.700 40.594 -3.894 1
1 1229 . 6 1 1 A 96 96 ILE N N 156 124.100 123.394 0.706 1
1 1230 . 6 1 1 A 97 97 PRO HA H 157 4.370 4.870 -0.500 1
1 1237 . 6 1 1 A 97 97 PRO C C 157 176.000 176.901 -0.901 1
1 1238 . 6 1 1 A 97 97 PRO CA C 157 63.200 62.108 1.092 1
1 1239 . 6 1 1 A 97 97 PRO CB C 157 32.400 32.588 -0.188 1
1 1242 . 6 1 1 A 98 98 LYS H H 158 8.380 8.823 -0.443 1
1 1243 . 6 1 1 A 98 98 LYS HA H 158 4.190 4.418 -0.228 1
1 1252 . 6 1 1 A 98 98 LYS C C 158 176.800 176.440 0.360 1
1 1253 . 6 1 1 A 98 98 LYS CA C 158 57.100 56.520 0.580 1
1 1254 . 6 1 1 A 98 98 LYS CB C 158 32.800 33.088 -0.288 1
1 1258 . 6 1 1 A 98 98 LYS N N 158 120.800 118.890 1.910 1
1 1259 . 6 1 1 A 99 99 ILE H H 159 7.930 7.314 0.616 1
1 1260 . 6 1 1 A 99 99 ILE HA H 159 4.200 4.141 0.059 1
1 1270 . 6 1 1 A 99 99 ILE C C 159 175.400 174.928 0.472 1
1 1271 . 6 1 1 A 99 99 ILE CA C 159 60.600 60.977 -0.377 1
1 1272 . 6 1 1 A 99 99 ILE CB C 159 39.100 36.456 2.644 1
1 1276 . 6 1 1 A 99 99 ILE N N 159 120.200 121.297 -1.097 1
1 1277 . 6 1 1 A 100 100 ALA H H 160 8.370 8.111 0.259 1
1 1278 . 6 1 1 A 100 100 ALA HA H 160 4.370 4.444 -0.074 1
1 1282 . 6 1 1 A 100 100 ALA C C 160 177.200 177.781 -0.581 1
1 1283 . 6 1 1 A 100 100 ALA CA C 160 52.200 51.585 0.615 1
1 1284 . 6 1 1 A 100 100 ALA CB C 160 19.400 20.856 -1.456 1
1 1285 . 6 1 1 A 100 100 ALA N N 160 128.300 130.461 -2.161 1
1 1286 . 6 1 1 A 101 101 LEU H H 161 8.250 8.553 -0.303 1
1 1287 . 6 1 1 A 101 101 LEU HA H 161 4.280 4.195 0.085 1
1 1297 . 6 1 1 A 101 101 LEU C C 161 177.200 177.289 -0.089 1
1 1298 . 6 1 1 A 101 101 LEU CA C 161 55.200 55.187 0.013 1
1 1299 . 6 1 1 A 101 101 LEU CB C 161 42.400 40.793 1.607 1
1 1303 . 6 1 1 A 101 101 LEU N N 161 121.900 119.924 1.976 1
1 1304 . 6 1 1 A 102 102 GLU H H 162 8.390 8.775 -0.385 1
1 1305 . 6 1 1 A 102 102 GLU HA H 162 4.230 4.080 0.150 1
1 1310 . 6 1 1 A 102 102 GLU C C 162 176.100 176.523 -0.423 1
1 1311 . 6 1 1 A 102 102 GLU CA C 162 56.400 59.309 -2.909 1
1 1312 . 6 1 1 A 102 102 GLU CB C 162 30.500 30.058 0.442 1
1 1314 . 6 1 1 A 102 102 GLU N N 162 121.300 126.725 -5.425 1
1 1315 . 6 1 1 A 103 103 HIS H H 163 8.330 7.991 0.339 1
1 1316 . 6 1 1 A 103 103 HIS HA H 163 4.590 4.763 -0.173 1
1 1319 . 6 1 1 A 103 103 HIS C C 163 176.100 174.924 1.176 1
1 1320 . 6 1 1 A 103 103 HIS CA C 163 56.000 56.480 -0.480 1
1 1321 . 6 1 1 A 103 103 HIS CB C 163 30.500 31.351 -0.851 1
1 1322 . 6 1 1 A 103 103 HIS N N 163 120.000 116.601 3.399 1
1 1323 . 6 1 1 A 107 107 HIS HA H 167 4.620 4.676 -0.056 1
1 1326 . 6 1 1 A 107 107 HIS C C 167 173.900 174.544 -0.644 1
1 1327 . 6 1 1 A 107 107 HIS CA C 167 56.000 55.396 0.604 1
1 1328 . 6 1 1 A 107 107 HIS CB C 167 30.300 31.676 -1.376 1
1 15 . 7 1 1 A 2 2 ASP H H 62 8.760 8.590 0.170 1
1 16 . 7 1 1 A 2 2 ASP HA H 62 4.810 4.810 0.000 1
1 19 . 7 1 1 A 2 2 ASP C C 62 175.800 175.325 0.475 1
1 20 . 7 1 1 A 2 2 ASP CA C 62 54.800 54.075 0.725 1
1 21 . 7 1 1 A 2 2 ASP CB C 62 41.600 42.215 -0.615 1
1 22 . 7 1 1 A 2 2 ASP N N 62 120.900 124.540 -3.640 1
1 23 . 7 1 1 A 3 3 SER H H 63 8.710 8.507 0.203 1
1 24 . 7 1 1 A 3 3 SER HA H 63 4.970 5.013 -0.043 1
1 27 . 7 1 1 A 3 3 SER C C 63 175.600 175.431 0.169 1
1 28 . 7 1 1 A 3 3 SER CA C 63 57.500 56.897 0.603 1
1 29 . 7 1 1 A 3 3 SER CB C 63 65.900 65.992 -0.092 1
1 30 . 7 1 1 A 3 3 SER N N 63 116.300 116.918 -0.618 1
1 31 . 7 1 1 A 4 4 PHE H H 64 9.370 9.489 -0.119 1
1 32 . 7 1 1 A 4 4 PHE HA H 64 4.010 4.161 -0.151 1
1 39 . 7 1 1 A 4 4 PHE C C 64 176.700 177.329 -0.629 1
1 40 . 7 1 1 A 4 4 PHE CA C 64 62.200 61.625 0.575 1
1 41 . 7 1 1 A 4 4 PHE CB C 64 38.500 39.492 -0.992 1
1 46 . 7 1 1 A 4 4 PHE N N 64 121.400 124.172 -2.772 1
1 47 . 7 1 1 A 5 5 GLY H H 65 8.930 7.921 1.009 1
1 48 . 7 1 1 A 5 5 GLY HA2 H 65 2.020 2.593 -0.573 1
1 49 . 7 1 1 A 5 5 GLY HA3 H 65 3.250 2.723 0.527 1
1 50 . 7 1 1 A 5 5 GLY C C 65 175.200 174.911 0.289 1
1 51 . 7 1 1 A 5 5 GLY CA C 65 46.300 46.612 -0.312 1
1 52 . 7 1 1 A 5 5 GLY N N 65 106.500 104.822 1.678 1
1 53 . 7 1 1 A 6 6 ASP H H 66 7.630 7.782 -0.152 1
1 54 . 7 1 1 A 6 6 ASP HA H 66 4.100 4.100 0.000 1
1 57 . 7 1 1 A 6 6 ASP C C 66 179.500 178.410 1.090 1
1 58 . 7 1 1 A 6 6 ASP CA C 66 57.400 56.892 0.508 1
1 59 . 7 1 1 A 6 6 ASP CB C 66 40.500 41.328 -0.828 1
1 60 . 7 1 1 A 6 6 ASP N N 66 120.500 120.715 -0.215 1
1 61 . 7 1 1 A 7 7 TRP H H 67 7.190 7.649 -0.459 1
1 62 . 7 1 1 A 7 7 TRP HA H 67 3.860 4.243 -0.383 1
1 71 . 7 1 1 A 7 7 TRP C C 67 177.200 178.419 -1.219 1
1 72 . 7 1 1 A 7 7 TRP CA C 67 61.100 60.151 0.949 1
1 73 . 7 1 1 A 7 7 TRP CB C 67 28.300 29.125 -0.825 1
1 79 . 7 1 1 A 7 7 TRP N N 67 120.700 120.014 0.686 1
1 81 . 7 1 1 A 8 8 ALA H H 68 9.040 8.366 0.674 1
1 82 . 7 1 1 A 8 8 ALA HA H 68 3.730 3.737 -0.007 1
1 86 . 7 1 1 A 8 8 ALA C C 68 179.500 179.486 0.014 1
1 87 . 7 1 1 A 8 8 ALA CA C 68 55.200 55.108 0.092 1
1 88 . 7 1 1 A 8 8 ALA CB C 68 18.600 17.795 0.805 1
1 89 . 7 1 1 A 8 8 ALA N N 68 125.700 122.157 3.543 1
1 90 . 7 1 1 A 9 9 GLU H H 69 8.060 8.022 0.038 1
1 91 . 7 1 1 A 9 9 GLU HA H 69 4.020 4.114 -0.094 1
1 96 . 7 1 1 A 9 9 GLU C C 69 180.400 178.283 2.117 1
1 97 . 7 1 1 A 9 9 GLU CA C 69 58.800 58.665 0.135 1
1 98 . 7 1 1 A 9 9 GLU CB C 69 28.500 29.460 -0.960 1
1 99 . 7 1 1 A 9 9 GLU N N 69 115.400 118.589 -3.189 1
1 100 . 7 1 1 A 10 10 LYS H H 70 7.740 7.997 -0.257 1
1 101 . 7 1 1 A 10 10 LYS HA H 70 3.910 4.032 -0.122 1
1 110 . 7 1 1 A 10 10 LYS C C 70 179.500 178.958 0.542 1
1 111 . 7 1 1 A 10 10 LYS CA C 70 60.000 58.520 1.480 1
1 112 . 7 1 1 A 10 10 LYS CB C 70 32.400 31.966 0.434 1
1 116 . 7 1 1 A 10 10 LYS N N 70 122.700 119.320 3.380 1
1 117 . 7 1 1 A 11 11 PHE H H 71 8.750 8.389 0.361 1
1 118 . 7 1 1 A 11 11 PHE HA H 71 4.080 4.276 -0.196 1
1 126 . 7 1 1 A 11 11 PHE C C 71 177.100 177.112 -0.012 1
1 127 . 7 1 1 A 11 11 PHE CA C 71 61.200 61.232 -0.032 1
1 128 . 7 1 1 A 11 11 PHE CB C 71 38.900 39.288 -0.388 1
1 134 . 7 1 1 A 11 11 PHE N N 71 123.500 120.494 3.006 1
1 135 . 7 1 1 A 12 12 LEU H H 72 8.400 8.669 -0.269 1
1 136 . 7 1 1 A 12 12 LEU HA H 72 3.520 3.631 -0.111 1
1 146 . 7 1 1 A 12 12 LEU C C 72 180.000 179.503 0.497 1
1 147 . 7 1 1 A 12 12 LEU CA C 72 58.200 58.225 -0.025 1
1 148 . 7 1 1 A 12 12 LEU CB C 72 41.700 41.597 0.103 1
1 152 . 7 1 1 A 12 12 LEU N N 72 121.100 119.208 1.892 1
1 153 . 7 1 1 A 13 13 LYS H H 73 7.810 8.199 -0.389 1
1 154 . 7 1 1 A 13 13 LYS HA H 73 4.080 3.969 0.111 1
1 156 . 7 1 1 A 13 13 LYS C C 73 179.300 178.671 0.629 1
1 157 . 7 1 1 A 13 13 LYS CA C 73 59.000 58.780 0.220 1
1 158 . 7 1 1 A 13 13 LYS CB C 73 31.900 32.057 -0.157 1
1 159 . 7 1 1 A 13 13 LYS N N 73 119.400 120.339 -0.939 1
1 160 . 7 1 1 A 14 14 SER H H 74 8.210 8.244 -0.034 1
1 161 . 7 1 1 A 14 14 SER HA H 74 4.210 4.162 0.048 1
1 164 . 7 1 1 A 14 14 SER C C 74 176.300 177.159 -0.859 1
1 165 . 7 1 1 A 14 14 SER CA C 74 61.400 61.201 0.199 1
1 166 . 7 1 1 A 14 14 SER CB C 74 62.600 62.300 0.300 1
1 167 . 7 1 1 A 14 14 SER N N 74 117.600 115.298 2.302 1
1 168 . 7 1 1 A 15 15 LYS H H 75 7.760 7.354 0.406 1
1 169 . 7 1 1 A 15 15 LYS HA H 75 4.040 4.048 -0.008 1
1 178 . 7 1 1 A 15 15 LYS C C 75 178.500 178.838 -0.338 1
1 179 . 7 1 1 A 15 15 LYS CA C 75 56.500 59.343 -2.843 1
1 180 . 7 1 1 A 15 15 LYS CB C 75 30.600 32.084 -1.484 1
1 184 . 7 1 1 A 15 15 LYS N N 75 120.100 122.782 -2.682 1
1 185 . 7 1 1 A 16 16 GLU H H 76 7.680 8.315 -0.635 1
1 186 . 7 1 1 A 16 16 GLU HA H 76 4.030 4.010 0.020 1
1 191 . 7 1 1 A 16 16 GLU C C 76 179.900 178.627 1.273 1
1 192 . 7 1 1 A 16 16 GLU CA C 76 59.200 59.518 -0.318 1
1 193 . 7 1 1 A 16 16 GLU CB C 76 29.600 29.203 0.397 1
1 195 . 7 1 1 A 16 16 GLU N N 76 119.700 119.795 -0.095 1
1 196 . 7 1 1 A 17 17 ALA H H 77 8.030 8.153 -0.123 1
1 197 . 7 1 1 A 17 17 ALA HA H 77 4.200 4.100 0.100 1
1 201 . 7 1 1 A 17 17 ALA C C 77 178.900 179.569 -0.669 1
1 202 . 7 1 1 A 17 17 ALA CA C 77 54.400 54.944 -0.544 1
1 203 . 7 1 1 A 17 17 ALA CB C 77 18.100 18.451 -0.351 1
1 204 . 7 1 1 A 17 17 ALA N N 77 123.000 121.517 1.483 1
1 205 . 7 1 1 A 18 18 ASP H H 78 7.860 8.066 -0.206 1
1 206 . 7 1 1 A 18 18 ASP HA H 78 4.600 4.474 0.126 1
1 209 . 7 1 1 A 18 18 ASP C C 78 177.500 176.253 1.247 1
1 210 . 7 1 1 A 18 18 ASP CA C 78 55.100 54.683 0.417 1
1 211 . 7 1 1 A 18 18 ASP CB C 78 41.400 40.743 0.657 1
1 212 . 7 1 1 A 18 18 ASP N N 78 117.700 116.599 1.101 1
1 213 . 7 1 1 A 19 19 GLY H H 79 7.910 7.891 0.019 1
1 214 . 7 1 1 A 19 19 GLY HA2 H 79 3.860 4.029 -0.169 1
1 215 . 7 1 1 A 19 19 GLY HA3 H 79 4.080 4.031 0.049 1
1 216 . 7 1 1 A 19 19 GLY C C 79 175.300 174.885 0.415 1
1 217 . 7 1 1 A 19 19 GLY CA C 79 46.200 45.338 0.862 1
1 218 . 7 1 1 A 19 19 GLY N N 79 107.100 106.831 0.269 1
1 219 . 7 1 1 A 20 20 VAL H H 80 7.150 7.440 -0.290 1
1 220 . 7 1 1 A 20 20 VAL HA H 80 4.250 4.226 0.024 1
1 228 . 7 1 1 A 20 20 VAL C C 80 175.100 175.578 -0.478 1
1 229 . 7 1 1 A 20 20 VAL CA C 80 61.800 61.506 0.294 1
1 230 . 7 1 1 A 20 20 VAL CB C 80 32.200 32.739 -0.539 1
1 233 . 7 1 1 A 20 20 VAL N N 80 114.600 119.295 -4.695 1
1 234 . 7 1 1 A 21 21 SER H H 81 8.560 8.725 -0.165 1
1 235 . 7 1 1 A 21 21 SER HA H 81 4.390 4.430 -0.040 1
1 238 . 7 1 1 A 21 21 SER C C 81 174.600 175.688 -1.088 1
1 239 . 7 1 1 A 21 21 SER CA C 81 57.900 59.129 -1.229 1
1 240 . 7 1 1 A 21 21 SER CB C 81 64.700 63.921 0.779 1
1 241 . 7 1 1 A 21 21 SER N N 81 118.700 119.455 -0.755 1
1 242 . 7 1 1 A 22 22 VAL H H 82 8.690 8.700 -0.010 1
1 243 . 7 1 1 A 22 22 VAL HA H 82 3.700 3.652 0.048 1
1 251 . 7 1 1 A 22 22 VAL C C 82 178.000 177.273 0.727 1
1 252 . 7 1 1 A 22 22 VAL CA C 82 66.500 66.534 -0.034 1
1 253 . 7 1 1 A 22 22 VAL CB C 82 31.700 31.625 0.075 1
1 256 . 7 1 1 A 22 22 VAL N N 82 122.100 124.556 -2.456 1
1 257 . 7 1 1 A 23 23 SER H H 83 8.300 8.098 0.202 1
1 258 . 7 1 1 A 23 23 SER HA H 83 4.210 4.021 0.189 1
1 261 . 7 1 1 A 23 23 SER C C 83 177.600 175.992 1.608 1
1 262 . 7 1 1 A 23 23 SER CA C 83 61.400 62.145 -0.745 1
1 263 . 7 1 1 A 23 23 SER CB C 83 62.400 62.827 -0.427 1
1 264 . 7 1 1 A 23 23 SER N N 83 113.600 115.491 -1.891 1
1 265 . 7 1 1 A 24 24 GLN H H 84 7.820 7.902 -0.082 1
1 266 . 7 1 1 A 24 24 GLN HA H 84 3.970 3.881 0.089 1
1 273 . 7 1 1 A 24 24 GLN C C 84 178.400 177.898 0.502 1
1 274 . 7 1 1 A 24 24 GLN CA C 84 58.400 58.779 -0.379 1
1 275 . 7 1 1 A 24 24 GLN CB C 84 28.900 28.035 0.865 1
1 278 . 7 1 1 A 24 24 GLN N N 84 122.900 121.101 1.799 1
1 280 . 7 1 1 A 25 25 LEU H H 85 8.920 8.037 0.883 1
1 281 . 7 1 1 A 25 25 LEU HA H 85 4.130 4.285 -0.155 1
1 291 . 7 1 1 A 25 25 LEU C C 85 178.800 178.701 0.099 1
1 292 . 7 1 1 A 25 25 LEU CA C 85 58.300 57.644 0.656 1
1 293 . 7 1 1 A 25 25 LEU CB C 85 41.200 41.784 -0.584 1
1 297 . 7 1 1 A 25 25 LEU N N 85 122.200 121.054 1.146 1
1 298 . 7 1 1 A 26 26 ASN H H 86 8.860 9.228 -0.368 1
1 299 . 7 1 1 A 26 26 ASN HA H 86 4.420 4.352 0.068 1
1 304 . 7 1 1 A 26 26 ASN C C 86 179.000 177.905 1.095 1
1 305 . 7 1 1 A 26 26 ASN CA C 86 55.900 56.586 -0.686 1
1 306 . 7 1 1 A 26 26 ASN CB C 86 37.200 38.453 -1.253 1
1 308 . 7 1 1 A 26 26 ASN N N 86 117.600 117.571 0.029 1
1 310 . 7 1 1 A 27 27 SER H H 87 7.840 8.243 -0.403 1
1 311 . 7 1 1 A 27 27 SER HA H 87 4.100 3.897 0.203 1
1 314 . 7 1 1 A 27 27 SER C C 87 179.000 176.604 2.396 1
1 315 . 7 1 1 A 27 27 SER CA C 87 62.100 61.114 0.986 1
1 316 . 7 1 1 A 27 27 SER CB C 87 62.100 62.108 -0.008 1
1 317 . 7 1 1 A 27 27 SER N N 87 118.500 114.301 4.199 1
1 318 . 7 1 1 A 28 28 TYR H H 88 8.180 7.616 0.564 1
1 319 . 7 1 1 A 28 28 TYR HA H 88 4.600 4.371 0.229 1
1 326 . 7 1 1 A 28 28 TYR C C 88 174.800 178.170 -3.370 1
1 327 . 7 1 1 A 28 28 TYR CA C 88 61.200 61.812 -0.612 1
1 328 . 7 1 1 A 28 28 TYR CB C 88 37.800 38.498 -0.698 1
1 333 . 7 1 1 A 28 28 TYR N N 88 119.300 119.645 -0.345 1
1 334 . 7 1 1 A 29 29 LYS H H 89 9.040 8.376 0.664 1
1 335 . 7 1 1 A 29 29 LYS HA H 89 3.890 4.082 -0.192 1
1 344 . 7 1 1 A 29 29 LYS C C 89 179.000 178.453 0.547 1
1 345 . 7 1 1 A 29 29 LYS CA C 89 61.300 59.619 1.681 1
1 346 . 7 1 1 A 29 29 LYS CB C 89 32.800 31.948 0.852 1
1 350 . 7 1 1 A 29 29 LYS N N 89 119.300 120.344 -1.044 1
1 351 . 7 1 1 A 30 30 ASN H H 90 7.770 8.333 -0.563 1
1 352 . 7 1 1 A 30 30 ASN HA H 90 4.560 4.435 0.125 1
1 357 . 7 1 1 A 30 30 ASN C C 90 178.300 177.496 0.804 1
1 358 . 7 1 1 A 30 30 ASN CA C 90 56.200 56.368 -0.168 1
1 359 . 7 1 1 A 30 30 ASN CB C 90 38.900 39.032 -0.132 1
1 361 . 7 1 1 A 30 30 ASN N N 90 117.800 117.298 0.502 1
1 363 . 7 1 1 A 31 31 TYR H H 91 8.860 7.727 1.133 1
1 364 . 7 1 1 A 31 31 TYR HA H 91 4.910 4.546 0.364 1
1 371 . 7 1 1 A 31 31 TYR C C 91 178.300 178.277 0.023 1
1 372 . 7 1 1 A 31 31 TYR CA C 91 59.700 60.815 -1.115 1
1 373 . 7 1 1 A 31 31 TYR CB C 91 37.500 37.680 -0.180 1
1 378 . 7 1 1 A 31 31 TYR N N 91 119.400 117.902 1.498 1
1 379 . 7 1 1 A 32 32 CYS H H 92 8.640 8.068 0.572 1
1 380 . 7 1 1 A 32 32 CYS HA H 92 4.410 4.278 0.132 1
1 383 . 7 1 1 A 32 32 CYS C C 92 173.700 177.313 -3.613 1
1 384 . 7 1 1 A 32 32 CYS CA C 92 65.500 62.744 2.756 1
1 385 . 7 1 1 A 32 32 CYS CB C 92 28.300 26.548 1.752 1
1 386 . 7 1 1 A 32 32 CYS N N 92 113.500 119.575 -6.075 1
1 387 . 7 1 1 A 33 33 ARG H H 93 8.440 8.392 0.048 1
1 388 . 7 1 1 A 33 33 ARG HA H 93 3.740 4.117 -0.377 1
1 391 . 7 1 1 A 33 33 ARG C C 93 177.200 176.501 0.699 1
1 392 . 7 1 1 A 33 33 ARG CA C 93 58.300 58.218 0.082 1
1 393 . 7 1 1 A 33 33 ARG CB C 93 30.200 29.868 0.332 1
1 394 . 7 1 1 A 33 33 ARG N N 93 111.400 120.026 -8.626 1
1 395 . 7 1 1 A 34 34 ASN H H 94 8.020 8.040 -0.020 1
1 396 . 7 1 1 A 34 34 ASN HA H 94 4.980 4.838 0.142 1
1 401 . 7 1 1 A 34 34 ASN C C 94 176.700 176.873 -0.173 1
1 402 . 7 1 1 A 34 34 ASN CA C 94 53.400 54.370 -0.970 1
1 403 . 7 1 1 A 34 34 ASN CB C 94 38.000 40.148 -2.148 1
1 405 . 7 1 1 A 34 34 ASN N N 94 113.600 115.456 -1.856 1
1 407 . 7 1 1 A 35 35 HIS H H 95 7.200 8.095 -0.895 1
1 408 . 7 1 1 A 35 35 HIS HA H 95 4.470 4.496 -0.026 1
1 411 . 7 1 1 A 35 35 HIS C C 95 176.600 176.388 0.212 1
1 412 . 7 1 1 A 35 35 HIS CA C 95 60.000 58.719 1.281 1
1 413 . 7 1 1 A 35 35 HIS CB C 95 30.500 30.836 -0.336 1
1 414 . 7 1 1 A 35 35 HIS N N 95 115.600 116.682 -1.082 1
1 415 . 7 1 1 A 36 36 LEU H H 96 8.170 7.596 0.574 1
1 416 . 7 1 1 A 36 36 LEU HA H 96 4.730 4.454 0.276 1
1 426 . 7 1 1 A 36 36 LEU C C 96 176.800 177.606 -0.806 1
1 427 . 7 1 1 A 36 36 LEU CA C 96 54.400 54.762 -0.362 1
1 428 . 7 1 1 A 36 36 LEU CB C 96 40.600 42.137 -1.537 1
1 432 . 7 1 1 A 36 36 LEU N N 96 114.000 120.109 -6.109 1
1 433 . 7 1 1 A 37 37 SER H H 97 7.140 8.075 -0.935 1
1 434 . 7 1 1 A 37 37 SER HA H 97 4.730 4.302 0.428 1
1 437 . 7 1 1 A 37 37 SER CA C 97 62.700 63.508 -0.808 1
1 438 . 7 1 1 A 37 37 SER CB C 97 62.600 61.910 0.690 1
1 439 . 7 1 1 A 37 37 SER N N 97 117.200 116.279 0.921 1
1 440 . 7 1 1 A 38 38 PRO HA H 98 4.560 4.361 0.199 1
1 447 . 7 1 1 A 38 38 PRO C C 98 177.900 179.121 -1.221 1
1 448 . 7 1 1 A 38 38 PRO CA C 98 65.700 66.167 -0.467 1
1 449 . 7 1 1 A 38 38 PRO CB C 98 31.800 30.947 0.853 1
1 452 . 7 1 1 A 39 39 LEU H H 99 8.090 7.665 0.425 1
1 453 . 7 1 1 A 39 39 LEU HA H 99 4.260 4.065 0.195 1
1 463 . 7 1 1 A 39 39 LEU C C 99 178.700 178.740 -0.040 1
1 464 . 7 1 1 A 39 39 LEU CA C 99 54.300 57.353 -3.053 1
1 465 . 7 1 1 A 39 39 LEU CB C 99 42.400 41.400 1.000 1
1 469 . 7 1 1 A 39 39 LEU N N 99 112.400 117.022 -4.622 1
1 470 . 7 1 1 A 40 40 TYR H H 100 8.350 8.496 -0.146 1
1 471 . 7 1 1 A 40 40 TYR HA H 100 4.170 4.399 -0.229 1
1 478 . 7 1 1 A 40 40 TYR C C 100 178.300 176.790 1.510 1
1 479 . 7 1 1 A 40 40 TYR CA C 100 63.400 61.954 1.446 1
1 480 . 7 1 1 A 40 40 TYR CB C 100 38.600 39.152 -0.552 1
1 485 . 7 1 1 A 40 40 TYR N N 100 119.400 120.897 -1.497 1
1 486 . 7 1 1 A 41 41 MET H H 101 8.640 8.059 0.581 1
1 487 . 7 1 1 A 41 41 MET HA H 101 4.260 4.724 -0.464 1
1 488 . 7 1 1 A 41 41 MET C C 101 177.000 175.328 1.672 1
1 489 . 7 1 1 A 41 41 MET CA C 101 54.600 54.486 0.114 1
1 490 . 7 1 1 A 41 41 MET N N 101 111.800 116.093 -4.293 1
1 491 . 7 1 1 A 42 42 LYS H H 102 7.880 7.922 -0.042 1
1 492 . 7 1 1 A 42 42 LYS HA H 102 4.430 4.651 -0.221 1
1 501 . 7 1 1 A 42 42 LYS C C 102 176.300 176.398 -0.098 1
1 502 . 7 1 1 A 42 42 LYS CA C 102 56.000 54.946 1.054 1
1 503 . 7 1 1 A 42 42 LYS CB C 102 33.400 33.941 -0.541 1
1 507 . 7 1 1 A 42 42 LYS N N 102 121.700 120.234 1.466 1
1 508 . 7 1 1 A 43 43 SER H H 103 9.160 8.931 0.229 1
1 509 . 7 1 1 A 43 43 SER HA H 103 4.620 4.605 0.015 1
1 513 . 7 1 1 A 43 43 SER C C 103 176.300 175.737 0.563 1
1 514 . 7 1 1 A 43 43 SER CA C 103 58.700 58.890 -0.190 1
1 515 . 7 1 1 A 43 43 SER CB C 103 63.700 63.959 -0.259 1
1 516 . 7 1 1 A 43 43 SER N N 103 118.800 119.629 -0.829 1
1 517 . 7 1 1 A 44 44 LEU H H 104 8.860 9.294 -0.434 1
1 518 . 7 1 1 A 44 44 LEU HA H 104 4.130 4.209 -0.079 1
1 528 . 7 1 1 A 44 44 LEU C C 104 178.700 178.454 0.246 1
1 529 . 7 1 1 A 44 44 LEU CA C 104 58.800 57.923 0.877 1
1 530 . 7 1 1 A 44 44 LEU CB C 104 42.600 41.485 1.115 1
1 534 . 7 1 1 A 44 44 LEU N N 104 124.200 126.251 -2.051 1
1 535 . 7 1 1 A 45 45 SER H H 105 8.330 8.195 0.135 1
1 536 . 7 1 1 A 45 45 SER HA H 105 4.310 4.377 -0.067 1
1 539 . 7 1 1 A 45 45 SER C C 105 175.000 175.177 -0.177 1
1 540 . 7 1 1 A 45 45 SER CA C 105 60.100 60.150 -0.050 1
1 541 . 7 1 1 A 45 45 SER CB C 105 63.400 63.427 -0.027 1
1 542 . 7 1 1 A 45 45 SER N N 105 107.700 113.378 -5.678 1
1 543 . 7 1 1 A 46 46 GLU H H 106 7.800 8.295 -0.495 1
1 544 . 7 1 1 A 46 46 GLU HA H 106 4.570 4.457 0.113 1
1 549 . 7 1 1 A 46 46 GLU C C 106 174.100 175.640 -1.540 1
1 550 . 7 1 1 A 46 46 GLU CA C 106 55.600 55.952 -0.352 1
1 551 . 7 1 1 A 46 46 GLU CB C 106 31.200 30.641 0.559 1
1 553 . 7 1 1 A 46 46 GLU N N 106 119.600 119.448 0.152 1
1 554 . 7 1 1 A 47 47 ILE H H 107 7.100 7.084 0.016 1
1 555 . 7 1 1 A 47 47 ILE HA H 107 4.040 4.235 -0.195 1
1 565 . 7 1 1 A 47 47 ILE C C 107 174.100 175.069 -0.969 1
1 566 . 7 1 1 A 47 47 ILE CA C 107 62.300 60.786 1.514 1
1 567 . 7 1 1 A 47 47 ILE CB C 107 38.500 37.877 0.623 1
1 571 . 7 1 1 A 47 47 ILE N N 107 120.600 121.705 -1.105 1
1 572 . 7 1 1 A 48 48 LEU H H 108 9.180 8.858 0.322 1
1 573 . 7 1 1 A 48 48 LEU HA H 108 4.940 4.720 0.220 1
1 583 . 7 1 1 A 48 48 LEU CA C 108 51.900 51.736 0.164 1
1 584 . 7 1 1 A 48 48 LEU CB C 108 42.000 41.902 0.098 1
1 588 . 7 1 1 A 48 48 LEU N N 108 129.400 128.917 0.483 1
1 589 . 7 1 1 A 49 49 PRO HA H 109 3.910 4.259 -0.349 1
1 596 . 7 1 1 A 49 49 PRO C C 109 178.500 177.903 0.597 1
1 597 . 7 1 1 A 49 49 PRO CA C 109 66.600 64.968 1.632 1
1 598 . 7 1 1 A 49 49 PRO CB C 109 31.300 31.675 -0.375 1
1 601 . 7 1 1 A 50 50 ALA H H 110 8.280 8.136 0.144 1
1 602 . 7 1 1 A 50 50 ALA HA H 110 4.110 4.117 -0.007 1
1 606 . 7 1 1 A 50 50 ALA C C 110 179.700 179.520 0.180 1
1 607 . 7 1 1 A 50 50 ALA CA C 110 55.100 54.399 0.701 1
1 608 . 7 1 1 A 50 50 ALA CB C 110 19.200 18.376 0.824 1
1 609 . 7 1 1 A 50 50 ALA N N 110 116.100 119.220 -3.120 1
1 610 . 7 1 1 A 51 51 ASP H H 111 7.790 7.895 -0.105 1
1 611 . 7 1 1 A 51 51 ASP HA H 111 4.440 4.439 0.001 1
1 614 . 7 1 1 A 51 51 ASP C C 111 178.200 178.672 -0.472 1
1 615 . 7 1 1 A 51 51 ASP CA C 111 57.600 57.279 0.321 1
1 616 . 7 1 1 A 51 51 ASP CB C 111 41.800 41.048 0.752 1
1 617 . 7 1 1 A 51 51 ASP N N 111 116.500 118.210 -1.710 1
1 618 . 7 1 1 A 52 52 ILE H H 112 7.020 7.606 -0.586 1
1 619 . 7 1 1 A 52 52 ILE HA H 112 3.750 3.671 0.079 1
1 629 . 7 1 1 A 52 52 ILE C C 112 177.300 177.704 -0.404 1
1 630 . 7 1 1 A 52 52 ILE CA C 112 63.500 65.052 -1.552 1
1 631 . 7 1 1 A 52 52 ILE CB C 112 37.500 36.998 0.502 1
1 635 . 7 1 1 A 52 52 ILE N N 112 116.700 119.489 -2.789 1
1 636 . 7 1 1 A 53 53 GLN H H 113 9.150 8.199 0.951 1
1 637 . 7 1 1 A 53 53 GLN HA H 113 3.720 3.972 -0.252 1
1 644 . 7 1 1 A 53 53 GLN C C 113 177.500 178.262 -0.762 1
1 645 . 7 1 1 A 53 53 GLN CA C 113 58.200 58.921 -0.721 1
1 646 . 7 1 1 A 53 53 GLN CB C 113 30.200 28.779 1.421 1
1 649 . 7 1 1 A 53 53 GLN N N 113 121.200 121.368 -0.168 1
1 651 . 7 1 1 A 54 54 SER H H 114 8.150 8.385 -0.235 1
1 652 . 7 1 1 A 54 54 SER HA H 114 4.180 4.196 -0.016 1
1 655 . 7 1 1 A 54 54 SER C C 114 175.900 177.709 -1.809 1
1 656 . 7 1 1 A 54 54 SER CA C 114 62.100 61.446 0.654 1
1 657 . 7 1 1 A 54 54 SER CB C 114 62.800 62.797 0.003 1
1 658 . 7 1 1 A 54 54 SER N N 114 112.200 115.511 -3.311 1
1 659 . 7 1 1 A 55 55 ILE H H 115 6.760 7.566 -0.806 1
1 660 . 7 1 1 A 55 55 ILE HA H 115 3.860 3.678 0.182 1
1 670 . 7 1 1 A 55 55 ILE C C 115 179.200 178.334 0.866 1
1 671 . 7 1 1 A 55 55 ILE CA C 115 64.700 64.528 0.172 1
1 672 . 7 1 1 A 55 55 ILE CB C 115 38.900 37.934 0.966 1
1 676 . 7 1 1 A 55 55 ILE N N 115 119.500 122.915 -3.415 1
1 677 . 7 1 1 A 56 56 ILE H H 116 7.750 7.928 -0.178 1
1 678 . 7 1 1 A 56 56 ILE HA H 116 3.690 3.578 0.112 1
1 688 . 7 1 1 A 56 56 ILE C C 116 176.900 178.208 -1.308 1
1 689 . 7 1 1 A 56 56 ILE CA C 116 62.800 64.959 -2.159 1
1 690 . 7 1 1 A 56 56 ILE CB C 116 36.200 37.511 -1.311 1
1 694 . 7 1 1 A 56 56 ILE N N 116 120.200 120.978 -0.778 1
1 695 . 7 1 1 A 57 57 ASN H H 117 8.690 7.895 0.795 1
1 696 . 7 1 1 A 57 57 ASN HA H 117 4.440 4.467 -0.027 1
1 701 . 7 1 1 A 57 57 ASN C C 117 177.200 177.183 0.017 1
1 702 . 7 1 1 A 57 57 ASN CA C 117 54.800 55.878 -1.078 1
1 703 . 7 1 1 A 57 57 ASN CB C 117 38.100 38.457 -0.357 1
1 705 . 7 1 1 A 57 57 ASN N N 117 117.000 120.199 -3.199 1
1 707 . 7 1 1 A 58 58 GLU H H 118 7.630 8.356 -0.726 1
1 708 . 7 1 1 A 58 58 GLU HA H 118 4.450 4.376 0.074 1
1 713 . 7 1 1 A 58 58 GLU C C 118 176.500 176.519 -0.019 1
1 714 . 7 1 1 A 58 58 GLU CA C 118 56.200 57.080 -0.880 1
1 715 . 7 1 1 A 58 58 GLU CB C 118 30.200 29.242 0.958 1
1 717 . 7 1 1 A 58 58 GLU N N 118 116.300 115.074 1.226 1
1 718 . 7 1 1 A 59 59 THR H H 119 7.540 7.304 0.236 1
1 719 . 7 1 1 A 59 59 THR HA H 119 4.230 4.387 -0.157 1
1 724 . 7 1 1 A 59 59 THR C C 119 174.200 174.542 -0.342 1
1 725 . 7 1 1 A 59 59 THR CA C 119 63.800 63.476 0.324 1
1 726 . 7 1 1 A 59 59 THR CB C 119 68.900 68.770 0.130 1
1 728 . 7 1 1 A 59 59 THR N N 119 117.600 116.901 0.699 1
1 729 . 7 1 1 A 60 60 LYS H H 120 8.860 8.714 0.146 1
1 730 . 7 1 1 A 60 60 LYS HA H 120 4.490 4.533 -0.043 1
1 739 . 7 1 1 A 60 60 LYS C C 120 175.800 175.815 -0.015 1
1 740 . 7 1 1 A 60 60 LYS CA C 120 54.900 55.439 -0.539 1
1 741 . 7 1 1 A 60 60 LYS CB C 120 29.800 32.334 -2.534 1
1 745 . 7 1 1 A 60 60 LYS N N 120 128.500 125.288 3.212 1
1 746 . 7 1 1 A 61 61 LEU H H 121 7.150 7.410 -0.260 1
1 747 . 7 1 1 A 61 61 LEU HA H 121 4.710 4.730 -0.020 1
1 757 . 7 1 1 A 61 61 LEU C C 121 175.000 176.408 -1.408 1
1 758 . 7 1 1 A 61 61 LEU CA C 121 52.800 53.644 -0.844 1
1 759 . 7 1 1 A 61 61 LEU CB C 121 46.400 42.890 3.510 1
1 763 . 7 1 1 A 61 61 LEU N N 121 120.700 121.556 -0.856 1
1 764 . 7 1 1 A 62 62 ALA H H 122 8.000 8.620 -0.620 1
1 765 . 7 1 1 A 62 62 ALA HA H 122 4.250 4.476 -0.226 1
1 769 . 7 1 1 A 62 62 ALA CA C 122 52.100 51.761 0.339 1
1 770 . 7 1 1 A 62 62 ALA CB C 122 19.500 20.062 -0.562 1
1 771 . 7 1 1 A 62 62 ALA N N 122 119.900 122.914 -3.014 1
1 772 . 7 1 1 A 63 63 LYS H H 123 8.770 8.892 -0.122 1
1 773 . 7 1 1 A 63 63 LYS HA H 123 3.800 3.921 -0.121 1
1 782 . 7 1 1 A 63 63 LYS C C 123 178.300 178.254 0.046 1
1 783 . 7 1 1 A 63 63 LYS CA C 123 60.700 60.180 0.520 1
1 784 . 7 1 1 A 63 63 LYS CB C 123 32.300 32.056 0.244 1
1 788 . 7 1 1 A 63 63 LYS N N 123 121.400 120.882 0.518 1
1 789 . 7 1 1 A 64 64 ASN H H 124 9.020 8.623 0.397 1
1 790 . 7 1 1 A 64 64 ASN HA H 124 4.430 4.426 0.004 1
1 795 . 7 1 1 A 64 64 ASN C C 124 178.300 177.344 0.956 1
1 796 . 7 1 1 A 64 64 ASN CA C 124 56.200 55.794 0.406 1
1 797 . 7 1 1 A 64 64 ASN CB C 124 37.300 37.332 -0.032 1
1 799 . 7 1 1 A 64 64 ASN N N 124 115.000 114.753 0.247 1
1 801 . 7 1 1 A 65 65 THR H H 125 7.620 8.034 -0.414 1
1 802 . 7 1 1 A 65 65 THR HA H 125 4.030 4.011 0.019 1
1 807 . 7 1 1 A 65 65 THR C C 125 175.500 176.618 -1.118 1
1 808 . 7 1 1 A 65 65 THR CA C 125 66.000 66.943 -0.943 1
1 809 . 7 1 1 A 65 65 THR CB C 125 67.600 68.060 -0.460 1
1 811 . 7 1 1 A 65 65 THR N N 125 119.800 116.530 3.270 1
1 812 . 7 1 1 A 66 66 LEU H H 126 8.020 8.187 -0.167 1
1 813 . 7 1 1 A 66 66 LEU HA H 126 3.790 3.757 0.033 1
1 823 . 7 1 1 A 66 66 LEU C C 126 179.200 179.977 -0.777 1
1 824 . 7 1 1 A 66 66 LEU CA C 126 58.700 58.179 0.521 1
1 825 . 7 1 1 A 66 66 LEU CB C 126 41.300 41.594 -0.294 1
1 829 . 7 1 1 A 66 66 LEU N N 126 121.200 121.170 0.030 1
1 830 . 7 1 1 A 67 67 LYS H H 127 8.380 8.052 0.328 1
1 831 . 7 1 1 A 67 67 LYS HA H 127 3.740 4.077 -0.337 1
1 840 . 7 1 1 A 67 67 LYS C C 127 178.300 178.759 -0.459 1
1 841 . 7 1 1 A 67 67 LYS CA C 127 60.100 58.531 1.569 1
1 842 . 7 1 1 A 67 67 LYS CB C 127 32.400 31.600 0.800 1
1 846 . 7 1 1 A 67 67 LYS N N 127 117.000 118.172 -1.172 1
1 847 . 7 1 1 A 68 68 ALA H H 128 7.480 7.947 -0.467 1
1 848 . 7 1 1 A 68 68 ALA HA H 128 4.210 4.085 0.125 1
1 852 . 7 1 1 A 68 68 ALA C C 128 181.200 179.984 1.216 1
1 853 . 7 1 1 A 68 68 ALA CA C 128 55.200 54.928 0.272 1
1 854 . 7 1 1 A 68 68 ALA CB C 128 18.600 18.219 0.381 1
1 855 . 7 1 1 A 68 68 ALA N N 128 122.900 122.248 0.652 1
1 856 . 7 1 1 A 69 69 ILE H H 129 8.250 7.425 0.825 1
1 857 . 7 1 1 A 69 69 ILE HA H 129 3.130 3.420 -0.290 1
1 867 . 7 1 1 A 69 69 ILE C C 129 177.400 177.789 -0.389 1
1 868 . 7 1 1 A 69 69 ILE CA C 129 66.700 65.205 1.495 1
1 869 . 7 1 1 A 69 69 ILE CB C 129 37.900 37.350 0.550 1
1 873 . 7 1 1 A 69 69 ILE N N 129 122.800 118.773 4.027 1
1 874 . 7 1 1 A 70 70 ARG H H 130 8.040 7.825 0.215 1
1 875 . 7 1 1 A 70 70 ARG HA H 130 3.620 3.859 -0.239 1
1 882 . 7 1 1 A 70 70 ARG C C 130 177.800 178.905 -1.105 1
1 883 . 7 1 1 A 70 70 ARG CA C 130 60.700 59.950 0.750 1
1 884 . 7 1 1 A 70 70 ARG CB C 130 29.600 29.885 -0.285 1
1 887 . 7 1 1 A 70 70 ARG N N 130 119.700 120.896 -1.196 1
1 888 . 7 1 1 A 71 71 ASN H H 131 8.920 8.534 0.386 1
1 889 . 7 1 1 A 71 71 ASN HA H 131 4.430 4.533 -0.103 1
1 894 . 7 1 1 A 71 71 ASN C C 131 177.500 178.264 -0.764 1
1 895 . 7 1 1 A 71 71 ASN CA C 131 56.100 56.190 -0.090 1
1 896 . 7 1 1 A 71 71 ASN CB C 131 38.600 38.763 -0.163 1
1 898 . 7 1 1 A 71 71 ASN N N 131 117.200 117.775 -0.575 1
1 900 . 7 1 1 A 72 72 THR H H 132 8.300 8.513 -0.213 1
1 901 . 7 1 1 A 72 72 THR HA H 132 4.430 4.013 0.417 1
1 906 . 7 1 1 A 72 72 THR C C 132 175.100 176.869 -1.769 1
1 907 . 7 1 1 A 72 72 THR CA C 132 68.200 66.681 1.519 1
1 908 . 7 1 1 A 72 72 THR CB C 132 68.500 69.171 -0.671 1
1 910 . 7 1 1 A 72 72 THR N N 132 119.200 116.547 2.653 1
1 911 . 7 1 1 A 73 73 ALA H H 133 7.950 8.522 -0.572 1
1 912 . 7 1 1 A 73 73 ALA HA H 133 4.040 4.058 -0.018 1
1 916 . 7 1 1 A 73 73 ALA C C 133 178.200 179.837 -1.637 1
1 917 . 7 1 1 A 73 73 ALA CA C 133 55.900 55.323 0.577 1
1 918 . 7 1 1 A 73 73 ALA CB C 133 16.700 18.053 -1.353 1
1 919 . 7 1 1 A 73 73 ALA N N 133 120.900 123.821 -2.921 1
1 920 . 7 1 1 A 74 74 SER H H 134 8.440 7.802 0.638 1
1 921 . 7 1 1 A 74 74 SER HA H 134 4.430 4.259 0.171 1
1 924 . 7 1 1 A 74 74 SER C C 134 178.800 177.482 1.318 1
1 925 . 7 1 1 A 74 74 SER CA C 134 61.300 61.521 -0.221 1
1 926 . 7 1 1 A 74 74 SER CB C 134 62.600 62.952 -0.352 1
1 927 . 7 1 1 A 74 74 SER N N 134 110.100 113.655 -3.555 1
1 928 . 7 1 1 A 75 75 GLN H H 135 8.340 7.764 0.576 1
1 929 . 7 1 1 A 75 75 GLN HA H 135 3.880 4.047 -0.167 1
1 936 . 7 1 1 A 75 75 GLN C C 135 178.800 178.709 0.091 1
1 937 . 7 1 1 A 75 75 GLN CA C 135 59.600 58.888 0.712 1
1 938 . 7 1 1 A 75 75 GLN CB C 135 29.900 28.234 1.666 1
1 941 . 7 1 1 A 75 75 GLN N N 135 118.100 120.711 -2.611 1
1 943 . 7 1 1 A 76 76 ILE H H 136 7.670 7.210 0.460 1
1 944 . 7 1 1 A 76 76 ILE HA H 136 3.200 3.242 -0.042 1
1 954 . 7 1 1 A 76 76 ILE C C 136 177.500 177.635 -0.135 1
1 955 . 7 1 1 A 76 76 ILE CA C 136 66.100 65.066 1.034 1
1 956 . 7 1 1 A 76 76 ILE CB C 136 37.400 37.174 0.226 1
1 960 . 7 1 1 A 76 76 ILE N N 136 122.500 119.927 2.573 1
1 961 . 7 1 1 A 77 77 PHE H H 137 7.930 7.813 0.117 1
1 962 . 7 1 1 A 77 77 PHE HA H 137 3.890 4.076 -0.186 1
1 969 . 7 1 1 A 77 77 PHE C C 137 178.200 178.302 -0.102 1
1 970 . 7 1 1 A 77 77 PHE CA C 137 63.600 60.239 3.361 1
1 971 . 7 1 1 A 77 77 PHE CB C 137 39.300 38.460 0.840 1
1 976 . 7 1 1 A 77 77 PHE N N 137 116.100 118.446 -2.346 1
1 977 . 7 1 1 A 78 78 ARG H H 138 8.900 8.320 0.580 1
1 978 . 7 1 1 A 78 78 ARG HA H 138 3.910 3.971 -0.061 1
1 986 . 7 1 1 A 78 78 ARG C C 138 178.300 178.850 -0.550 1
1 987 . 7 1 1 A 78 78 ARG CA C 138 60.100 59.230 0.870 1
1 988 . 7 1 1 A 78 78 ARG CB C 138 29.600 29.847 -0.247 1
1 991 . 7 1 1 A 78 78 ARG N N 138 118.600 119.900 -1.300 1
1 993 . 7 1 1 A 79 79 LEU H H 139 7.730 7.714 0.016 1
1 994 . 7 1 1 A 79 79 LEU HA H 139 4.280 4.055 0.225 1
1 1004 . 7 1 1 A 79 79 LEU C C 139 179.000 178.309 0.691 1
1 1005 . 7 1 1 A 79 79 LEU CA C 139 57.800 57.616 0.184 1
1 1006 . 7 1 1 A 79 79 LEU CB C 139 41.900 41.455 0.445 1
1 1010 . 7 1 1 A 79 79 LEU N N 139 121.900 121.283 0.617 1
1 1011 . 7 1 1 A 80 80 ALA H H 140 7.590 7.201 0.389 1
1 1012 . 7 1 1 A 80 80 ALA HA H 140 2.710 2.799 -0.089 1
1 1016 . 7 1 1 A 80 80 ALA C C 140 179.900 179.979 -0.079 1
1 1017 . 7 1 1 A 80 80 ALA CA C 140 55.100 54.298 0.802 1
1 1018 . 7 1 1 A 80 80 ALA CB C 140 17.600 17.364 0.236 1
1 1019 . 7 1 1 A 80 80 ALA N N 140 123.400 120.211 3.189 1
1 1020 . 7 1 1 A 81 81 ILE H H 141 8.910 7.660 1.250 1
1 1021 . 7 1 1 A 81 81 ILE HA H 141 4.110 3.875 0.235 1
1 1031 . 7 1 1 A 81 81 ILE C C 141 181.700 177.842 3.858 1
1 1032 . 7 1 1 A 81 81 ILE CA C 141 64.800 65.334 -0.534 1
1 1033 . 7 1 1 A 81 81 ILE CB C 141 38.600 37.644 0.956 1
1 1037 . 7 1 1 A 81 81 ILE N N 141 122.400 118.747 3.653 1
1 1038 . 7 1 1 A 82 82 GLU H H 142 8.560 8.391 0.169 1
1 1039 . 7 1 1 A 82 82 GLU HA H 142 4.100 4.083 0.017 1
1 1044 . 7 1 1 A 82 82 GLU C C 142 177.700 178.095 -0.395 1
1 1045 . 7 1 1 A 82 82 GLU CA C 142 59.100 59.691 -0.591 1
1 1046 . 7 1 1 A 82 82 GLU CB C 142 29.200 29.214 -0.014 1
1 1048 . 7 1 1 A 82 82 GLU N N 142 123.200 120.507 2.693 1
1 1049 . 7 1 1 A 83 83 ASN H H 143 7.310 7.515 -0.205 1
1 1050 . 7 1 1 A 83 83 ASN HA H 143 4.750 4.922 -0.172 1
1 1055 . 7 1 1 A 83 83 ASN C C 143 173.200 174.733 -1.533 1
1 1056 . 7 1 1 A 83 83 ASN CA C 143 54.200 53.052 1.148 1
1 1057 . 7 1 1 A 83 83 ASN CB C 143 41.300 38.725 2.575 1
1 1059 . 7 1 1 A 83 83 ASN N N 143 114.900 115.319 -0.419 1
1 1061 . 7 1 1 A 84 84 ARG H H 144 8.320 8.051 0.269 1
1 1062 . 7 1 1 A 84 84 ARG HA H 144 4.120 4.007 0.113 1
1 1069 . 7 1 1 A 84 84 ARG C C 144 175.300 176.159 -0.859 1
1 1070 . 7 1 1 A 84 84 ARG CA C 144 57.100 56.988 0.112 1
1 1071 . 7 1 1 A 84 84 ARG CB C 144 26.000 28.028 -2.028 1
1 1074 . 7 1 1 A 84 84 ARG N N 144 114.400 117.524 -3.124 1
1 1075 . 7 1 1 A 85 85 ALA H H 145 8.350 8.435 -0.085 1
1 1076 . 7 1 1 A 85 85 ALA HA H 145 4.320 4.357 -0.037 1
1 1080 . 7 1 1 A 85 85 ALA C C 145 176.500 177.470 -0.970 1
1 1081 . 7 1 1 A 85 85 ALA CA C 145 53.400 53.367 0.033 1
1 1082 . 7 1 1 A 85 85 ALA CB C 145 19.900 19.910 -0.010 1
1 1083 . 7 1 1 A 85 85 ALA N N 145 120.600 120.313 0.287 1
1 1084 . 7 1 1 A 86 86 ILE H H 146 7.290 7.204 0.086 1
1 1085 . 7 1 1 A 86 86 ILE HA H 146 4.400 4.626 -0.226 1
1 1095 . 7 1 1 A 86 86 ILE C C 146 173.600 174.136 -0.536 1
1 1096 . 7 1 1 A 86 86 ILE CA C 146 59.200 60.168 -0.968 1
1 1097 . 7 1 1 A 86 86 ILE CB C 146 41.600 41.717 -0.117 1
1 1101 . 7 1 1 A 86 86 ILE N N 146 111.500 115.805 -4.305 1
1 1102 . 7 1 1 A 87 87 ASP H H 147 8.270 8.852 -0.582 1
1 1103 . 7 1 1 A 87 87 ASP HA H 147 4.940 4.923 0.017 1
1 1106 . 7 1 1 A 87 87 ASP C C 147 174.700 175.332 -0.632 1
1 1107 . 7 1 1 A 87 87 ASP CA C 147 53.700 53.274 0.426 1
1 1108 . 7 1 1 A 87 87 ASP CB C 147 41.800 41.331 0.469 1
1 1109 . 7 1 1 A 87 87 ASP N N 147 119.400 128.452 -9.052 1
1 1110 . 7 1 1 A 88 88 PHE H H 148 7.230 7.667 -0.437 1
1 1111 . 7 1 1 A 88 88 PHE HA H 148 4.690 4.891 -0.201 1
1 1119 . 7 1 1 A 88 88 PHE C C 148 171.500 172.950 -1.450 1
1 1120 . 7 1 1 A 88 88 PHE CA C 148 56.400 56.459 -0.059 1
1 1121 . 7 1 1 A 88 88 PHE CB C 148 42.000 42.609 -0.609 1
1 1127 . 7 1 1 A 88 88 PHE N N 148 119.700 121.033 -1.333 1
1 1128 . 7 1 1 A 89 89 ASN H H 149 8.060 8.240 -0.180 1
1 1129 . 7 1 1 A 89 89 ASN HA H 149 4.490 4.968 -0.478 1
1 1134 . 7 1 1 A 89 89 ASN CA C 149 48.100 48.737 -0.637 1
1 1135 . 7 1 1 A 89 89 ASN CB C 149 39.200 39.676 -0.476 1
1 1137 . 7 1 1 A 89 89 ASN N N 149 119.700 125.220 -5.520 1
1 1139 . 7 1 1 A 90 90 PRO HA H 150 3.970 4.301 -0.331 1
1 1146 . 7 1 1 A 90 90 PRO C C 150 177.700 177.493 0.207 1
1 1147 . 7 1 1 A 90 90 PRO CA C 150 63.900 64.466 -0.566 1
1 1148 . 7 1 1 A 90 90 PRO CB C 150 31.700 31.607 0.093 1
1 1151 . 7 1 1 A 91 91 ALA H H 151 7.240 7.861 -0.621 1
1 1152 . 7 1 1 A 91 91 ALA HA H 151 3.900 4.114 -0.214 1
1 1156 . 7 1 1 A 91 91 ALA C C 151 178.000 179.472 -1.472 1
1 1157 . 7 1 1 A 91 91 ALA CA C 151 53.900 54.145 -0.245 1
1 1158 . 7 1 1 A 91 91 ALA CB C 151 17.700 18.431 -0.731 1
1 1159 . 7 1 1 A 91 91 ALA N N 151 115.700 118.980 -3.280 1
1 1160 . 7 1 1 A 92 92 ASP H H 152 7.080 7.910 -0.830 1
1 1161 . 7 1 1 A 92 92 ASP HA H 152 4.220 4.256 -0.036 1
1 1164 . 7 1 1 A 92 92 ASP C C 152 176.200 177.250 -1.050 1
1 1165 . 7 1 1 A 92 92 ASP CA C 152 55.800 56.859 -1.059 1
1 1166 . 7 1 1 A 92 92 ASP CB C 152 39.500 40.473 -0.973 1
1 1167 . 7 1 1 A 92 92 ASP N N 152 117.100 119.519 -2.419 1
1 1168 . 7 1 1 A 93 93 TYR H H 153 7.060 7.448 -0.388 1
1 1169 . 7 1 1 A 93 93 TYR HA H 153 4.490 4.495 -0.005 1
1 1176 . 7 1 1 A 93 93 TYR C C 153 174.700 175.882 -1.182 1
1 1177 . 7 1 1 A 93 93 TYR CA C 153 57.600 58.867 -1.267 1
1 1178 . 7 1 1 A 93 93 TYR CB C 153 38.500 38.428 0.072 1
1 1183 . 7 1 1 A 93 93 TYR N N 153 116.800 116.333 0.467 1
1 1184 . 7 1 1 A 94 94 VAL H H 154 7.000 7.163 -0.163 1
1 1185 . 7 1 1 A 94 94 VAL HA H 154 4.040 4.074 -0.034 1
1 1193 . 7 1 1 A 94 94 VAL C C 154 174.700 175.154 -0.454 1
1 1194 . 7 1 1 A 94 94 VAL CA C 154 62.100 62.659 -0.559 1
1 1195 . 7 1 1 A 94 94 VAL CB C 154 32.700 31.551 1.149 1
1 1198 . 7 1 1 A 94 94 VAL N N 154 120.600 120.975 -0.375 1
1 1199 . 7 1 1 A 95 95 ARG H H 155 9.430 8.756 0.674 1
1 1200 . 7 1 1 A 95 95 ARG HA H 155 4.640 4.591 0.049 1
1 1207 . 7 1 1 A 95 95 ARG C C 155 175.400 175.518 -0.118 1
1 1208 . 7 1 1 A 95 95 ARG CA C 155 54.200 55.637 -1.437 1
1 1209 . 7 1 1 A 95 95 ARG CB C 155 32.400 31.646 0.754 1
1 1212 . 7 1 1 A 95 95 ARG N N 155 128.200 127.248 0.952 1
1 1213 . 7 1 1 A 96 96 ILE H H 156 8.700 8.578 0.122 1
1 1214 . 7 1 1 A 96 96 ILE HA H 156 4.440 4.605 -0.165 1
1 1224 . 7 1 1 A 96 96 ILE CA C 156 56.500 57.888 -1.388 1
1 1225 . 7 1 1 A 96 96 ILE CB C 156 36.700 38.429 -1.729 1
1 1229 . 7 1 1 A 96 96 ILE N N 156 124.100 124.092 0.008 1
1 1230 . 7 1 1 A 97 97 PRO HA H 157 4.370 4.700 -0.330 1
1 1237 . 7 1 1 A 97 97 PRO C C 157 176.000 176.892 -0.892 1
1 1238 . 7 1 1 A 97 97 PRO CA C 157 63.200 63.035 0.165 1
1 1239 . 7 1 1 A 97 97 PRO CB C 157 32.400 33.034 -0.634 1
1 1242 . 7 1 1 A 98 98 LYS H H 158 8.380 8.920 -0.540 1
1 1243 . 7 1 1 A 98 98 LYS HA H 158 4.190 4.492 -0.302 1
1 1252 . 7 1 1 A 98 98 LYS C C 158 176.800 175.944 0.856 1
1 1253 . 7 1 1 A 98 98 LYS CA C 158 57.100 56.413 0.687 1
1 1254 . 7 1 1 A 98 98 LYS CB C 158 32.800 34.205 -1.405 1
1 1258 . 7 1 1 A 98 98 LYS N N 158 120.800 118.456 2.344 1
1 1259 . 7 1 1 A 99 99 ILE H H 159 7.930 7.572 0.358 1
1 1260 . 7 1 1 A 99 99 ILE HA H 159 4.200 4.643 -0.443 1
1 1270 . 7 1 1 A 99 99 ILE C C 159 175.400 175.660 -0.260 1
1 1271 . 7 1 1 A 99 99 ILE CA C 159 60.600 59.383 1.217 1
1 1272 . 7 1 1 A 99 99 ILE CB C 159 39.100 41.086 -1.986 1
1 1276 . 7 1 1 A 99 99 ILE N N 159 120.200 119.517 0.683 1
1 1277 . 7 1 1 A 100 100 ALA H H 160 8.370 8.674 -0.304 1
1 1278 . 7 1 1 A 100 100 ALA HA H 160 4.370 4.374 -0.004 1
1 1282 . 7 1 1 A 100 100 ALA C C 160 177.200 177.283 -0.083 1
1 1283 . 7 1 1 A 100 100 ALA CA C 160 52.200 52.718 -0.518 1
1 1284 . 7 1 1 A 100 100 ALA CB C 160 19.400 18.934 0.466 1
1 1285 . 7 1 1 A 100 100 ALA N N 160 128.300 129.371 -1.071 1
1 1286 . 7 1 1 A 101 101 LEU H H 161 8.250 8.588 -0.338 1
1 1287 . 7 1 1 A 101 101 LEU HA H 161 4.280 4.711 -0.431 1
1 1297 . 7 1 1 A 101 101 LEU C C 161 177.200 176.867 0.333 1
1 1298 . 7 1 1 A 101 101 LEU CA C 161 55.200 53.841 1.359 1
1 1299 . 7 1 1 A 101 101 LEU CB C 161 42.400 43.005 -0.605 1
1 1303 . 7 1 1 A 101 101 LEU N N 161 121.900 124.360 -2.460 1
1 1304 . 7 1 1 A 102 102 GLU H H 162 8.390 8.952 -0.562 1
1 1305 . 7 1 1 A 102 102 GLU HA H 162 4.230 4.016 0.214 1
1 1310 . 7 1 1 A 102 102 GLU C C 162 176.100 175.029 1.071 1
1 1311 . 7 1 1 A 102 102 GLU CA C 162 56.400 58.037 -1.637 1
1 1312 . 7 1 1 A 102 102 GLU CB C 162 30.500 28.114 2.386 1
1 1314 . 7 1 1 A 102 102 GLU N N 162 121.300 116.881 4.419 1
1 1315 . 7 1 1 A 103 103 HIS H H 163 8.330 7.994 0.336 1
1 1316 . 7 1 1 A 103 103 HIS HA H 163 4.590 4.924 -0.334 1
1 1319 . 7 1 1 A 103 103 HIS C C 163 176.100 173.710 2.390 1
1 1320 . 7 1 1 A 103 103 HIS CA C 163 56.000 54.395 1.605 1
1 1321 . 7 1 1 A 103 103 HIS CB C 163 30.500 30.657 -0.157 1
1 1322 . 7 1 1 A 103 103 HIS N N 163 120.000 119.958 0.042 1
1 1323 . 7 1 1 A 107 107 HIS HA H 167 4.620 4.601 0.019 1
1 1326 . 7 1 1 A 107 107 HIS C C 167 173.900 173.865 0.035 1
1 1327 . 7 1 1 A 107 107 HIS CA C 167 56.000 56.126 -0.126 1
1 1328 . 7 1 1 A 107 107 HIS CB C 167 30.300 29.356 0.944 1
1 15 . 8 1 1 A 2 2 ASP H H 62 8.760 7.898 0.862 1
1 16 . 8 1 1 A 2 2 ASP HA H 62 4.810 4.545 0.265 1
1 19 . 8 1 1 A 2 2 ASP C C 62 175.800 176.497 -0.697 1
1 20 . 8 1 1 A 2 2 ASP CA C 62 54.800 54.718 0.082 1
1 21 . 8 1 1 A 2 2 ASP CB C 62 41.600 41.084 0.516 1
1 22 . 8 1 1 A 2 2 ASP N N 62 120.900 117.525 3.375 1
1 23 . 8 1 1 A 3 3 SER H H 63 8.710 8.863 -0.153 1
1 24 . 8 1 1 A 3 3 SER HA H 63 4.970 5.110 -0.140 1
1 27 . 8 1 1 A 3 3 SER C C 63 175.600 175.049 0.551 1
1 28 . 8 1 1 A 3 3 SER CA C 63 57.500 56.028 1.472 1
1 29 . 8 1 1 A 3 3 SER CB C 63 65.900 66.289 -0.389 1
1 30 . 8 1 1 A 3 3 SER N N 63 116.300 116.231 0.069 1
1 31 . 8 1 1 A 4 4 PHE H H 64 9.370 9.238 0.132 1
1 32 . 8 1 1 A 4 4 PHE HA H 64 4.010 4.088 -0.078 1
1 39 . 8 1 1 A 4 4 PHE C C 64 176.700 177.379 -0.679 1
1 40 . 8 1 1 A 4 4 PHE CA C 64 62.200 61.630 0.570 1
1 41 . 8 1 1 A 4 4 PHE CB C 64 38.500 39.291 -0.791 1
1 46 . 8 1 1 A 4 4 PHE N N 64 121.400 121.658 -0.258 1
1 47 . 8 1 1 A 5 5 GLY H H 65 8.930 7.877 1.053 1
1 48 . 8 1 1 A 5 5 GLY HA2 H 65 2.020 2.374 -0.354 1
1 49 . 8 1 1 A 5 5 GLY HA3 H 65 3.250 2.825 0.425 1
1 50 . 8 1 1 A 5 5 GLY C C 65 175.200 175.555 -0.355 1
1 51 . 8 1 1 A 5 5 GLY CA C 65 46.300 46.485 -0.185 1
1 52 . 8 1 1 A 5 5 GLY N N 65 106.500 104.484 2.016 1
1 53 . 8 1 1 A 6 6 ASP H H 66 7.630 7.211 0.419 1
1 54 . 8 1 1 A 6 6 ASP HA H 66 4.100 4.153 -0.053 1
1 57 . 8 1 1 A 6 6 ASP C C 66 179.500 178.664 0.836 1
1 58 . 8 1 1 A 6 6 ASP CA C 66 57.400 56.706 0.694 1
1 59 . 8 1 1 A 6 6 ASP CB C 66 40.500 40.343 0.157 1
1 60 . 8 1 1 A 6 6 ASP N N 66 120.500 121.346 -0.846 1
1 61 . 8 1 1 A 7 7 TRP H H 67 7.190 7.874 -0.684 1
1 62 . 8 1 1 A 7 7 TRP HA H 67 3.860 4.244 -0.384 1
1 71 . 8 1 1 A 7 7 TRP C C 67 177.200 178.317 -1.117 1
1 72 . 8 1 1 A 7 7 TRP CA C 67 61.100 60.115 0.985 1
1 73 . 8 1 1 A 7 7 TRP CB C 67 28.300 29.258 -0.958 1
1 79 . 8 1 1 A 7 7 TRP N N 67 120.700 120.546 0.154 1
1 81 . 8 1 1 A 8 8 ALA H H 68 9.040 8.428 0.612 1
1 82 . 8 1 1 A 8 8 ALA HA H 68 3.730 3.813 -0.083 1
1 86 . 8 1 1 A 8 8 ALA C C 68 179.500 179.264 0.236 1
1 87 . 8 1 1 A 8 8 ALA CA C 68 55.200 55.151 0.049 1
1 88 . 8 1 1 A 8 8 ALA CB C 68 18.600 17.817 0.783 1
1 89 . 8 1 1 A 8 8 ALA N N 68 125.700 122.019 3.681 1
1 90 . 8 1 1 A 9 9 GLU H H 69 8.060 8.101 -0.041 1
1 91 . 8 1 1 A 9 9 GLU HA H 69 4.020 4.072 -0.052 1
1 96 . 8 1 1 A 9 9 GLU C C 69 180.400 179.137 1.263 1
1 97 . 8 1 1 A 9 9 GLU CA C 69 58.800 59.208 -0.408 1
1 98 . 8 1 1 A 9 9 GLU CB C 69 28.500 29.253 -0.753 1
1 99 . 8 1 1 A 9 9 GLU N N 69 115.400 118.404 -3.004 1
1 100 . 8 1 1 A 10 10 LYS H H 70 7.740 7.882 -0.142 1
1 101 . 8 1 1 A 10 10 LYS HA H 70 3.910 3.997 -0.087 1
1 110 . 8 1 1 A 10 10 LYS C C 70 179.500 178.920 0.580 1
1 111 . 8 1 1 A 10 10 LYS CA C 70 60.000 59.038 0.962 1
1 112 . 8 1 1 A 10 10 LYS CB C 70 32.400 32.078 0.322 1
1 116 . 8 1 1 A 10 10 LYS N N 70 122.700 119.633 3.067 1
1 117 . 8 1 1 A 11 11 PHE H H 71 8.750 8.447 0.303 1
1 118 . 8 1 1 A 11 11 PHE HA H 71 4.080 4.144 -0.064 1
1 126 . 8 1 1 A 11 11 PHE C C 71 177.100 177.277 -0.177 1
1 127 . 8 1 1 A 11 11 PHE CA C 71 61.200 61.392 -0.192 1
1 128 . 8 1 1 A 11 11 PHE CB C 71 38.900 39.159 -0.259 1
1 134 . 8 1 1 A 11 11 PHE N N 71 123.500 120.579 2.921 1
1 135 . 8 1 1 A 12 12 LEU H H 72 8.400 8.888 -0.488 1
1 136 . 8 1 1 A 12 12 LEU HA H 72 3.520 3.832 -0.312 1
1 146 . 8 1 1 A 12 12 LEU C C 72 180.000 179.534 0.466 1
1 147 . 8 1 1 A 12 12 LEU CA C 72 58.200 58.130 0.070 1
1 148 . 8 1 1 A 12 12 LEU CB C 72 41.700 41.528 0.172 1
1 152 . 8 1 1 A 12 12 LEU N N 72 121.100 119.515 1.585 1
1 153 . 8 1 1 A 13 13 LYS H H 73 7.810 8.076 -0.266 1
1 154 . 8 1 1 A 13 13 LYS HA H 73 4.080 4.032 0.048 1
1 156 . 8 1 1 A 13 13 LYS C C 73 179.300 178.499 0.801 1
1 157 . 8 1 1 A 13 13 LYS CA C 73 59.000 58.812 0.188 1
1 158 . 8 1 1 A 13 13 LYS CB C 73 31.900 32.041 -0.141 1
1 159 . 8 1 1 A 13 13 LYS N N 73 119.400 120.574 -1.174 1
1 160 . 8 1 1 A 14 14 SER H H 74 8.210 7.943 0.267 1
1 161 . 8 1 1 A 14 14 SER HA H 74 4.210 4.129 0.081 1
1 164 . 8 1 1 A 14 14 SER C C 74 176.300 177.356 -1.056 1
1 165 . 8 1 1 A 14 14 SER CA C 74 61.400 61.242 0.158 1
1 166 . 8 1 1 A 14 14 SER CB C 74 62.600 62.773 -0.173 1
1 167 . 8 1 1 A 14 14 SER N N 74 117.600 114.766 2.834 1
1 168 . 8 1 1 A 15 15 LYS H H 75 7.760 7.872 -0.112 1
1 169 . 8 1 1 A 15 15 LYS HA H 75 4.040 3.908 0.132 1
1 178 . 8 1 1 A 15 15 LYS C C 75 178.500 178.989 -0.489 1
1 179 . 8 1 1 A 15 15 LYS CA C 75 56.500 59.545 -3.045 1
1 180 . 8 1 1 A 15 15 LYS CB C 75 30.600 31.792 -1.192 1
1 184 . 8 1 1 A 15 15 LYS N N 75 120.100 122.212 -2.112 1
1 185 . 8 1 1 A 16 16 GLU H H 76 7.680 8.572 -0.892 1
1 186 . 8 1 1 A 16 16 GLU HA H 76 4.030 4.006 0.024 1
1 191 . 8 1 1 A 16 16 GLU C C 76 179.900 178.769 1.131 1
1 192 . 8 1 1 A 16 16 GLU CA C 76 59.200 59.701 -0.501 1
1 193 . 8 1 1 A 16 16 GLU CB C 76 29.600 29.233 0.367 1
1 195 . 8 1 1 A 16 16 GLU N N 76 119.700 119.620 0.080 1
1 196 . 8 1 1 A 17 17 ALA H H 77 8.030 7.826 0.204 1
1 197 . 8 1 1 A 17 17 ALA HA H 77 4.200 4.097 0.103 1
1 201 . 8 1 1 A 17 17 ALA C C 77 178.900 179.698 -0.798 1
1 202 . 8 1 1 A 17 17 ALA CA C 77 54.400 54.731 -0.331 1
1 203 . 8 1 1 A 17 17 ALA CB C 77 18.100 18.352 -0.252 1
1 204 . 8 1 1 A 17 17 ALA N N 77 123.000 121.024 1.976 1
1 205 . 8 1 1 A 18 18 ASP H H 78 7.860 8.247 -0.387 1
1 206 . 8 1 1 A 18 18 ASP HA H 78 4.600 4.427 0.173 1
1 209 . 8 1 1 A 18 18 ASP C C 78 177.500 176.260 1.240 1
1 210 . 8 1 1 A 18 18 ASP CA C 78 55.100 55.200 -0.100 1
1 211 . 8 1 1 A 18 18 ASP CB C 78 41.400 40.872 0.528 1
1 212 . 8 1 1 A 18 18 ASP N N 78 117.700 117.388 0.312 1
1 213 . 8 1 1 A 19 19 GLY H H 79 7.910 7.657 0.253 1
1 214 . 8 1 1 A 19 19 GLY HA2 H 79 3.860 4.047 -0.187 1
1 215 . 8 1 1 A 19 19 GLY HA3 H 79 4.080 4.050 0.030 1
1 216 . 8 1 1 A 19 19 GLY C C 79 175.300 173.974 1.326 1
1 217 . 8 1 1 A 19 19 GLY CA C 79 46.200 45.678 0.522 1
1 218 . 8 1 1 A 19 19 GLY N N 79 107.100 106.775 0.325 1
1 219 . 8 1 1 A 20 20 VAL H H 80 7.150 7.859 -0.709 1
1 220 . 8 1 1 A 20 20 VAL HA H 80 4.250 4.906 -0.656 1
1 228 . 8 1 1 A 20 20 VAL C C 80 175.100 174.808 0.292 1
1 229 . 8 1 1 A 20 20 VAL CA C 80 61.800 59.381 2.419 1
1 230 . 8 1 1 A 20 20 VAL CB C 80 32.200 34.892 -2.692 1
1 233 . 8 1 1 A 20 20 VAL N N 80 114.600 114.350 0.250 1
1 234 . 8 1 1 A 21 21 SER H H 81 8.560 8.620 -0.060 1
1 235 . 8 1 1 A 21 21 SER HA H 81 4.390 4.543 -0.153 1
1 238 . 8 1 1 A 21 21 SER C C 81 174.600 175.305 -0.705 1
1 239 . 8 1 1 A 21 21 SER CA C 81 57.900 58.719 -0.819 1
1 240 . 8 1 1 A 21 21 SER CB C 81 64.700 63.607 1.093 1
1 241 . 8 1 1 A 21 21 SER N N 81 118.700 118.448 0.252 1
1 242 . 8 1 1 A 22 22 VAL H H 82 8.690 8.537 0.153 1
1 243 . 8 1 1 A 22 22 VAL HA H 82 3.700 3.857 -0.157 1
1 251 . 8 1 1 A 22 22 VAL C C 82 178.000 177.208 0.792 1
1 252 . 8 1 1 A 22 22 VAL CA C 82 66.500 65.165 1.335 1
1 253 . 8 1 1 A 22 22 VAL CB C 82 31.700 31.654 0.046 1
1 256 . 8 1 1 A 22 22 VAL N N 82 122.100 126.772 -4.672 1
1 257 . 8 1 1 A 23 23 SER H H 83 8.300 7.653 0.647 1
1 258 . 8 1 1 A 23 23 SER HA H 83 4.210 4.105 0.105 1
1 261 . 8 1 1 A 23 23 SER C C 83 177.600 176.827 0.773 1
1 262 . 8 1 1 A 23 23 SER CA C 83 61.400 61.173 0.227 1
1 263 . 8 1 1 A 23 23 SER CB C 83 62.400 63.106 -0.706 1
1 264 . 8 1 1 A 23 23 SER N N 83 113.600 117.140 -3.540 1
1 265 . 8 1 1 A 24 24 GLN H H 84 7.820 7.947 -0.127 1
1 266 . 8 1 1 A 24 24 GLN HA H 84 3.970 3.862 0.108 1
1 273 . 8 1 1 A 24 24 GLN C C 84 178.400 177.578 0.822 1
1 274 . 8 1 1 A 24 24 GLN CA C 84 58.400 58.608 -0.208 1
1 275 . 8 1 1 A 24 24 GLN CB C 84 28.900 27.976 0.924 1
1 278 . 8 1 1 A 24 24 GLN N N 84 122.900 120.563 2.337 1
1 280 . 8 1 1 A 25 25 LEU H H 85 8.920 8.074 0.846 1
1 281 . 8 1 1 A 25 25 LEU HA H 85 4.130 4.081 0.049 1
1 291 . 8 1 1 A 25 25 LEU C C 85 178.800 178.479 0.321 1
1 292 . 8 1 1 A 25 25 LEU CA C 85 58.300 57.528 0.772 1
1 293 . 8 1 1 A 25 25 LEU CB C 85 41.200 41.545 -0.345 1
1 297 . 8 1 1 A 25 25 LEU N N 85 122.200 121.044 1.156 1
1 298 . 8 1 1 A 26 26 ASN H H 86 8.860 8.677 0.183 1
1 299 . 8 1 1 A 26 26 ASN HA H 86 4.420 4.323 0.097 1
1 304 . 8 1 1 A 26 26 ASN C C 86 179.000 177.929 1.071 1
1 305 . 8 1 1 A 26 26 ASN CA C 86 55.900 56.499 -0.599 1
1 306 . 8 1 1 A 26 26 ASN CB C 86 37.200 38.363 -1.163 1
1 308 . 8 1 1 A 26 26 ASN N N 86 117.600 117.203 0.397 1
1 310 . 8 1 1 A 27 27 SER H H 87 7.840 8.270 -0.430 1
1 311 . 8 1 1 A 27 27 SER HA H 87 4.100 3.928 0.172 1
1 314 . 8 1 1 A 27 27 SER C C 87 179.000 176.358 2.642 1
1 315 . 8 1 1 A 27 27 SER CA C 87 62.100 61.093 1.007 1
1 316 . 8 1 1 A 27 27 SER CB C 87 62.100 62.122 -0.022 1
1 317 . 8 1 1 A 27 27 SER N N 87 118.500 114.375 4.125 1
1 318 . 8 1 1 A 28 28 TYR H H 88 8.180 7.439 0.741 1
1 319 . 8 1 1 A 28 28 TYR HA H 88 4.600 4.375 0.225 1
1 326 . 8 1 1 A 28 28 TYR C C 88 174.800 178.513 -3.713 1
1 327 . 8 1 1 A 28 28 TYR CA C 88 61.200 62.027 -0.827 1
1 328 . 8 1 1 A 28 28 TYR CB C 88 37.800 38.286 -0.486 1
1 333 . 8 1 1 A 28 28 TYR N N 88 119.300 119.497 -0.197 1
1 334 . 8 1 1 A 29 29 LYS H H 89 9.040 8.090 0.950 1
1 335 . 8 1 1 A 29 29 LYS HA H 89 3.890 4.307 -0.417 1
1 344 . 8 1 1 A 29 29 LYS C C 89 179.000 179.822 -0.822 1
1 345 . 8 1 1 A 29 29 LYS CA C 89 61.300 59.245 2.055 1
1 346 . 8 1 1 A 29 29 LYS CB C 89 32.800 31.916 0.884 1
1 350 . 8 1 1 A 29 29 LYS N N 89 119.300 118.901 0.399 1
1 351 . 8 1 1 A 30 30 ASN H H 90 7.770 8.329 -0.559 1
1 352 . 8 1 1 A 30 30 ASN HA H 90 4.560 4.335 0.225 1
1 357 . 8 1 1 A 30 30 ASN C C 90 178.300 178.217 0.083 1
1 358 . 8 1 1 A 30 30 ASN CA C 90 56.200 56.372 -0.172 1
1 359 . 8 1 1 A 30 30 ASN CB C 90 38.900 37.613 1.287 1
1 361 . 8 1 1 A 30 30 ASN N N 90 117.800 117.808 -0.008 1
1 363 . 8 1 1 A 31 31 TYR H H 91 8.860 7.410 1.450 1
1 364 . 8 1 1 A 31 31 TYR HA H 91 4.910 4.412 0.498 1
1 371 . 8 1 1 A 31 31 TYR C C 91 178.300 178.987 -0.687 1
1 372 . 8 1 1 A 31 31 TYR CA C 91 59.700 60.790 -1.090 1
1 373 . 8 1 1 A 31 31 TYR CB C 91 37.500 37.745 -0.245 1
1 378 . 8 1 1 A 31 31 TYR N N 91 119.400 118.891 0.509 1
1 379 . 8 1 1 A 32 32 CYS H H 92 8.640 8.371 0.269 1
1 380 . 8 1 1 A 32 32 CYS HA H 92 4.410 4.535 -0.125 1
1 383 . 8 1 1 A 32 32 CYS C C 92 173.700 176.919 -3.219 1
1 384 . 8 1 1 A 32 32 CYS CA C 92 65.500 62.116 3.384 1
1 385 . 8 1 1 A 32 32 CYS CB C 92 28.300 27.723 0.577 1
1 386 . 8 1 1 A 32 32 CYS N N 92 113.500 119.457 -5.957 1
1 387 . 8 1 1 A 33 33 ARG H H 93 8.440 8.627 -0.187 1
1 388 . 8 1 1 A 33 33 ARG HA H 93 3.740 3.704 0.036 1
1 391 . 8 1 1 A 33 33 ARG C C 93 177.200 178.419 -1.219 1
1 392 . 8 1 1 A 33 33 ARG CA C 93 58.300 58.928 -0.628 1
1 393 . 8 1 1 A 33 33 ARG CB C 93 30.200 29.834 0.366 1
1 394 . 8 1 1 A 33 33 ARG N N 93 111.400 121.357 -9.957 1
1 395 . 8 1 1 A 34 34 ASN H H 94 8.020 7.670 0.350 1
1 396 . 8 1 1 A 34 34 ASN HA H 94 4.980 4.570 0.410 1
1 401 . 8 1 1 A 34 34 ASN C C 94 176.700 176.971 -0.271 1
1 402 . 8 1 1 A 34 34 ASN CA C 94 53.400 55.288 -1.888 1
1 403 . 8 1 1 A 34 34 ASN CB C 94 38.000 39.127 -1.127 1
1 405 . 8 1 1 A 34 34 ASN N N 94 113.600 116.717 -3.117 1
1 407 . 8 1 1 A 35 35 HIS H H 95 7.200 7.715 -0.515 1
1 408 . 8 1 1 A 35 35 HIS HA H 95 4.470 4.481 -0.011 1
1 411 . 8 1 1 A 35 35 HIS C C 95 176.600 176.427 0.173 1
1 412 . 8 1 1 A 35 35 HIS CA C 95 60.000 59.518 0.482 1
1 413 . 8 1 1 A 35 35 HIS CB C 95 30.500 31.178 -0.678 1
1 414 . 8 1 1 A 35 35 HIS N N 95 115.600 117.696 -2.096 1
1 415 . 8 1 1 A 36 36 LEU H H 96 8.170 8.024 0.146 1
1 416 . 8 1 1 A 36 36 LEU HA H 96 4.730 4.429 0.301 1
1 426 . 8 1 1 A 36 36 LEU C C 96 176.800 177.503 -0.703 1
1 427 . 8 1 1 A 36 36 LEU CA C 96 54.400 54.626 -0.226 1
1 428 . 8 1 1 A 36 36 LEU CB C 96 40.600 41.627 -1.027 1
1 432 . 8 1 1 A 36 36 LEU N N 96 114.000 119.438 -5.438 1
1 433 . 8 1 1 A 37 37 SER H H 97 7.140 8.309 -1.169 1
1 434 . 8 1 1 A 37 37 SER HA H 97 4.730 4.288 0.442 1
1 437 . 8 1 1 A 37 37 SER CA C 97 62.700 62.717 -0.017 1
1 438 . 8 1 1 A 37 37 SER CB C 97 62.600 61.496 1.104 1
1 439 . 8 1 1 A 37 37 SER N N 97 117.200 116.034 1.166 1
1 440 . 8 1 1 A 38 38 PRO HA H 98 4.560 4.369 0.191 1
1 447 . 8 1 1 A 38 38 PRO C C 98 177.900 179.137 -1.237 1
1 448 . 8 1 1 A 38 38 PRO CA C 98 65.700 65.985 -0.285 1
1 449 . 8 1 1 A 38 38 PRO CB C 98 31.800 30.806 0.994 1
1 452 . 8 1 1 A 39 39 LEU H H 99 8.090 7.565 0.525 1
1 453 . 8 1 1 A 39 39 LEU HA H 99 4.260 4.032 0.228 1
1 463 . 8 1 1 A 39 39 LEU C C 99 178.700 178.535 0.165 1
1 464 . 8 1 1 A 39 39 LEU CA C 99 54.300 57.452 -3.152 1
1 465 . 8 1 1 A 39 39 LEU CB C 99 42.400 41.615 0.785 1
1 469 . 8 1 1 A 39 39 LEU N N 99 112.400 117.302 -4.902 1
1 470 . 8 1 1 A 40 40 TYR H H 100 8.350 8.785 -0.435 1
1 471 . 8 1 1 A 40 40 TYR HA H 100 4.170 4.490 -0.320 1
1 478 . 8 1 1 A 40 40 TYR C C 100 178.300 176.827 1.473 1
1 479 . 8 1 1 A 40 40 TYR CA C 100 63.400 61.989 1.411 1
1 480 . 8 1 1 A 40 40 TYR CB C 100 38.600 39.176 -0.576 1
1 485 . 8 1 1 A 40 40 TYR N N 100 119.400 120.917 -1.517 1
1 486 . 8 1 1 A 41 41 MET H H 101 8.640 7.978 0.662 1
1 487 . 8 1 1 A 41 41 MET HA H 101 4.260 4.683 -0.423 1
1 488 . 8 1 1 A 41 41 MET C C 101 177.000 175.732 1.268 1
1 489 . 8 1 1 A 41 41 MET CA C 101 54.600 54.306 0.294 1
1 490 . 8 1 1 A 41 41 MET N N 101 111.800 116.153 -4.353 1
1 491 . 8 1 1 A 42 42 LYS H H 102 7.880 8.006 -0.126 1
1 492 . 8 1 1 A 42 42 LYS HA H 102 4.430 4.877 -0.447 1
1 501 . 8 1 1 A 42 42 LYS C C 102 176.300 175.633 0.667 1
1 502 . 8 1 1 A 42 42 LYS CA C 102 56.000 54.262 1.738 1
1 503 . 8 1 1 A 42 42 LYS CB C 102 33.400 34.208 -0.808 1
1 507 . 8 1 1 A 42 42 LYS N N 102 121.700 119.651 2.049 1
1 508 . 8 1 1 A 43 43 SER H H 103 9.160 8.806 0.354 1
1 509 . 8 1 1 A 43 43 SER HA H 103 4.620 4.837 -0.217 1
1 513 . 8 1 1 A 43 43 SER C C 103 176.300 175.568 0.732 1
1 514 . 8 1 1 A 43 43 SER CA C 103 58.700 57.208 1.492 1
1 515 . 8 1 1 A 43 43 SER CB C 103 63.700 64.806 -1.106 1
1 516 . 8 1 1 A 43 43 SER N N 103 118.800 116.861 1.939 1
1 517 . 8 1 1 A 44 44 LEU H H 104 8.860 8.939 -0.079 1
1 518 . 8 1 1 A 44 44 LEU HA H 104 4.130 4.248 -0.118 1
1 528 . 8 1 1 A 44 44 LEU C C 104 178.700 178.500 0.200 1
1 529 . 8 1 1 A 44 44 LEU CA C 104 58.800 57.723 1.077 1
1 530 . 8 1 1 A 44 44 LEU CB C 104 42.600 41.585 1.015 1
1 534 . 8 1 1 A 44 44 LEU N N 104 124.200 128.451 -4.251 1
1 535 . 8 1 1 A 45 45 SER H H 105 8.330 8.018 0.312 1
1 536 . 8 1 1 A 45 45 SER HA H 105 4.310 4.392 -0.082 1
1 539 . 8 1 1 A 45 45 SER C C 105 175.000 175.472 -0.472 1
1 540 . 8 1 1 A 45 45 SER CA C 105 60.100 60.256 -0.156 1
1 541 . 8 1 1 A 45 45 SER CB C 105 63.400 63.537 -0.137 1
1 542 . 8 1 1 A 45 45 SER N N 105 107.700 112.730 -5.030 1
1 543 . 8 1 1 A 46 46 GLU H H 106 7.800 7.673 0.127 1
1 544 . 8 1 1 A 46 46 GLU HA H 106 4.570 4.354 0.216 1
1 549 . 8 1 1 A 46 46 GLU C C 106 174.100 176.911 -2.811 1
1 550 . 8 1 1 A 46 46 GLU CA C 106 55.600 56.922 -1.322 1
1 551 . 8 1 1 A 46 46 GLU CB C 106 31.200 30.495 0.705 1
1 553 . 8 1 1 A 46 46 GLU N N 106 119.600 120.029 -0.429 1
1 554 . 8 1 1 A 47 47 ILE H H 107 7.100 7.233 -0.133 1
1 555 . 8 1 1 A 47 47 ILE HA H 107 4.040 3.967 0.073 1
1 565 . 8 1 1 A 47 47 ILE C C 107 174.100 175.128 -1.028 1
1 566 . 8 1 1 A 47 47 ILE CA C 107 62.300 61.773 0.527 1
1 567 . 8 1 1 A 47 47 ILE CB C 107 38.500 37.930 0.570 1
1 571 . 8 1 1 A 47 47 ILE N N 107 120.600 122.052 -1.452 1
1 572 . 8 1 1 A 48 48 LEU H H 108 9.180 8.782 0.398 1
1 573 . 8 1 1 A 48 48 LEU HA H 108 4.940 4.577 0.363 1
1 583 . 8 1 1 A 48 48 LEU CA C 108 51.900 52.368 -0.468 1
1 584 . 8 1 1 A 48 48 LEU CB C 108 42.000 41.983 0.017 1
1 588 . 8 1 1 A 48 48 LEU N N 108 129.400 129.317 0.083 1
1 589 . 8 1 1 A 49 49 PRO HA H 109 3.910 4.162 -0.252 1
1 596 . 8 1 1 A 49 49 PRO C C 109 178.500 177.988 0.512 1
1 597 . 8 1 1 A 49 49 PRO CA C 109 66.600 64.930 1.670 1
1 598 . 8 1 1 A 49 49 PRO CB C 109 31.300 31.536 -0.236 1
1 601 . 8 1 1 A 50 50 ALA H H 110 8.280 8.141 0.139 1
1 602 . 8 1 1 A 50 50 ALA HA H 110 4.110 4.037 0.073 1
1 606 . 8 1 1 A 50 50 ALA C C 110 179.700 179.672 0.028 1
1 607 . 8 1 1 A 50 50 ALA CA C 110 55.100 54.944 0.156 1
1 608 . 8 1 1 A 50 50 ALA CB C 110 19.200 18.298 0.902 1
1 609 . 8 1 1 A 50 50 ALA N N 110 116.100 119.326 -3.226 1
1 610 . 8 1 1 A 51 51 ASP H H 111 7.790 8.007 -0.217 1
1 611 . 8 1 1 A 51 51 ASP HA H 111 4.440 4.341 0.099 1
1 614 . 8 1 1 A 51 51 ASP C C 111 178.200 178.436 -0.236 1
1 615 . 8 1 1 A 51 51 ASP CA C 111 57.600 57.389 0.211 1
1 616 . 8 1 1 A 51 51 ASP CB C 111 41.800 41.186 0.614 1
1 617 . 8 1 1 A 51 51 ASP N N 111 116.500 118.052 -1.552 1
1 618 . 8 1 1 A 52 52 ILE H H 112 7.020 7.767 -0.747 1
1 619 . 8 1 1 A 52 52 ILE HA H 112 3.750 3.609 0.141 1
1 629 . 8 1 1 A 52 52 ILE C C 112 177.300 177.786 -0.486 1
1 630 . 8 1 1 A 52 52 ILE CA C 112 63.500 65.213 -1.713 1
1 631 . 8 1 1 A 52 52 ILE CB C 112 37.500 37.490 0.010 1
1 635 . 8 1 1 A 52 52 ILE N N 112 116.700 119.459 -2.759 1
1 636 . 8 1 1 A 53 53 GLN H H 113 9.150 8.542 0.608 1
1 637 . 8 1 1 A 53 53 GLN HA H 113 3.720 3.934 -0.214 1
1 644 . 8 1 1 A 53 53 GLN C C 113 177.500 178.270 -0.770 1
1 645 . 8 1 1 A 53 53 GLN CA C 113 58.200 58.813 -0.613 1
1 646 . 8 1 1 A 53 53 GLN CB C 113 30.200 28.572 1.628 1
1 649 . 8 1 1 A 53 53 GLN N N 113 121.200 120.987 0.213 1
1 651 . 8 1 1 A 54 54 SER H H 114 8.150 8.076 0.074 1
1 652 . 8 1 1 A 54 54 SER HA H 114 4.180 4.103 0.077 1
1 655 . 8 1 1 A 54 54 SER C C 114 175.900 176.277 -0.377 1
1 656 . 8 1 1 A 54 54 SER CA C 114 62.100 62.658 -0.558 1
1 657 . 8 1 1 A 54 54 SER CB C 114 62.800 62.804 -0.004 1
1 658 . 8 1 1 A 54 54 SER N N 114 112.200 116.812 -4.612 1
1 659 . 8 1 1 A 55 55 ILE H H 115 6.760 7.527 -0.767 1
1 660 . 8 1 1 A 55 55 ILE HA H 115 3.860 3.673 0.187 1
1 670 . 8 1 1 A 55 55 ILE C C 115 179.200 178.280 0.920 1
1 671 . 8 1 1 A 55 55 ILE CA C 115 64.700 64.712 -0.012 1
1 672 . 8 1 1 A 55 55 ILE CB C 115 38.900 37.774 1.126 1
1 676 . 8 1 1 A 55 55 ILE N N 115 119.500 120.451 -0.951 1
1 677 . 8 1 1 A 56 56 ILE H H 116 7.750 8.279 -0.529 1
1 678 . 8 1 1 A 56 56 ILE HA H 116 3.690 3.503 0.187 1
1 688 . 8 1 1 A 56 56 ILE C C 116 176.900 178.294 -1.394 1
1 689 . 8 1 1 A 56 56 ILE CA C 116 62.800 65.194 -2.394 1
1 690 . 8 1 1 A 56 56 ILE CB C 116 36.200 37.613 -1.413 1
1 694 . 8 1 1 A 56 56 ILE N N 116 120.200 120.397 -0.197 1
1 695 . 8 1 1 A 57 57 ASN H H 117 8.690 8.381 0.309 1
1 696 . 8 1 1 A 57 57 ASN HA H 117 4.440 4.494 -0.054 1
1 701 . 8 1 1 A 57 57 ASN C C 117 177.200 177.690 -0.490 1
1 702 . 8 1 1 A 57 57 ASN CA C 117 54.800 56.502 -1.702 1
1 703 . 8 1 1 A 57 57 ASN CB C 117 38.100 37.859 0.241 1
1 705 . 8 1 1 A 57 57 ASN N N 117 117.000 118.301 -1.301 1
1 707 . 8 1 1 A 58 58 GLU H H 118 7.630 8.244 -0.614 1
1 708 . 8 1 1 A 58 58 GLU HA H 118 4.450 4.284 0.166 1
1 713 . 8 1 1 A 58 58 GLU C C 118 176.500 176.911 -0.411 1
1 714 . 8 1 1 A 58 58 GLU CA C 118 56.200 58.086 -1.886 1
1 715 . 8 1 1 A 58 58 GLU CB C 118 30.200 28.939 1.261 1
1 717 . 8 1 1 A 58 58 GLU N N 118 116.300 115.366 0.934 1
1 718 . 8 1 1 A 59 59 THR H H 119 7.540 7.357 0.183 1
1 719 . 8 1 1 A 59 59 THR HA H 119 4.230 4.292 -0.062 1
1 724 . 8 1 1 A 59 59 THR C C 119 174.200 175.053 -0.853 1
1 725 . 8 1 1 A 59 59 THR CA C 119 63.800 63.757 0.043 1
1 726 . 8 1 1 A 59 59 THR CB C 119 68.900 68.627 0.273 1
1 728 . 8 1 1 A 59 59 THR N N 119 117.600 116.927 0.673 1
1 729 . 8 1 1 A 60 60 LYS H H 120 8.860 8.736 0.124 1
1 730 . 8 1 1 A 60 60 LYS HA H 120 4.490 4.375 0.115 1
1 739 . 8 1 1 A 60 60 LYS C C 120 175.800 175.985 -0.185 1
1 740 . 8 1 1 A 60 60 LYS CA C 120 54.900 56.203 -1.303 1
1 741 . 8 1 1 A 60 60 LYS CB C 120 29.800 32.008 -2.208 1
1 745 . 8 1 1 A 60 60 LYS N N 120 128.500 122.122 6.378 1
1 746 . 8 1 1 A 61 61 LEU H H 121 7.150 7.236 -0.086 1
1 747 . 8 1 1 A 61 61 LEU HA H 121 4.710 4.402 0.308 1
1 757 . 8 1 1 A 61 61 LEU C C 121 175.000 176.590 -1.590 1
1 758 . 8 1 1 A 61 61 LEU CA C 121 52.800 54.397 -1.597 1
1 759 . 8 1 1 A 61 61 LEU CB C 121 46.400 42.349 4.051 1
1 763 . 8 1 1 A 61 61 LEU N N 121 120.700 122.186 -1.486 1
1 764 . 8 1 1 A 62 62 ALA H H 122 8.000 8.487 -0.487 1
1 765 . 8 1 1 A 62 62 ALA HA H 122 4.250 4.375 -0.125 1
1 769 . 8 1 1 A 62 62 ALA CA C 122 52.100 52.300 -0.200 1
1 770 . 8 1 1 A 62 62 ALA CB C 122 19.500 19.289 0.211 1
1 771 . 8 1 1 A 62 62 ALA N N 122 119.900 122.952 -3.052 1
1 772 . 8 1 1 A 63 63 LYS H H 123 8.770 8.727 0.043 1
1 773 . 8 1 1 A 63 63 LYS HA H 123 3.800 3.887 -0.087 1
1 782 . 8 1 1 A 63 63 LYS C C 123 178.300 178.433 -0.133 1
1 783 . 8 1 1 A 63 63 LYS CA C 123 60.700 59.991 0.709 1
1 784 . 8 1 1 A 63 63 LYS CB C 123 32.300 32.077 0.223 1
1 788 . 8 1 1 A 63 63 LYS N N 123 121.400 121.656 -0.256 1
1 789 . 8 1 1 A 64 64 ASN H H 124 9.020 8.701 0.319 1
1 790 . 8 1 1 A 64 64 ASN HA H 124 4.430 4.456 -0.026 1
1 795 . 8 1 1 A 64 64 ASN C C 124 178.300 177.118 1.182 1
1 796 . 8 1 1 A 64 64 ASN CA C 124 56.200 55.781 0.419 1
1 797 . 8 1 1 A 64 64 ASN CB C 124 37.300 37.252 0.048 1
1 799 . 8 1 1 A 64 64 ASN N N 124 115.000 114.554 0.446 1
1 801 . 8 1 1 A 65 65 THR H H 125 7.620 7.766 -0.146 1
1 802 . 8 1 1 A 65 65 THR HA H 125 4.030 4.001 0.029 1
1 807 . 8 1 1 A 65 65 THR C C 125 175.500 176.755 -1.255 1
1 808 . 8 1 1 A 65 65 THR CA C 125 66.000 66.782 -0.782 1
1 809 . 8 1 1 A 65 65 THR CB C 125 67.600 68.727 -1.127 1
1 811 . 8 1 1 A 65 65 THR N N 125 119.800 116.237 3.563 1
1 812 . 8 1 1 A 66 66 LEU H H 126 8.020 8.219 -0.199 1
1 813 . 8 1 1 A 66 66 LEU HA H 126 3.790 3.794 -0.004 1
1 823 . 8 1 1 A 66 66 LEU C C 126 179.200 179.260 -0.060 1
1 824 . 8 1 1 A 66 66 LEU CA C 126 58.700 58.187 0.513 1
1 825 . 8 1 1 A 66 66 LEU CB C 126 41.300 41.644 -0.344 1
1 829 . 8 1 1 A 66 66 LEU N N 126 121.200 121.289 -0.089 1
1 830 . 8 1 1 A 67 67 LYS H H 127 8.380 8.291 0.089 1
1 831 . 8 1 1 A 67 67 LYS HA H 127 3.740 4.026 -0.286 1
1 840 . 8 1 1 A 67 67 LYS C C 127 178.300 179.207 -0.907 1
1 841 . 8 1 1 A 67 67 LYS CA C 127 60.100 59.379 0.721 1
1 842 . 8 1 1 A 67 67 LYS CB C 127 32.400 32.167 0.233 1
1 846 . 8 1 1 A 67 67 LYS N N 127 117.000 117.844 -0.844 1
1 847 . 8 1 1 A 68 68 ALA H H 128 7.480 7.579 -0.099 1
1 848 . 8 1 1 A 68 68 ALA HA H 128 4.210 3.979 0.231 1
1 852 . 8 1 1 A 68 68 ALA C C 128 181.200 179.603 1.597 1
1 853 . 8 1 1 A 68 68 ALA CA C 128 55.200 54.832 0.368 1
1 854 . 8 1 1 A 68 68 ALA CB C 128 18.600 18.266 0.334 1
1 855 . 8 1 1 A 68 68 ALA N N 128 122.900 121.861 1.039 1
1 856 . 8 1 1 A 69 69 ILE H H 129 8.250 7.867 0.383 1
1 857 . 8 1 1 A 69 69 ILE HA H 129 3.130 3.239 -0.109 1
1 867 . 8 1 1 A 69 69 ILE C C 129 177.400 177.774 -0.374 1
1 868 . 8 1 1 A 69 69 ILE CA C 129 66.700 65.329 1.371 1
1 869 . 8 1 1 A 69 69 ILE CB C 129 37.900 37.355 0.545 1
1 873 . 8 1 1 A 69 69 ILE N N 129 122.800 117.866 4.934 1
1 874 . 8 1 1 A 70 70 ARG H H 130 8.040 8.228 -0.188 1
1 875 . 8 1 1 A 70 70 ARG HA H 130 3.620 3.909 -0.289 1
1 882 . 8 1 1 A 70 70 ARG C C 130 177.800 178.451 -0.651 1
1 883 . 8 1 1 A 70 70 ARG CA C 130 60.700 59.872 0.828 1
1 884 . 8 1 1 A 70 70 ARG CB C 130 29.600 30.041 -0.441 1
1 887 . 8 1 1 A 70 70 ARG N N 130 119.700 120.507 -0.807 1
1 888 . 8 1 1 A 71 71 ASN H H 131 8.920 8.429 0.491 1
1 889 . 8 1 1 A 71 71 ASN HA H 131 4.430 4.419 0.011 1
1 894 . 8 1 1 A 71 71 ASN C C 131 177.500 177.661 -0.161 1
1 895 . 8 1 1 A 71 71 ASN CA C 131 56.100 56.620 -0.520 1
1 896 . 8 1 1 A 71 71 ASN CB C 131 38.600 39.243 -0.643 1
1 898 . 8 1 1 A 71 71 ASN N N 131 117.200 117.977 -0.777 1
1 900 . 8 1 1 A 72 72 THR H H 132 8.300 8.225 0.075 1
1 901 . 8 1 1 A 72 72 THR HA H 132 4.430 3.818 0.612 1
1 906 . 8 1 1 A 72 72 THR C C 132 175.100 176.604 -1.504 1
1 907 . 8 1 1 A 72 72 THR CA C 132 68.200 66.507 1.693 1
1 908 . 8 1 1 A 72 72 THR CB C 132 68.500 68.871 -0.371 1
1 910 . 8 1 1 A 72 72 THR N N 132 119.200 115.595 3.605 1
1 911 . 8 1 1 A 73 73 ALA H H 133 7.950 8.248 -0.298 1
1 912 . 8 1 1 A 73 73 ALA HA H 133 4.040 4.149 -0.109 1
1 916 . 8 1 1 A 73 73 ALA C C 133 178.200 179.231 -1.031 1
1 917 . 8 1 1 A 73 73 ALA CA C 133 55.900 55.456 0.444 1
1 918 . 8 1 1 A 73 73 ALA CB C 133 16.700 17.983 -1.283 1
1 919 . 8 1 1 A 73 73 ALA N N 133 120.900 123.893 -2.993 1
1 920 . 8 1 1 A 74 74 SER H H 134 8.440 8.316 0.124 1
1 921 . 8 1 1 A 74 74 SER HA H 134 4.430 4.265 0.165 1
1 924 . 8 1 1 A 74 74 SER C C 134 178.800 176.948 1.852 1
1 925 . 8 1 1 A 74 74 SER CA C 134 61.300 61.684 -0.384 1
1 926 . 8 1 1 A 74 74 SER CB C 134 62.600 62.857 -0.257 1
1 927 . 8 1 1 A 74 74 SER N N 134 110.100 113.391 -3.291 1
1 928 . 8 1 1 A 75 75 GLN H H 135 8.340 7.892 0.448 1
1 929 . 8 1 1 A 75 75 GLN HA H 135 3.880 4.008 -0.128 1
1 936 . 8 1 1 A 75 75 GLN C C 135 178.800 178.706 0.094 1
1 937 . 8 1 1 A 75 75 GLN CA C 135 59.600 58.493 1.107 1
1 938 . 8 1 1 A 75 75 GLN CB C 135 29.900 28.370 1.530 1
1 941 . 8 1 1 A 75 75 GLN N N 135 118.100 120.527 -2.427 1
1 943 . 8 1 1 A 76 76 ILE H H 136 7.670 7.317 0.353 1
1 944 . 8 1 1 A 76 76 ILE HA H 136 3.200 3.181 0.019 1
1 954 . 8 1 1 A 76 76 ILE C C 136 177.500 177.770 -0.270 1
1 955 . 8 1 1 A 76 76 ILE CA C 136 66.100 65.085 1.015 1
1 956 . 8 1 1 A 76 76 ILE CB C 136 37.400 37.334 0.066 1
1 960 . 8 1 1 A 76 76 ILE N N 136 122.500 120.023 2.477 1
1 961 . 8 1 1 A 77 77 PHE H H 137 7.930 7.759 0.171 1
1 962 . 8 1 1 A 77 77 PHE HA H 137 3.890 4.058 -0.168 1
1 969 . 8 1 1 A 77 77 PHE C C 137 178.200 178.354 -0.154 1
1 970 . 8 1 1 A 77 77 PHE CA C 137 63.600 60.459 3.141 1
1 971 . 8 1 1 A 77 77 PHE CB C 137 39.300 38.487 0.813 1
1 976 . 8 1 1 A 77 77 PHE N N 137 116.100 118.651 -2.551 1
1 977 . 8 1 1 A 78 78 ARG H H 138 8.900 7.910 0.990 1
1 978 . 8 1 1 A 78 78 ARG HA H 138 3.910 4.055 -0.145 1
1 986 . 8 1 1 A 78 78 ARG C C 138 178.300 178.671 -0.371 1
1 987 . 8 1 1 A 78 78 ARG CA C 138 60.100 58.544 1.556 1
1 988 . 8 1 1 A 78 78 ARG CB C 138 29.600 29.493 0.107 1
1 991 . 8 1 1 A 78 78 ARG N N 138 118.600 119.681 -1.081 1
1 993 . 8 1 1 A 79 79 LEU H H 139 7.730 7.924 -0.194 1
1 994 . 8 1 1 A 79 79 LEU HA H 139 4.280 4.068 0.212 1
1 1004 . 8 1 1 A 79 79 LEU C C 139 179.000 178.227 0.773 1
1 1005 . 8 1 1 A 79 79 LEU CA C 139 57.800 57.658 0.142 1
1 1006 . 8 1 1 A 79 79 LEU CB C 139 41.900 41.248 0.652 1
1 1010 . 8 1 1 A 79 79 LEU N N 139 121.900 121.686 0.214 1
1 1011 . 8 1 1 A 80 80 ALA H H 140 7.590 7.454 0.136 1
1 1012 . 8 1 1 A 80 80 ALA HA H 140 2.710 3.054 -0.344 1
1 1016 . 8 1 1 A 80 80 ALA C C 140 179.900 180.333 -0.433 1
1 1017 . 8 1 1 A 80 80 ALA CA C 140 55.100 54.514 0.586 1
1 1018 . 8 1 1 A 80 80 ALA CB C 140 17.600 17.791 -0.191 1
1 1019 . 8 1 1 A 80 80 ALA N N 140 123.400 119.661 3.739 1
1 1020 . 8 1 1 A 81 81 ILE H H 141 8.910 7.626 1.284 1
1 1021 . 8 1 1 A 81 81 ILE HA H 141 4.110 4.031 0.079 1
1 1031 . 8 1 1 A 81 81 ILE C C 141 181.700 177.628 4.072 1
1 1032 . 8 1 1 A 81 81 ILE CA C 141 64.800 65.316 -0.516 1
1 1033 . 8 1 1 A 81 81 ILE CB C 141 38.600 37.652 0.948 1
1 1037 . 8 1 1 A 81 81 ILE N N 141 122.400 118.656 3.744 1
1 1038 . 8 1 1 A 82 82 GLU H H 142 8.560 8.339 0.221 1
1 1039 . 8 1 1 A 82 82 GLU HA H 142 4.100 4.075 0.025 1
1 1044 . 8 1 1 A 82 82 GLU C C 142 177.700 178.110 -0.410 1
1 1045 . 8 1 1 A 82 82 GLU CA C 142 59.100 59.327 -0.227 1
1 1046 . 8 1 1 A 82 82 GLU CB C 142 29.200 29.161 0.039 1
1 1048 . 8 1 1 A 82 82 GLU N N 142 123.200 120.291 2.909 1
1 1049 . 8 1 1 A 83 83 ASN H H 143 7.310 7.729 -0.419 1
1 1050 . 8 1 1 A 83 83 ASN HA H 143 4.750 4.893 -0.143 1
1 1055 . 8 1 1 A 83 83 ASN C C 143 173.200 174.352 -1.152 1
1 1056 . 8 1 1 A 83 83 ASN CA C 143 54.200 52.815 1.385 1
1 1057 . 8 1 1 A 83 83 ASN CB C 143 41.300 38.849 2.451 1
1 1059 . 8 1 1 A 83 83 ASN N N 143 114.900 115.438 -0.538 1
1 1061 . 8 1 1 A 84 84 ARG H H 144 8.320 7.909 0.411 1
1 1062 . 8 1 1 A 84 84 ARG HA H 144 4.120 4.029 0.091 1
1 1069 . 8 1 1 A 84 84 ARG C C 144 175.300 175.795 -0.495 1
1 1070 . 8 1 1 A 84 84 ARG CA C 144 57.100 56.974 0.126 1
1 1071 . 8 1 1 A 84 84 ARG CB C 144 26.000 26.704 -0.704 1
1 1074 . 8 1 1 A 84 84 ARG N N 144 114.400 115.005 -0.605 1
1 1075 . 8 1 1 A 85 85 ALA H H 145 8.350 8.276 0.074 1
1 1076 . 8 1 1 A 85 85 ALA HA H 145 4.320 4.288 0.032 1
1 1080 . 8 1 1 A 85 85 ALA C C 145 176.500 177.214 -0.714 1
1 1081 . 8 1 1 A 85 85 ALA CA C 145 53.400 53.573 -0.173 1
1 1082 . 8 1 1 A 85 85 ALA CB C 145 19.900 19.574 0.326 1
1 1083 . 8 1 1 A 85 85 ALA N N 145 120.600 119.288 1.312 1
1 1084 . 8 1 1 A 86 86 ILE H H 146 7.290 7.120 0.170 1
1 1085 . 8 1 1 A 86 86 ILE HA H 146 4.400 4.626 -0.226 1
1 1095 . 8 1 1 A 86 86 ILE C C 146 173.600 173.879 -0.279 1
1 1096 . 8 1 1 A 86 86 ILE CA C 146 59.200 59.466 -0.266 1
1 1097 . 8 1 1 A 86 86 ILE CB C 146 41.600 41.520 0.080 1
1 1101 . 8 1 1 A 86 86 ILE N N 146 111.500 115.943 -4.443 1
1 1102 . 8 1 1 A 87 87 ASP H H 147 8.270 8.761 -0.491 1
1 1103 . 8 1 1 A 87 87 ASP HA H 147 4.940 4.817 0.123 1
1 1106 . 8 1 1 A 87 87 ASP C C 147 174.700 175.633 -0.933 1
1 1107 . 8 1 1 A 87 87 ASP CA C 147 53.700 53.623 0.077 1
1 1108 . 8 1 1 A 87 87 ASP CB C 147 41.800 41.521 0.279 1
1 1109 . 8 1 1 A 87 87 ASP N N 147 119.400 126.072 -6.672 1
1 1110 . 8 1 1 A 88 88 PHE H H 148 7.230 7.598 -0.368 1
1 1111 . 8 1 1 A 88 88 PHE HA H 148 4.690 4.784 -0.094 1
1 1119 . 8 1 1 A 88 88 PHE C C 148 171.500 173.377 -1.877 1
1 1120 . 8 1 1 A 88 88 PHE CA C 148 56.400 57.923 -1.523 1
1 1121 . 8 1 1 A 88 88 PHE CB C 148 42.000 42.526 -0.526 1
1 1127 . 8 1 1 A 88 88 PHE N N 148 119.700 119.326 0.374 1
1 1128 . 8 1 1 A 89 89 ASN H H 149 8.060 7.909 0.151 1
1 1129 . 8 1 1 A 89 89 ASN HA H 149 4.490 5.080 -0.590 1
1 1134 . 8 1 1 A 89 89 ASN CA C 149 48.100 50.228 -2.128 1
1 1135 . 8 1 1 A 89 89 ASN CB C 149 39.200 39.834 -0.634 1
1 1137 . 8 1 1 A 89 89 ASN N N 149 119.700 122.316 -2.616 1
1 1139 . 8 1 1 A 90 90 PRO HA H 150 3.970 4.226 -0.256 1
1 1146 . 8 1 1 A 90 90 PRO C C 150 177.700 177.053 0.647 1
1 1147 . 8 1 1 A 90 90 PRO CA C 150 63.900 63.782 0.118 1
1 1148 . 8 1 1 A 90 90 PRO CB C 150 31.700 31.490 0.210 1
1 1151 . 8 1 1 A 91 91 ALA H H 151 7.240 7.624 -0.384 1
1 1152 . 8 1 1 A 91 91 ALA HA H 151 3.900 3.906 -0.006 1
1 1156 . 8 1 1 A 91 91 ALA C C 151 178.000 179.863 -1.863 1
1 1157 . 8 1 1 A 91 91 ALA CA C 151 53.900 54.783 -0.883 1
1 1158 . 8 1 1 A 91 91 ALA CB C 151 17.700 18.263 -0.563 1
1 1159 . 8 1 1 A 91 91 ALA N N 151 115.700 119.942 -4.242 1
1 1160 . 8 1 1 A 92 92 ASP H H 152 7.080 7.826 -0.746 1
1 1161 . 8 1 1 A 92 92 ASP HA H 152 4.220 4.344 -0.124 1
1 1164 . 8 1 1 A 92 92 ASP C C 152 176.200 177.811 -1.611 1
1 1165 . 8 1 1 A 92 92 ASP CA C 152 55.800 56.504 -0.704 1
1 1166 . 8 1 1 A 92 92 ASP CB C 152 39.500 40.635 -1.135 1
1 1167 . 8 1 1 A 92 92 ASP N N 152 117.100 119.056 -1.956 1
1 1168 . 8 1 1 A 93 93 TYR H H 153 7.060 7.496 -0.436 1
1 1169 . 8 1 1 A 93 93 TYR HA H 153 4.490 4.241 0.249 1
1 1176 . 8 1 1 A 93 93 TYR C C 153 174.700 176.054 -1.354 1
1 1177 . 8 1 1 A 93 93 TYR CA C 153 57.600 59.801 -2.201 1
1 1178 . 8 1 1 A 93 93 TYR CB C 153 38.500 39.504 -1.004 1
1 1183 . 8 1 1 A 93 93 TYR N N 153 116.800 121.067 -4.267 1
1 1184 . 8 1 1 A 94 94 VAL H H 154 7.000 7.218 -0.218 1
1 1185 . 8 1 1 A 94 94 VAL HA H 154 4.040 3.969 0.071 1
1 1193 . 8 1 1 A 94 94 VAL C C 154 174.700 175.216 -0.516 1
1 1194 . 8 1 1 A 94 94 VAL CA C 154 62.100 62.889 -0.789 1
1 1195 . 8 1 1 A 94 94 VAL CB C 154 32.700 32.105 0.595 1
1 1198 . 8 1 1 A 94 94 VAL N N 154 120.600 120.318 0.282 1
1 1199 . 8 1 1 A 95 95 ARG H H 155 9.430 8.688 0.742 1
1 1200 . 8 1 1 A 95 95 ARG HA H 155 4.640 4.575 0.065 1
1 1207 . 8 1 1 A 95 95 ARG C C 155 175.400 175.703 -0.303 1
1 1208 . 8 1 1 A 95 95 ARG CA C 155 54.200 55.885 -1.685 1
1 1209 . 8 1 1 A 95 95 ARG CB C 155 32.400 31.472 0.928 1
1 1212 . 8 1 1 A 95 95 ARG N N 155 128.200 127.029 1.171 1
1 1213 . 8 1 1 A 96 96 ILE H H 156 8.700 8.715 -0.015 1
1 1214 . 8 1 1 A 96 96 ILE HA H 156 4.440 4.501 -0.061 1
1 1224 . 8 1 1 A 96 96 ILE CA C 156 56.500 58.059 -1.559 1
1 1225 . 8 1 1 A 96 96 ILE CB C 156 36.700 39.007 -2.307 1
1 1229 . 8 1 1 A 96 96 ILE N N 156 124.100 122.161 1.939 1
1 1230 . 8 1 1 A 97 97 PRO HA H 157 4.370 4.495 -0.125 1
1 1237 . 8 1 1 A 97 97 PRO C C 157 176.000 176.769 -0.769 1
1 1238 . 8 1 1 A 97 97 PRO CA C 157 63.200 63.349 -0.149 1
1 1239 . 8 1 1 A 97 97 PRO CB C 157 32.400 32.179 0.221 1
1 1242 . 8 1 1 A 98 98 LYS H H 158 8.380 9.077 -0.697 1
1 1243 . 8 1 1 A 98 98 LYS HA H 158 4.190 4.296 -0.106 1
1 1252 . 8 1 1 A 98 98 LYS C C 158 176.800 177.232 -0.432 1
1 1253 . 8 1 1 A 98 98 LYS CA C 158 57.100 58.376 -1.276 1
1 1254 . 8 1 1 A 98 98 LYS CB C 158 32.800 33.758 -0.958 1
1 1258 . 8 1 1 A 98 98 LYS N N 158 120.800 121.304 -0.504 1
1 1259 . 8 1 1 A 99 99 ILE H H 159 7.930 7.769 0.161 1
1 1260 . 8 1 1 A 99 99 ILE HA H 159 4.200 3.750 0.450 1
1 1270 . 8 1 1 A 99 99 ILE C C 159 175.400 175.278 0.122 1
1 1271 . 8 1 1 A 99 99 ILE CA C 159 60.600 63.992 -3.392 1
1 1272 . 8 1 1 A 99 99 ILE CB C 159 39.100 35.967 3.133 1
1 1276 . 8 1 1 A 99 99 ILE N N 159 120.200 116.265 3.935 1
1 1277 . 8 1 1 A 100 100 ALA H H 160 8.370 8.494 -0.124 1
1 1278 . 8 1 1 A 100 100 ALA HA H 160 4.370 4.214 0.156 1
1 1282 . 8 1 1 A 100 100 ALA C C 160 177.200 177.921 -0.721 1
1 1283 . 8 1 1 A 100 100 ALA CA C 160 52.200 52.812 -0.612 1
1 1284 . 8 1 1 A 100 100 ALA CB C 160 19.400 18.345 1.055 1
1 1285 . 8 1 1 A 100 100 ALA N N 160 128.300 123.058 5.242 1
1 1286 . 8 1 1 A 101 101 LEU H H 161 8.250 8.620 -0.370 1
1 1287 . 8 1 1 A 101 101 LEU HA H 161 4.280 3.723 0.557 1
1 1297 . 8 1 1 A 101 101 LEU C C 161 177.200 175.049 2.151 1
1 1298 . 8 1 1 A 101 101 LEU CA C 161 55.200 55.949 -0.749 1
1 1299 . 8 1 1 A 101 101 LEU CB C 161 42.400 39.684 2.716 1
1 1303 . 8 1 1 A 101 101 LEU N N 161 121.900 120.974 0.926 1
1 1304 . 8 1 1 A 102 102 GLU H H 162 8.390 7.310 1.080 1
1 1305 . 8 1 1 A 102 102 GLU HA H 162 4.230 4.238 -0.008 1
1 1310 . 8 1 1 A 102 102 GLU C C 162 176.100 174.694 1.406 1
1 1311 . 8 1 1 A 102 102 GLU CA C 162 56.400 55.517 0.883 1
1 1312 . 8 1 1 A 102 102 GLU CB C 162 30.500 28.959 1.541 1
1 1314 . 8 1 1 A 102 102 GLU N N 162 121.300 119.477 1.823 1
1 1315 . 8 1 1 A 103 103 HIS H H 163 8.330 8.294 0.036 1
1 1316 . 8 1 1 A 103 103 HIS HA H 163 4.590 4.662 -0.072 1
1 1319 . 8 1 1 A 103 103 HIS C C 163 176.100 174.853 1.247 1
1 1320 . 8 1 1 A 103 103 HIS CA C 163 56.000 55.056 0.944 1
1 1321 . 8 1 1 A 103 103 HIS CB C 163 30.500 30.472 0.028 1
1 1322 . 8 1 1 A 103 103 HIS N N 163 120.000 124.885 -4.885 1
1 1323 . 8 1 1 A 107 107 HIS HA H 167 4.620 4.759 -0.139 1
1 1326 . 8 1 1 A 107 107 HIS C C 167 173.900 174.042 -0.142 1
1 1327 . 8 1 1 A 107 107 HIS CA C 167 56.000 55.723 0.277 1
1 1328 . 8 1 1 A 107 107 HIS CB C 167 30.300 30.286 0.014 1
1 15 . 9 1 1 A 2 2 ASP H H 62 8.760 8.525 0.235 1
1 16 . 9 1 1 A 2 2 ASP HA H 62 4.810 4.781 0.029 1
1 19 . 9 1 1 A 2 2 ASP C C 62 175.800 175.292 0.508 1
1 20 . 9 1 1 A 2 2 ASP CA C 62 54.800 55.733 -0.933 1
1 21 . 9 1 1 A 2 2 ASP CB C 62 41.600 39.608 1.992 1
1 22 . 9 1 1 A 2 2 ASP N N 62 120.900 114.709 6.191 1
1 23 . 9 1 1 A 3 3 SER H H 63 8.710 8.092 0.618 1
1 24 . 9 1 1 A 3 3 SER HA H 63 4.970 4.771 0.199 1
1 27 . 9 1 1 A 3 3 SER C C 63 175.600 175.293 0.307 1
1 28 . 9 1 1 A 3 3 SER CA C 63 57.500 58.404 -0.904 1
1 29 . 9 1 1 A 3 3 SER CB C 63 65.900 64.570 1.330 1
1 30 . 9 1 1 A 3 3 SER N N 63 116.300 114.232 2.068 1
1 31 . 9 1 1 A 4 4 PHE H H 64 9.370 9.513 -0.143 1
1 32 . 9 1 1 A 4 4 PHE HA H 64 4.010 4.070 -0.060 1
1 39 . 9 1 1 A 4 4 PHE C C 64 176.700 177.732 -1.032 1
1 40 . 9 1 1 A 4 4 PHE CA C 64 62.200 61.579 0.621 1
1 41 . 9 1 1 A 4 4 PHE CB C 64 38.500 39.225 -0.725 1
1 46 . 9 1 1 A 4 4 PHE N N 64 121.400 124.188 -2.788 1
1 47 . 9 1 1 A 5 5 GLY H H 65 8.930 7.967 0.963 1
1 48 . 9 1 1 A 5 5 GLY HA2 H 65 2.020 2.479 -0.459 1
1 49 . 9 1 1 A 5 5 GLY HA3 H 65 3.250 2.972 0.278 1
1 50 . 9 1 1 A 5 5 GLY C C 65 175.200 175.159 0.041 1
1 51 . 9 1 1 A 5 5 GLY CA C 65 46.300 46.359 -0.059 1
1 52 . 9 1 1 A 5 5 GLY N N 65 106.500 105.445 1.055 1
1 53 . 9 1 1 A 6 6 ASP H H 66 7.630 8.010 -0.380 1
1 54 . 9 1 1 A 6 6 ASP HA H 66 4.100 4.189 -0.089 1
1 57 . 9 1 1 A 6 6 ASP C C 66 179.500 178.645 0.855 1
1 58 . 9 1 1 A 6 6 ASP CA C 66 57.400 56.776 0.624 1
1 59 . 9 1 1 A 6 6 ASP CB C 66 40.500 41.075 -0.575 1
1 60 . 9 1 1 A 6 6 ASP N N 66 120.500 121.253 -0.753 1
1 61 . 9 1 1 A 7 7 TRP H H 67 7.190 8.158 -0.968 1
1 62 . 9 1 1 A 7 7 TRP HA H 67 3.860 4.240 -0.380 1
1 71 . 9 1 1 A 7 7 TRP C C 67 177.200 178.347 -1.147 1
1 72 . 9 1 1 A 7 7 TRP CA C 67 61.100 59.677 1.423 1
1 73 . 9 1 1 A 7 7 TRP CB C 67 28.300 28.268 0.032 1
1 79 . 9 1 1 A 7 7 TRP N N 67 120.700 119.446 1.254 1
1 81 . 9 1 1 A 8 8 ALA H H 68 9.040 8.240 0.800 1
1 82 . 9 1 1 A 8 8 ALA HA H 68 3.730 3.805 -0.075 1
1 86 . 9 1 1 A 8 8 ALA C C 68 179.500 179.219 0.281 1
1 87 . 9 1 1 A 8 8 ALA CA C 68 55.200 55.207 -0.007 1
1 88 . 9 1 1 A 8 8 ALA CB C 68 18.600 17.934 0.666 1
1 89 . 9 1 1 A 8 8 ALA N N 68 125.700 122.713 2.987 1
1 90 . 9 1 1 A 9 9 GLU H H 69 8.060 7.792 0.268 1
1 91 . 9 1 1 A 9 9 GLU HA H 69 4.020 4.032 -0.012 1
1 96 . 9 1 1 A 9 9 GLU C C 69 180.400 178.938 1.462 1
1 97 . 9 1 1 A 9 9 GLU CA C 69 58.800 60.315 -1.515 1
1 98 . 9 1 1 A 9 9 GLU CB C 69 28.500 29.025 -0.525 1
1 99 . 9 1 1 A 9 9 GLU N N 69 115.400 118.336 -2.936 1
1 100 . 9 1 1 A 10 10 LYS H H 70 7.740 7.450 0.290 1
1 101 . 9 1 1 A 10 10 LYS HA H 70 3.910 4.002 -0.092 1
1 110 . 9 1 1 A 10 10 LYS C C 70 179.500 179.014 0.486 1
1 111 . 9 1 1 A 10 10 LYS CA C 70 60.000 58.921 1.079 1
1 112 . 9 1 1 A 10 10 LYS CB C 70 32.400 32.093 0.307 1
1 116 . 9 1 1 A 10 10 LYS N N 70 122.700 119.620 3.080 1
1 117 . 9 1 1 A 11 11 PHE H H 71 8.750 8.355 0.395 1
1 118 . 9 1 1 A 11 11 PHE HA H 71 4.080 4.243 -0.163 1
1 126 . 9 1 1 A 11 11 PHE C C 71 177.100 177.041 0.059 1
1 127 . 9 1 1 A 11 11 PHE CA C 71 61.200 61.465 -0.265 1
1 128 . 9 1 1 A 11 11 PHE CB C 71 38.900 38.787 0.113 1
1 134 . 9 1 1 A 11 11 PHE N N 71 123.500 120.636 2.864 1
1 135 . 9 1 1 A 12 12 LEU H H 72 8.400 9.035 -0.635 1
1 136 . 9 1 1 A 12 12 LEU HA H 72 3.520 3.608 -0.088 1
1 146 . 9 1 1 A 12 12 LEU C C 72 180.000 179.031 0.969 1
1 147 . 9 1 1 A 12 12 LEU CA C 72 58.200 57.890 0.310 1
1 148 . 9 1 1 A 12 12 LEU CB C 72 41.700 41.455 0.245 1
1 152 . 9 1 1 A 12 12 LEU N N 72 121.100 119.287 1.813 1
1 153 . 9 1 1 A 13 13 LYS H H 73 7.810 7.935 -0.125 1
1 154 . 9 1 1 A 13 13 LYS HA H 73 4.080 3.993 0.087 1
1 156 . 9 1 1 A 13 13 LYS C C 73 179.300 178.752 0.548 1
1 157 . 9 1 1 A 13 13 LYS CA C 73 59.000 58.734 0.266 1
1 158 . 9 1 1 A 13 13 LYS CB C 73 31.900 31.776 0.124 1
1 159 . 9 1 1 A 13 13 LYS N N 73 119.400 121.092 -1.692 1
1 160 . 9 1 1 A 14 14 SER H H 74 8.210 7.942 0.268 1
1 161 . 9 1 1 A 14 14 SER HA H 74 4.210 4.130 0.080 1
1 164 . 9 1 1 A 14 14 SER C C 74 176.300 177.164 -0.864 1
1 165 . 9 1 1 A 14 14 SER CA C 74 61.400 61.130 0.270 1
1 166 . 9 1 1 A 14 14 SER CB C 74 62.600 62.339 0.261 1
1 167 . 9 1 1 A 14 14 SER N N 74 117.600 115.333 2.267 1
1 168 . 9 1 1 A 15 15 LYS H H 75 7.760 7.257 0.503 1
1 169 . 9 1 1 A 15 15 LYS HA H 75 4.040 3.987 0.053 1
1 178 . 9 1 1 A 15 15 LYS C C 75 178.500 178.916 -0.416 1
1 179 . 9 1 1 A 15 15 LYS CA C 75 56.500 59.192 -2.692 1
1 180 . 9 1 1 A 15 15 LYS CB C 75 30.600 32.091 -1.491 1
1 184 . 9 1 1 A 15 15 LYS N N 75 120.100 122.289 -2.189 1
1 185 . 9 1 1 A 16 16 GLU H H 76 7.680 8.501 -0.821 1
1 186 . 9 1 1 A 16 16 GLU HA H 76 4.030 4.035 -0.005 1
1 191 . 9 1 1 A 16 16 GLU C C 76 179.900 178.540 1.360 1
1 192 . 9 1 1 A 16 16 GLU CA C 76 59.200 59.537 -0.337 1
1 193 . 9 1 1 A 16 16 GLU CB C 76 29.600 29.346 0.254 1
1 195 . 9 1 1 A 16 16 GLU N N 76 119.700 119.378 0.322 1
1 196 . 9 1 1 A 17 17 ALA H H 77 8.030 7.970 0.060 1
1 197 . 9 1 1 A 17 17 ALA HA H 77 4.200 4.193 0.007 1
1 201 . 9 1 1 A 17 17 ALA C C 77 178.900 179.557 -0.657 1
1 202 . 9 1 1 A 17 17 ALA CA C 77 54.400 53.253 1.147 1
1 203 . 9 1 1 A 17 17 ALA CB C 77 18.100 19.030 -0.930 1
1 204 . 9 1 1 A 17 17 ALA N N 77 123.000 120.459 2.541 1
1 205 . 9 1 1 A 18 18 ASP H H 78 7.860 7.636 0.224 1
1 206 . 9 1 1 A 18 18 ASP HA H 78 4.600 4.563 0.037 1
1 209 . 9 1 1 A 18 18 ASP C C 78 177.500 176.167 1.333 1
1 210 . 9 1 1 A 18 18 ASP CA C 78 55.100 54.702 0.398 1
1 211 . 9 1 1 A 18 18 ASP CB C 78 41.400 41.170 0.230 1
1 212 . 9 1 1 A 18 18 ASP N N 78 117.700 117.862 -0.162 1
1 213 . 9 1 1 A 19 19 GLY H H 79 7.910 7.481 0.429 1
1 214 . 9 1 1 A 19 19 GLY HA2 H 79 3.860 4.052 -0.192 1
1 215 . 9 1 1 A 19 19 GLY HA3 H 79 4.080 4.056 0.024 1
1 216 . 9 1 1 A 19 19 GLY C C 79 175.300 174.822 0.478 1
1 217 . 9 1 1 A 19 19 GLY CA C 79 46.200 44.885 1.315 1
1 218 . 9 1 1 A 19 19 GLY N N 79 107.100 107.510 -0.410 1
1 219 . 9 1 1 A 20 20 VAL H H 80 7.150 7.349 -0.199 1
1 220 . 9 1 1 A 20 20 VAL HA H 80 4.250 4.209 0.041 1
1 228 . 9 1 1 A 20 20 VAL C C 80 175.100 175.200 -0.100 1
1 229 . 9 1 1 A 20 20 VAL CA C 80 61.800 61.682 0.118 1
1 230 . 9 1 1 A 20 20 VAL CB C 80 32.200 32.535 -0.335 1
1 233 . 9 1 1 A 20 20 VAL N N 80 114.600 120.419 -5.819 1
1 234 . 9 1 1 A 21 21 SER H H 81 8.560 8.784 -0.224 1
1 235 . 9 1 1 A 21 21 SER HA H 81 4.390 4.613 -0.223 1
1 238 . 9 1 1 A 21 21 SER C C 81 174.600 175.766 -1.166 1
1 239 . 9 1 1 A 21 21 SER CA C 81 57.900 58.391 -0.491 1
1 240 . 9 1 1 A 21 21 SER CB C 81 64.700 63.896 0.804 1
1 241 . 9 1 1 A 21 21 SER N N 81 118.700 120.217 -1.517 1
1 242 . 9 1 1 A 22 22 VAL H H 82 8.690 8.794 -0.104 1
1 243 . 9 1 1 A 22 22 VAL HA H 82 3.700 3.743 -0.043 1
1 251 . 9 1 1 A 22 22 VAL C C 82 178.000 177.952 0.048 1
1 252 . 9 1 1 A 22 22 VAL CA C 82 66.500 65.478 1.022 1
1 253 . 9 1 1 A 22 22 VAL CB C 82 31.700 31.491 0.209 1
1 256 . 9 1 1 A 22 22 VAL N N 82 122.100 124.694 -2.594 1
1 257 . 9 1 1 A 23 23 SER H H 83 8.300 8.314 -0.014 1
1 258 . 9 1 1 A 23 23 SER HA H 83 4.210 4.109 0.101 1
1 261 . 9 1 1 A 23 23 SER C C 83 177.600 176.587 1.013 1
1 262 . 9 1 1 A 23 23 SER CA C 83 61.400 61.543 -0.143 1
1 263 . 9 1 1 A 23 23 SER CB C 83 62.400 62.387 0.013 1
1 264 . 9 1 1 A 23 23 SER N N 83 113.600 116.082 -2.482 1
1 265 . 9 1 1 A 24 24 GLN H H 84 7.820 7.619 0.201 1
1 266 . 9 1 1 A 24 24 GLN HA H 84 3.970 3.992 -0.022 1
1 273 . 9 1 1 A 24 24 GLN C C 84 178.400 177.816 0.584 1
1 274 . 9 1 1 A 24 24 GLN CA C 84 58.400 58.675 -0.275 1
1 275 . 9 1 1 A 24 24 GLN CB C 84 28.900 28.348 0.552 1
1 278 . 9 1 1 A 24 24 GLN N N 84 122.900 121.173 1.727 1
1 280 . 9 1 1 A 25 25 LEU H H 85 8.920 8.391 0.529 1
1 281 . 9 1 1 A 25 25 LEU HA H 85 4.130 4.307 -0.177 1
1 291 . 9 1 1 A 25 25 LEU C C 85 178.800 178.560 0.240 1
1 292 . 9 1 1 A 25 25 LEU CA C 85 58.300 57.891 0.409 1
1 293 . 9 1 1 A 25 25 LEU CB C 85 41.200 41.671 -0.471 1
1 297 . 9 1 1 A 25 25 LEU N N 85 122.200 121.450 0.750 1
1 298 . 9 1 1 A 26 26 ASN H H 86 8.860 8.842 0.018 1
1 299 . 9 1 1 A 26 26 ASN HA H 86 4.420 4.431 -0.011 1
1 304 . 9 1 1 A 26 26 ASN C C 86 179.000 178.060 0.940 1
1 305 . 9 1 1 A 26 26 ASN CA C 86 55.900 56.199 -0.299 1
1 306 . 9 1 1 A 26 26 ASN CB C 86 37.200 37.554 -0.354 1
1 308 . 9 1 1 A 26 26 ASN N N 86 117.600 117.272 0.328 1
1 310 . 9 1 1 A 27 27 SER H H 87 7.840 7.693 0.147 1
1 311 . 9 1 1 A 27 27 SER HA H 87 4.100 3.982 0.118 1
1 314 . 9 1 1 A 27 27 SER C C 87 179.000 177.112 1.888 1
1 315 . 9 1 1 A 27 27 SER CA C 87 62.100 61.169 0.931 1
1 316 . 9 1 1 A 27 27 SER CB C 87 62.100 63.016 -0.916 1
1 317 . 9 1 1 A 27 27 SER N N 87 118.500 115.027 3.473 1
1 318 . 9 1 1 A 28 28 TYR H H 88 8.180 7.763 0.417 1
1 319 . 9 1 1 A 28 28 TYR HA H 88 4.600 4.571 0.029 1
1 326 . 9 1 1 A 28 28 TYR C C 88 174.800 178.675 -3.875 1
1 327 . 9 1 1 A 28 28 TYR CA C 88 61.200 62.302 -1.102 1
1 328 . 9 1 1 A 28 28 TYR CB C 88 37.800 37.887 -0.087 1
1 333 . 9 1 1 A 28 28 TYR N N 88 119.300 119.614 -0.314 1
1 334 . 9 1 1 A 29 29 LYS H H 89 9.040 8.094 0.946 1
1 335 . 9 1 1 A 29 29 LYS HA H 89 3.890 4.416 -0.526 1
1 344 . 9 1 1 A 29 29 LYS C C 89 179.000 179.582 -0.582 1
1 345 . 9 1 1 A 29 29 LYS CA C 89 61.300 58.937 2.363 1
1 346 . 9 1 1 A 29 29 LYS CB C 89 32.800 32.174 0.626 1
1 350 . 9 1 1 A 29 29 LYS N N 89 119.300 119.349 -0.049 1
1 351 . 9 1 1 A 30 30 ASN H H 90 7.770 8.283 -0.513 1
1 352 . 9 1 1 A 30 30 ASN HA H 90 4.560 4.375 0.185 1
1 357 . 9 1 1 A 30 30 ASN C C 90 178.300 178.264 0.036 1
1 358 . 9 1 1 A 30 30 ASN CA C 90 56.200 56.328 -0.128 1
1 359 . 9 1 1 A 30 30 ASN CB C 90 38.900 37.505 1.395 1
1 361 . 9 1 1 A 30 30 ASN N N 90 117.800 118.343 -0.543 1
1 363 . 9 1 1 A 31 31 TYR H H 91 8.860 7.850 1.010 1
1 364 . 9 1 1 A 31 31 TYR HA H 91 4.910 4.503 0.407 1
1 371 . 9 1 1 A 31 31 TYR C C 91 178.300 179.124 -0.824 1
1 372 . 9 1 1 A 31 31 TYR CA C 91 59.700 60.823 -1.123 1
1 373 . 9 1 1 A 31 31 TYR CB C 91 37.500 37.499 0.001 1
1 378 . 9 1 1 A 31 31 TYR N N 91 119.400 119.279 0.121 1
1 379 . 9 1 1 A 32 32 CYS H H 92 8.640 8.343 0.297 1
1 380 . 9 1 1 A 32 32 CYS HA H 92 4.410 4.550 -0.140 1
1 383 . 9 1 1 A 32 32 CYS C C 92 173.700 176.829 -3.129 1
1 384 . 9 1 1 A 32 32 CYS CA C 92 65.500 61.873 3.627 1
1 385 . 9 1 1 A 32 32 CYS CB C 92 28.300 27.680 0.620 1
1 386 . 9 1 1 A 32 32 CYS N N 92 113.500 119.808 -6.308 1
1 387 . 9 1 1 A 33 33 ARG H H 93 8.440 7.756 0.684 1
1 388 . 9 1 1 A 33 33 ARG HA H 93 3.740 3.966 -0.226 1
1 391 . 9 1 1 A 33 33 ARG C C 93 177.200 177.847 -0.647 1
1 392 . 9 1 1 A 33 33 ARG CA C 93 58.300 58.983 -0.683 1
1 393 . 9 1 1 A 33 33 ARG CB C 93 30.200 30.452 -0.252 1
1 394 . 9 1 1 A 33 33 ARG N N 93 111.400 119.942 -8.542 1
1 395 . 9 1 1 A 34 34 ASN H H 94 8.020 7.985 0.035 1
1 396 . 9 1 1 A 34 34 ASN HA H 94 4.980 4.737 0.243 1
1 401 . 9 1 1 A 34 34 ASN C C 94 176.700 176.913 -0.213 1
1 402 . 9 1 1 A 34 34 ASN CA C 94 53.400 55.027 -1.627 1
1 403 . 9 1 1 A 34 34 ASN CB C 94 38.000 39.447 -1.447 1
1 405 . 9 1 1 A 34 34 ASN N N 94 113.600 115.966 -2.366 1
1 407 . 9 1 1 A 35 35 HIS H H 95 7.200 7.830 -0.630 1
1 408 . 9 1 1 A 35 35 HIS HA H 95 4.470 4.456 0.014 1
1 411 . 9 1 1 A 35 35 HIS C C 95 176.600 176.154 0.446 1
1 412 . 9 1 1 A 35 35 HIS CA C 95 60.000 59.531 0.469 1
1 413 . 9 1 1 A 35 35 HIS CB C 95 30.500 31.061 -0.561 1
1 414 . 9 1 1 A 35 35 HIS N N 95 115.600 117.569 -1.969 1
1 415 . 9 1 1 A 36 36 LEU H H 96 8.170 8.644 -0.474 1
1 416 . 9 1 1 A 36 36 LEU HA H 96 4.730 4.517 0.213 1
1 426 . 9 1 1 A 36 36 LEU C C 96 176.800 177.607 -0.807 1
1 427 . 9 1 1 A 36 36 LEU CA C 96 54.400 54.608 -0.208 1
1 428 . 9 1 1 A 36 36 LEU CB C 96 40.600 41.682 -1.082 1
1 432 . 9 1 1 A 36 36 LEU N N 96 114.000 118.786 -4.786 1
1 433 . 9 1 1 A 37 37 SER H H 97 7.140 8.370 -1.230 1
1 434 . 9 1 1 A 37 37 SER HA H 97 4.730 4.311 0.419 1
1 437 . 9 1 1 A 37 37 SER CA C 97 62.700 62.677 0.023 1
1 438 . 9 1 1 A 37 37 SER CB C 97 62.600 61.784 0.816 1
1 439 . 9 1 1 A 37 37 SER N N 97 117.200 116.077 1.123 1
1 440 . 9 1 1 A 38 38 PRO HA H 98 4.560 4.418 0.142 1
1 447 . 9 1 1 A 38 38 PRO C C 98 177.900 178.588 -0.688 1
1 448 . 9 1 1 A 38 38 PRO CA C 98 65.700 65.612 0.088 1
1 449 . 9 1 1 A 38 38 PRO CB C 98 31.800 30.900 0.900 1
1 452 . 9 1 1 A 39 39 LEU H H 99 8.090 7.622 0.468 1
1 453 . 9 1 1 A 39 39 LEU HA H 99 4.260 4.030 0.230 1
1 463 . 9 1 1 A 39 39 LEU C C 99 178.700 178.529 0.171 1
1 464 . 9 1 1 A 39 39 LEU CA C 99 54.300 57.339 -3.039 1
1 465 . 9 1 1 A 39 39 LEU CB C 99 42.400 41.624 0.776 1
1 469 . 9 1 1 A 39 39 LEU N N 99 112.400 117.616 -5.216 1
1 470 . 9 1 1 A 40 40 TYR H H 100 8.350 8.847 -0.497 1
1 471 . 9 1 1 A 40 40 TYR HA H 100 4.170 4.396 -0.226 1
1 478 . 9 1 1 A 40 40 TYR C C 100 178.300 176.868 1.432 1
1 479 . 9 1 1 A 40 40 TYR CA C 100 63.400 62.100 1.300 1
1 480 . 9 1 1 A 40 40 TYR CB C 100 38.600 39.228 -0.628 1
1 485 . 9 1 1 A 40 40 TYR N N 100 119.400 120.915 -1.515 1
1 486 . 9 1 1 A 41 41 MET H H 101 8.640 8.085 0.555 1
1 487 . 9 1 1 A 41 41 MET HA H 101 4.260 4.726 -0.466 1
1 488 . 9 1 1 A 41 41 MET C C 101 177.000 176.404 0.596 1
1 489 . 9 1 1 A 41 41 MET CA C 101 54.600 54.862 -0.262 1
1 490 . 9 1 1 A 41 41 MET N N 101 111.800 116.282 -4.482 1
1 491 . 9 1 1 A 42 42 LYS H H 102 7.880 7.805 0.075 1
1 492 . 9 1 1 A 42 42 LYS HA H 102 4.430 4.556 -0.126 1
1 501 . 9 1 1 A 42 42 LYS C C 102 176.300 176.535 -0.235 1
1 502 . 9 1 1 A 42 42 LYS CA C 102 56.000 55.325 0.675 1
1 503 . 9 1 1 A 42 42 LYS CB C 102 33.400 33.497 -0.097 1
1 507 . 9 1 1 A 42 42 LYS N N 102 121.700 120.186 1.514 1
1 508 . 9 1 1 A 43 43 SER H H 103 9.160 9.123 0.037 1
1 509 . 9 1 1 A 43 43 SER HA H 103 4.620 4.652 -0.032 1
1 513 . 9 1 1 A 43 43 SER C C 103 176.300 175.935 0.365 1
1 514 . 9 1 1 A 43 43 SER CA C 103 58.700 58.004 0.696 1
1 515 . 9 1 1 A 43 43 SER CB C 103 63.700 64.276 -0.576 1
1 516 . 9 1 1 A 43 43 SER N N 103 118.800 118.733 0.067 1
1 517 . 9 1 1 A 44 44 LEU H H 104 8.860 9.225 -0.365 1
1 518 . 9 1 1 A 44 44 LEU HA H 104 4.130 4.173 -0.043 1
1 528 . 9 1 1 A 44 44 LEU C C 104 178.700 178.330 0.370 1
1 529 . 9 1 1 A 44 44 LEU CA C 104 58.800 57.967 0.833 1
1 530 . 9 1 1 A 44 44 LEU CB C 104 42.600 41.338 1.262 1
1 534 . 9 1 1 A 44 44 LEU N N 104 124.200 126.507 -2.307 1
1 535 . 9 1 1 A 45 45 SER H H 105 8.330 8.204 0.126 1
1 536 . 9 1 1 A 45 45 SER HA H 105 4.310 4.623 -0.313 1
1 539 . 9 1 1 A 45 45 SER C C 105 175.000 174.947 0.053 1
1 540 . 9 1 1 A 45 45 SER CA C 105 60.100 59.343 0.757 1
1 541 . 9 1 1 A 45 45 SER CB C 105 63.400 63.554 -0.154 1
1 542 . 9 1 1 A 45 45 SER N N 105 107.700 114.962 -7.262 1
1 543 . 9 1 1 A 46 46 GLU H H 106 7.800 8.284 -0.484 1
1 544 . 9 1 1 A 46 46 GLU HA H 106 4.570 4.400 0.170 1
1 549 . 9 1 1 A 46 46 GLU C C 106 174.100 175.844 -1.744 1
1 550 . 9 1 1 A 46 46 GLU CA C 106 55.600 56.120 -0.520 1
1 551 . 9 1 1 A 46 46 GLU CB C 106 31.200 30.393 0.807 1
1 553 . 9 1 1 A 46 46 GLU N N 106 119.600 118.420 1.180 1
1 554 . 9 1 1 A 47 47 ILE H H 107 7.100 7.171 -0.071 1
1 555 . 9 1 1 A 47 47 ILE HA H 107 4.040 4.318 -0.278 1
1 565 . 9 1 1 A 47 47 ILE C C 107 174.100 174.729 -0.629 1
1 566 . 9 1 1 A 47 47 ILE CA C 107 62.300 60.450 1.850 1
1 567 . 9 1 1 A 47 47 ILE CB C 107 38.500 37.850 0.650 1
1 571 . 9 1 1 A 47 47 ILE N N 107 120.600 121.345 -0.745 1
1 572 . 9 1 1 A 48 48 LEU H H 108 9.180 9.051 0.129 1
1 573 . 9 1 1 A 48 48 LEU HA H 108 4.940 4.674 0.266 1
1 583 . 9 1 1 A 48 48 LEU CA C 108 51.900 52.445 -0.545 1
1 584 . 9 1 1 A 48 48 LEU CB C 108 42.000 42.024 -0.024 1
1 588 . 9 1 1 A 48 48 LEU N N 108 129.400 128.778 0.622 1
1 589 . 9 1 1 A 49 49 PRO HA H 109 3.910 4.288 -0.378 1
1 596 . 9 1 1 A 49 49 PRO C C 109 178.500 177.843 0.657 1
1 597 . 9 1 1 A 49 49 PRO CA C 109 66.600 65.097 1.503 1
1 598 . 9 1 1 A 49 49 PRO CB C 109 31.300 31.959 -0.659 1
1 601 . 9 1 1 A 50 50 ALA H H 110 8.280 8.393 -0.113 1
1 602 . 9 1 1 A 50 50 ALA HA H 110 4.110 4.086 0.024 1
1 606 . 9 1 1 A 50 50 ALA C C 110 179.700 180.139 -0.439 1
1 607 . 9 1 1 A 50 50 ALA CA C 110 55.100 55.205 -0.105 1
1 608 . 9 1 1 A 50 50 ALA CB C 110 19.200 18.503 0.697 1
1 609 . 9 1 1 A 50 50 ALA N N 110 116.100 118.892 -2.792 1
1 610 . 9 1 1 A 51 51 ASP H H 111 7.790 7.967 -0.177 1
1 611 . 9 1 1 A 51 51 ASP HA H 111 4.440 4.355 0.085 1
1 614 . 9 1 1 A 51 51 ASP C C 111 178.200 178.825 -0.625 1
1 615 . 9 1 1 A 51 51 ASP CA C 111 57.600 57.379 0.221 1
1 616 . 9 1 1 A 51 51 ASP CB C 111 41.800 40.524 1.276 1
1 617 . 9 1 1 A 51 51 ASP N N 111 116.500 118.682 -2.182 1
1 618 . 9 1 1 A 52 52 ILE H H 112 7.020 7.420 -0.400 1
1 619 . 9 1 1 A 52 52 ILE HA H 112 3.750 3.603 0.147 1
1 629 . 9 1 1 A 52 52 ILE C C 112 177.300 177.731 -0.431 1
1 630 . 9 1 1 A 52 52 ILE CA C 112 63.500 65.154 -1.654 1
1 631 . 9 1 1 A 52 52 ILE CB C 112 37.500 37.736 -0.236 1
1 635 . 9 1 1 A 52 52 ILE N N 112 116.700 120.631 -3.931 1
1 636 . 9 1 1 A 53 53 GLN H H 113 9.150 8.628 0.522 1
1 637 . 9 1 1 A 53 53 GLN HA H 113 3.720 3.932 -0.212 1
1 644 . 9 1 1 A 53 53 GLN C C 113 177.500 178.157 -0.657 1
1 645 . 9 1 1 A 53 53 GLN CA C 113 58.200 58.837 -0.637 1
1 646 . 9 1 1 A 53 53 GLN CB C 113 30.200 28.677 1.523 1
1 649 . 9 1 1 A 53 53 GLN N N 113 121.200 120.850 0.350 1
1 651 . 9 1 1 A 54 54 SER H H 114 8.150 8.594 -0.444 1
1 652 . 9 1 1 A 54 54 SER HA H 114 4.180 4.189 -0.009 1
1 655 . 9 1 1 A 54 54 SER C C 114 175.900 177.800 -1.900 1
1 656 . 9 1 1 A 54 54 SER CA C 114 62.100 61.471 0.629 1
1 657 . 9 1 1 A 54 54 SER CB C 114 62.800 62.500 0.300 1
1 658 . 9 1 1 A 54 54 SER N N 114 112.200 115.577 -3.377 1
1 659 . 9 1 1 A 55 55 ILE H H 115 6.760 7.647 -0.887 1
1 660 . 9 1 1 A 55 55 ILE HA H 115 3.860 3.702 0.158 1
1 670 . 9 1 1 A 55 55 ILE C C 115 179.200 178.085 1.115 1
1 671 . 9 1 1 A 55 55 ILE CA C 115 64.700 64.660 0.040 1
1 672 . 9 1 1 A 55 55 ILE CB C 115 38.900 38.033 0.867 1
1 676 . 9 1 1 A 55 55 ILE N N 115 119.500 122.632 -3.132 1
1 677 . 9 1 1 A 56 56 ILE H H 116 7.750 8.222 -0.472 1
1 678 . 9 1 1 A 56 56 ILE HA H 116 3.690 3.724 -0.034 1
1 688 . 9 1 1 A 56 56 ILE C C 116 176.900 177.968 -1.068 1
1 689 . 9 1 1 A 56 56 ILE CA C 116 62.800 64.612 -1.812 1
1 690 . 9 1 1 A 56 56 ILE CB C 116 36.200 37.302 -1.102 1
1 694 . 9 1 1 A 56 56 ILE N N 116 120.200 121.407 -1.207 1
1 695 . 9 1 1 A 57 57 ASN H H 117 8.690 7.821 0.869 1
1 696 . 9 1 1 A 57 57 ASN HA H 117 4.440 4.503 -0.063 1
1 701 . 9 1 1 A 57 57 ASN C C 117 177.200 177.741 -0.541 1
1 702 . 9 1 1 A 57 57 ASN CA C 117 54.800 56.042 -1.242 1
1 703 . 9 1 1 A 57 57 ASN CB C 117 38.100 38.630 -0.530 1
1 705 . 9 1 1 A 57 57 ASN N N 117 117.000 120.519 -3.519 1
1 707 . 9 1 1 A 58 58 GLU H H 118 7.630 8.110 -0.480 1
1 708 . 9 1 1 A 58 58 GLU HA H 118 4.450 4.315 0.135 1
1 713 . 9 1 1 A 58 58 GLU C C 118 176.500 177.534 -1.034 1
1 714 . 9 1 1 A 58 58 GLU CA C 118 56.200 57.853 -1.653 1
1 715 . 9 1 1 A 58 58 GLU CB C 118 30.200 30.138 0.062 1
1 717 . 9 1 1 A 58 58 GLU N N 118 116.300 117.634 -1.334 1
1 718 . 9 1 1 A 59 59 THR H H 119 7.540 7.813 -0.273 1
1 719 . 9 1 1 A 59 59 THR HA H 119 4.230 4.358 -0.128 1
1 724 . 9 1 1 A 59 59 THR C C 119 174.200 174.600 -0.400 1
1 725 . 9 1 1 A 59 59 THR CA C 119 63.800 63.466 0.334 1
1 726 . 9 1 1 A 59 59 THR CB C 119 68.900 68.588 0.312 1
1 728 . 9 1 1 A 59 59 THR N N 119 117.600 115.561 2.039 1
1 729 . 9 1 1 A 60 60 LYS H H 120 8.860 8.577 0.283 1
1 730 . 9 1 1 A 60 60 LYS HA H 120 4.490 4.527 -0.037 1
1 739 . 9 1 1 A 60 60 LYS C C 120 175.800 176.557 -0.757 1
1 740 . 9 1 1 A 60 60 LYS CA C 120 54.900 55.541 -0.641 1
1 741 . 9 1 1 A 60 60 LYS CB C 120 29.800 32.252 -2.452 1
1 745 . 9 1 1 A 60 60 LYS N N 120 128.500 125.900 2.600 1
1 746 . 9 1 1 A 61 61 LEU H H 121 7.150 7.302 -0.152 1
1 747 . 9 1 1 A 61 61 LEU HA H 121 4.710 4.503 0.207 1
1 757 . 9 1 1 A 61 61 LEU C C 121 175.000 176.348 -1.348 1
1 758 . 9 1 1 A 61 61 LEU CA C 121 52.800 54.264 -1.464 1
1 759 . 9 1 1 A 61 61 LEU CB C 121 46.400 42.295 4.105 1
1 763 . 9 1 1 A 61 61 LEU N N 121 120.700 121.480 -0.780 1
1 764 . 9 1 1 A 62 62 ALA H H 122 8.000 8.359 -0.359 1
1 765 . 9 1 1 A 62 62 ALA HA H 122 4.250 4.362 -0.112 1
1 769 . 9 1 1 A 62 62 ALA CA C 122 52.100 52.313 -0.213 1
1 770 . 9 1 1 A 62 62 ALA CB C 122 19.500 19.334 0.166 1
1 771 . 9 1 1 A 62 62 ALA N N 122 119.900 122.803 -2.903 1
1 772 . 9 1 1 A 63 63 LYS H H 123 8.770 8.809 -0.039 1
1 773 . 9 1 1 A 63 63 LYS HA H 123 3.800 3.936 -0.136 1
1 782 . 9 1 1 A 63 63 LYS C C 123 178.300 178.314 -0.014 1
1 783 . 9 1 1 A 63 63 LYS CA C 123 60.700 60.122 0.578 1
1 784 . 9 1 1 A 63 63 LYS CB C 123 32.300 32.118 0.182 1
1 788 . 9 1 1 A 63 63 LYS N N 123 121.400 121.404 -0.004 1
1 789 . 9 1 1 A 64 64 ASN H H 124 9.020 8.271 0.749 1
1 790 . 9 1 1 A 64 64 ASN HA H 124 4.430 4.459 -0.029 1
1 795 . 9 1 1 A 64 64 ASN C C 124 178.300 177.941 0.359 1
1 796 . 9 1 1 A 64 64 ASN CA C 124 56.200 56.380 -0.180 1
1 797 . 9 1 1 A 64 64 ASN CB C 124 37.300 38.557 -1.257 1
1 799 . 9 1 1 A 64 64 ASN N N 124 115.000 118.399 -3.399 1
1 801 . 9 1 1 A 65 65 THR H H 125 7.620 8.044 -0.424 1
1 802 . 9 1 1 A 65 65 THR HA H 125 4.030 4.031 -0.001 1
1 807 . 9 1 1 A 65 65 THR C C 125 175.500 176.552 -1.052 1
1 808 . 9 1 1 A 65 65 THR CA C 125 66.000 67.714 -1.714 1
1 809 . 9 1 1 A 65 65 THR CB C 125 67.600 68.430 -0.830 1
1 811 . 9 1 1 A 65 65 THR N N 125 119.800 116.629 3.171 1
1 812 . 9 1 1 A 66 66 LEU H H 126 8.020 8.163 -0.143 1
1 813 . 9 1 1 A 66 66 LEU HA H 126 3.790 3.819 -0.029 1
1 823 . 9 1 1 A 66 66 LEU C C 126 179.200 179.352 -0.152 1
1 824 . 9 1 1 A 66 66 LEU CA C 126 58.700 58.003 0.697 1
1 825 . 9 1 1 A 66 66 LEU CB C 126 41.300 41.217 0.083 1
1 829 . 9 1 1 A 66 66 LEU N N 126 121.200 120.933 0.267 1
1 830 . 9 1 1 A 67 67 LYS H H 127 8.380 8.159 0.221 1
1 831 . 9 1 1 A 67 67 LYS HA H 127 3.740 4.111 -0.371 1
1 840 . 9 1 1 A 67 67 LYS C C 127 178.300 179.323 -1.023 1
1 841 . 9 1 1 A 67 67 LYS CA C 127 60.100 59.457 0.643 1
1 842 . 9 1 1 A 67 67 LYS CB C 127 32.400 32.211 0.189 1
1 846 . 9 1 1 A 67 67 LYS N N 127 117.000 118.300 -1.300 1
1 847 . 9 1 1 A 68 68 ALA H H 128 7.480 8.095 -0.615 1
1 848 . 9 1 1 A 68 68 ALA HA H 128 4.210 4.024 0.186 1
1 852 . 9 1 1 A 68 68 ALA C C 128 181.200 179.777 1.423 1
1 853 . 9 1 1 A 68 68 ALA CA C 128 55.200 54.911 0.289 1
1 854 . 9 1 1 A 68 68 ALA CB C 128 18.600 18.446 0.154 1
1 855 . 9 1 1 A 68 68 ALA N N 128 122.900 122.068 0.832 1
1 856 . 9 1 1 A 69 69 ILE H H 129 8.250 7.687 0.563 1
1 857 . 9 1 1 A 69 69 ILE HA H 129 3.130 3.231 -0.101 1
1 867 . 9 1 1 A 69 69 ILE C C 129 177.400 177.909 -0.509 1
1 868 . 9 1 1 A 69 69 ILE CA C 129 66.700 65.373 1.327 1
1 869 . 9 1 1 A 69 69 ILE CB C 129 37.900 37.545 0.355 1
1 873 . 9 1 1 A 69 69 ILE N N 129 122.800 118.738 4.062 1
1 874 . 9 1 1 A 70 70 ARG H H 130 8.040 7.817 0.223 1
1 875 . 9 1 1 A 70 70 ARG HA H 130 3.620 3.900 -0.280 1
1 882 . 9 1 1 A 70 70 ARG C C 130 177.800 178.622 -0.822 1
1 883 . 9 1 1 A 70 70 ARG CA C 130 60.700 59.848 0.852 1
1 884 . 9 1 1 A 70 70 ARG CB C 130 29.600 29.751 -0.151 1
1 887 . 9 1 1 A 70 70 ARG N N 130 119.700 120.620 -0.920 1
1 888 . 9 1 1 A 71 71 ASN H H 131 8.920 8.331 0.589 1
1 889 . 9 1 1 A 71 71 ASN HA H 131 4.430 4.477 -0.047 1
1 894 . 9 1 1 A 71 71 ASN C C 131 177.500 177.799 -0.299 1
1 895 . 9 1 1 A 71 71 ASN CA C 131 56.100 56.614 -0.514 1
1 896 . 9 1 1 A 71 71 ASN CB C 131 38.600 39.266 -0.666 1
1 898 . 9 1 1 A 71 71 ASN N N 131 117.200 118.008 -0.808 1
1 900 . 9 1 1 A 72 72 THR H H 132 8.300 8.345 -0.045 1
1 901 . 9 1 1 A 72 72 THR HA H 132 4.430 3.933 0.497 1
1 906 . 9 1 1 A 72 72 THR C C 132 175.100 176.477 -1.377 1
1 907 . 9 1 1 A 72 72 THR CA C 132 68.200 66.370 1.830 1
1 908 . 9 1 1 A 72 72 THR CB C 132 68.500 68.840 -0.340 1
1 910 . 9 1 1 A 72 72 THR N N 132 119.200 115.929 3.271 1
1 911 . 9 1 1 A 73 73 ALA H H 133 7.950 8.137 -0.187 1
1 912 . 9 1 1 A 73 73 ALA HA H 133 4.040 4.063 -0.023 1
1 916 . 9 1 1 A 73 73 ALA C C 133 178.200 179.377 -1.177 1
1 917 . 9 1 1 A 73 73 ALA CA C 133 55.900 55.429 0.471 1
1 918 . 9 1 1 A 73 73 ALA CB C 133 16.700 18.038 -1.338 1
1 919 . 9 1 1 A 73 73 ALA N N 133 120.900 123.699 -2.799 1
1 920 . 9 1 1 A 74 74 SER H H 134 8.440 8.431 0.009 1
1 921 . 9 1 1 A 74 74 SER HA H 134 4.430 4.343 0.087 1
1 924 . 9 1 1 A 74 74 SER C C 134 178.800 177.307 1.493 1
1 925 . 9 1 1 A 74 74 SER CA C 134 61.300 60.741 0.559 1
1 926 . 9 1 1 A 74 74 SER CB C 134 62.600 63.187 -0.587 1
1 927 . 9 1 1 A 74 74 SER N N 134 110.100 113.281 -3.181 1
1 928 . 9 1 1 A 75 75 GLN H H 135 8.340 7.491 0.849 1
1 929 . 9 1 1 A 75 75 GLN HA H 135 3.880 3.974 -0.094 1
1 936 . 9 1 1 A 75 75 GLN C C 135 178.800 178.824 -0.024 1
1 937 . 9 1 1 A 75 75 GLN CA C 135 59.600 58.579 1.021 1
1 938 . 9 1 1 A 75 75 GLN CB C 135 29.900 28.111 1.789 1
1 941 . 9 1 1 A 75 75 GLN N N 135 118.100 121.013 -2.913 1
1 943 . 9 1 1 A 76 76 ILE H H 136 7.670 7.246 0.424 1
1 944 . 9 1 1 A 76 76 ILE HA H 136 3.200 3.192 0.008 1
1 954 . 9 1 1 A 76 76 ILE C C 136 177.500 177.770 -0.270 1
1 955 . 9 1 1 A 76 76 ILE CA C 136 66.100 64.905 1.195 1
1 956 . 9 1 1 A 76 76 ILE CB C 136 37.400 37.225 0.175 1
1 960 . 9 1 1 A 76 76 ILE N N 136 122.500 120.252 2.248 1
1 961 . 9 1 1 A 77 77 PHE H H 137 7.930 7.842 0.088 1
1 962 . 9 1 1 A 77 77 PHE HA H 137 3.890 4.084 -0.194 1
1 969 . 9 1 1 A 77 77 PHE C C 137 178.200 178.154 0.046 1
1 970 . 9 1 1 A 77 77 PHE CA C 137 63.600 60.578 3.022 1
1 971 . 9 1 1 A 77 77 PHE CB C 137 39.300 38.457 0.843 1
1 976 . 9 1 1 A 77 77 PHE N N 137 116.100 118.793 -2.693 1
1 977 . 9 1 1 A 78 78 ARG H H 138 8.900 8.100 0.800 1
1 978 . 9 1 1 A 78 78 ARG HA H 138 3.910 3.878 0.032 1
1 986 . 9 1 1 A 78 78 ARG C C 138 178.300 178.801 -0.501 1
1 987 . 9 1 1 A 78 78 ARG CA C 138 60.100 59.240 0.860 1
1 988 . 9 1 1 A 78 78 ARG CB C 138 29.600 29.747 -0.147 1
1 991 . 9 1 1 A 78 78 ARG N N 138 118.600 119.465 -0.865 1
1 993 . 9 1 1 A 79 79 LEU H H 139 7.730 7.804 -0.074 1
1 994 . 9 1 1 A 79 79 LEU HA H 139 4.280 4.060 0.220 1
1 1004 . 9 1 1 A 79 79 LEU C C 139 179.000 178.441 0.559 1
1 1005 . 9 1 1 A 79 79 LEU CA C 139 57.800 57.678 0.122 1
1 1006 . 9 1 1 A 79 79 LEU CB C 139 41.900 41.290 0.610 1
1 1010 . 9 1 1 A 79 79 LEU N N 139 121.900 121.308 0.592 1
1 1011 . 9 1 1 A 80 80 ALA H H 140 7.590 7.425 0.165 1
1 1012 . 9 1 1 A 80 80 ALA HA H 140 2.710 2.705 0.005 1
1 1016 . 9 1 1 A 80 80 ALA C C 140 179.900 179.620 0.280 1
1 1017 . 9 1 1 A 80 80 ALA CA C 140 55.100 54.423 0.677 1
1 1018 . 9 1 1 A 80 80 ALA CB C 140 17.600 17.287 0.313 1
1 1019 . 9 1 1 A 80 80 ALA N N 140 123.400 120.258 3.142 1
1 1020 . 9 1 1 A 81 81 ILE H H 141 8.910 7.864 1.046 1
1 1021 . 9 1 1 A 81 81 ILE HA H 141 4.110 4.019 0.091 1
1 1031 . 9 1 1 A 81 81 ILE C C 141 181.700 177.845 3.855 1
1 1032 . 9 1 1 A 81 81 ILE CA C 141 64.800 65.330 -0.530 1
1 1033 . 9 1 1 A 81 81 ILE CB C 141 38.600 37.711 0.889 1
1 1037 . 9 1 1 A 81 81 ILE N N 141 122.400 118.864 3.536 1
1 1038 . 9 1 1 A 82 82 GLU H H 142 8.560 8.509 0.051 1
1 1039 . 9 1 1 A 82 82 GLU HA H 142 4.100 3.935 0.165 1
1 1044 . 9 1 1 A 82 82 GLU C C 142 177.700 178.489 -0.789 1
1 1045 . 9 1 1 A 82 82 GLU CA C 142 59.100 59.963 -0.863 1
1 1046 . 9 1 1 A 82 82 GLU CB C 142 29.200 29.326 -0.126 1
1 1048 . 9 1 1 A 82 82 GLU N N 142 123.200 120.199 3.001 1
1 1049 . 9 1 1 A 83 83 ASN H H 143 7.310 7.637 -0.327 1
1 1050 . 9 1 1 A 83 83 ASN HA H 143 4.750 4.900 -0.150 1
1 1055 . 9 1 1 A 83 83 ASN C C 143 173.200 174.125 -0.925 1
1 1056 . 9 1 1 A 83 83 ASN CA C 143 54.200 52.954 1.246 1
1 1057 . 9 1 1 A 83 83 ASN CB C 143 41.300 38.861 2.439 1
1 1059 . 9 1 1 A 83 83 ASN N N 143 114.900 115.018 -0.118 1
1 1061 . 9 1 1 A 84 84 ARG H H 144 8.320 7.912 0.408 1
1 1062 . 9 1 1 A 84 84 ARG HA H 144 4.120 3.999 0.121 1
1 1069 . 9 1 1 A 84 84 ARG C C 144 175.300 175.600 -0.300 1
1 1070 . 9 1 1 A 84 84 ARG CA C 144 57.100 56.962 0.138 1
1 1071 . 9 1 1 A 84 84 ARG CB C 144 26.000 26.849 -0.849 1
1 1074 . 9 1 1 A 84 84 ARG N N 144 114.400 114.961 -0.561 1
1 1075 . 9 1 1 A 85 85 ALA H H 145 8.350 8.431 -0.081 1
1 1076 . 9 1 1 A 85 85 ALA HA H 145 4.320 4.304 0.016 1
1 1080 . 9 1 1 A 85 85 ALA C C 145 176.500 177.128 -0.628 1
1 1081 . 9 1 1 A 85 85 ALA CA C 145 53.400 52.961 0.439 1
1 1082 . 9 1 1 A 85 85 ALA CB C 145 19.900 19.950 -0.050 1
1 1083 . 9 1 1 A 85 85 ALA N N 145 120.600 118.412 2.188 1
1 1084 . 9 1 1 A 86 86 ILE H H 146 7.290 7.521 -0.231 1
1 1085 . 9 1 1 A 86 86 ILE HA H 146 4.400 4.484 -0.084 1
1 1095 . 9 1 1 A 86 86 ILE C C 146 173.600 173.447 0.153 1
1 1096 . 9 1 1 A 86 86 ILE CA C 146 59.200 59.442 -0.242 1
1 1097 . 9 1 1 A 86 86 ILE CB C 146 41.600 41.211 0.389 1
1 1101 . 9 1 1 A 86 86 ILE N N 146 111.500 115.590 -4.090 1
1 1102 . 9 1 1 A 87 87 ASP H H 147 8.270 8.665 -0.395 1
1 1103 . 9 1 1 A 87 87 ASP HA H 147 4.940 4.853 0.087 1
1 1106 . 9 1 1 A 87 87 ASP C C 147 174.700 175.534 -0.834 1
1 1107 . 9 1 1 A 87 87 ASP CA C 147 53.700 53.119 0.581 1
1 1108 . 9 1 1 A 87 87 ASP CB C 147 41.800 41.584 0.216 1
1 1109 . 9 1 1 A 87 87 ASP N N 147 119.400 127.496 -8.096 1
1 1110 . 9 1 1 A 88 88 PHE H H 148 7.230 7.227 0.003 1
1 1111 . 9 1 1 A 88 88 PHE HA H 148 4.690 5.198 -0.508 1
1 1119 . 9 1 1 A 88 88 PHE C C 148 171.500 172.241 -0.741 1
1 1120 . 9 1 1 A 88 88 PHE CA C 148 56.400 56.059 0.341 1
1 1121 . 9 1 1 A 88 88 PHE CB C 148 42.000 41.630 0.370 1
1 1127 . 9 1 1 A 88 88 PHE N N 148 119.700 116.900 2.800 1
1 1128 . 9 1 1 A 89 89 ASN H H 149 8.060 8.906 -0.846 1
1 1129 . 9 1 1 A 89 89 ASN HA H 149 4.490 5.029 -0.539 1
1 1134 . 9 1 1 A 89 89 ASN CA C 149 48.100 49.205 -1.105 1
1 1135 . 9 1 1 A 89 89 ASN CB C 149 39.200 39.922 -0.722 1
1 1137 . 9 1 1 A 89 89 ASN N N 149 119.700 119.753 -0.053 1
1 1139 . 9 1 1 A 90 90 PRO HA H 150 3.970 4.305 -0.335 1
1 1146 . 9 1 1 A 90 90 PRO C C 150 177.700 177.950 -0.250 1
1 1147 . 9 1 1 A 90 90 PRO CA C 150 63.900 64.960 -1.060 1
1 1148 . 9 1 1 A 90 90 PRO CB C 150 31.700 31.509 0.191 1
1 1151 . 9 1 1 A 91 91 ALA H H 151 7.240 7.501 -0.261 1
1 1152 . 9 1 1 A 91 91 ALA HA H 151 3.900 4.076 -0.176 1
1 1156 . 9 1 1 A 91 91 ALA C C 151 178.000 179.977 -1.977 1
1 1157 . 9 1 1 A 91 91 ALA CA C 151 53.900 54.959 -1.059 1
1 1158 . 9 1 1 A 91 91 ALA CB C 151 17.700 18.488 -0.788 1
1 1159 . 9 1 1 A 91 91 ALA N N 151 115.700 119.094 -3.394 1
1 1160 . 9 1 1 A 92 92 ASP H H 152 7.080 8.084 -1.004 1
1 1161 . 9 1 1 A 92 92 ASP HA H 152 4.220 4.406 -0.186 1
1 1164 . 9 1 1 A 92 92 ASP C C 152 176.200 177.991 -1.791 1
1 1165 . 9 1 1 A 92 92 ASP CA C 152 55.800 56.939 -1.139 1
1 1166 . 9 1 1 A 92 92 ASP CB C 152 39.500 40.680 -1.180 1
1 1167 . 9 1 1 A 92 92 ASP N N 152 117.100 119.316 -2.216 1
1 1168 . 9 1 1 A 93 93 TYR H H 153 7.060 7.343 -0.283 1
1 1169 . 9 1 1 A 93 93 TYR HA H 153 4.490 4.214 0.276 1
1 1176 . 9 1 1 A 93 93 TYR C C 153 174.700 176.151 -1.451 1
1 1177 . 9 1 1 A 93 93 TYR CA C 153 57.600 59.723 -2.123 1
1 1178 . 9 1 1 A 93 93 TYR CB C 153 38.500 39.514 -1.014 1
1 1183 . 9 1 1 A 93 93 TYR N N 153 116.800 120.879 -4.079 1
1 1184 . 9 1 1 A 94 94 VAL H H 154 7.000 7.098 -0.098 1
1 1185 . 9 1 1 A 94 94 VAL HA H 154 4.040 3.751 0.289 1
1 1193 . 9 1 1 A 94 94 VAL C C 154 174.700 175.014 -0.314 1
1 1194 . 9 1 1 A 94 94 VAL CA C 154 62.100 63.006 -0.906 1
1 1195 . 9 1 1 A 94 94 VAL CB C 154 32.700 31.858 0.842 1
1 1198 . 9 1 1 A 94 94 VAL N N 154 120.600 120.568 0.032 1
1 1199 . 9 1 1 A 95 95 ARG H H 155 9.430 8.640 0.790 1
1 1200 . 9 1 1 A 95 95 ARG HA H 155 4.640 4.750 -0.110 1
1 1207 . 9 1 1 A 95 95 ARG C C 155 175.400 175.237 0.163 1
1 1208 . 9 1 1 A 95 95 ARG CA C 155 54.200 54.378 -0.178 1
1 1209 . 9 1 1 A 95 95 ARG CB C 155 32.400 32.263 0.137 1
1 1212 . 9 1 1 A 95 95 ARG N N 155 128.200 127.614 0.586 1
1 1213 . 9 1 1 A 96 96 ILE H H 156 8.700 8.470 0.230 1
1 1214 . 9 1 1 A 96 96 ILE HA H 156 4.440 4.238 0.202 1
1 1224 . 9 1 1 A 96 96 ILE CA C 156 56.500 60.080 -3.580 1
1 1225 . 9 1 1 A 96 96 ILE CB C 156 36.700 38.631 -1.931 1
1 1229 . 9 1 1 A 96 96 ILE N N 156 124.100 127.325 -3.225 1
1 1230 . 9 1 1 A 97 97 PRO HA H 157 4.370 4.345 0.025 1
1 1237 . 9 1 1 A 97 97 PRO C C 157 176.000 176.833 -0.833 1
1 1238 . 9 1 1 A 97 97 PRO CA C 157 63.200 63.720 -0.520 1
1 1239 . 9 1 1 A 97 97 PRO CB C 157 32.400 32.022 0.378 1
1 1242 . 9 1 1 A 98 98 LYS H H 158 8.380 9.133 -0.753 1
1 1243 . 9 1 1 A 98 98 LYS HA H 158 4.190 3.964 0.226 1
1 1252 . 9 1 1 A 98 98 LYS C C 158 176.800 176.158 0.642 1
1 1253 . 9 1 1 A 98 98 LYS CA C 158 57.100 58.386 -1.286 1
1 1254 . 9 1 1 A 98 98 LYS CB C 158 32.800 30.344 2.456 1
1 1258 . 9 1 1 A 98 98 LYS N N 158 120.800 116.255 4.545 1
1 1259 . 9 1 1 A 99 99 ILE H H 159 7.930 8.576 -0.646 1
1 1260 . 9 1 1 A 99 99 ILE HA H 159 4.200 3.792 0.408 1
1 1270 . 9 1 1 A 99 99 ILE C C 159 175.400 175.198 0.202 1
1 1271 . 9 1 1 A 99 99 ILE CA C 159 60.600 63.983 -3.383 1
1 1272 . 9 1 1 A 99 99 ILE CB C 159 39.100 35.806 3.294 1
1 1276 . 9 1 1 A 99 99 ILE N N 159 120.200 116.280 3.920 1
1 1277 . 9 1 1 A 100 100 ALA H H 160 8.370 8.505 -0.135 1
1 1278 . 9 1 1 A 100 100 ALA HA H 160 4.370 4.409 -0.039 1
1 1282 . 9 1 1 A 100 100 ALA C C 160 177.200 177.701 -0.501 1
1 1283 . 9 1 1 A 100 100 ALA CA C 160 52.200 52.392 -0.192 1
1 1284 . 9 1 1 A 100 100 ALA CB C 160 19.400 20.412 -1.012 1
1 1285 . 9 1 1 A 100 100 ALA N N 160 128.300 124.827 3.473 1
1 1286 . 9 1 1 A 101 101 LEU H H 161 8.250 8.606 -0.356 1
1 1287 . 9 1 1 A 101 101 LEU HA H 161 4.280 4.664 -0.384 1
1 1297 . 9 1 1 A 101 101 LEU C C 161 177.200 176.573 0.627 1
1 1298 . 9 1 1 A 101 101 LEU CA C 161 55.200 54.091 1.109 1
1 1299 . 9 1 1 A 101 101 LEU CB C 161 42.400 42.336 0.064 1
1 1303 . 9 1 1 A 101 101 LEU N N 161 121.900 117.750 4.150 1
1 1304 . 9 1 1 A 102 102 GLU H H 162 8.390 7.762 0.628 1
1 1305 . 9 1 1 A 102 102 GLU HA H 162 4.230 4.598 -0.368 1
1 1310 . 9 1 1 A 102 102 GLU C C 162 176.100 175.048 1.052 1
1 1311 . 9 1 1 A 102 102 GLU CA C 162 56.400 55.581 0.819 1
1 1312 . 9 1 1 A 102 102 GLU CB C 162 30.500 30.651 -0.151 1
1 1314 . 9 1 1 A 102 102 GLU N N 162 121.300 121.645 -0.345 1
1 1315 . 9 1 1 A 103 103 HIS H H 163 8.330 9.017 -0.687 1
1 1316 . 9 1 1 A 103 103 HIS HA H 163 4.590 5.137 -0.547 1
1 1319 . 9 1 1 A 103 103 HIS C C 163 176.100 174.492 1.608 1
1 1320 . 9 1 1 A 103 103 HIS CA C 163 56.000 54.307 1.693 1
1 1321 . 9 1 1 A 103 103 HIS CB C 163 30.500 31.297 -0.797 1
1 1322 . 9 1 1 A 103 103 HIS N N 163 120.000 128.060 -8.060 1
1 1323 . 9 1 1 A 107 107 HIS HA H 167 4.620 4.668 -0.048 1
1 1326 . 9 1 1 A 107 107 HIS C C 167 173.900 173.563 0.337 1
1 1327 . 9 1 1 A 107 107 HIS CA C 167 56.000 54.094 1.906 1
1 1328 . 9 1 1 A 107 107 HIS CB C 167 30.300 30.124 0.176 1
1 15 . 10 1 1 A 2 2 ASP H H 62 8.760 9.062 -0.302 1
1 16 . 10 1 1 A 2 2 ASP HA H 62 4.810 5.280 -0.470 1
1 19 . 10 1 1 A 2 2 ASP C C 62 175.800 173.910 1.890 1
1 20 . 10 1 1 A 2 2 ASP CA C 62 54.800 52.756 2.044 1
1 21 . 10 1 1 A 2 2 ASP CB C 62 41.600 44.749 -3.149 1
1 22 . 10 1 1 A 2 2 ASP N N 62 120.900 123.094 -2.194 1
1 23 . 10 1 1 A 3 3 SER H H 63 8.710 8.771 -0.061 1
1 24 . 10 1 1 A 3 3 SER HA H 63 4.970 5.043 -0.073 1
1 27 . 10 1 1 A 3 3 SER C C 63 175.600 174.844 0.756 1
1 28 . 10 1 1 A 3 3 SER CA C 63 57.500 55.837 1.663 1
1 29 . 10 1 1 A 3 3 SER CB C 63 65.900 65.744 0.156 1
1 30 . 10 1 1 A 3 3 SER N N 63 116.300 115.325 0.975 1
1 31 . 10 1 1 A 4 4 PHE H H 64 9.370 9.160 0.210 1
1 32 . 10 1 1 A 4 4 PHE HA H 64 4.010 4.257 -0.247 1
1 39 . 10 1 1 A 4 4 PHE C C 64 176.700 177.394 -0.694 1
1 40 . 10 1 1 A 4 4 PHE CA C 64 62.200 61.683 0.517 1
1 41 . 10 1 1 A 4 4 PHE CB C 64 38.500 39.386 -0.886 1
1 46 . 10 1 1 A 4 4 PHE N N 64 121.400 127.017 -5.617 1
1 47 . 10 1 1 A 5 5 GLY H H 65 8.930 7.926 1.004 1
1 48 . 10 1 1 A 5 5 GLY HA2 H 65 2.020 2.881 -0.861 1
1 49 . 10 1 1 A 5 5 GLY HA3 H 65 3.250 2.970 0.280 1
1 50 . 10 1 1 A 5 5 GLY C C 65 175.200 175.236 -0.036 1
1 51 . 10 1 1 A 5 5 GLY CA C 65 46.300 46.803 -0.503 1
1 52 . 10 1 1 A 5 5 GLY N N 65 106.500 105.355 1.145 1
1 53 . 10 1 1 A 6 6 ASP H H 66 7.630 7.876 -0.246 1
1 54 . 10 1 1 A 6 6 ASP HA H 66 4.100 4.254 -0.154 1
1 57 . 10 1 1 A 6 6 ASP C C 66 179.500 178.513 0.987 1
1 58 . 10 1 1 A 6 6 ASP CA C 66 57.400 56.863 0.537 1
1 59 . 10 1 1 A 6 6 ASP CB C 66 40.500 41.000 -0.500 1
1 60 . 10 1 1 A 6 6 ASP N N 66 120.500 120.726 -0.226 1
1 61 . 10 1 1 A 7 7 TRP H H 67 7.190 7.713 -0.523 1
1 62 . 10 1 1 A 7 7 TRP HA H 67 3.860 4.195 -0.335 1
1 71 . 10 1 1 A 7 7 TRP C C 67 177.200 178.230 -1.030 1
1 72 . 10 1 1 A 7 7 TRP CA C 67 61.100 59.715 1.385 1
1 73 . 10 1 1 A 7 7 TRP CB C 67 28.300 28.634 -0.334 1
1 79 . 10 1 1 A 7 7 TRP N N 67 120.700 120.193 0.507 1
1 81 . 10 1 1 A 8 8 ALA H H 68 9.040 8.248 0.792 1
1 82 . 10 1 1 A 8 8 ALA HA H 68 3.730 3.843 -0.113 1
1 86 . 10 1 1 A 8 8 ALA C C 68 179.500 179.868 -0.368 1
1 87 . 10 1 1 A 8 8 ALA CA C 68 55.200 55.251 -0.051 1
1 88 . 10 1 1 A 8 8 ALA CB C 68 18.600 18.057 0.543 1
1 89 . 10 1 1 A 8 8 ALA N N 68 125.700 122.581 3.119 1
1 90 . 10 1 1 A 9 9 GLU H H 69 8.060 7.852 0.208 1
1 91 . 10 1 1 A 9 9 GLU HA H 69 4.020 4.038 -0.018 1
1 96 . 10 1 1 A 9 9 GLU C C 69 180.400 178.812 1.588 1
1 97 . 10 1 1 A 9 9 GLU CA C 69 58.800 59.352 -0.552 1
1 98 . 10 1 1 A 9 9 GLU CB C 69 28.500 29.253 -0.753 1
1 99 . 10 1 1 A 9 9 GLU N N 69 115.400 117.913 -2.513 1
1 100 . 10 1 1 A 10 10 LYS H H 70 7.740 7.926 -0.186 1
1 101 . 10 1 1 A 10 10 LYS HA H 70 3.910 4.005 -0.095 1
1 110 . 10 1 1 A 10 10 LYS C C 70 179.500 179.111 0.389 1
1 111 . 10 1 1 A 10 10 LYS CA C 70 60.000 59.564 0.436 1
1 112 . 10 1 1 A 10 10 LYS CB C 70 32.400 32.247 0.153 1
1 116 . 10 1 1 A 10 10 LYS N N 70 122.700 119.793 2.907 1
1 117 . 10 1 1 A 11 11 PHE H H 71 8.750 8.413 0.337 1
1 118 . 10 1 1 A 11 11 PHE HA H 71 4.080 4.059 0.021 1
1 126 . 10 1 1 A 11 11 PHE C C 71 177.100 177.441 -0.341 1
1 127 . 10 1 1 A 11 11 PHE CA C 71 61.200 61.385 -0.185 1
1 128 . 10 1 1 A 11 11 PHE CB C 71 38.900 39.153 -0.253 1
1 134 . 10 1 1 A 11 11 PHE N N 71 123.500 120.504 2.996 1
1 135 . 10 1 1 A 12 12 LEU H H 72 8.400 8.593 -0.193 1
1 136 . 10 1 1 A 12 12 LEU HA H 72 3.520 3.723 -0.203 1
1 146 . 10 1 1 A 12 12 LEU C C 72 180.000 179.138 0.862 1
1 147 . 10 1 1 A 12 12 LEU CA C 72 58.200 57.965 0.235 1
1 148 . 10 1 1 A 12 12 LEU CB C 72 41.700 41.536 0.164 1
1 152 . 10 1 1 A 12 12 LEU N N 72 121.100 119.784 1.316 1
1 153 . 10 1 1 A 13 13 LYS H H 73 7.810 8.155 -0.345 1
1 154 . 10 1 1 A 13 13 LYS HA H 73 4.080 4.038 0.042 1
1 156 . 10 1 1 A 13 13 LYS C C 73 179.300 178.621 0.679 1
1 157 . 10 1 1 A 13 13 LYS CA C 73 59.000 58.548 0.452 1
1 158 . 10 1 1 A 13 13 LYS CB C 73 31.900 31.778 0.122 1
1 159 . 10 1 1 A 13 13 LYS N N 73 119.400 119.817 -0.417 1
1 160 . 10 1 1 A 14 14 SER H H 74 8.210 8.030 0.180 1
1 161 . 10 1 1 A 14 14 SER HA H 74 4.210 4.077 0.133 1
1 164 . 10 1 1 A 14 14 SER C C 74 176.300 176.998 -0.698 1
1 165 . 10 1 1 A 14 14 SER CA C 74 61.400 61.392 0.008 1
1 166 . 10 1 1 A 14 14 SER CB C 74 62.600 62.728 -0.128 1
1 167 . 10 1 1 A 14 14 SER N N 74 117.600 115.179 2.421 1
1 168 . 10 1 1 A 15 15 LYS H H 75 7.760 7.422 0.338 1
1 169 . 10 1 1 A 15 15 LYS HA H 75 4.040 3.967 0.073 1
1 178 . 10 1 1 A 15 15 LYS C C 75 178.500 179.042 -0.542 1
1 179 . 10 1 1 A 15 15 LYS CA C 75 56.500 59.222 -2.722 1
1 180 . 10 1 1 A 15 15 LYS CB C 75 30.600 32.012 -1.412 1
1 184 . 10 1 1 A 15 15 LYS N N 75 120.100 121.485 -1.385 1
1 185 . 10 1 1 A 16 16 GLU H H 76 7.680 8.467 -0.787 1
1 186 . 10 1 1 A 16 16 GLU HA H 76 4.030 4.008 0.022 1
1 191 . 10 1 1 A 16 16 GLU C C 76 179.900 178.799 1.101 1
1 192 . 10 1 1 A 16 16 GLU CA C 76 59.200 59.637 -0.437 1
1 193 . 10 1 1 A 16 16 GLU CB C 76 29.600 29.280 0.320 1
1 195 . 10 1 1 A 16 16 GLU N N 76 119.700 119.710 -0.010 1
1 196 . 10 1 1 A 17 17 ALA H H 77 8.030 8.374 -0.344 1
1 197 . 10 1 1 A 17 17 ALA HA H 77 4.200 4.055 0.145 1
1 201 . 10 1 1 A 17 17 ALA C C 77 178.900 179.277 -0.377 1
1 202 . 10 1 1 A 17 17 ALA CA C 77 54.400 54.702 -0.302 1
1 203 . 10 1 1 A 17 17 ALA CB C 77 18.100 18.136 -0.036 1
1 204 . 10 1 1 A 17 17 ALA N N 77 123.000 121.279 1.721 1
1 205 . 10 1 1 A 18 18 ASP H H 78 7.860 7.832 0.028 1
1 206 . 10 1 1 A 18 18 ASP HA H 78 4.600 4.462 0.138 1
1 209 . 10 1 1 A 18 18 ASP C C 78 177.500 176.263 1.237 1
1 210 . 10 1 1 A 18 18 ASP CA C 78 55.100 55.289 -0.189 1
1 211 . 10 1 1 A 18 18 ASP CB C 78 41.400 41.172 0.228 1
1 212 . 10 1 1 A 18 18 ASP N N 78 117.700 117.351 0.349 1
1 213 . 10 1 1 A 19 19 GLY H H 79 7.910 7.929 -0.019 1
1 214 . 10 1 1 A 19 19 GLY HA2 H 79 3.860 4.055 -0.195 1
1 215 . 10 1 1 A 19 19 GLY HA3 H 79 4.080 4.056 0.024 1
1 216 . 10 1 1 A 19 19 GLY C C 79 175.300 174.242 1.058 1
1 217 . 10 1 1 A 19 19 GLY CA C 79 46.200 45.479 0.721 1
1 218 . 10 1 1 A 19 19 GLY N N 79 107.100 106.854 0.246 1
1 219 . 10 1 1 A 20 20 VAL H H 80 7.150 7.461 -0.311 1
1 220 . 10 1 1 A 20 20 VAL HA H 80 4.250 4.855 -0.605 1
1 228 . 10 1 1 A 20 20 VAL C C 80 175.100 175.297 -0.197 1
1 229 . 10 1 1 A 20 20 VAL CA C 80 61.800 59.568 2.232 1
1 230 . 10 1 1 A 20 20 VAL CB C 80 32.200 34.671 -2.471 1
1 233 . 10 1 1 A 20 20 VAL N N 80 114.600 115.290 -0.690 1
1 234 . 10 1 1 A 21 21 SER H H 81 8.560 8.773 -0.213 1
1 235 . 10 1 1 A 21 21 SER HA H 81 4.390 4.811 -0.421 1
1 238 . 10 1 1 A 21 21 SER C C 81 174.600 176.172 -1.572 1
1 239 . 10 1 1 A 21 21 SER CA C 81 57.900 57.077 0.823 1
1 240 . 10 1 1 A 21 21 SER CB C 81 64.700 65.662 -0.962 1
1 241 . 10 1 1 A 21 21 SER N N 81 118.700 116.854 1.846 1
1 242 . 10 1 1 A 22 22 VAL H H 82 8.690 8.789 -0.099 1
1 243 . 10 1 1 A 22 22 VAL HA H 82 3.700 3.665 0.035 1
1 251 . 10 1 1 A 22 22 VAL C C 82 178.000 177.571 0.429 1
1 252 . 10 1 1 A 22 22 VAL CA C 82 66.500 66.597 -0.097 1
1 253 . 10 1 1 A 22 22 VAL CB C 82 31.700 31.433 0.267 1
1 256 . 10 1 1 A 22 22 VAL N N 82 122.100 121.974 0.126 1
1 257 . 10 1 1 A 23 23 SER H H 83 8.300 8.054 0.246 1
1 258 . 10 1 1 A 23 23 SER HA H 83 4.210 4.014 0.196 1
1 261 . 10 1 1 A 23 23 SER C C 83 177.600 177.464 0.136 1
1 262 . 10 1 1 A 23 23 SER CA C 83 61.400 61.529 -0.129 1
1 263 . 10 1 1 A 23 23 SER CB C 83 62.400 62.914 -0.514 1
1 264 . 10 1 1 A 23 23 SER N N 83 113.600 115.425 -1.825 1
1 265 . 10 1 1 A 24 24 GLN H H 84 7.820 7.931 -0.111 1
1 266 . 10 1 1 A 24 24 GLN HA H 84 3.970 3.854 0.116 1
1 273 . 10 1 1 A 24 24 GLN C C 84 178.400 178.331 0.069 1
1 274 . 10 1 1 A 24 24 GLN CA C 84 58.400 58.793 -0.393 1
1 275 . 10 1 1 A 24 24 GLN CB C 84 28.900 28.075 0.825 1
1 278 . 10 1 1 A 24 24 GLN N N 84 122.900 120.604 2.296 1
1 280 . 10 1 1 A 25 25 LEU H H 85 8.920 8.446 0.474 1
1 281 . 10 1 1 A 25 25 LEU HA H 85 4.130 4.173 -0.043 1
1 291 . 10 1 1 A 25 25 LEU C C 85 178.800 179.265 -0.465 1
1 292 . 10 1 1 A 25 25 LEU CA C 85 58.300 57.996 0.304 1
1 293 . 10 1 1 A 25 25 LEU CB C 85 41.200 41.061 0.139 1
1 297 . 10 1 1 A 25 25 LEU N N 85 122.200 119.492 2.708 1
1 298 . 10 1 1 A 26 26 ASN H H 86 8.860 8.519 0.341 1
1 299 . 10 1 1 A 26 26 ASN HA H 86 4.420 4.468 -0.048 1
1 304 . 10 1 1 A 26 26 ASN C C 86 179.000 177.517 1.483 1
1 305 . 10 1 1 A 26 26 ASN CA C 86 55.900 56.007 -0.107 1
1 306 . 10 1 1 A 26 26 ASN CB C 86 37.200 38.388 -1.188 1
1 308 . 10 1 1 A 26 26 ASN N N 86 117.600 118.929 -1.329 1
1 310 . 10 1 1 A 27 27 SER H H 87 7.840 8.021 -0.181 1
1 311 . 10 1 1 A 27 27 SER HA H 87 4.100 4.256 -0.156 1
1 314 . 10 1 1 A 27 27 SER C C 87 179.000 177.144 1.856 1
1 315 . 10 1 1 A 27 27 SER CA C 87 62.100 61.258 0.842 1
1 316 . 10 1 1 A 27 27 SER CB C 87 62.100 62.875 -0.775 1
1 317 . 10 1 1 A 27 27 SER N N 87 118.500 114.620 3.880 1
1 318 . 10 1 1 A 28 28 TYR H H 88 8.180 7.840 0.340 1
1 319 . 10 1 1 A 28 28 TYR HA H 88 4.600 4.276 0.324 1
1 326 . 10 1 1 A 28 28 TYR C C 88 174.800 178.536 -3.736 1
1 327 . 10 1 1 A 28 28 TYR CA C 88 61.200 62.112 -0.912 1
1 328 . 10 1 1 A 28 28 TYR CB C 88 37.800 37.917 -0.117 1
1 333 . 10 1 1 A 28 28 TYR N N 88 119.300 119.462 -0.162 1
1 334 . 10 1 1 A 29 29 LYS H H 89 9.040 8.195 0.845 1
1 335 . 10 1 1 A 29 29 LYS HA H 89 3.890 4.051 -0.161 1
1 344 . 10 1 1 A 29 29 LYS C C 89 179.000 179.038 -0.038 1
1 345 . 10 1 1 A 29 29 LYS CA C 89 61.300 59.601 1.699 1
1 346 . 10 1 1 A 29 29 LYS CB C 89 32.800 32.236 0.564 1
1 350 . 10 1 1 A 29 29 LYS N N 89 119.300 119.585 -0.285 1
1 351 . 10 1 1 A 30 30 ASN H H 90 7.770 7.728 0.042 1
1 352 . 10 1 1 A 30 30 ASN HA H 90 4.560 4.552 0.008 1
1 357 . 10 1 1 A 30 30 ASN C C 90 178.300 177.839 0.461 1
1 358 . 10 1 1 A 30 30 ASN CA C 90 56.200 56.451 -0.251 1
1 359 . 10 1 1 A 30 30 ASN CB C 90 38.900 38.929 -0.029 1
1 361 . 10 1 1 A 30 30 ASN N N 90 117.800 118.541 -0.741 1
1 363 . 10 1 1 A 31 31 TYR H H 91 8.860 8.286 0.574 1
1 364 . 10 1 1 A 31 31 TYR HA H 91 4.910 4.516 0.394 1
1 371 . 10 1 1 A 31 31 TYR C C 91 178.300 179.193 -0.893 1
1 372 . 10 1 1 A 31 31 TYR CA C 91 59.700 60.693 -0.993 1
1 373 . 10 1 1 A 31 31 TYR CB C 91 37.500 37.369 0.131 1
1 378 . 10 1 1 A 31 31 TYR N N 91 119.400 118.552 0.848 1
1 379 . 10 1 1 A 32 32 CYS H H 92 8.640 8.368 0.272 1
1 380 . 10 1 1 A 32 32 CYS HA H 92 4.410 4.426 -0.016 1
1 383 . 10 1 1 A 32 32 CYS C C 92 173.700 176.174 -2.474 1
1 384 . 10 1 1 A 32 32 CYS CA C 92 65.500 61.684 3.816 1
1 385 . 10 1 1 A 32 32 CYS CB C 92 28.300 27.452 0.848 1
1 386 . 10 1 1 A 32 32 CYS N N 92 113.500 120.034 -6.534 1
1 387 . 10 1 1 A 33 33 ARG H H 93 8.440 7.613 0.827 1
1 388 . 10 1 1 A 33 33 ARG HA H 93 3.740 4.255 -0.515 1
1 391 . 10 1 1 A 33 33 ARG C C 93 177.200 177.757 -0.557 1
1 392 . 10 1 1 A 33 33 ARG CA C 93 58.300 56.990 1.310 1
1 393 . 10 1 1 A 33 33 ARG CB C 93 30.200 30.617 -0.417 1
1 394 . 10 1 1 A 33 33 ARG N N 93 111.400 118.965 -7.565 1
1 395 . 10 1 1 A 34 34 ASN H H 94 8.020 8.360 -0.340 1
1 396 . 10 1 1 A 34 34 ASN HA H 94 4.980 4.693 0.287 1
1 401 . 10 1 1 A 34 34 ASN C C 94 176.700 177.091 -0.391 1
1 402 . 10 1 1 A 34 34 ASN CA C 94 53.400 54.992 -1.592 1
1 403 . 10 1 1 A 34 34 ASN CB C 94 38.000 39.511 -1.511 1
1 405 . 10 1 1 A 34 34 ASN N N 94 113.600 115.652 -2.052 1
1 407 . 10 1 1 A 35 35 HIS H H 95 7.200 7.648 -0.448 1
1 408 . 10 1 1 A 35 35 HIS HA H 95 4.470 4.440 0.030 1
1 411 . 10 1 1 A 35 35 HIS C C 95 176.600 176.035 0.565 1
1 412 . 10 1 1 A 35 35 HIS CA C 95 60.000 59.429 0.571 1
1 413 . 10 1 1 A 35 35 HIS CB C 95 30.500 31.166 -0.666 1
1 414 . 10 1 1 A 35 35 HIS N N 95 115.600 118.108 -2.508 1
1 415 . 10 1 1 A 36 36 LEU H H 96 8.170 7.935 0.235 1
1 416 . 10 1 1 A 36 36 LEU HA H 96 4.730 4.586 0.144 1
1 426 . 10 1 1 A 36 36 LEU C C 96 176.800 177.369 -0.569 1
1 427 . 10 1 1 A 36 36 LEU CA C 96 54.400 54.545 -0.145 1
1 428 . 10 1 1 A 36 36 LEU CB C 96 40.600 41.922 -1.322 1
1 432 . 10 1 1 A 36 36 LEU N N 96 114.000 119.026 -5.026 1
1 433 . 10 1 1 A 37 37 SER H H 97 7.140 8.295 -1.155 1
1 434 . 10 1 1 A 37 37 SER HA H 97 4.730 4.336 0.394 1
1 437 . 10 1 1 A 37 37 SER CA C 97 62.700 62.837 -0.137 1
1 438 . 10 1 1 A 37 37 SER CB C 97 62.600 61.219 1.381 1
1 439 . 10 1 1 A 37 37 SER N N 97 117.200 116.067 1.133 1
1 440 . 10 1 1 A 38 38 PRO HA H 98 4.560 4.444 0.116 1
1 447 . 10 1 1 A 38 38 PRO C C 98 177.900 177.810 0.090 1
1 448 . 10 1 1 A 38 38 PRO CA C 98 65.700 65.137 0.563 1
1 449 . 10 1 1 A 38 38 PRO CB C 98 31.800 31.305 0.495 1
1 452 . 10 1 1 A 39 39 LEU H H 99 8.090 7.757 0.333 1
1 453 . 10 1 1 A 39 39 LEU HA H 99 4.260 4.173 0.087 1
1 463 . 10 1 1 A 39 39 LEU C C 99 178.700 178.274 0.426 1
1 464 . 10 1 1 A 39 39 LEU CA C 99 54.300 57.005 -2.705 1
1 465 . 10 1 1 A 39 39 LEU CB C 99 42.400 41.763 0.637 1
1 469 . 10 1 1 A 39 39 LEU N N 99 112.400 117.232 -4.832 1
1 470 . 10 1 1 A 40 40 TYR H H 100 8.350 8.524 -0.174 1
1 471 . 10 1 1 A 40 40 TYR HA H 100 4.170 4.451 -0.281 1
1 478 . 10 1 1 A 40 40 TYR C C 100 178.300 178.207 0.093 1
1 479 . 10 1 1 A 40 40 TYR CA C 100 63.400 62.039 1.361 1
1 480 . 10 1 1 A 40 40 TYR CB C 100 38.600 39.265 -0.665 1
1 485 . 10 1 1 A 40 40 TYR N N 100 119.400 120.994 -1.594 1
1 486 . 10 1 1 A 41 41 MET H H 101 8.640 7.824 0.816 1
1 487 . 10 1 1 A 41 41 MET HA H 101 4.260 4.535 -0.275 1
1 488 . 10 1 1 A 41 41 MET C C 101 177.000 176.123 0.877 1
1 489 . 10 1 1 A 41 41 MET CA C 101 54.600 54.870 -0.270 1
1 490 . 10 1 1 A 41 41 MET N N 101 111.800 117.749 -5.949 1
1 491 . 10 1 1 A 42 42 LYS H H 102 7.880 7.664 0.216 1
1 492 . 10 1 1 A 42 42 LYS HA H 102 4.430 4.528 -0.098 1
1 501 . 10 1 1 A 42 42 LYS C C 102 176.300 176.051 0.249 1
1 502 . 10 1 1 A 42 42 LYS CA C 102 56.000 55.232 0.768 1
1 503 . 10 1 1 A 42 42 LYS CB C 102 33.400 33.505 -0.105 1
1 507 . 10 1 1 A 42 42 LYS N N 102 121.700 120.694 1.006 1
1 508 . 10 1 1 A 43 43 SER H H 103 9.160 8.814 0.346 1
1 509 . 10 1 1 A 43 43 SER HA H 103 4.620 4.557 0.063 1
1 513 . 10 1 1 A 43 43 SER C C 103 176.300 175.272 1.028 1
1 514 . 10 1 1 A 43 43 SER CA C 103 58.700 58.670 0.030 1
1 515 . 10 1 1 A 43 43 SER CB C 103 63.700 63.572 0.128 1
1 516 . 10 1 1 A 43 43 SER N N 103 118.800 117.590 1.210 1
1 517 . 10 1 1 A 44 44 LEU H H 104 8.860 8.486 0.374 1
1 518 . 10 1 1 A 44 44 LEU HA H 104 4.130 4.185 -0.055 1
1 528 . 10 1 1 A 44 44 LEU C C 104 178.700 178.612 0.088 1
1 529 . 10 1 1 A 44 44 LEU CA C 104 58.800 58.601 0.199 1
1 530 . 10 1 1 A 44 44 LEU CB C 104 42.600 41.504 1.096 1
1 534 . 10 1 1 A 44 44 LEU N N 104 124.200 130.752 -6.552 1
1 535 . 10 1 1 A 45 45 SER H H 105 8.330 8.182 0.148 1
1 536 . 10 1 1 A 45 45 SER HA H 105 4.310 4.312 -0.002 1
1 539 . 10 1 1 A 45 45 SER C C 105 175.000 174.838 0.162 1
1 540 . 10 1 1 A 45 45 SER CA C 105 60.100 60.559 -0.459 1
1 541 . 10 1 1 A 45 45 SER CB C 105 63.400 63.279 0.121 1
1 542 . 10 1 1 A 45 45 SER N N 105 107.700 114.968 -7.268 1
1 543 . 10 1 1 A 46 46 GLU H H 106 7.800 7.622 0.178 1
1 544 . 10 1 1 A 46 46 GLU HA H 106 4.570 4.424 0.146 1
1 549 . 10 1 1 A 46 46 GLU C C 106 174.100 176.292 -2.192 1
1 550 . 10 1 1 A 46 46 GLU CA C 106 55.600 56.053 -0.453 1
1 551 . 10 1 1 A 46 46 GLU CB C 106 31.200 30.474 0.726 1
1 553 . 10 1 1 A 46 46 GLU N N 106 119.600 118.012 1.588 1
1 554 . 10 1 1 A 47 47 ILE H H 107 7.100 7.200 -0.100 1
1 555 . 10 1 1 A 47 47 ILE HA H 107 4.040 4.098 -0.058 1
1 565 . 10 1 1 A 47 47 ILE C C 107 174.100 174.909 -0.809 1
1 566 . 10 1 1 A 47 47 ILE CA C 107 62.300 61.004 1.296 1
1 567 . 10 1 1 A 47 47 ILE CB C 107 38.500 38.813 -0.313 1
1 571 . 10 1 1 A 47 47 ILE N N 107 120.600 121.364 -0.764 1
1 572 . 10 1 1 A 48 48 LEU H H 108 9.180 8.769 0.411 1
1 573 . 10 1 1 A 48 48 LEU HA H 108 4.940 4.742 0.198 1
1 583 . 10 1 1 A 48 48 LEU CA C 108 51.900 51.929 -0.029 1
1 584 . 10 1 1 A 48 48 LEU CB C 108 42.000 43.121 -1.121 1
1 588 . 10 1 1 A 48 48 LEU N N 108 129.400 127.794 1.606 1
1 589 . 10 1 1 A 49 49 PRO HA H 109 3.910 4.322 -0.412 1
1 596 . 10 1 1 A 49 49 PRO C C 109 178.500 178.039 0.461 1
1 597 . 10 1 1 A 49 49 PRO CA C 109 66.600 64.520 2.080 1
1 598 . 10 1 1 A 49 49 PRO CB C 109 31.300 31.755 -0.455 1
1 601 . 10 1 1 A 50 50 ALA H H 110 8.280 8.151 0.129 1
1 602 . 10 1 1 A 50 50 ALA HA H 110 4.110 4.050 0.060 1
1 606 . 10 1 1 A 50 50 ALA C C 110 179.700 180.224 -0.524 1
1 607 . 10 1 1 A 50 50 ALA CA C 110 55.100 55.313 -0.213 1
1 608 . 10 1 1 A 50 50 ALA CB C 110 19.200 18.261 0.939 1
1 609 . 10 1 1 A 50 50 ALA N N 110 116.100 119.059 -2.959 1
1 610 . 10 1 1 A 51 51 ASP H H 111 7.790 8.140 -0.350 1
1 611 . 10 1 1 A 51 51 ASP HA H 111 4.440 4.352 0.088 1
1 614 . 10 1 1 A 51 51 ASP C C 111 178.200 178.981 -0.781 1
1 615 . 10 1 1 A 51 51 ASP CA C 111 57.600 57.441 0.159 1
1 616 . 10 1 1 A 51 51 ASP CB C 111 41.800 40.387 1.413 1
1 617 . 10 1 1 A 51 51 ASP N N 111 116.500 119.148 -2.648 1
1 618 . 10 1 1 A 52 52 ILE H H 112 7.020 7.797 -0.777 1
1 619 . 10 1 1 A 52 52 ILE HA H 112 3.750 3.701 0.049 1
1 629 . 10 1 1 A 52 52 ILE C C 112 177.300 178.029 -0.729 1
1 630 . 10 1 1 A 52 52 ILE CA C 112 63.500 64.915 -1.415 1
1 631 . 10 1 1 A 52 52 ILE CB C 112 37.500 36.294 1.206 1
1 635 . 10 1 1 A 52 52 ILE N N 112 116.700 120.375 -3.675 1
1 636 . 10 1 1 A 53 53 GLN H H 113 9.150 8.137 1.013 1
1 637 . 10 1 1 A 53 53 GLN HA H 113 3.720 3.987 -0.267 1
1 644 . 10 1 1 A 53 53 GLN C C 113 177.500 178.172 -0.672 1
1 645 . 10 1 1 A 53 53 GLN CA C 113 58.200 58.594 -0.394 1
1 646 . 10 1 1 A 53 53 GLN CB C 113 30.200 28.558 1.642 1
1 649 . 10 1 1 A 53 53 GLN N N 113 121.200 121.758 -0.558 1
1 651 . 10 1 1 A 54 54 SER H H 114 8.150 8.222 -0.072 1
1 652 . 10 1 1 A 54 54 SER HA H 114 4.180 4.228 -0.048 1
1 655 . 10 1 1 A 54 54 SER C C 114 175.900 177.495 -1.595 1
1 656 . 10 1 1 A 54 54 SER CA C 114 62.100 61.400 0.700 1
1 657 . 10 1 1 A 54 54 SER CB C 114 62.800 62.627 0.173 1
1 658 . 10 1 1 A 54 54 SER N N 114 112.200 115.883 -3.683 1
1 659 . 10 1 1 A 55 55 ILE H H 115 6.760 7.673 -0.913 1
1 660 . 10 1 1 A 55 55 ILE HA H 115 3.860 3.716 0.144 1
1 670 . 10 1 1 A 55 55 ILE C C 115 179.200 178.316 0.884 1
1 671 . 10 1 1 A 55 55 ILE CA C 115 64.700 64.903 -0.203 1
1 672 . 10 1 1 A 55 55 ILE CB C 115 38.900 37.948 0.952 1
1 676 . 10 1 1 A 55 55 ILE N N 115 119.500 122.729 -3.229 1
1 677 . 10 1 1 A 56 56 ILE H H 116 7.750 8.159 -0.409 1
1 678 . 10 1 1 A 56 56 ILE HA H 116 3.690 3.658 0.032 1
1 688 . 10 1 1 A 56 56 ILE C C 116 176.900 178.343 -1.443 1
1 689 . 10 1 1 A 56 56 ILE CA C 116 62.800 65.005 -2.205 1
1 690 . 10 1 1 A 56 56 ILE CB C 116 36.200 37.311 -1.111 1
1 694 . 10 1 1 A 56 56 ILE N N 116 120.200 120.722 -0.522 1
1 695 . 10 1 1 A 57 57 ASN H H 117 8.690 8.292 0.398 1
1 696 . 10 1 1 A 57 57 ASN HA H 117 4.440 4.403 0.037 1
1 701 . 10 1 1 A 57 57 ASN C C 117 177.200 177.291 -0.091 1
1 702 . 10 1 1 A 57 57 ASN CA C 117 54.800 57.062 -2.262 1
1 703 . 10 1 1 A 57 57 ASN CB C 117 38.100 38.895 -0.795 1
1 705 . 10 1 1 A 57 57 ASN N N 117 117.000 120.393 -3.393 1
1 707 . 10 1 1 A 58 58 GLU H H 118 7.630 7.958 -0.328 1
1 708 . 10 1 1 A 58 58 GLU HA H 118 4.450 4.374 0.076 1
1 713 . 10 1 1 A 58 58 GLU C C 118 176.500 176.884 -0.384 1
1 714 . 10 1 1 A 58 58 GLU CA C 118 56.200 57.519 -1.319 1
1 715 . 10 1 1 A 58 58 GLU CB C 118 30.200 30.350 -0.150 1
1 717 . 10 1 1 A 58 58 GLU N N 118 116.300 116.928 -0.628 1
1 718 . 10 1 1 A 59 59 THR H H 119 7.540 7.573 -0.033 1
1 719 . 10 1 1 A 59 59 THR HA H 119 4.230 4.340 -0.110 1
1 724 . 10 1 1 A 59 59 THR C C 119 174.200 174.039 0.161 1
1 725 . 10 1 1 A 59 59 THR CA C 119 63.800 62.933 0.867 1
1 726 . 10 1 1 A 59 59 THR CB C 119 68.900 69.136 -0.236 1
1 728 . 10 1 1 A 59 59 THR N N 119 117.600 115.923 1.677 1
1 729 . 10 1 1 A 60 60 LYS H H 120 8.860 9.059 -0.199 1
1 730 . 10 1 1 A 60 60 LYS HA H 120 4.490 4.922 -0.432 1
1 739 . 10 1 1 A 60 60 LYS C C 120 175.800 175.420 0.380 1
1 740 . 10 1 1 A 60 60 LYS CA C 120 54.900 55.657 -0.757 1
1 741 . 10 1 1 A 60 60 LYS CB C 120 29.800 32.888 -3.088 1
1 745 . 10 1 1 A 60 60 LYS N N 120 128.500 123.950 4.550 1
1 746 . 10 1 1 A 61 61 LEU H H 121 7.150 8.459 -1.309 1
1 747 . 10 1 1 A 61 61 LEU HA H 121 4.710 4.903 -0.193 1
1 757 . 10 1 1 A 61 61 LEU C C 121 175.000 175.799 -0.799 1
1 758 . 10 1 1 A 61 61 LEU CA C 121 52.800 53.249 -0.449 1
1 759 . 10 1 1 A 61 61 LEU CB C 121 46.400 45.580 0.820 1
1 763 . 10 1 1 A 61 61 LEU N N 121 120.700 125.945 -5.245 1
1 764 . 10 1 1 A 62 62 ALA H H 122 8.000 8.481 -0.481 1
1 765 . 10 1 1 A 62 62 ALA HA H 122 4.250 4.376 -0.126 1
1 769 . 10 1 1 A 62 62 ALA CA C 122 52.100 52.612 -0.512 1
1 770 . 10 1 1 A 62 62 ALA CB C 122 19.500 19.151 0.349 1
1 771 . 10 1 1 A 62 62 ALA N N 122 119.900 123.311 -3.411 1
1 772 . 10 1 1 A 63 63 LYS H H 123 8.770 8.722 0.048 1
1 773 . 10 1 1 A 63 63 LYS HA H 123 3.800 4.054 -0.254 1
1 782 . 10 1 1 A 63 63 LYS C C 123 178.300 178.369 -0.069 1
1 783 . 10 1 1 A 63 63 LYS CA C 123 60.700 59.160 1.540 1
1 784 . 10 1 1 A 63 63 LYS CB C 123 32.300 32.012 0.288 1
1 788 . 10 1 1 A 63 63 LYS N N 123 121.400 122.245 -0.845 1
1 789 . 10 1 1 A 64 64 ASN H H 124 9.020 8.683 0.337 1
1 790 . 10 1 1 A 64 64 ASN HA H 124 4.430 4.486 -0.056 1
1 795 . 10 1 1 A 64 64 ASN C C 124 178.300 177.304 0.996 1
1 796 . 10 1 1 A 64 64 ASN CA C 124 56.200 55.804 0.396 1
1 797 . 10 1 1 A 64 64 ASN CB C 124 37.300 37.247 0.053 1
1 799 . 10 1 1 A 64 64 ASN N N 124 115.000 117.878 -2.878 1
1 801 . 10 1 1 A 65 65 THR H H 125 7.620 7.896 -0.276 1
1 802 . 10 1 1 A 65 65 THR HA H 125 4.030 4.143 -0.113 1
1 807 . 10 1 1 A 65 65 THR C C 125 175.500 177.238 -1.738 1
1 808 . 10 1 1 A 65 65 THR CA C 125 66.000 66.613 -0.613 1
1 809 . 10 1 1 A 65 65 THR CB C 125 67.600 68.446 -0.846 1
1 811 . 10 1 1 A 65 65 THR N N 125 119.800 116.601 3.199 1
1 812 . 10 1 1 A 66 66 LEU H H 126 8.020 8.152 -0.132 1
1 813 . 10 1 1 A 66 66 LEU HA H 126 3.790 3.981 -0.191 1
1 823 . 10 1 1 A 66 66 LEU C C 126 179.200 179.382 -0.182 1
1 824 . 10 1 1 A 66 66 LEU CA C 126 58.700 57.944 0.756 1
1 825 . 10 1 1 A 66 66 LEU CB C 126 41.300 41.195 0.105 1
1 829 . 10 1 1 A 66 66 LEU N N 126 121.200 121.844 -0.644 1
1 830 . 10 1 1 A 67 67 LYS H H 127 8.380 8.173 0.207 1
1 831 . 10 1 1 A 67 67 LYS HA H 127 3.740 4.162 -0.422 1
1 840 . 10 1 1 A 67 67 LYS C C 127 178.300 179.413 -1.113 1
1 841 . 10 1 1 A 67 67 LYS CA C 127 60.100 59.097 1.003 1
1 842 . 10 1 1 A 67 67 LYS CB C 127 32.400 31.810 0.590 1
1 846 . 10 1 1 A 67 67 LYS N N 127 117.000 118.047 -1.047 1
1 847 . 10 1 1 A 68 68 ALA H H 128 7.480 8.007 -0.527 1
1 848 . 10 1 1 A 68 68 ALA HA H 128 4.210 4.065 0.145 1
1 852 . 10 1 1 A 68 68 ALA C C 128 181.200 180.327 0.873 1
1 853 . 10 1 1 A 68 68 ALA CA C 128 55.200 54.964 0.236 1
1 854 . 10 1 1 A 68 68 ALA CB C 128 18.600 18.145 0.455 1
1 855 . 10 1 1 A 68 68 ALA N N 128 122.900 122.018 0.882 1
1 856 . 10 1 1 A 69 69 ILE H H 129 8.250 7.830 0.420 1
1 857 . 10 1 1 A 69 69 ILE HA H 129 3.130 3.666 -0.536 1
1 867 . 10 1 1 A 69 69 ILE C C 129 177.400 177.744 -0.344 1
1 868 . 10 1 1 A 69 69 ILE CA C 129 66.700 65.537 1.163 1
1 869 . 10 1 1 A 69 69 ILE CB C 129 37.900 37.716 0.184 1
1 873 . 10 1 1 A 69 69 ILE N N 129 122.800 119.152 3.648 1
1 874 . 10 1 1 A 70 70 ARG H H 130 8.040 8.194 -0.154 1
1 875 . 10 1 1 A 70 70 ARG HA H 130 3.620 3.912 -0.292 1
1 882 . 10 1 1 A 70 70 ARG C C 130 177.800 178.631 -0.831 1
1 883 . 10 1 1 A 70 70 ARG CA C 130 60.700 60.063 0.637 1
1 884 . 10 1 1 A 70 70 ARG CB C 130 29.600 30.186 -0.586 1
1 887 . 10 1 1 A 70 70 ARG N N 130 119.700 120.643 -0.943 1
1 888 . 10 1 1 A 71 71 ASN H H 131 8.920 8.646 0.274 1
1 889 . 10 1 1 A 71 71 ASN HA H 131 4.430 4.457 -0.027 1
1 894 . 10 1 1 A 71 71 ASN C C 131 177.500 177.596 -0.096 1
1 895 . 10 1 1 A 71 71 ASN CA C 131 56.100 56.684 -0.584 1
1 896 . 10 1 1 A 71 71 ASN CB C 131 38.600 39.595 -0.995 1
1 898 . 10 1 1 A 71 71 ASN N N 131 117.200 118.567 -1.367 1
1 900 . 10 1 1 A 72 72 THR H H 132 8.300 8.512 -0.212 1
1 901 . 10 1 1 A 72 72 THR HA H 132 4.430 3.644 0.786 1
1 906 . 10 1 1 A 72 72 THR C C 132 175.100 176.747 -1.647 1
1 907 . 10 1 1 A 72 72 THR CA C 132 68.200 66.385 1.815 1
1 908 . 10 1 1 A 72 72 THR CB C 132 68.500 68.814 -0.314 1
1 910 . 10 1 1 A 72 72 THR N N 132 119.200 115.335 3.865 1
1 911 . 10 1 1 A 73 73 ALA H H 133 7.950 8.269 -0.319 1
1 912 . 10 1 1 A 73 73 ALA HA H 133 4.040 3.965 0.075 1
1 916 . 10 1 1 A 73 73 ALA C C 133 178.200 179.847 -1.647 1
1 917 . 10 1 1 A 73 73 ALA CA C 133 55.900 55.240 0.660 1
1 918 . 10 1 1 A 73 73 ALA CB C 133 16.700 18.158 -1.458 1
1 919 . 10 1 1 A 73 73 ALA N N 133 120.900 123.972 -3.072 1
1 920 . 10 1 1 A 74 74 SER H H 134 8.440 7.848 0.592 1
1 921 . 10 1 1 A 74 74 SER HA H 134 4.430 4.332 0.098 1
1 924 . 10 1 1 A 74 74 SER C C 134 178.800 177.433 1.367 1
1 925 . 10 1 1 A 74 74 SER CA C 134 61.300 61.449 -0.149 1
1 926 . 10 1 1 A 74 74 SER CB C 134 62.600 62.974 -0.374 1
1 927 . 10 1 1 A 74 74 SER N N 134 110.100 113.498 -3.398 1
1 928 . 10 1 1 A 75 75 GLN H H 135 8.340 7.863 0.477 1
1 929 . 10 1 1 A 75 75 GLN HA H 135 3.880 4.057 -0.177 1
1 936 . 10 1 1 A 75 75 GLN C C 135 178.800 178.810 -0.010 1
1 937 . 10 1 1 A 75 75 GLN CA C 135 59.600 58.773 0.827 1
1 938 . 10 1 1 A 75 75 GLN CB C 135 29.900 28.435 1.465 1
1 941 . 10 1 1 A 75 75 GLN N N 135 118.100 121.184 -3.084 1
1 943 . 10 1 1 A 76 76 ILE H H 136 7.670 7.348 0.322 1
1 944 . 10 1 1 A 76 76 ILE HA H 136 3.200 3.439 -0.239 1
1 954 . 10 1 1 A 76 76 ILE C C 136 177.500 177.735 -0.235 1
1 955 . 10 1 1 A 76 76 ILE CA C 136 66.100 65.156 0.944 1
1 956 . 10 1 1 A 76 76 ILE CB C 136 37.400 37.259 0.141 1
1 960 . 10 1 1 A 76 76 ILE N N 136 122.500 120.240 2.260 1
1 961 . 10 1 1 A 77 77 PHE H H 137 7.930 7.576 0.354 1
1 962 . 10 1 1 A 77 77 PHE HA H 137 3.890 3.952 -0.062 1
1 969 . 10 1 1 A 77 77 PHE C C 137 178.200 178.255 -0.055 1
1 970 . 10 1 1 A 77 77 PHE CA C 137 63.600 60.252 3.348 1
1 971 . 10 1 1 A 77 77 PHE CB C 137 39.300 38.597 0.703 1
1 976 . 10 1 1 A 77 77 PHE N N 137 116.100 118.283 -2.183 1
1 977 . 10 1 1 A 78 78 ARG H H 138 8.900 8.285 0.615 1
1 978 . 10 1 1 A 78 78 ARG HA H 138 3.910 3.924 -0.014 1
1 986 . 10 1 1 A 78 78 ARG C C 138 178.300 178.859 -0.559 1
1 987 . 10 1 1 A 78 78 ARG CA C 138 60.100 59.247 0.853 1
1 988 . 10 1 1 A 78 78 ARG CB C 138 29.600 29.832 -0.232 1
1 991 . 10 1 1 A 78 78 ARG N N 138 118.600 119.620 -1.020 1
1 993 . 10 1 1 A 79 79 LEU H H 139 7.730 8.030 -0.300 1
1 994 . 10 1 1 A 79 79 LEU HA H 139 4.280 4.225 0.055 1
1 1004 . 10 1 1 A 79 79 LEU C C 139 179.000 178.288 0.712 1
1 1005 . 10 1 1 A 79 79 LEU CA C 139 57.800 57.591 0.209 1
1 1006 . 10 1 1 A 79 79 LEU CB C 139 41.900 41.331 0.569 1
1 1010 . 10 1 1 A 79 79 LEU N N 139 121.900 121.279 0.621 1
1 1011 . 10 1 1 A 80 80 ALA H H 140 7.590 7.447 0.143 1
1 1012 . 10 1 1 A 80 80 ALA HA H 140 2.710 2.779 -0.069 1
1 1016 . 10 1 1 A 80 80 ALA C C 140 179.900 179.983 -0.083 1
1 1017 . 10 1 1 A 80 80 ALA CA C 140 55.100 54.505 0.595 1
1 1018 . 10 1 1 A 80 80 ALA CB C 140 17.600 17.443 0.157 1
1 1019 . 10 1 1 A 80 80 ALA N N 140 123.400 120.085 3.315 1
1 1020 . 10 1 1 A 81 81 ILE H H 141 8.910 7.924 0.986 1
1 1021 . 10 1 1 A 81 81 ILE HA H 141 4.110 3.536 0.574 1
1 1031 . 10 1 1 A 81 81 ILE C C 141 181.700 177.620 4.080 1
1 1032 . 10 1 1 A 81 81 ILE CA C 141 64.800 65.145 -0.345 1
1 1033 . 10 1 1 A 81 81 ILE CB C 141 38.600 37.544 1.056 1
1 1037 . 10 1 1 A 81 81 ILE N N 141 122.400 118.808 3.592 1
1 1038 . 10 1 1 A 82 82 GLU H H 142 8.560 8.574 -0.014 1
1 1039 . 10 1 1 A 82 82 GLU HA H 142 4.100 3.966 0.134 1
1 1044 . 10 1 1 A 82 82 GLU C C 142 177.700 178.557 -0.857 1
1 1045 . 10 1 1 A 82 82 GLU CA C 142 59.100 59.956 -0.856 1
1 1046 . 10 1 1 A 82 82 GLU CB C 142 29.200 29.267 -0.067 1
1 1048 . 10 1 1 A 82 82 GLU N N 142 123.200 120.407 2.793 1
1 1049 . 10 1 1 A 83 83 ASN H H 143 7.310 8.074 -0.764 1
1 1050 . 10 1 1 A 83 83 ASN HA H 143 4.750 4.883 -0.133 1
1 1055 . 10 1 1 A 83 83 ASN C C 143 173.200 174.313 -1.113 1
1 1056 . 10 1 1 A 83 83 ASN CA C 143 54.200 52.953 1.247 1
1 1057 . 10 1 1 A 83 83 ASN CB C 143 41.300 38.739 2.561 1
1 1059 . 10 1 1 A 83 83 ASN N N 143 114.900 115.363 -0.463 1
1 1061 . 10 1 1 A 84 84 ARG H H 144 8.320 7.932 0.388 1
1 1062 . 10 1 1 A 84 84 ARG HA H 144 4.120 3.968 0.152 1
1 1069 . 10 1 1 A 84 84 ARG C C 144 175.300 175.643 -0.343 1
1 1070 . 10 1 1 A 84 84 ARG CA C 144 57.100 56.895 0.205 1
1 1071 . 10 1 1 A 84 84 ARG CB C 144 26.000 27.138 -1.138 1
1 1074 . 10 1 1 A 84 84 ARG N N 144 114.400 115.185 -0.785 1
1 1075 . 10 1 1 A 85 85 ALA H H 145 8.350 8.530 -0.180 1
1 1076 . 10 1 1 A 85 85 ALA HA H 145 4.320 4.403 -0.083 1
1 1080 . 10 1 1 A 85 85 ALA C C 145 176.500 176.774 -0.274 1
1 1081 . 10 1 1 A 85 85 ALA CA C 145 53.400 54.212 -0.812 1
1 1082 . 10 1 1 A 85 85 ALA CB C 145 19.900 19.971 -0.071 1
1 1083 . 10 1 1 A 85 85 ALA N N 145 120.600 118.473 2.127 1
1 1084 . 10 1 1 A 86 86 ILE H H 146 7.290 7.565 -0.275 1
1 1085 . 10 1 1 A 86 86 ILE HA H 146 4.400 4.592 -0.192 1
1 1095 . 10 1 1 A 86 86 ILE C C 146 173.600 175.092 -1.492 1
1 1096 . 10 1 1 A 86 86 ILE CA C 146 59.200 59.345 -0.145 1
1 1097 . 10 1 1 A 86 86 ILE CB C 146 41.600 40.181 1.419 1
1 1101 . 10 1 1 A 86 86 ILE N N 146 111.500 117.086 -5.586 1
1 1102 . 10 1 1 A 87 87 ASP H H 147 8.270 9.165 -0.895 1
1 1103 . 10 1 1 A 87 87 ASP HA H 147 4.940 4.702 0.238 1
1 1106 . 10 1 1 A 87 87 ASP C C 147 174.700 176.015 -1.315 1
1 1107 . 10 1 1 A 87 87 ASP CA C 147 53.700 54.719 -1.019 1
1 1108 . 10 1 1 A 87 87 ASP CB C 147 41.800 42.275 -0.475 1
1 1109 . 10 1 1 A 87 87 ASP N N 147 119.400 126.982 -7.582 1
1 1110 . 10 1 1 A 88 88 PHE H H 148 7.230 7.430 -0.200 1
1 1111 . 10 1 1 A 88 88 PHE HA H 148 4.690 5.017 -0.327 1
1 1119 . 10 1 1 A 88 88 PHE C C 148 171.500 172.297 -0.797 1
1 1120 . 10 1 1 A 88 88 PHE CA C 148 56.400 56.120 0.280 1
1 1121 . 10 1 1 A 88 88 PHE CB C 148 42.000 40.799 1.201 1
1 1127 . 10 1 1 A 88 88 PHE N N 148 119.700 115.804 3.896 1
1 1128 . 10 1 1 A 89 89 ASN H H 149 8.060 8.982 -0.922 1
1 1129 . 10 1 1 A 89 89 ASN HA H 149 4.490 5.027 -0.537 1
1 1134 . 10 1 1 A 89 89 ASN CA C 149 48.100 48.874 -0.774 1
1 1135 . 10 1 1 A 89 89 ASN CB C 149 39.200 39.779 -0.579 1
1 1137 . 10 1 1 A 89 89 ASN N N 149 119.700 119.409 0.291 1
1 1139 . 10 1 1 A 90 90 PRO HA H 150 3.970 4.704 -0.734 1
1 1146 . 10 1 1 A 90 90 PRO C C 150 177.700 177.271 0.429 1
1 1147 . 10 1 1 A 90 90 PRO CA C 150 63.900 64.311 -0.411 1
1 1148 . 10 1 1 A 90 90 PRO CB C 150 31.700 31.638 0.062 1
1 1151 . 10 1 1 A 91 91 ALA H H 151 7.240 7.730 -0.490 1
1 1152 . 10 1 1 A 91 91 ALA HA H 151 3.900 4.162 -0.262 1
1 1156 . 10 1 1 A 91 91 ALA C C 151 178.000 179.411 -1.411 1
1 1157 . 10 1 1 A 91 91 ALA CA C 151 53.900 54.140 -0.240 1
1 1158 . 10 1 1 A 91 91 ALA CB C 151 17.700 18.476 -0.776 1
1 1159 . 10 1 1 A 91 91 ALA N N 151 115.700 119.653 -3.953 1
1 1160 . 10 1 1 A 92 92 ASP H H 152 7.080 8.014 -0.934 1
1 1161 . 10 1 1 A 92 92 ASP HA H 152 4.220 4.367 -0.147 1
1 1164 . 10 1 1 A 92 92 ASP C C 152 176.200 176.869 -0.669 1
1 1165 . 10 1 1 A 92 92 ASP CA C 152 55.800 56.284 -0.484 1
1 1166 . 10 1 1 A 92 92 ASP CB C 152 39.500 40.485 -0.985 1
1 1167 . 10 1 1 A 92 92 ASP N N 152 117.100 119.796 -2.696 1
1 1168 . 10 1 1 A 93 93 TYR H H 153 7.060 7.588 -0.528 1
1 1169 . 10 1 1 A 93 93 TYR HA H 153 4.490 4.631 -0.141 1
1 1176 . 10 1 1 A 93 93 TYR C C 153 174.700 175.144 -0.444 1
1 1177 . 10 1 1 A 93 93 TYR CA C 153 57.600 58.397 -0.797 1
1 1178 . 10 1 1 A 93 93 TYR CB C 153 38.500 38.826 -0.326 1
1 1183 . 10 1 1 A 93 93 TYR N N 153 116.800 117.071 -0.271 1
1 1184 . 10 1 1 A 94 94 VAL H H 154 7.000 7.203 -0.203 1
1 1185 . 10 1 1 A 94 94 VAL HA H 154 4.040 4.340 -0.300 1
1 1193 . 10 1 1 A 94 94 VAL C C 154 174.700 175.314 -0.614 1
1 1194 . 10 1 1 A 94 94 VAL CA C 154 62.100 62.099 0.001 1
1 1195 . 10 1 1 A 94 94 VAL CB C 154 32.700 32.659 0.041 1
1 1198 . 10 1 1 A 94 94 VAL N N 154 120.600 120.746 -0.146 1
1 1199 . 10 1 1 A 95 95 ARG H H 155 9.430 9.019 0.411 1
1 1200 . 10 1 1 A 95 95 ARG HA H 155 4.640 4.688 -0.048 1
1 1207 . 10 1 1 A 95 95 ARG C C 155 175.400 175.632 -0.232 1
1 1208 . 10 1 1 A 95 95 ARG CA C 155 54.200 56.030 -1.830 1
1 1209 . 10 1 1 A 95 95 ARG CB C 155 32.400 31.288 1.112 1
1 1212 . 10 1 1 A 95 95 ARG N N 155 128.200 127.693 0.507 1
1 1213 . 10 1 1 A 96 96 ILE H H 156 8.700 8.629 0.071 1
1 1214 . 10 1 1 A 96 96 ILE HA H 156 4.440 4.585 -0.145 1
1 1224 . 10 1 1 A 96 96 ILE CA C 156 56.500 57.574 -1.074 1
1 1225 . 10 1 1 A 96 96 ILE CB C 156 36.700 39.665 -2.965 1
1 1229 . 10 1 1 A 96 96 ILE N N 156 124.100 126.741 -2.641 1
1 1230 . 10 1 1 A 97 97 PRO HA H 157 4.370 4.600 -0.230 1
1 1237 . 10 1 1 A 97 97 PRO C C 157 176.000 177.169 -1.169 1
1 1238 . 10 1 1 A 97 97 PRO CA C 157 63.200 63.294 -0.094 1
1 1239 . 10 1 1 A 97 97 PRO CB C 157 32.400 31.878 0.522 1
1 1242 . 10 1 1 A 98 98 LYS H H 158 8.380 8.824 -0.444 1
1 1243 . 10 1 1 A 98 98 LYS HA H 158 4.190 4.381 -0.191 1
1 1252 . 10 1 1 A 98 98 LYS C C 158 176.800 175.882 0.918 1
1 1253 . 10 1 1 A 98 98 LYS CA C 158 57.100 56.944 0.156 1
1 1254 . 10 1 1 A 98 98 LYS CB C 158 32.800 33.264 -0.464 1
1 1258 . 10 1 1 A 98 98 LYS N N 158 120.800 119.183 1.617 1
1 1259 . 10 1 1 A 99 99 ILE H H 159 7.930 7.618 0.312 1
1 1260 . 10 1 1 A 99 99 ILE HA H 159 4.200 4.414 -0.214 1
1 1270 . 10 1 1 A 99 99 ILE C C 159 175.400 174.887 0.513 1
1 1271 . 10 1 1 A 99 99 ILE CA C 159 60.600 60.509 0.091 1
1 1272 . 10 1 1 A 99 99 ILE CB C 159 39.100 38.734 0.366 1
1 1276 . 10 1 1 A 99 99 ILE N N 159 120.200 120.299 -0.099 1
1 1277 . 10 1 1 A 100 100 ALA H H 160 8.370 8.521 -0.151 1
1 1278 . 10 1 1 A 100 100 ALA HA H 160 4.370 4.717 -0.347 1
1 1282 . 10 1 1 A 100 100 ALA C C 160 177.200 176.915 0.285 1
1 1283 . 10 1 1 A 100 100 ALA CA C 160 52.200 51.560 0.640 1
1 1284 . 10 1 1 A 100 100 ALA CB C 160 19.400 21.088 -1.688 1
1 1285 . 10 1 1 A 100 100 ALA N N 160 128.300 129.012 -0.712 1
1 1286 . 10 1 1 A 101 101 LEU H H 161 8.250 8.717 -0.467 1
1 1287 . 10 1 1 A 101 101 LEU HA H 161 4.280 4.097 0.183 1
1 1297 . 10 1 1 A 101 101 LEU C C 161 177.200 176.391 0.809 1
1 1298 . 10 1 1 A 101 101 LEU CA C 161 55.200 57.008 -1.808 1
1 1299 . 10 1 1 A 101 101 LEU CB C 161 42.400 40.746 1.654 1
1 1303 . 10 1 1 A 101 101 LEU N N 161 121.900 119.809 2.091 1
1 1304 . 10 1 1 A 102 102 GLU H H 162 8.390 8.377 0.013 1
1 1305 . 10 1 1 A 102 102 GLU HA H 162 4.230 4.511 -0.281 1
1 1310 . 10 1 1 A 102 102 GLU C C 162 176.100 176.364 -0.264 1
1 1311 . 10 1 1 A 102 102 GLU CA C 162 56.400 56.225 0.175 1
1 1312 . 10 1 1 A 102 102 GLU CB C 162 30.500 30.518 -0.018 1
1 1314 . 10 1 1 A 102 102 GLU N N 162 121.300 120.652 0.648 1
1 1315 . 10 1 1 A 103 103 HIS H H 163 8.330 8.229 0.101 1
1 1316 . 10 1 1 A 103 103 HIS HA H 163 4.590 5.021 -0.431 1
1 1319 . 10 1 1 A 103 103 HIS C C 163 176.100 175.197 0.903 1
1 1320 . 10 1 1 A 103 103 HIS CA C 163 56.000 53.991 2.009 1
1 1321 . 10 1 1 A 103 103 HIS CB C 163 30.500 29.690 0.810 1
1 1322 . 10 1 1 A 103 103 HIS N N 163 120.000 118.114 1.886 1
1 1323 . 10 1 1 A 107 107 HIS HA H 167 4.620 4.848 -0.228 1
1 1326 . 10 1 1 A 107 107 HIS C C 167 173.900 175.177 -1.277 1
1 1327 . 10 1 1 A 107 107 HIS CA C 167 56.000 55.115 0.885 1
1 1328 . 10 1 1 A 107 107 HIS CB C 167 30.300 32.006 -1.706 1
1 15 . 11 1 1 A 2 2 ASP H H 62 8.760 8.109 0.651 1
1 16 . 11 1 1 A 2 2 ASP HA H 62 4.810 5.130 -0.320 1
1 19 . 11 1 1 A 2 2 ASP C C 62 175.800 173.779 2.021 1
1 20 . 11 1 1 A 2 2 ASP CA C 62 54.800 53.265 1.535 1
1 21 . 11 1 1 A 2 2 ASP CB C 62 41.600 43.819 -2.219 1
1 22 . 11 1 1 A 2 2 ASP N N 62 120.900 119.337 1.563 1
1 23 . 11 1 1 A 3 3 SER H H 63 8.710 8.415 0.295 1
1 24 . 11 1 1 A 3 3 SER HA H 63 4.970 5.316 -0.346 1
1 27 . 11 1 1 A 3 3 SER C C 63 175.600 175.679 -0.079 1
1 28 . 11 1 1 A 3 3 SER CA C 63 57.500 55.462 2.038 1
1 29 . 11 1 1 A 3 3 SER CB C 63 65.900 66.753 -0.853 1
1 30 . 11 1 1 A 3 3 SER N N 63 116.300 114.634 1.666 1
1 31 . 11 1 1 A 4 4 PHE H H 64 9.370 10.028 -0.658 1
1 32 . 11 1 1 A 4 4 PHE HA H 64 4.010 4.279 -0.269 1
1 39 . 11 1 1 A 4 4 PHE C C 64 176.700 177.360 -0.660 1
1 40 . 11 1 1 A 4 4 PHE CA C 64 62.200 61.718 0.482 1
1 41 . 11 1 1 A 4 4 PHE CB C 64 38.500 39.384 -0.884 1
1 46 . 11 1 1 A 4 4 PHE N N 64 121.400 122.477 -1.077 1
1 47 . 11 1 1 A 5 5 GLY H H 65 8.930 8.325 0.605 1
1 48 . 11 1 1 A 5 5 GLY HA2 H 65 2.020 3.209 -1.189 1
1 49 . 11 1 1 A 5 5 GLY HA3 H 65 3.250 3.251 -0.001 1
1 50 . 11 1 1 A 5 5 GLY C C 65 175.200 175.388 -0.188 1
1 51 . 11 1 1 A 5 5 GLY CA C 65 46.300 46.847 -0.547 1
1 52 . 11 1 1 A 5 5 GLY N N 65 106.500 105.518 0.982 1
1 53 . 11 1 1 A 6 6 ASP H H 66 7.630 7.497 0.133 1
1 54 . 11 1 1 A 6 6 ASP HA H 66 4.100 4.192 -0.092 1
1 57 . 11 1 1 A 6 6 ASP C C 66 179.500 178.827 0.673 1
1 58 . 11 1 1 A 6 6 ASP CA C 66 57.400 56.711 0.689 1
1 59 . 11 1 1 A 6 6 ASP CB C 66 40.500 40.127 0.373 1
1 60 . 11 1 1 A 6 6 ASP N N 66 120.500 121.496 -0.996 1
1 61 . 11 1 1 A 7 7 TRP H H 67 7.190 7.611 -0.421 1
1 62 . 11 1 1 A 7 7 TRP HA H 67 3.860 4.248 -0.388 1
1 71 . 11 1 1 A 7 7 TRP C C 67 177.200 178.539 -1.339 1
1 72 . 11 1 1 A 7 7 TRP CA C 67 61.100 60.302 0.798 1
1 73 . 11 1 1 A 7 7 TRP CB C 67 28.300 29.494 -1.194 1
1 79 . 11 1 1 A 7 7 TRP N N 67 120.700 120.574 0.126 1
1 81 . 11 1 1 A 8 8 ALA H H 68 9.040 8.526 0.514 1
1 82 . 11 1 1 A 8 8 ALA HA H 68 3.730 3.810 -0.080 1
1 86 . 11 1 1 A 8 8 ALA C C 68 179.500 179.434 0.066 1
1 87 . 11 1 1 A 8 8 ALA CA C 68 55.200 55.252 -0.052 1
1 88 . 11 1 1 A 8 8 ALA CB C 68 18.600 18.115 0.485 1
1 89 . 11 1 1 A 8 8 ALA N N 68 125.700 122.127 3.573 1
1 90 . 11 1 1 A 9 9 GLU H H 69 8.060 8.121 -0.061 1
1 91 . 11 1 1 A 9 9 GLU HA H 69 4.020 4.083 -0.063 1
1 96 . 11 1 1 A 9 9 GLU C C 69 180.400 178.792 1.608 1
1 97 . 11 1 1 A 9 9 GLU CA C 69 58.800 59.600 -0.800 1
1 98 . 11 1 1 A 9 9 GLU CB C 69 28.500 29.152 -0.652 1
1 99 . 11 1 1 A 9 9 GLU N N 69 115.400 118.589 -3.189 1
1 100 . 11 1 1 A 10 10 LYS H H 70 7.740 7.684 0.056 1
1 101 . 11 1 1 A 10 10 LYS HA H 70 3.910 4.015 -0.105 1
1 110 . 11 1 1 A 10 10 LYS C C 70 179.500 178.988 0.512 1
1 111 . 11 1 1 A 10 10 LYS CA C 70 60.000 58.842 1.158 1
1 112 . 11 1 1 A 10 10 LYS CB C 70 32.400 32.014 0.386 1
1 116 . 11 1 1 A 10 10 LYS N N 70 122.700 119.695 3.005 1
1 117 . 11 1 1 A 11 11 PHE H H 71 8.750 8.361 0.389 1
1 118 . 11 1 1 A 11 11 PHE HA H 71 4.080 4.244 -0.164 1
1 126 . 11 1 1 A 11 11 PHE C C 71 177.100 176.929 0.171 1
1 127 . 11 1 1 A 11 11 PHE CA C 71 61.200 61.286 -0.086 1
1 128 . 11 1 1 A 11 11 PHE CB C 71 38.900 39.225 -0.325 1
1 134 . 11 1 1 A 11 11 PHE N N 71 123.500 120.670 2.830 1
1 135 . 11 1 1 A 12 12 LEU H H 72 8.400 8.476 -0.076 1
1 136 . 11 1 1 A 12 12 LEU HA H 72 3.520 3.863 -0.343 1
1 146 . 11 1 1 A 12 12 LEU C C 72 180.000 179.374 0.626 1
1 147 . 11 1 1 A 12 12 LEU CA C 72 58.200 57.836 0.364 1
1 148 . 11 1 1 A 12 12 LEU CB C 72 41.700 41.450 0.250 1
1 152 . 11 1 1 A 12 12 LEU N N 72 121.100 119.080 2.020 1
1 153 . 11 1 1 A 13 13 LYS H H 73 7.810 8.222 -0.412 1
1 154 . 11 1 1 A 13 13 LYS HA H 73 4.080 3.987 0.093 1
1 156 . 11 1 1 A 13 13 LYS C C 73 179.300 179.120 0.180 1
1 157 . 11 1 1 A 13 13 LYS CA C 73 59.000 59.209 -0.209 1
1 158 . 11 1 1 A 13 13 LYS CB C 73 31.900 32.283 -0.383 1
1 159 . 11 1 1 A 13 13 LYS N N 73 119.400 118.931 0.469 1
1 160 . 11 1 1 A 14 14 SER H H 74 8.210 8.230 -0.020 1
1 161 . 11 1 1 A 14 14 SER HA H 74 4.210 4.118 0.092 1
1 164 . 11 1 1 A 14 14 SER C C 74 176.300 176.678 -0.378 1
1 165 . 11 1 1 A 14 14 SER CA C 74 61.400 61.144 0.256 1
1 166 . 11 1 1 A 14 14 SER CB C 74 62.600 62.309 0.291 1
1 167 . 11 1 1 A 14 14 SER N N 74 117.600 114.747 2.853 1
1 168 . 11 1 1 A 15 15 LYS H H 75 7.760 7.739 0.021 1
1 169 . 11 1 1 A 15 15 LYS HA H 75 4.040 3.759 0.281 1
1 178 . 11 1 1 A 15 15 LYS C C 75 178.500 178.146 0.354 1
1 179 . 11 1 1 A 15 15 LYS CA C 75 56.500 59.127 -2.627 1
1 180 . 11 1 1 A 15 15 LYS CB C 75 30.600 31.304 -0.704 1
1 184 . 11 1 1 A 15 15 LYS N N 75 120.100 121.328 -1.228 1
1 185 . 11 1 1 A 16 16 GLU H H 76 7.680 8.473 -0.793 1
1 186 . 11 1 1 A 16 16 GLU HA H 76 4.030 4.003 0.027 1
1 191 . 11 1 1 A 16 16 GLU C C 76 179.900 178.717 1.183 1
1 192 . 11 1 1 A 16 16 GLU CA C 76 59.200 59.603 -0.403 1
1 193 . 11 1 1 A 16 16 GLU CB C 76 29.600 29.272 0.328 1
1 195 . 11 1 1 A 16 16 GLU N N 76 119.700 119.241 0.459 1
1 196 . 11 1 1 A 17 17 ALA H H 77 8.030 7.708 0.322 1
1 197 . 11 1 1 A 17 17 ALA HA H 77 4.200 4.133 0.067 1
1 201 . 11 1 1 A 17 17 ALA C C 77 178.900 178.852 0.048 1
1 202 . 11 1 1 A 17 17 ALA CA C 77 54.400 53.565 0.835 1
1 203 . 11 1 1 A 17 17 ALA CB C 77 18.100 18.340 -0.240 1
1 204 . 11 1 1 A 17 17 ALA N N 77 123.000 121.054 1.946 1
1 205 . 11 1 1 A 18 18 ASP H H 78 7.860 7.518 0.342 1
1 206 . 11 1 1 A 18 18 ASP HA H 78 4.600 4.639 -0.039 1
1 209 . 11 1 1 A 18 18 ASP C C 78 177.500 176.375 1.125 1
1 210 . 11 1 1 A 18 18 ASP CA C 78 55.100 54.194 0.906 1
1 211 . 11 1 1 A 18 18 ASP CB C 78 41.400 41.269 0.131 1
1 212 . 11 1 1 A 18 18 ASP N N 78 117.700 116.887 0.813 1
1 213 . 11 1 1 A 19 19 GLY H H 79 7.910 7.816 0.094 1
1 214 . 11 1 1 A 19 19 GLY HA2 H 79 3.860 3.942 -0.082 1
1 215 . 11 1 1 A 19 19 GLY HA3 H 79 4.080 3.943 0.137 1
1 216 . 11 1 1 A 19 19 GLY C C 79 175.300 174.071 1.229 1
1 217 . 11 1 1 A 19 19 GLY CA C 79 46.200 46.711 -0.511 1
1 218 . 11 1 1 A 19 19 GLY N N 79 107.100 107.732 -0.632 1
1 219 . 11 1 1 A 20 20 VAL H H 80 7.150 7.717 -0.567 1
1 220 . 11 1 1 A 20 20 VAL HA H 80 4.250 4.870 -0.620 1
1 228 . 11 1 1 A 20 20 VAL C C 80 175.100 174.927 0.173 1
1 229 . 11 1 1 A 20 20 VAL CA C 80 61.800 59.408 2.392 1
1 230 . 11 1 1 A 20 20 VAL CB C 80 32.200 35.002 -2.802 1
1 233 . 11 1 1 A 20 20 VAL N N 80 114.600 114.440 0.160 1
1 234 . 11 1 1 A 21 21 SER H H 81 8.560 8.733 -0.173 1
1 235 . 11 1 1 A 21 21 SER HA H 81 4.390 4.577 -0.187 1
1 238 . 11 1 1 A 21 21 SER C C 81 174.600 175.619 -1.019 1
1 239 . 11 1 1 A 21 21 SER CA C 81 57.900 58.776 -0.876 1
1 240 . 11 1 1 A 21 21 SER CB C 81 64.700 63.646 1.054 1
1 241 . 11 1 1 A 21 21 SER N N 81 118.700 118.733 -0.033 1
1 242 . 11 1 1 A 22 22 VAL H H 82 8.690 8.754 -0.064 1
1 243 . 11 1 1 A 22 22 VAL HA H 82 3.700 3.682 0.018 1
1 251 . 11 1 1 A 22 22 VAL C C 82 178.000 177.840 0.160 1
1 252 . 11 1 1 A 22 22 VAL CA C 82 66.500 66.665 -0.165 1
1 253 . 11 1 1 A 22 22 VAL CB C 82 31.700 31.636 0.064 1
1 256 . 11 1 1 A 22 22 VAL N N 82 122.100 127.553 -5.453 1
1 257 . 11 1 1 A 23 23 SER H H 83 8.300 8.103 0.197 1
1 258 . 11 1 1 A 23 23 SER HA H 83 4.210 4.151 0.059 1
1 261 . 11 1 1 A 23 23 SER C C 83 177.600 177.075 0.525 1
1 262 . 11 1 1 A 23 23 SER CA C 83 61.400 61.177 0.223 1
1 263 . 11 1 1 A 23 23 SER CB C 83 62.400 63.239 -0.839 1
1 264 . 11 1 1 A 23 23 SER N N 83 113.600 115.449 -1.849 1
1 265 . 11 1 1 A 24 24 GLN H H 84 7.820 7.973 -0.153 1
1 266 . 11 1 1 A 24 24 GLN HA H 84 3.970 4.079 -0.109 1
1 273 . 11 1 1 A 24 24 GLN C C 84 178.400 178.081 0.319 1
1 274 . 11 1 1 A 24 24 GLN CA C 84 58.400 58.706 -0.306 1
1 275 . 11 1 1 A 24 24 GLN CB C 84 28.900 28.441 0.459 1
1 278 . 11 1 1 A 24 24 GLN N N 84 122.900 120.597 2.303 1
1 280 . 11 1 1 A 25 25 LEU H H 85 8.920 8.411 0.509 1
1 281 . 11 1 1 A 25 25 LEU HA H 85 4.130 4.426 -0.296 1
1 291 . 11 1 1 A 25 25 LEU C C 85 178.800 178.912 -0.112 1
1 292 . 11 1 1 A 25 25 LEU CA C 85 58.300 57.839 0.461 1
1 293 . 11 1 1 A 25 25 LEU CB C 85 41.200 41.950 -0.750 1
1 297 . 11 1 1 A 25 25 LEU N N 85 122.200 121.391 0.809 1
1 298 . 11 1 1 A 26 26 ASN H H 86 8.860 8.748 0.112 1
1 299 . 11 1 1 A 26 26 ASN HA H 86 4.420 4.498 -0.078 1
1 304 . 11 1 1 A 26 26 ASN C C 86 179.000 178.113 0.887 1
1 305 . 11 1 1 A 26 26 ASN CA C 86 55.900 55.739 0.161 1
1 306 . 11 1 1 A 26 26 ASN CB C 86 37.200 38.034 -0.834 1
1 308 . 11 1 1 A 26 26 ASN N N 86 117.600 117.280 0.320 1
1 310 . 11 1 1 A 27 27 SER H H 87 7.840 7.754 0.086 1
1 311 . 11 1 1 A 27 27 SER HA H 87 4.100 4.181 -0.081 1
1 314 . 11 1 1 A 27 27 SER C C 87 179.000 177.135 1.865 1
1 315 . 11 1 1 A 27 27 SER CA C 87 62.100 61.240 0.860 1
1 316 . 11 1 1 A 27 27 SER CB C 87 62.100 62.910 -0.810 1
1 317 . 11 1 1 A 27 27 SER N N 87 118.500 115.366 3.134 1
1 318 . 11 1 1 A 28 28 TYR H H 88 8.180 7.771 0.409 1
1 319 . 11 1 1 A 28 28 TYR HA H 88 4.600 4.550 0.050 1
1 326 . 11 1 1 A 28 28 TYR C C 88 174.800 178.272 -3.472 1
1 327 . 11 1 1 A 28 28 TYR CA C 88 61.200 62.046 -0.846 1
1 328 . 11 1 1 A 28 28 TYR CB C 88 37.800 38.194 -0.394 1
1 333 . 11 1 1 A 28 28 TYR N N 88 119.300 119.521 -0.221 1
1 334 . 11 1 1 A 29 29 LYS H H 89 9.040 8.567 0.473 1
1 335 . 11 1 1 A 29 29 LYS HA H 89 3.890 4.083 -0.193 1
1 344 . 11 1 1 A 29 29 LYS C C 89 179.000 178.451 0.549 1
1 345 . 11 1 1 A 29 29 LYS CA C 89 61.300 59.990 1.310 1
1 346 . 11 1 1 A 29 29 LYS CB C 89 32.800 32.092 0.708 1
1 350 . 11 1 1 A 29 29 LYS N N 89 119.300 122.319 -3.019 1
1 351 . 11 1 1 A 30 30 ASN H H 90 7.770 7.971 -0.201 1
1 352 . 11 1 1 A 30 30 ASN HA H 90 4.560 4.427 0.133 1
1 357 . 11 1 1 A 30 30 ASN C C 90 178.300 177.535 0.765 1
1 358 . 11 1 1 A 30 30 ASN CA C 90 56.200 56.276 -0.076 1
1 359 . 11 1 1 A 30 30 ASN CB C 90 38.900 38.378 0.522 1
1 361 . 11 1 1 A 30 30 ASN N N 90 117.800 117.422 0.378 1
1 363 . 11 1 1 A 31 31 TYR H H 91 8.860 7.885 0.975 1
1 364 . 11 1 1 A 31 31 TYR HA H 91 4.910 4.579 0.331 1
1 371 . 11 1 1 A 31 31 TYR C C 91 178.300 178.757 -0.457 1
1 372 . 11 1 1 A 31 31 TYR CA C 91 59.700 60.629 -0.929 1
1 373 . 11 1 1 A 31 31 TYR CB C 91 37.500 38.086 -0.586 1
1 378 . 11 1 1 A 31 31 TYR N N 91 119.400 118.524 0.876 1
1 379 . 11 1 1 A 32 32 CYS H H 92 8.640 8.679 -0.039 1
1 380 . 11 1 1 A 32 32 CYS HA H 92 4.410 4.217 0.193 1
1 383 . 11 1 1 A 32 32 CYS C C 92 173.700 176.746 -3.046 1
1 384 . 11 1 1 A 32 32 CYS CA C 92 65.500 63.850 1.650 1
1 385 . 11 1 1 A 32 32 CYS CB C 92 28.300 27.201 1.099 1
1 386 . 11 1 1 A 32 32 CYS N N 92 113.500 118.252 -4.752 1
1 387 . 11 1 1 A 33 33 ARG H H 93 8.440 7.842 0.598 1
1 388 . 11 1 1 A 33 33 ARG HA H 93 3.740 3.206 0.534 1
1 391 . 11 1 1 A 33 33 ARG C C 93 177.200 177.906 -0.706 1
1 392 . 11 1 1 A 33 33 ARG CA C 93 58.300 58.109 0.191 1
1 393 . 11 1 1 A 33 33 ARG CB C 93 30.200 29.721 0.479 1
1 394 . 11 1 1 A 33 33 ARG N N 93 111.400 120.278 -8.878 1
1 395 . 11 1 1 A 34 34 ASN H H 94 8.020 7.608 0.412 1
1 396 . 11 1 1 A 34 34 ASN HA H 94 4.980 4.579 0.401 1
1 401 . 11 1 1 A 34 34 ASN C C 94 176.700 177.312 -0.612 1
1 402 . 11 1 1 A 34 34 ASN CA C 94 53.400 55.434 -2.034 1
1 403 . 11 1 1 A 34 34 ASN CB C 94 38.000 38.939 -0.939 1
1 405 . 11 1 1 A 34 34 ASN N N 94 113.600 117.806 -4.206 1
1 407 . 11 1 1 A 35 35 HIS H H 95 7.200 7.862 -0.662 1
1 408 . 11 1 1 A 35 35 HIS HA H 95 4.470 4.372 0.098 1
1 411 . 11 1 1 A 35 35 HIS C C 95 176.600 176.022 0.578 1
1 412 . 11 1 1 A 35 35 HIS CA C 95 60.000 59.775 0.225 1
1 413 . 11 1 1 A 35 35 HIS CB C 95 30.500 31.292 -0.792 1
1 414 . 11 1 1 A 35 35 HIS N N 95 115.600 117.038 -1.438 1
1 415 . 11 1 1 A 36 36 LEU H H 96 8.170 7.956 0.214 1
1 416 . 11 1 1 A 36 36 LEU HA H 96 4.730 4.633 0.097 1
1 426 . 11 1 1 A 36 36 LEU C C 96 176.800 177.371 -0.571 1
1 427 . 11 1 1 A 36 36 LEU CA C 96 54.400 54.551 -0.151 1
1 428 . 11 1 1 A 36 36 LEU CB C 96 40.600 42.068 -1.468 1
1 432 . 11 1 1 A 36 36 LEU N N 96 114.000 119.201 -5.201 1
1 433 . 11 1 1 A 37 37 SER H H 97 7.140 8.302 -1.162 1
1 434 . 11 1 1 A 37 37 SER HA H 97 4.730 4.312 0.418 1
1 437 . 11 1 1 A 37 37 SER CA C 97 62.700 62.828 -0.128 1
1 438 . 11 1 1 A 37 37 SER CB C 97 62.600 61.375 1.225 1
1 439 . 11 1 1 A 37 37 SER N N 97 117.200 116.022 1.178 1
1 440 . 11 1 1 A 38 38 PRO HA H 98 4.560 4.411 0.149 1
1 447 . 11 1 1 A 38 38 PRO C C 98 177.900 178.627 -0.727 1
1 448 . 11 1 1 A 38 38 PRO CA C 98 65.700 65.823 -0.123 1
1 449 . 11 1 1 A 38 38 PRO CB C 98 31.800 30.743 1.057 1
1 452 . 11 1 1 A 39 39 LEU H H 99 8.090 7.444 0.646 1
1 453 . 11 1 1 A 39 39 LEU HA H 99 4.260 4.057 0.203 1
1 463 . 11 1 1 A 39 39 LEU C C 99 178.700 178.478 0.222 1
1 464 . 11 1 1 A 39 39 LEU CA C 99 54.300 57.252 -2.952 1
1 465 . 11 1 1 A 39 39 LEU CB C 99 42.400 41.458 0.942 1
1 469 . 11 1 1 A 39 39 LEU N N 99 112.400 117.507 -5.107 1
1 470 . 11 1 1 A 40 40 TYR H H 100 8.350 8.719 -0.369 1
1 471 . 11 1 1 A 40 40 TYR HA H 100 4.170 4.466 -0.296 1
1 478 . 11 1 1 A 40 40 TYR C C 100 178.300 177.424 0.876 1
1 479 . 11 1 1 A 40 40 TYR CA C 100 63.400 61.800 1.600 1
1 480 . 11 1 1 A 40 40 TYR CB C 100 38.600 39.121 -0.521 1
1 485 . 11 1 1 A 40 40 TYR N N 100 119.400 120.562 -1.162 1
1 486 . 11 1 1 A 41 41 MET H H 101 8.640 8.184 0.456 1
1 487 . 11 1 1 A 41 41 MET HA H 101 4.260 4.556 -0.296 1
1 488 . 11 1 1 A 41 41 MET C C 101 177.000 175.747 1.253 1
1 489 . 11 1 1 A 41 41 MET CA C 101 54.600 54.864 -0.264 1
1 490 . 11 1 1 A 41 41 MET N N 101 111.800 114.653 -2.853 1
1 491 . 11 1 1 A 42 42 LYS H H 102 7.880 7.898 -0.018 1
1 492 . 11 1 1 A 42 42 LYS HA H 102 4.430 4.826 -0.396 1
1 501 . 11 1 1 A 42 42 LYS C C 102 176.300 175.943 0.357 1
1 502 . 11 1 1 A 42 42 LYS CA C 102 56.000 54.347 1.653 1
1 503 . 11 1 1 A 42 42 LYS CB C 102 33.400 34.090 -0.690 1
1 507 . 11 1 1 A 42 42 LYS N N 102 121.700 120.219 1.481 1
1 508 . 11 1 1 A 43 43 SER H H 103 9.160 8.824 0.336 1
1 509 . 11 1 1 A 43 43 SER HA H 103 4.620 5.111 -0.491 1
1 513 . 11 1 1 A 43 43 SER C C 103 176.300 176.441 -0.141 1
1 514 . 11 1 1 A 43 43 SER CA C 103 58.700 56.643 2.057 1
1 515 . 11 1 1 A 43 43 SER CB C 103 63.700 66.427 -2.727 1
1 516 . 11 1 1 A 43 43 SER N N 103 118.800 114.231 4.569 1
1 517 . 11 1 1 A 44 44 LEU H H 104 8.860 8.518 0.342 1
1 518 . 11 1 1 A 44 44 LEU HA H 104 4.130 4.288 -0.158 1
1 528 . 11 1 1 A 44 44 LEU C C 104 178.700 178.627 0.073 1
1 529 . 11 1 1 A 44 44 LEU CA C 104 58.800 57.873 0.927 1
1 530 . 11 1 1 A 44 44 LEU CB C 104 42.600 41.609 0.991 1
1 534 . 11 1 1 A 44 44 LEU N N 104 124.200 122.424 1.776 1
1 535 . 11 1 1 A 45 45 SER H H 105 8.330 8.197 0.133 1
1 536 . 11 1 1 A 45 45 SER HA H 105 4.310 4.389 -0.079 1
1 539 . 11 1 1 A 45 45 SER C C 105 175.000 175.468 -0.468 1
1 540 . 11 1 1 A 45 45 SER CA C 105 60.100 60.612 -0.512 1
1 541 . 11 1 1 A 45 45 SER CB C 105 63.400 63.644 -0.244 1
1 542 . 11 1 1 A 45 45 SER N N 105 107.700 115.723 -8.023 1
1 543 . 11 1 1 A 46 46 GLU H H 106 7.800 7.834 -0.034 1
1 544 . 11 1 1 A 46 46 GLU HA H 106 4.570 4.397 0.173 1
1 549 . 11 1 1 A 46 46 GLU C C 106 174.100 177.401 -3.301 1
1 550 . 11 1 1 A 46 46 GLU CA C 106 55.600 57.978 -2.378 1
1 551 . 11 1 1 A 46 46 GLU CB C 106 31.200 29.962 1.238 1
1 553 . 11 1 1 A 46 46 GLU N N 106 119.600 118.768 0.832 1
1 554 . 11 1 1 A 47 47 ILE H H 107 7.100 7.301 -0.201 1
1 555 . 11 1 1 A 47 47 ILE HA H 107 4.040 4.005 0.035 1
1 565 . 11 1 1 A 47 47 ILE C C 107 174.100 175.330 -1.230 1
1 566 . 11 1 1 A 47 47 ILE CA C 107 62.300 62.112 0.188 1
1 567 . 11 1 1 A 47 47 ILE CB C 107 38.500 37.879 0.621 1
1 571 . 11 1 1 A 47 47 ILE N N 107 120.600 122.005 -1.405 1
1 572 . 11 1 1 A 48 48 LEU H H 108 9.180 8.873 0.307 1
1 573 . 11 1 1 A 48 48 LEU HA H 108 4.940 4.761 0.179 1
1 583 . 11 1 1 A 48 48 LEU CA C 108 51.900 51.456 0.444 1
1 584 . 11 1 1 A 48 48 LEU CB C 108 42.000 42.577 -0.577 1
1 588 . 11 1 1 A 48 48 LEU N N 108 129.400 128.753 0.647 1
1 589 . 11 1 1 A 49 49 PRO HA H 109 3.910 4.275 -0.365 1
1 596 . 11 1 1 A 49 49 PRO C C 109 178.500 178.112 0.388 1
1 597 . 11 1 1 A 49 49 PRO CA C 109 66.600 65.519 1.081 1
1 598 . 11 1 1 A 49 49 PRO CB C 109 31.300 31.688 -0.388 1
1 601 . 11 1 1 A 50 50 ALA H H 110 8.280 8.261 0.019 1
1 602 . 11 1 1 A 50 50 ALA HA H 110 4.110 4.082 0.028 1
1 606 . 11 1 1 A 50 50 ALA C C 110 179.700 179.710 -0.010 1
1 607 . 11 1 1 A 50 50 ALA CA C 110 55.100 54.818 0.282 1
1 608 . 11 1 1 A 50 50 ALA CB C 110 19.200 18.327 0.873 1
1 609 . 11 1 1 A 50 50 ALA N N 110 116.100 118.842 -2.742 1
1 610 . 11 1 1 A 51 51 ASP H H 111 7.790 8.043 -0.253 1
1 611 . 11 1 1 A 51 51 ASP HA H 111 4.440 4.359 0.081 1
1 614 . 11 1 1 A 51 51 ASP C C 111 178.200 178.699 -0.499 1
1 615 . 11 1 1 A 51 51 ASP CA C 111 57.600 57.342 0.258 1
1 616 . 11 1 1 A 51 51 ASP CB C 111 41.800 41.135 0.665 1
1 617 . 11 1 1 A 51 51 ASP N N 111 116.500 117.857 -1.357 1
1 618 . 11 1 1 A 52 52 ILE H H 112 7.020 7.616 -0.596 1
1 619 . 11 1 1 A 52 52 ILE HA H 112 3.750 3.687 0.063 1
1 629 . 11 1 1 A 52 52 ILE C C 112 177.300 177.784 -0.484 1
1 630 . 11 1 1 A 52 52 ILE CA C 112 63.500 65.024 -1.524 1
1 631 . 11 1 1 A 52 52 ILE CB C 112 37.500 37.032 0.468 1
1 635 . 11 1 1 A 52 52 ILE N N 112 116.700 119.750 -3.050 1
1 636 . 11 1 1 A 53 53 GLN H H 113 9.150 8.208 0.942 1
1 637 . 11 1 1 A 53 53 GLN HA H 113 3.720 4.008 -0.288 1
1 644 . 11 1 1 A 53 53 GLN C C 113 177.500 178.194 -0.694 1
1 645 . 11 1 1 A 53 53 GLN CA C 113 58.200 58.681 -0.481 1
1 646 . 11 1 1 A 53 53 GLN CB C 113 30.200 28.626 1.574 1
1 649 . 11 1 1 A 53 53 GLN N N 113 121.200 121.557 -0.357 1
1 651 . 11 1 1 A 54 54 SER H H 114 8.150 8.422 -0.272 1
1 652 . 11 1 1 A 54 54 SER HA H 114 4.180 4.239 -0.059 1
1 655 . 11 1 1 A 54 54 SER C C 114 175.900 177.591 -1.691 1
1 656 . 11 1 1 A 54 54 SER CA C 114 62.100 61.389 0.711 1
1 657 . 11 1 1 A 54 54 SER CB C 114 62.800 62.583 0.217 1
1 658 . 11 1 1 A 54 54 SER N N 114 112.200 115.708 -3.508 1
1 659 . 11 1 1 A 55 55 ILE H H 115 6.760 7.500 -0.740 1
1 660 . 11 1 1 A 55 55 ILE HA H 115 3.860 3.636 0.224 1
1 670 . 11 1 1 A 55 55 ILE C C 115 179.200 178.060 1.140 1
1 671 . 11 1 1 A 55 55 ILE CA C 115 64.700 65.391 -0.691 1
1 672 . 11 1 1 A 55 55 ILE CB C 115 38.900 38.117 0.783 1
1 676 . 11 1 1 A 55 55 ILE N N 115 119.500 122.867 -3.367 1
1 677 . 11 1 1 A 56 56 ILE H H 116 7.750 7.967 -0.217 1
1 678 . 11 1 1 A 56 56 ILE HA H 116 3.690 3.741 -0.051 1
1 688 . 11 1 1 A 56 56 ILE C C 116 176.900 178.536 -1.636 1
1 689 . 11 1 1 A 56 56 ILE CA C 116 62.800 64.913 -2.113 1
1 690 . 11 1 1 A 56 56 ILE CB C 116 36.200 37.216 -1.016 1
1 694 . 11 1 1 A 56 56 ILE N N 116 120.200 119.520 0.680 1
1 695 . 11 1 1 A 57 57 ASN H H 117 8.690 8.225 0.465 1
1 696 . 11 1 1 A 57 57 ASN HA H 117 4.440 4.377 0.063 1
1 701 . 11 1 1 A 57 57 ASN C C 117 177.200 177.069 0.131 1
1 702 . 11 1 1 A 57 57 ASN CA C 117 54.800 57.013 -2.213 1
1 703 . 11 1 1 A 57 57 ASN CB C 117 38.100 38.884 -0.784 1
1 705 . 11 1 1 A 57 57 ASN N N 117 117.000 120.474 -3.474 1
1 707 . 11 1 1 A 58 58 GLU H H 118 7.630 7.668 -0.038 1
1 708 . 11 1 1 A 58 58 GLU HA H 118 4.450 4.367 0.083 1
1 713 . 11 1 1 A 58 58 GLU C C 118 176.500 177.420 -0.920 1
1 714 . 11 1 1 A 58 58 GLU CA C 118 56.200 57.864 -1.664 1
1 715 . 11 1 1 A 58 58 GLU CB C 118 30.200 30.519 -0.319 1
1 717 . 11 1 1 A 58 58 GLU N N 118 116.300 116.608 -0.308 1
1 718 . 11 1 1 A 59 59 THR H H 119 7.540 7.758 -0.218 1
1 719 . 11 1 1 A 59 59 THR HA H 119 4.230 4.198 0.032 1
1 724 . 11 1 1 A 59 59 THR C C 119 174.200 174.265 -0.065 1
1 725 . 11 1 1 A 59 59 THR CA C 119 63.800 64.157 -0.357 1
1 726 . 11 1 1 A 59 59 THR CB C 119 68.900 69.213 -0.313 1
1 728 . 11 1 1 A 59 59 THR N N 119 117.600 116.416 1.184 1
1 729 . 11 1 1 A 60 60 LYS H H 120 8.860 8.747 0.113 1
1 730 . 11 1 1 A 60 60 LYS HA H 120 4.490 4.586 -0.096 1
1 739 . 11 1 1 A 60 60 LYS C C 120 175.800 175.255 0.545 1
1 740 . 11 1 1 A 60 60 LYS CA C 120 54.900 55.260 -0.360 1
1 741 . 11 1 1 A 60 60 LYS CB C 120 29.800 31.101 -1.301 1
1 745 . 11 1 1 A 60 60 LYS N N 120 128.500 128.759 -0.259 1
1 746 . 11 1 1 A 61 61 LEU H H 121 7.150 7.826 -0.676 1
1 747 . 11 1 1 A 61 61 LEU HA H 121 4.710 4.882 -0.172 1
1 757 . 11 1 1 A 61 61 LEU C C 121 175.000 175.813 -0.813 1
1 758 . 11 1 1 A 61 61 LEU CA C 121 52.800 53.192 -0.392 1
1 759 . 11 1 1 A 61 61 LEU CB C 121 46.400 44.687 1.713 1
1 763 . 11 1 1 A 61 61 LEU N N 121 120.700 125.907 -5.207 1
1 764 . 11 1 1 A 62 62 ALA H H 122 8.000 8.594 -0.594 1
1 765 . 11 1 1 A 62 62 ALA HA H 122 4.250 4.405 -0.155 1
1 769 . 11 1 1 A 62 62 ALA CA C 122 52.100 52.145 -0.045 1
1 770 . 11 1 1 A 62 62 ALA CB C 122 19.500 19.335 0.165 1
1 771 . 11 1 1 A 62 62 ALA N N 122 119.900 123.234 -3.334 1
1 772 . 11 1 1 A 63 63 LYS H H 123 8.770 9.045 -0.275 1
1 773 . 11 1 1 A 63 63 LYS HA H 123 3.800 3.901 -0.101 1
1 782 . 11 1 1 A 63 63 LYS C C 123 178.300 178.929 -0.629 1
1 783 . 11 1 1 A 63 63 LYS CA C 123 60.700 59.923 0.777 1
1 784 . 11 1 1 A 63 63 LYS CB C 123 32.300 32.115 0.185 1
1 788 . 11 1 1 A 63 63 LYS N N 123 121.400 122.254 -0.854 1
1 789 . 11 1 1 A 64 64 ASN H H 124 9.020 7.919 1.101 1
1 790 . 11 1 1 A 64 64 ASN HA H 124 4.430 4.543 -0.113 1
1 795 . 11 1 1 A 64 64 ASN C C 124 178.300 178.032 0.268 1
1 796 . 11 1 1 A 64 64 ASN CA C 124 56.200 55.866 0.334 1
1 797 . 11 1 1 A 64 64 ASN CB C 124 37.300 38.569 -1.269 1
1 799 . 11 1 1 A 64 64 ASN N N 124 115.000 117.735 -2.735 1
1 801 . 11 1 1 A 65 65 THR H H 125 7.620 8.080 -0.460 1
1 802 . 11 1 1 A 65 65 THR HA H 125 4.030 4.074 -0.044 1
1 807 . 11 1 1 A 65 65 THR C C 125 175.500 176.564 -1.064 1
1 808 . 11 1 1 A 65 65 THR CA C 125 66.000 67.410 -1.410 1
1 809 . 11 1 1 A 65 65 THR CB C 125 67.600 67.927 -0.327 1
1 811 . 11 1 1 A 65 65 THR N N 125 119.800 116.229 3.571 1
1 812 . 11 1 1 A 66 66 LEU H H 126 8.020 8.642 -0.622 1
1 813 . 11 1 1 A 66 66 LEU HA H 126 3.790 3.872 -0.082 1
1 823 . 11 1 1 A 66 66 LEU C C 126 179.200 179.296 -0.096 1
1 824 . 11 1 1 A 66 66 LEU CA C 126 58.700 58.060 0.640 1
1 825 . 11 1 1 A 66 66 LEU CB C 126 41.300 41.262 0.038 1
1 829 . 11 1 1 A 66 66 LEU N N 126 121.200 121.016 0.184 1
1 830 . 11 1 1 A 67 67 LYS H H 127 8.380 8.445 -0.065 1
1 831 . 11 1 1 A 67 67 LYS HA H 127 3.740 4.018 -0.278 1
1 840 . 11 1 1 A 67 67 LYS C C 127 178.300 179.686 -1.386 1
1 841 . 11 1 1 A 67 67 LYS CA C 127 60.100 59.705 0.395 1
1 842 . 11 1 1 A 67 67 LYS CB C 127 32.400 32.205 0.195 1
1 846 . 11 1 1 A 67 67 LYS N N 127 117.000 118.012 -1.012 1
1 847 . 11 1 1 A 68 68 ALA H H 128 7.480 8.003 -0.523 1
1 848 . 11 1 1 A 68 68 ALA HA H 128 4.210 4.004 0.206 1
1 852 . 11 1 1 A 68 68 ALA C C 128 181.200 180.121 1.079 1
1 853 . 11 1 1 A 68 68 ALA CA C 128 55.200 55.044 0.156 1
1 854 . 11 1 1 A 68 68 ALA CB C 128 18.600 18.441 0.159 1
1 855 . 11 1 1 A 68 68 ALA N N 128 122.900 121.957 0.943 1
1 856 . 11 1 1 A 69 69 ILE H H 129 8.250 7.865 0.385 1
1 857 . 11 1 1 A 69 69 ILE HA H 129 3.130 3.688 -0.558 1
1 867 . 11 1 1 A 69 69 ILE C C 129 177.400 177.890 -0.490 1
1 868 . 11 1 1 A 69 69 ILE CA C 129 66.700 65.484 1.216 1
1 869 . 11 1 1 A 69 69 ILE CB C 129 37.900 37.735 0.165 1
1 873 . 11 1 1 A 69 69 ILE N N 129 122.800 119.014 3.786 1
1 874 . 11 1 1 A 70 70 ARG H H 130 8.040 8.000 0.040 1
1 875 . 11 1 1 A 70 70 ARG HA H 130 3.620 3.905 -0.285 1
1 882 . 11 1 1 A 70 70 ARG C C 130 177.800 178.303 -0.503 1
1 883 . 11 1 1 A 70 70 ARG CA C 130 60.700 59.751 0.949 1
1 884 . 11 1 1 A 70 70 ARG CB C 130 29.600 29.657 -0.057 1
1 887 . 11 1 1 A 70 70 ARG N N 130 119.700 120.624 -0.924 1
1 888 . 11 1 1 A 71 71 ASN H H 131 8.920 8.563 0.357 1
1 889 . 11 1 1 A 71 71 ASN HA H 131 4.430 4.490 -0.060 1
1 894 . 11 1 1 A 71 71 ASN C C 131 177.500 177.868 -0.368 1
1 895 . 11 1 1 A 71 71 ASN CA C 131 56.100 56.641 -0.541 1
1 896 . 11 1 1 A 71 71 ASN CB C 131 38.600 39.515 -0.915 1
1 898 . 11 1 1 A 71 71 ASN N N 131 117.200 117.937 -0.737 1
1 900 . 11 1 1 A 72 72 THR H H 132 8.300 8.387 -0.087 1
1 901 . 11 1 1 A 72 72 THR HA H 132 4.430 3.736 0.694 1
1 906 . 11 1 1 A 72 72 THR C C 132 175.100 176.328 -1.228 1
1 907 . 11 1 1 A 72 72 THR CA C 132 68.200 66.299 1.901 1
1 908 . 11 1 1 A 72 72 THR CB C 132 68.500 68.603 -0.103 1
1 910 . 11 1 1 A 72 72 THR N N 132 119.200 115.127 4.073 1
1 911 . 11 1 1 A 73 73 ALA H H 133 7.950 8.167 -0.217 1
1 912 . 11 1 1 A 73 73 ALA HA H 133 4.040 4.111 -0.071 1
1 916 . 11 1 1 A 73 73 ALA C C 133 178.200 179.923 -1.723 1
1 917 . 11 1 1 A 73 73 ALA CA C 133 55.900 55.456 0.444 1
1 918 . 11 1 1 A 73 73 ALA CB C 133 16.700 18.304 -1.604 1
1 919 . 11 1 1 A 73 73 ALA N N 133 120.900 123.518 -2.618 1
1 920 . 11 1 1 A 74 74 SER H H 134 8.440 8.776 -0.336 1
1 921 . 11 1 1 A 74 74 SER HA H 134 4.430 4.520 -0.090 1
1 924 . 11 1 1 A 74 74 SER C C 134 178.800 177.361 1.439 1
1 925 . 11 1 1 A 74 74 SER CA C 134 61.300 61.585 -0.285 1
1 926 . 11 1 1 A 74 74 SER CB C 134 62.600 62.567 0.033 1
1 927 . 11 1 1 A 74 74 SER N N 134 110.100 113.317 -3.217 1
1 928 . 11 1 1 A 75 75 GLN H H 135 8.340 7.741 0.599 1
1 929 . 11 1 1 A 75 75 GLN HA H 135 3.880 4.113 -0.233 1
1 936 . 11 1 1 A 75 75 GLN C C 135 178.800 179.023 -0.223 1
1 937 . 11 1 1 A 75 75 GLN CA C 135 59.600 58.905 0.695 1
1 938 . 11 1 1 A 75 75 GLN CB C 135 29.900 28.488 1.412 1
1 941 . 11 1 1 A 75 75 GLN N N 135 118.100 121.904 -3.804 1
1 943 . 11 1 1 A 76 76 ILE H H 136 7.670 7.463 0.207 1
1 944 . 11 1 1 A 76 76 ILE HA H 136 3.200 3.638 -0.438 1
1 954 . 11 1 1 A 76 76 ILE C C 136 177.500 177.926 -0.426 1
1 955 . 11 1 1 A 76 76 ILE CA C 136 66.100 65.002 1.098 1
1 956 . 11 1 1 A 76 76 ILE CB C 136 37.400 37.357 0.043 1
1 960 . 11 1 1 A 76 76 ILE N N 136 122.500 120.343 2.157 1
1 961 . 11 1 1 A 77 77 PHE H H 137 7.930 7.746 0.184 1
1 962 . 11 1 1 A 77 77 PHE HA H 137 3.890 4.142 -0.252 1
1 969 . 11 1 1 A 77 77 PHE C C 137 178.200 178.366 -0.166 1
1 970 . 11 1 1 A 77 77 PHE CA C 137 63.600 60.730 2.870 1
1 971 . 11 1 1 A 77 77 PHE CB C 137 39.300 38.540 0.760 1
1 976 . 11 1 1 A 77 77 PHE N N 137 116.100 119.867 -3.767 1
1 977 . 11 1 1 A 78 78 ARG H H 138 8.900 8.233 0.667 1
1 978 . 11 1 1 A 78 78 ARG HA H 138 3.910 3.969 -0.059 1
1 986 . 11 1 1 A 78 78 ARG C C 138 178.300 178.898 -0.598 1
1 987 . 11 1 1 A 78 78 ARG CA C 138 60.100 59.266 0.834 1
1 988 . 11 1 1 A 78 78 ARG CB C 138 29.600 29.906 -0.306 1
1 991 . 11 1 1 A 78 78 ARG N N 138 118.600 119.252 -0.652 1
1 993 . 11 1 1 A 79 79 LEU H H 139 7.730 8.044 -0.314 1
1 994 . 11 1 1 A 79 79 LEU HA H 139 4.280 4.137 0.143 1
1 1004 . 11 1 1 A 79 79 LEU C C 139 179.000 178.391 0.609 1
1 1005 . 11 1 1 A 79 79 LEU CA C 139 57.800 57.954 -0.154 1
1 1006 . 11 1 1 A 79 79 LEU CB C 139 41.900 41.283 0.617 1
1 1010 . 11 1 1 A 79 79 LEU N N 139 121.900 121.362 0.538 1
1 1011 . 11 1 1 A 80 80 ALA H H 140 7.590 7.358 0.232 1
1 1012 . 11 1 1 A 80 80 ALA HA H 140 2.710 3.417 -0.707 1
1 1016 . 11 1 1 A 80 80 ALA C C 140 179.900 180.023 -0.123 1
1 1017 . 11 1 1 A 80 80 ALA CA C 140 55.100 54.465 0.635 1
1 1018 . 11 1 1 A 80 80 ALA CB C 140 17.600 17.527 0.073 1
1 1019 . 11 1 1 A 80 80 ALA N N 140 123.400 120.145 3.255 1
1 1020 . 11 1 1 A 81 81 ILE H H 141 8.910 7.748 1.162 1
1 1021 . 11 1 1 A 81 81 ILE HA H 141 4.110 4.223 -0.113 1
1 1031 . 11 1 1 A 81 81 ILE C C 141 181.700 177.455 4.245 1
1 1032 . 11 1 1 A 81 81 ILE CA C 141 64.800 65.299 -0.499 1
1 1033 . 11 1 1 A 81 81 ILE CB C 141 38.600 37.564 1.036 1
1 1037 . 11 1 1 A 81 81 ILE N N 141 122.400 119.071 3.329 1
1 1038 . 11 1 1 A 82 82 GLU H H 142 8.560 8.586 -0.026 1
1 1039 . 11 1 1 A 82 82 GLU HA H 142 4.100 3.995 0.105 1
1 1044 . 11 1 1 A 82 82 GLU C C 142 177.700 178.596 -0.896 1
1 1045 . 11 1 1 A 82 82 GLU CA C 142 59.100 59.990 -0.890 1
1 1046 . 11 1 1 A 82 82 GLU CB C 142 29.200 29.280 -0.080 1
1 1048 . 11 1 1 A 82 82 GLU N N 142 123.200 119.941 3.259 1
1 1049 . 11 1 1 A 83 83 ASN H H 143 7.310 7.657 -0.347 1
1 1050 . 11 1 1 A 83 83 ASN HA H 143 4.750 4.884 -0.134 1
1 1055 . 11 1 1 A 83 83 ASN C C 143 173.200 174.394 -1.194 1
1 1056 . 11 1 1 A 83 83 ASN CA C 143 54.200 52.961 1.239 1
1 1057 . 11 1 1 A 83 83 ASN CB C 143 41.300 38.742 2.558 1
1 1059 . 11 1 1 A 83 83 ASN N N 143 114.900 115.415 -0.515 1
1 1061 . 11 1 1 A 84 84 ARG H H 144 8.320 7.996 0.324 1
1 1062 . 11 1 1 A 84 84 ARG HA H 144 4.120 4.036 0.084 1
1 1069 . 11 1 1 A 84 84 ARG C C 144 175.300 175.973 -0.673 1
1 1070 . 11 1 1 A 84 84 ARG CA C 144 57.100 57.030 0.070 1
1 1071 . 11 1 1 A 84 84 ARG CB C 144 26.000 26.839 -0.839 1
1 1074 . 11 1 1 A 84 84 ARG N N 144 114.400 115.209 -0.809 1
1 1075 . 11 1 1 A 85 85 ALA H H 145 8.350 8.099 0.251 1
1 1076 . 11 1 1 A 85 85 ALA HA H 145 4.320 4.299 0.021 1
1 1080 . 11 1 1 A 85 85 ALA C C 145 176.500 177.554 -1.054 1
1 1081 . 11 1 1 A 85 85 ALA CA C 145 53.400 54.062 -0.662 1
1 1082 . 11 1 1 A 85 85 ALA CB C 145 19.900 19.757 0.143 1
1 1083 . 11 1 1 A 85 85 ALA N N 145 120.600 119.314 1.286 1
1 1084 . 11 1 1 A 86 86 ILE H H 146 7.290 7.314 -0.024 1
1 1085 . 11 1 1 A 86 86 ILE HA H 146 4.400 4.746 -0.346 1
1 1095 . 11 1 1 A 86 86 ILE C C 146 173.600 173.090 0.510 1
1 1096 . 11 1 1 A 86 86 ILE CA C 146 59.200 60.068 -0.868 1
1 1097 . 11 1 1 A 86 86 ILE CB C 146 41.600 41.903 -0.303 1
1 1101 . 11 1 1 A 86 86 ILE N N 146 111.500 115.979 -4.479 1
1 1102 . 11 1 1 A 87 87 ASP H H 147 8.270 9.021 -0.751 1
1 1103 . 11 1 1 A 87 87 ASP HA H 147 4.940 5.039 -0.099 1
1 1106 . 11 1 1 A 87 87 ASP C C 147 174.700 174.809 -0.109 1
1 1107 . 11 1 1 A 87 87 ASP CA C 147 53.700 52.806 0.894 1
1 1108 . 11 1 1 A 87 87 ASP CB C 147 41.800 41.219 0.581 1
1 1109 . 11 1 1 A 87 87 ASP N N 147 119.400 129.705 -10.305 1
1 1110 . 11 1 1 A 88 88 PHE H H 148 7.230 7.714 -0.484 1
1 1111 . 11 1 1 A 88 88 PHE HA H 148 4.690 4.900 -0.210 1
1 1119 . 11 1 1 A 88 88 PHE C C 148 171.500 172.760 -1.260 1
1 1120 . 11 1 1 A 88 88 PHE CA C 148 56.400 57.846 -1.446 1
1 1121 . 11 1 1 A 88 88 PHE CB C 148 42.000 42.132 -0.132 1
1 1127 . 11 1 1 A 88 88 PHE N N 148 119.700 123.107 -3.407 1
1 1128 . 11 1 1 A 89 89 ASN H H 149 8.060 8.236 -0.176 1
1 1129 . 11 1 1 A 89 89 ASN HA H 149 4.490 4.789 -0.299 1
1 1134 . 11 1 1 A 89 89 ASN CA C 149 48.100 48.492 -0.392 1
1 1135 . 11 1 1 A 89 89 ASN CB C 149 39.200 39.468 -0.268 1
1 1137 . 11 1 1 A 89 89 ASN N N 149 119.700 125.473 -5.773 1
1 1139 . 11 1 1 A 90 90 PRO HA H 150 3.970 4.257 -0.287 1
1 1146 . 11 1 1 A 90 90 PRO C C 150 177.700 178.092 -0.392 1
1 1147 . 11 1 1 A 90 90 PRO CA C 150 63.900 64.757 -0.857 1
1 1148 . 11 1 1 A 90 90 PRO CB C 150 31.700 31.662 0.038 1
1 1151 . 11 1 1 A 91 91 ALA H H 151 7.240 7.375 -0.135 1
1 1152 . 11 1 1 A 91 91 ALA HA H 151 3.900 4.131 -0.231 1
1 1156 . 11 1 1 A 91 91 ALA C C 151 178.000 179.357 -1.357 1
1 1157 . 11 1 1 A 91 91 ALA CA C 151 53.900 53.941 -0.041 1
1 1158 . 11 1 1 A 91 91 ALA CB C 151 17.700 18.567 -0.867 1
1 1159 . 11 1 1 A 91 91 ALA N N 151 115.700 119.048 -3.348 1
1 1160 . 11 1 1 A 92 92 ASP H H 152 7.080 7.670 -0.590 1
1 1161 . 11 1 1 A 92 92 ASP HA H 152 4.220 4.217 0.003 1
1 1164 . 11 1 1 A 92 92 ASP C C 152 176.200 176.905 -0.705 1
1 1165 . 11 1 1 A 92 92 ASP CA C 152 55.800 56.571 -0.771 1
1 1166 . 11 1 1 A 92 92 ASP CB C 152 39.500 40.258 -0.758 1
1 1167 . 11 1 1 A 92 92 ASP N N 152 117.100 119.296 -2.196 1
1 1168 . 11 1 1 A 93 93 TYR H H 153 7.060 7.059 0.001 1
1 1169 . 11 1 1 A 93 93 TYR HA H 153 4.490 4.496 -0.006 1
1 1176 . 11 1 1 A 93 93 TYR C C 153 174.700 175.284 -0.584 1
1 1177 . 11 1 1 A 93 93 TYR CA C 153 57.600 58.733 -1.133 1
1 1178 . 11 1 1 A 93 93 TYR CB C 153 38.500 38.483 0.017 1
1 1183 . 11 1 1 A 93 93 TYR N N 153 116.800 116.591 0.209 1
1 1184 . 11 1 1 A 94 94 VAL H H 154 7.000 7.512 -0.512 1
1 1185 . 11 1 1 A 94 94 VAL HA H 154 4.040 4.178 -0.138 1
1 1193 . 11 1 1 A 94 94 VAL C C 154 174.700 175.287 -0.587 1
1 1194 . 11 1 1 A 94 94 VAL CA C 154 62.100 62.330 -0.230 1
1 1195 . 11 1 1 A 94 94 VAL CB C 154 32.700 32.903 -0.203 1
1 1198 . 11 1 1 A 94 94 VAL N N 154 120.600 120.125 0.475 1
1 1199 . 11 1 1 A 95 95 ARG H H 155 9.430 9.263 0.167 1
1 1200 . 11 1 1 A 95 95 ARG HA H 155 4.640 5.003 -0.363 1
1 1207 . 11 1 1 A 95 95 ARG C C 155 175.400 174.722 0.678 1
1 1208 . 11 1 1 A 95 95 ARG CA C 155 54.200 54.120 0.080 1
1 1209 . 11 1 1 A 95 95 ARG CB C 155 32.400 33.999 -1.599 1
1 1212 . 11 1 1 A 95 95 ARG N N 155 128.200 123.761 4.439 1
1 1213 . 11 1 1 A 96 96 ILE H H 156 8.700 9.015 -0.315 1
1 1214 . 11 1 1 A 96 96 ILE HA H 156 4.440 4.581 -0.141 1
1 1224 . 11 1 1 A 96 96 ILE CA C 156 56.500 57.795 -1.295 1
1 1225 . 11 1 1 A 96 96 ILE CB C 156 36.700 38.538 -1.838 1
1 1229 . 11 1 1 A 96 96 ILE N N 156 124.100 123.003 1.097 1
1 1230 . 11 1 1 A 97 97 PRO HA H 157 4.370 4.828 -0.458 1
1 1237 . 11 1 1 A 97 97 PRO C C 157 176.000 177.353 -1.353 1
1 1238 . 11 1 1 A 97 97 PRO CA C 157 63.200 62.921 0.279 1
1 1239 . 11 1 1 A 97 97 PRO CB C 157 32.400 31.903 0.497 1
1 1242 . 11 1 1 A 98 98 LYS H H 158 8.380 8.827 -0.447 1
1 1243 . 11 1 1 A 98 98 LYS HA H 158 4.190 4.131 0.059 1
1 1252 . 11 1 1 A 98 98 LYS C C 158 176.800 176.842 -0.042 1
1 1253 . 11 1 1 A 98 98 LYS CA C 158 57.100 56.793 0.307 1
1 1254 . 11 1 1 A 98 98 LYS CB C 158 32.800 32.731 0.069 1
1 1258 . 11 1 1 A 98 98 LYS N N 158 120.800 121.771 -0.971 1
1 1259 . 11 1 1 A 99 99 ILE H H 159 7.930 7.910 0.020 1
1 1260 . 11 1 1 A 99 99 ILE HA H 159 4.200 3.767 0.433 1
1 1270 . 11 1 1 A 99 99 ILE C C 159 175.400 175.494 -0.094 1
1 1271 . 11 1 1 A 99 99 ILE CA C 159 60.600 64.026 -3.426 1
1 1272 . 11 1 1 A 99 99 ILE CB C 159 39.100 35.861 3.239 1
1 1276 . 11 1 1 A 99 99 ILE N N 159 120.200 116.296 3.904 1
1 1277 . 11 1 1 A 100 100 ALA H H 160 8.370 8.436 -0.066 1
1 1278 . 11 1 1 A 100 100 ALA HA H 160 4.370 4.269 0.101 1
1 1282 . 11 1 1 A 100 100 ALA C C 160 177.200 177.118 0.082 1
1 1283 . 11 1 1 A 100 100 ALA CA C 160 52.200 51.515 0.685 1
1 1284 . 11 1 1 A 100 100 ALA CB C 160 19.400 17.776 1.624 1
1 1285 . 11 1 1 A 100 100 ALA N N 160 128.300 124.955 3.345 1
1 1286 . 11 1 1 A 101 101 LEU H H 161 8.250 8.565 -0.315 1
1 1287 . 11 1 1 A 101 101 LEU HA H 161 4.280 4.581 -0.301 1
1 1297 . 11 1 1 A 101 101 LEU C C 161 177.200 176.565 0.635 1
1 1298 . 11 1 1 A 101 101 LEU CA C 161 55.200 54.336 0.864 1
1 1299 . 11 1 1 A 101 101 LEU CB C 161 42.400 43.124 -0.724 1
1 1303 . 11 1 1 A 101 101 LEU N N 161 121.900 124.679 -2.779 1
1 1304 . 11 1 1 A 102 102 GLU H H 162 8.390 8.022 0.368 1
1 1305 . 11 1 1 A 102 102 GLU HA H 162 4.230 4.114 0.116 1
1 1310 . 11 1 1 A 102 102 GLU C C 162 176.100 174.320 1.780 1
1 1311 . 11 1 1 A 102 102 GLU CA C 162 56.400 58.462 -2.062 1
1 1312 . 11 1 1 A 102 102 GLU CB C 162 30.500 28.393 2.107 1
1 1314 . 11 1 1 A 102 102 GLU N N 162 121.300 118.010 3.290 1
1 1315 . 11 1 1 A 103 103 HIS H H 163 8.330 8.414 -0.084 1
1 1316 . 11 1 1 A 103 103 HIS HA H 163 4.590 4.995 -0.405 1
1 1319 . 11 1 1 A 103 103 HIS C C 163 176.100 173.863 2.237 1
1 1320 . 11 1 1 A 103 103 HIS CA C 163 56.000 53.681 2.319 1
1 1321 . 11 1 1 A 103 103 HIS CB C 163 30.500 31.760 -1.260 1
1 1322 . 11 1 1 A 103 103 HIS N N 163 120.000 120.346 -0.346 1
1 1323 . 11 1 1 A 107 107 HIS HA H 167 4.620 4.730 -0.110 1
1 1326 . 11 1 1 A 107 107 HIS C C 167 173.900 174.749 -0.849 1
1 1327 . 11 1 1 A 107 107 HIS CA C 167 56.000 55.278 0.722 1
1 1328 . 11 1 1 A 107 107 HIS CB C 167 30.300 28.285 2.015 1
1 15 . 12 1 1 A 2 2 ASP H H 62 8.760 8.991 -0.231 1
1 16 . 12 1 1 A 2 2 ASP HA H 62 4.810 5.620 -0.810 1
1 19 . 12 1 1 A 2 2 ASP C C 62 175.800 174.786 1.014 1
1 20 . 12 1 1 A 2 2 ASP CA C 62 54.800 52.989 1.811 1
1 21 . 12 1 1 A 2 2 ASP CB C 62 41.600 43.179 -1.579 1
1 22 . 12 1 1 A 2 2 ASP N N 62 120.900 118.379 2.521 1
1 23 . 12 1 1 A 3 3 SER H H 63 8.710 9.079 -0.369 1
1 24 . 12 1 1 A 3 3 SER HA H 63 4.970 5.025 -0.055 1
1 27 . 12 1 1 A 3 3 SER C C 63 175.600 174.534 1.066 1
1 28 . 12 1 1 A 3 3 SER CA C 63 57.500 57.068 0.432 1
1 29 . 12 1 1 A 3 3 SER CB C 63 65.900 65.615 0.285 1
1 30 . 12 1 1 A 3 3 SER N N 63 116.300 119.527 -3.227 1
1 31 . 12 1 1 A 4 4 PHE H H 64 9.370 9.196 0.174 1
1 32 . 12 1 1 A 4 4 PHE HA H 64 4.010 3.982 0.028 1
1 39 . 12 1 1 A 4 4 PHE C C 64 176.700 177.587 -0.887 1
1 40 . 12 1 1 A 4 4 PHE CA C 64 62.200 61.520 0.680 1
1 41 . 12 1 1 A 4 4 PHE CB C 64 38.500 39.521 -1.021 1
1 46 . 12 1 1 A 4 4 PHE N N 64 121.400 124.726 -3.326 1
1 47 . 12 1 1 A 5 5 GLY H H 65 8.930 8.156 0.774 1
1 48 . 12 1 1 A 5 5 GLY HA2 H 65 2.020 2.658 -0.638 1
1 49 . 12 1 1 A 5 5 GLY HA3 H 65 3.250 3.243 0.007 1
1 50 . 12 1 1 A 5 5 GLY C C 65 175.200 175.195 0.005 1
1 51 . 12 1 1 A 5 5 GLY CA C 65 46.300 46.453 -0.153 1
1 52 . 12 1 1 A 5 5 GLY N N 65 106.500 106.196 0.304 1
1 53 . 12 1 1 A 6 6 ASP H H 66 7.630 8.090 -0.460 1
1 54 . 12 1 1 A 6 6 ASP HA H 66 4.100 4.152 -0.052 1
1 57 . 12 1 1 A 6 6 ASP C C 66 179.500 178.535 0.965 1
1 58 . 12 1 1 A 6 6 ASP CA C 66 57.400 56.943 0.457 1
1 59 . 12 1 1 A 6 6 ASP CB C 66 40.500 41.220 -0.720 1
1 60 . 12 1 1 A 6 6 ASP N N 66 120.500 121.185 -0.685 1
1 61 . 12 1 1 A 7 7 TRP H H 67 7.190 7.838 -0.648 1
1 62 . 12 1 1 A 7 7 TRP HA H 67 3.860 4.276 -0.416 1
1 71 . 12 1 1 A 7 7 TRP C C 67 177.200 178.326 -1.126 1
1 72 . 12 1 1 A 7 7 TRP CA C 67 61.100 59.439 1.661 1
1 73 . 12 1 1 A 7 7 TRP CB C 67 28.300 28.735 -0.435 1
1 79 . 12 1 1 A 7 7 TRP N N 67 120.700 119.245 1.455 1
1 81 . 12 1 1 A 8 8 ALA H H 68 9.040 8.383 0.657 1
1 82 . 12 1 1 A 8 8 ALA HA H 68 3.730 3.871 -0.141 1
1 86 . 12 1 1 A 8 8 ALA C C 68 179.500 179.105 0.395 1
1 87 . 12 1 1 A 8 8 ALA CA C 68 55.200 55.238 -0.038 1
1 88 . 12 1 1 A 8 8 ALA CB C 68 18.600 17.838 0.762 1
1 89 . 12 1 1 A 8 8 ALA N N 68 125.700 122.748 2.952 1
1 90 . 12 1 1 A 9 9 GLU H H 69 8.060 8.112 -0.052 1
1 91 . 12 1 1 A 9 9 GLU HA H 69 4.020 4.051 -0.031 1
1 96 . 12 1 1 A 9 9 GLU C C 69 180.400 179.005 1.395 1
1 97 . 12 1 1 A 9 9 GLU CA C 69 58.800 60.011 -1.211 1
1 98 . 12 1 1 A 9 9 GLU CB C 69 28.500 29.115 -0.615 1
1 99 . 12 1 1 A 9 9 GLU N N 69 115.400 118.269 -2.869 1
1 100 . 12 1 1 A 10 10 LYS H H 70 7.740 7.495 0.245 1
1 101 . 12 1 1 A 10 10 LYS HA H 70 3.910 4.012 -0.102 1
1 110 . 12 1 1 A 10 10 LYS C C 70 179.500 178.953 0.547 1
1 111 . 12 1 1 A 10 10 LYS CA C 70 60.000 59.349 0.651 1
1 112 . 12 1 1 A 10 10 LYS CB C 70 32.400 32.005 0.395 1
1 116 . 12 1 1 A 10 10 LYS N N 70 122.700 119.079 3.621 1
1 117 . 12 1 1 A 11 11 PHE H H 71 8.750 8.516 0.234 1
1 118 . 12 1 1 A 11 11 PHE HA H 71 4.080 4.256 -0.176 1
1 126 . 12 1 1 A 11 11 PHE C C 71 177.100 177.387 -0.287 1
1 127 . 12 1 1 A 11 11 PHE CA C 71 61.200 61.327 -0.127 1
1 128 . 12 1 1 A 11 11 PHE CB C 71 38.900 39.370 -0.470 1
1 134 . 12 1 1 A 11 11 PHE N N 71 123.500 120.614 2.886 1
1 135 . 12 1 1 A 12 12 LEU H H 72 8.400 8.890 -0.490 1
1 136 . 12 1 1 A 12 12 LEU HA H 72 3.520 3.737 -0.217 1
1 146 . 12 1 1 A 12 12 LEU C C 72 180.000 179.232 0.768 1
1 147 . 12 1 1 A 12 12 LEU CA C 72 58.200 57.871 0.329 1
1 148 . 12 1 1 A 12 12 LEU CB C 72 41.700 41.055 0.645 1
1 152 . 12 1 1 A 12 12 LEU N N 72 121.100 119.745 1.355 1
1 153 . 12 1 1 A 13 13 LYS H H 73 7.810 8.134 -0.324 1
1 154 . 12 1 1 A 13 13 LYS HA H 73 4.080 4.021 0.059 1
1 156 . 12 1 1 A 13 13 LYS C C 73 179.300 178.749 0.551 1
1 157 . 12 1 1 A 13 13 LYS CA C 73 59.000 58.653 0.347 1
1 158 . 12 1 1 A 13 13 LYS CB C 73 31.900 31.819 0.081 1
1 159 . 12 1 1 A 13 13 LYS N N 73 119.400 120.123 -0.723 1
1 160 . 12 1 1 A 14 14 SER H H 74 8.210 8.325 -0.115 1
1 161 . 12 1 1 A 14 14 SER HA H 74 4.210 4.115 0.095 1
1 164 . 12 1 1 A 14 14 SER C C 74 176.300 177.129 -0.829 1
1 165 . 12 1 1 A 14 14 SER CA C 74 61.400 61.199 0.201 1
1 166 . 12 1 1 A 14 14 SER CB C 74 62.600 62.245 0.355 1
1 167 . 12 1 1 A 14 14 SER N N 74 117.600 115.287 2.313 1
1 168 . 12 1 1 A 15 15 LYS H H 75 7.760 7.360 0.400 1
1 169 . 12 1 1 A 15 15 LYS HA H 75 4.040 3.855 0.185 1
1 178 . 12 1 1 A 15 15 LYS C C 75 178.500 178.692 -0.192 1
1 179 . 12 1 1 A 15 15 LYS CA C 75 56.500 59.398 -2.898 1
1 180 . 12 1 1 A 15 15 LYS CB C 75 30.600 31.684 -1.084 1
1 184 . 12 1 1 A 15 15 LYS N N 75 120.100 122.876 -2.776 1
1 185 . 12 1 1 A 16 16 GLU H H 76 7.680 8.449 -0.769 1
1 186 . 12 1 1 A 16 16 GLU HA H 76 4.030 3.999 0.031 1
1 191 . 12 1 1 A 16 16 GLU C C 76 179.900 178.566 1.334 1
1 192 . 12 1 1 A 16 16 GLU CA C 76 59.200 59.510 -0.310 1
1 193 . 12 1 1 A 16 16 GLU CB C 76 29.600 29.285 0.315 1
1 195 . 12 1 1 A 16 16 GLU N N 76 119.700 119.266 0.434 1
1 196 . 12 1 1 A 17 17 ALA H H 77 8.030 7.727 0.303 1
1 197 . 12 1 1 A 17 17 ALA HA H 77 4.200 4.089 0.111 1
1 201 . 12 1 1 A 17 17 ALA C C 77 178.900 179.162 -0.262 1
1 202 . 12 1 1 A 17 17 ALA CA C 77 54.400 54.067 0.333 1
1 203 . 12 1 1 A 17 17 ALA CB C 77 18.100 18.577 -0.477 1
1 204 . 12 1 1 A 17 17 ALA N N 77 123.000 120.534 2.466 1
1 205 . 12 1 1 A 18 18 ASP H H 78 7.860 7.940 -0.080 1
1 206 . 12 1 1 A 18 18 ASP HA H 78 4.600 4.366 0.234 1
1 209 . 12 1 1 A 18 18 ASP C C 78 177.500 176.453 1.047 1
1 210 . 12 1 1 A 18 18 ASP CA C 78 55.100 55.679 -0.579 1
1 211 . 12 1 1 A 18 18 ASP CB C 78 41.400 41.157 0.243 1
1 212 . 12 1 1 A 18 18 ASP N N 78 117.700 117.743 -0.043 1
1 213 . 12 1 1 A 19 19 GLY H H 79 7.910 7.470 0.440 1
1 214 . 12 1 1 A 19 19 GLY HA2 H 79 3.860 4.085 -0.225 1
1 215 . 12 1 1 A 19 19 GLY HA3 H 79 4.080 4.087 -0.007 1
1 216 . 12 1 1 A 19 19 GLY C C 79 175.300 173.774 1.526 1
1 217 . 12 1 1 A 19 19 GLY CA C 79 46.200 45.213 0.987 1
1 218 . 12 1 1 A 19 19 GLY N N 79 107.100 106.173 0.927 1
1 219 . 12 1 1 A 20 20 VAL H H 80 7.150 7.827 -0.677 1
1 220 . 12 1 1 A 20 20 VAL HA H 80 4.250 4.950 -0.700 1
1 228 . 12 1 1 A 20 20 VAL C C 80 175.100 175.332 -0.232 1
1 229 . 12 1 1 A 20 20 VAL CA C 80 61.800 59.230 2.570 1
1 230 . 12 1 1 A 20 20 VAL CB C 80 32.200 34.978 -2.778 1
1 233 . 12 1 1 A 20 20 VAL N N 80 114.600 115.267 -0.667 1
1 234 . 12 1 1 A 21 21 SER H H 81 8.560 8.813 -0.253 1
1 235 . 12 1 1 A 21 21 SER HA H 81 4.390 4.851 -0.461 1
1 238 . 12 1 1 A 21 21 SER C C 81 174.600 175.486 -0.886 1
1 239 . 12 1 1 A 21 21 SER CA C 81 57.900 57.219 0.681 1
1 240 . 12 1 1 A 21 21 SER CB C 81 64.700 65.583 -0.883 1
1 241 . 12 1 1 A 21 21 SER N N 81 118.700 116.358 2.342 1
1 242 . 12 1 1 A 22 22 VAL H H 82 8.690 8.601 0.089 1
1 243 . 12 1 1 A 22 22 VAL HA H 82 3.700 3.896 -0.196 1
1 251 . 12 1 1 A 22 22 VAL C C 82 178.000 177.397 0.603 1
1 252 . 12 1 1 A 22 22 VAL CA C 82 66.500 65.424 1.076 1
1 253 . 12 1 1 A 22 22 VAL CB C 82 31.700 31.568 0.132 1
1 256 . 12 1 1 A 22 22 VAL N N 82 122.100 122.059 0.041 1
1 257 . 12 1 1 A 23 23 SER H H 83 8.300 8.160 0.140 1
1 258 . 12 1 1 A 23 23 SER HA H 83 4.210 4.143 0.067 1
1 261 . 12 1 1 A 23 23 SER C C 83 177.600 177.189 0.411 1
1 262 . 12 1 1 A 23 23 SER CA C 83 61.400 61.243 0.157 1
1 263 . 12 1 1 A 23 23 SER CB C 83 62.400 63.126 -0.726 1
1 264 . 12 1 1 A 23 23 SER N N 83 113.600 117.131 -3.531 1
1 265 . 12 1 1 A 24 24 GLN H H 84 7.820 7.389 0.431 1
1 266 . 12 1 1 A 24 24 GLN HA H 84 3.970 4.108 -0.138 1
1 273 . 12 1 1 A 24 24 GLN C C 84 178.400 178.406 -0.006 1
1 274 . 12 1 1 A 24 24 GLN CA C 84 58.400 59.132 -0.732 1
1 275 . 12 1 1 A 24 24 GLN CB C 84 28.900 28.716 0.184 1
1 278 . 12 1 1 A 24 24 GLN N N 84 122.900 121.853 1.047 1
1 280 . 12 1 1 A 25 25 LEU H H 85 8.920 8.012 0.908 1
1 281 . 12 1 1 A 25 25 LEU HA H 85 4.130 4.262 -0.132 1
1 291 . 12 1 1 A 25 25 LEU C C 85 178.800 178.726 0.074 1
1 292 . 12 1 1 A 25 25 LEU CA C 85 58.300 57.998 0.302 1
1 293 . 12 1 1 A 25 25 LEU CB C 85 41.200 41.690 -0.490 1
1 297 . 12 1 1 A 25 25 LEU N N 85 122.200 121.746 0.454 1
1 298 . 12 1 1 A 26 26 ASN H H 86 8.860 8.698 0.162 1
1 299 . 12 1 1 A 26 26 ASN HA H 86 4.420 4.541 -0.121 1
1 304 . 12 1 1 A 26 26 ASN C C 86 179.000 177.303 1.697 1
1 305 . 12 1 1 A 26 26 ASN CA C 86 55.900 56.506 -0.606 1
1 306 . 12 1 1 A 26 26 ASN CB C 86 37.200 39.379 -2.179 1
1 308 . 12 1 1 A 26 26 ASN N N 86 117.600 117.736 -0.136 1
1 310 . 12 1 1 A 27 27 SER H H 87 7.840 8.036 -0.196 1
1 311 . 12 1 1 A 27 27 SER HA H 87 4.100 4.218 -0.118 1
1 314 . 12 1 1 A 27 27 SER C C 87 179.000 176.830 2.170 1
1 315 . 12 1 1 A 27 27 SER CA C 87 62.100 61.335 0.765 1
1 316 . 12 1 1 A 27 27 SER CB C 87 62.100 62.445 -0.345 1
1 317 . 12 1 1 A 27 27 SER N N 87 118.500 115.838 2.662 1
1 318 . 12 1 1 A 28 28 TYR H H 88 8.180 8.348 -0.168 1
1 319 . 12 1 1 A 28 28 TYR HA H 88 4.600 4.520 0.080 1
1 326 . 12 1 1 A 28 28 TYR C C 88 174.800 178.162 -3.362 1
1 327 . 12 1 1 A 28 28 TYR CA C 88 61.200 61.886 -0.686 1
1 328 . 12 1 1 A 28 28 TYR CB C 88 37.800 38.373 -0.573 1
1 333 . 12 1 1 A 28 28 TYR N N 88 119.300 119.883 -0.583 1
1 334 . 12 1 1 A 29 29 LYS H H 89 9.040 8.508 0.532 1
1 335 . 12 1 1 A 29 29 LYS HA H 89 3.890 4.078 -0.188 1
1 344 . 12 1 1 A 29 29 LYS C C 89 179.000 178.684 0.316 1
1 345 . 12 1 1 A 29 29 LYS CA C 89 61.300 60.168 1.132 1
1 346 . 12 1 1 A 29 29 LYS CB C 89 32.800 32.178 0.622 1
1 350 . 12 1 1 A 29 29 LYS N N 89 119.300 121.143 -1.843 1
1 351 . 12 1 1 A 30 30 ASN H H 90 7.770 8.175 -0.405 1
1 352 . 12 1 1 A 30 30 ASN HA H 90 4.560 4.354 0.206 1
1 357 . 12 1 1 A 30 30 ASN C C 90 178.300 177.376 0.924 1
1 358 . 12 1 1 A 30 30 ASN CA C 90 56.200 56.580 -0.380 1
1 359 . 12 1 1 A 30 30 ASN CB C 90 38.900 40.218 -1.318 1
1 361 . 12 1 1 A 30 30 ASN N N 90 117.800 117.425 0.375 1
1 363 . 12 1 1 A 31 31 TYR H H 91 8.860 8.219 0.641 1
1 364 . 12 1 1 A 31 31 TYR HA H 91 4.910 4.681 0.229 1
1 371 . 12 1 1 A 31 31 TYR C C 91 178.300 178.775 -0.475 1
1 372 . 12 1 1 A 31 31 TYR CA C 91 59.700 60.825 -1.125 1
1 373 . 12 1 1 A 31 31 TYR CB C 91 37.500 37.765 -0.265 1
1 378 . 12 1 1 A 31 31 TYR N N 91 119.400 117.929 1.471 1
1 379 . 12 1 1 A 32 32 CYS H H 92 8.640 8.114 0.526 1
1 380 . 12 1 1 A 32 32 CYS HA H 92 4.410 4.551 -0.141 1
1 383 . 12 1 1 A 32 32 CYS C C 92 173.700 177.363 -3.663 1
1 384 . 12 1 1 A 32 32 CYS CA C 92 65.500 62.400 3.100 1
1 385 . 12 1 1 A 32 32 CYS CB C 92 28.300 27.408 0.892 1
1 386 . 12 1 1 A 32 32 CYS N N 92 113.500 119.408 -5.908 1
1 387 . 12 1 1 A 33 33 ARG H H 93 8.440 8.309 0.131 1
1 388 . 12 1 1 A 33 33 ARG HA H 93 3.740 3.962 -0.222 1
1 391 . 12 1 1 A 33 33 ARG C C 93 177.200 178.102 -0.902 1
1 392 . 12 1 1 A 33 33 ARG CA C 93 58.300 58.847 -0.547 1
1 393 . 12 1 1 A 33 33 ARG CB C 93 30.200 30.417 -0.217 1
1 394 . 12 1 1 A 33 33 ARG N N 93 111.400 121.769 -10.369 1
1 395 . 12 1 1 A 34 34 ASN H H 94 8.020 7.807 0.213 1
1 396 . 12 1 1 A 34 34 ASN HA H 94 4.980 4.748 0.232 1
1 401 . 12 1 1 A 34 34 ASN C C 94 176.700 177.163 -0.463 1
1 402 . 12 1 1 A 34 34 ASN CA C 94 53.400 54.887 -1.487 1
1 403 . 12 1 1 A 34 34 ASN CB C 94 38.000 39.108 -1.108 1
1 405 . 12 1 1 A 34 34 ASN N N 94 113.600 117.322 -3.722 1
1 407 . 12 1 1 A 35 35 HIS H H 95 7.200 7.712 -0.512 1
1 408 . 12 1 1 A 35 35 HIS HA H 95 4.470 4.559 -0.089 1
1 411 . 12 1 1 A 35 35 HIS C C 95 176.600 176.333 0.267 1
1 412 . 12 1 1 A 35 35 HIS CA C 95 60.000 58.604 1.396 1
1 413 . 12 1 1 A 35 35 HIS CB C 95 30.500 30.707 -0.207 1
1 414 . 12 1 1 A 35 35 HIS N N 95 115.600 116.776 -1.176 1
1 415 . 12 1 1 A 36 36 LEU H H 96 8.170 7.556 0.614 1
1 416 . 12 1 1 A 36 36 LEU HA H 96 4.730 4.655 0.075 1
1 426 . 12 1 1 A 36 36 LEU C C 96 176.800 177.124 -0.324 1
1 427 . 12 1 1 A 36 36 LEU CA C 96 54.400 54.581 -0.181 1
1 428 . 12 1 1 A 36 36 LEU CB C 96 40.600 42.717 -2.117 1
1 432 . 12 1 1 A 36 36 LEU N N 96 114.000 118.277 -4.277 1
1 433 . 12 1 1 A 37 37 SER H H 97 7.140 8.354 -1.214 1
1 434 . 12 1 1 A 37 37 SER HA H 97 4.730 4.341 0.389 1
1 437 . 12 1 1 A 37 37 SER CA C 97 62.700 62.702 -0.002 1
1 438 . 12 1 1 A 37 37 SER CB C 97 62.600 61.874 0.726 1
1 439 . 12 1 1 A 37 37 SER N N 97 117.200 116.047 1.153 1
1 440 . 12 1 1 A 38 38 PRO HA H 98 4.560 4.427 0.133 1
1 447 . 12 1 1 A 38 38 PRO C C 98 177.900 177.857 0.043 1
1 448 . 12 1 1 A 38 38 PRO CA C 98 65.700 65.155 0.545 1
1 449 . 12 1 1 A 38 38 PRO CB C 98 31.800 31.304 0.496 1
1 452 . 12 1 1 A 39 39 LEU H H 99 8.090 7.566 0.524 1
1 453 . 12 1 1 A 39 39 LEU HA H 99 4.260 4.133 0.127 1
1 463 . 12 1 1 A 39 39 LEU C C 99 178.700 178.127 0.573 1
1 464 . 12 1 1 A 39 39 LEU CA C 99 54.300 57.057 -2.757 1
1 465 . 12 1 1 A 39 39 LEU CB C 99 42.400 41.766 0.634 1
1 469 . 12 1 1 A 39 39 LEU N N 99 112.400 117.388 -4.988 1
1 470 . 12 1 1 A 40 40 TYR H H 100 8.350 8.526 -0.176 1
1 471 . 12 1 1 A 40 40 TYR HA H 100 4.170 4.431 -0.261 1
1 478 . 12 1 1 A 40 40 TYR C C 100 178.300 177.442 0.858 1
1 479 . 12 1 1 A 40 40 TYR CA C 100 63.400 62.061 1.339 1
1 480 . 12 1 1 A 40 40 TYR CB C 100 38.600 39.015 -0.415 1
1 485 . 12 1 1 A 40 40 TYR N N 100 119.400 120.542 -1.142 1
1 486 . 12 1 1 A 41 41 MET H H 101 8.640 8.335 0.305 1
1 487 . 12 1 1 A 41 41 MET HA H 101 4.260 4.656 -0.396 1
1 488 . 12 1 1 A 41 41 MET C C 101 177.000 176.648 0.352 1
1 489 . 12 1 1 A 41 41 MET CA C 101 54.600 56.865 -2.265 1
1 490 . 12 1 1 A 41 41 MET N N 101 111.800 117.019 -5.219 1
1 491 . 12 1 1 A 42 42 LYS H H 102 7.880 7.529 0.351 1
1 492 . 12 1 1 A 42 42 LYS HA H 102 4.430 4.582 -0.152 1
1 501 . 12 1 1 A 42 42 LYS C C 102 176.300 176.226 0.074 1
1 502 . 12 1 1 A 42 42 LYS CA C 102 56.000 55.156 0.844 1
1 503 . 12 1 1 A 42 42 LYS CB C 102 33.400 33.411 -0.011 1
1 507 . 12 1 1 A 42 42 LYS N N 102 121.700 118.771 2.929 1
1 508 . 12 1 1 A 43 43 SER H H 103 9.160 8.839 0.321 1
1 509 . 12 1 1 A 43 43 SER HA H 103 4.620 4.555 0.065 1
1 513 . 12 1 1 A 43 43 SER C C 103 176.300 175.233 1.067 1
1 514 . 12 1 1 A 43 43 SER CA C 103 58.700 59.040 -0.340 1
1 515 . 12 1 1 A 43 43 SER CB C 103 63.700 63.629 0.071 1
1 516 . 12 1 1 A 43 43 SER N N 103 118.800 117.697 1.103 1
1 517 . 12 1 1 A 44 44 LEU H H 104 8.860 9.357 -0.497 1
1 518 . 12 1 1 A 44 44 LEU HA H 104 4.130 4.142 -0.012 1
1 528 . 12 1 1 A 44 44 LEU C C 104 178.700 177.920 0.780 1
1 529 . 12 1 1 A 44 44 LEU CA C 104 58.800 58.520 0.280 1
1 530 . 12 1 1 A 44 44 LEU CB C 104 42.600 41.280 1.320 1
1 534 . 12 1 1 A 44 44 LEU N N 104 124.200 128.067 -3.867 1
1 535 . 12 1 1 A 45 45 SER H H 105 8.330 8.868 -0.538 1
1 536 . 12 1 1 A 45 45 SER HA H 105 4.310 4.287 0.023 1
1 539 . 12 1 1 A 45 45 SER C C 105 175.000 175.289 -0.289 1
1 540 . 12 1 1 A 45 45 SER CA C 105 60.100 60.588 -0.488 1
1 541 . 12 1 1 A 45 45 SER CB C 105 63.400 62.714 0.686 1
1 542 . 12 1 1 A 45 45 SER N N 105 107.700 113.918 -6.218 1
1 543 . 12 1 1 A 46 46 GLU H H 106 7.800 7.489 0.311 1
1 544 . 12 1 1 A 46 46 GLU HA H 106 4.570 4.470 0.100 1
1 549 . 12 1 1 A 46 46 GLU C C 106 174.100 176.986 -2.886 1
1 550 . 12 1 1 A 46 46 GLU CA C 106 55.600 56.664 -1.064 1
1 551 . 12 1 1 A 46 46 GLU CB C 106 31.200 30.410 0.790 1
1 553 . 12 1 1 A 46 46 GLU N N 106 119.600 118.452 1.148 1
1 554 . 12 1 1 A 47 47 ILE H H 107 7.100 7.191 -0.091 1
1 555 . 12 1 1 A 47 47 ILE HA H 107 4.040 4.044 -0.004 1
1 565 . 12 1 1 A 47 47 ILE C C 107 174.100 175.469 -1.369 1
1 566 . 12 1 1 A 47 47 ILE CA C 107 62.300 62.135 0.165 1
1 567 . 12 1 1 A 47 47 ILE CB C 107 38.500 38.034 0.466 1
1 571 . 12 1 1 A 47 47 ILE N N 107 120.600 122.179 -1.579 1
1 572 . 12 1 1 A 48 48 LEU H H 108 9.180 8.436 0.744 1
1 573 . 12 1 1 A 48 48 LEU HA H 108 4.940 4.619 0.321 1
1 583 . 12 1 1 A 48 48 LEU CA C 108 51.900 52.961 -1.061 1
1 584 . 12 1 1 A 48 48 LEU CB C 108 42.000 41.431 0.569 1
1 588 . 12 1 1 A 48 48 LEU N N 108 129.400 128.645 0.755 1
1 589 . 12 1 1 A 49 49 PRO HA H 109 3.910 4.291 -0.381 1
1 596 . 12 1 1 A 49 49 PRO C C 109 178.500 177.967 0.533 1
1 597 . 12 1 1 A 49 49 PRO CA C 109 66.600 65.227 1.373 1
1 598 . 12 1 1 A 49 49 PRO CB C 109 31.300 31.852 -0.552 1
1 601 . 12 1 1 A 50 50 ALA H H 110 8.280 8.411 -0.131 1
1 602 . 12 1 1 A 50 50 ALA HA H 110 4.110 4.077 0.033 1
1 606 . 12 1 1 A 50 50 ALA C C 110 179.700 180.173 -0.473 1
1 607 . 12 1 1 A 50 50 ALA CA C 110 55.100 55.328 -0.228 1
1 608 . 12 1 1 A 50 50 ALA CB C 110 19.200 18.517 0.683 1
1 609 . 12 1 1 A 50 50 ALA N N 110 116.100 119.123 -3.023 1
1 610 . 12 1 1 A 51 51 ASP H H 111 7.790 7.993 -0.203 1
1 611 . 12 1 1 A 51 51 ASP HA H 111 4.440 4.304 0.136 1
1 614 . 12 1 1 A 51 51 ASP C C 111 178.200 179.031 -0.831 1
1 615 . 12 1 1 A 51 51 ASP CA C 111 57.600 57.444 0.156 1
1 616 . 12 1 1 A 51 51 ASP CB C 111 41.800 40.777 1.023 1
1 617 . 12 1 1 A 51 51 ASP N N 111 116.500 118.876 -2.376 1
1 618 . 12 1 1 A 52 52 ILE H H 112 7.020 7.550 -0.530 1
1 619 . 12 1 1 A 52 52 ILE HA H 112 3.750 3.625 0.125 1
1 629 . 12 1 1 A 52 52 ILE C C 112 177.300 177.781 -0.481 1
1 630 . 12 1 1 A 52 52 ILE CA C 112 63.500 65.008 -1.508 1
1 631 . 12 1 1 A 52 52 ILE CB C 112 37.500 37.659 -0.159 1
1 635 . 12 1 1 A 52 52 ILE N N 112 116.700 120.145 -3.445 1
1 636 . 12 1 1 A 53 53 GLN H H 113 9.150 8.328 0.822 1
1 637 . 12 1 1 A 53 53 GLN HA H 113 3.720 3.964 -0.244 1
1 644 . 12 1 1 A 53 53 GLN C C 113 177.500 177.823 -0.323 1
1 645 . 12 1 1 A 53 53 GLN CA C 113 58.200 58.693 -0.493 1
1 646 . 12 1 1 A 53 53 GLN CB C 113 30.200 28.356 1.844 1
1 649 . 12 1 1 A 53 53 GLN N N 113 121.200 120.964 0.236 1
1 651 . 12 1 1 A 54 54 SER H H 114 8.150 7.993 0.157 1
1 652 . 12 1 1 A 54 54 SER HA H 114 4.180 4.215 -0.035 1
1 655 . 12 1 1 A 54 54 SER C C 114 175.900 177.402 -1.502 1
1 656 . 12 1 1 A 54 54 SER CA C 114 62.100 61.737 0.363 1
1 657 . 12 1 1 A 54 54 SER CB C 114 62.800 63.084 -0.284 1
1 658 . 12 1 1 A 54 54 SER N N 114 112.200 114.304 -2.104 1
1 659 . 12 1 1 A 55 55 ILE H H 115 6.760 7.676 -0.916 1
1 660 . 12 1 1 A 55 55 ILE HA H 115 3.860 3.674 0.186 1
1 670 . 12 1 1 A 55 55 ILE C C 115 179.200 177.949 1.251 1
1 671 . 12 1 1 A 55 55 ILE CA C 115 64.700 65.459 -0.759 1
1 672 . 12 1 1 A 55 55 ILE CB C 115 38.900 38.077 0.823 1
1 676 . 12 1 1 A 55 55 ILE N N 115 119.500 121.021 -1.521 1
1 677 . 12 1 1 A 56 56 ILE H H 116 7.750 8.249 -0.499 1
1 678 . 12 1 1 A 56 56 ILE HA H 116 3.690 3.581 0.109 1
1 688 . 12 1 1 A 56 56 ILE C C 116 176.900 178.400 -1.500 1
1 689 . 12 1 1 A 56 56 ILE CA C 116 62.800 65.119 -2.319 1
1 690 . 12 1 1 A 56 56 ILE CB C 116 36.200 37.426 -1.226 1
1 694 . 12 1 1 A 56 56 ILE N N 116 120.200 119.611 0.589 1
1 695 . 12 1 1 A 57 57 ASN H H 117 8.690 8.370 0.320 1
1 696 . 12 1 1 A 57 57 ASN HA H 117 4.440 4.407 0.033 1
1 701 . 12 1 1 A 57 57 ASN C C 117 177.200 177.035 0.165 1
1 702 . 12 1 1 A 57 57 ASN CA C 117 54.800 56.784 -1.984 1
1 703 . 12 1 1 A 57 57 ASN CB C 117 38.100 38.832 -0.732 1
1 705 . 12 1 1 A 57 57 ASN N N 117 117.000 120.040 -3.040 1
1 707 . 12 1 1 A 58 58 GLU H H 118 7.630 7.983 -0.353 1
1 708 . 12 1 1 A 58 58 GLU HA H 118 4.450 4.381 0.069 1
1 713 . 12 1 1 A 58 58 GLU C C 118 176.500 176.591 -0.091 1
1 714 . 12 1 1 A 58 58 GLU CA C 118 56.200 56.651 -0.451 1
1 715 . 12 1 1 A 58 58 GLU CB C 118 30.200 29.389 0.811 1
1 717 . 12 1 1 A 58 58 GLU N N 118 116.300 114.981 1.319 1
1 718 . 12 1 1 A 59 59 THR H H 119 7.540 7.424 0.116 1
1 719 . 12 1 1 A 59 59 THR HA H 119 4.230 4.203 0.027 1
1 724 . 12 1 1 A 59 59 THR C C 119 174.200 174.254 -0.054 1
1 725 . 12 1 1 A 59 59 THR CA C 119 63.800 64.081 -0.281 1
1 726 . 12 1 1 A 59 59 THR CB C 119 68.900 69.074 -0.174 1
1 728 . 12 1 1 A 59 59 THR N N 119 117.600 117.414 0.186 1
1 729 . 12 1 1 A 60 60 LYS H H 120 8.860 8.758 0.102 1
1 730 . 12 1 1 A 60 60 LYS HA H 120 4.490 4.637 -0.147 1
1 739 . 12 1 1 A 60 60 LYS C C 120 175.800 175.308 0.492 1
1 740 . 12 1 1 A 60 60 LYS CA C 120 54.900 55.530 -0.630 1
1 741 . 12 1 1 A 60 60 LYS CB C 120 29.800 31.213 -1.413 1
1 745 . 12 1 1 A 60 60 LYS N N 120 128.500 128.438 0.062 1
1 746 . 12 1 1 A 61 61 LEU H H 121 7.150 7.920 -0.770 1
1 747 . 12 1 1 A 61 61 LEU HA H 121 4.710 4.955 -0.245 1
1 757 . 12 1 1 A 61 61 LEU C C 121 175.000 175.897 -0.897 1
1 758 . 12 1 1 A 61 61 LEU CA C 121 52.800 53.234 -0.434 1
1 759 . 12 1 1 A 61 61 LEU CB C 121 46.400 45.446 0.954 1
1 763 . 12 1 1 A 61 61 LEU N N 121 120.700 126.111 -5.411 1
1 764 . 12 1 1 A 62 62 ALA H H 122 8.000 8.610 -0.610 1
1 765 . 12 1 1 A 62 62 ALA HA H 122 4.250 4.437 -0.187 1
1 769 . 12 1 1 A 62 62 ALA CA C 122 52.100 51.916 0.184 1
1 770 . 12 1 1 A 62 62 ALA CB C 122 19.500 19.647 -0.147 1
1 771 . 12 1 1 A 62 62 ALA N N 122 119.900 123.445 -3.545 1
1 772 . 12 1 1 A 63 63 LYS H H 123 8.770 9.036 -0.266 1
1 773 . 12 1 1 A 63 63 LYS HA H 123 3.800 3.916 -0.116 1
1 782 . 12 1 1 A 63 63 LYS C C 123 178.300 178.363 -0.063 1
1 783 . 12 1 1 A 63 63 LYS CA C 123 60.700 59.790 0.910 1
1 784 . 12 1 1 A 63 63 LYS CB C 123 32.300 32.176 0.124 1
1 788 . 12 1 1 A 63 63 LYS N N 123 121.400 121.309 0.091 1
1 789 . 12 1 1 A 64 64 ASN H H 124 9.020 8.504 0.516 1
1 790 . 12 1 1 A 64 64 ASN HA H 124 4.430 4.431 -0.001 1
1 795 . 12 1 1 A 64 64 ASN C C 124 178.300 177.270 1.030 1
1 796 . 12 1 1 A 64 64 ASN CA C 124 56.200 55.806 0.394 1
1 797 . 12 1 1 A 64 64 ASN CB C 124 37.300 37.439 -0.139 1
1 799 . 12 1 1 A 64 64 ASN N N 124 115.000 117.272 -2.272 1
1 801 . 12 1 1 A 65 65 THR H H 125 7.620 8.036 -0.416 1
1 802 . 12 1 1 A 65 65 THR HA H 125 4.030 4.001 0.029 1
1 807 . 12 1 1 A 65 65 THR C C 125 175.500 176.774 -1.274 1
1 808 . 12 1 1 A 65 65 THR CA C 125 66.000 67.076 -1.076 1
1 809 . 12 1 1 A 65 65 THR CB C 125 67.600 68.012 -0.412 1
1 811 . 12 1 1 A 65 65 THR N N 125 119.800 116.631 3.169 1
1 812 . 12 1 1 A 66 66 LEU H H 126 8.020 8.452 -0.432 1
1 813 . 12 1 1 A 66 66 LEU HA H 126 3.790 3.838 -0.048 1
1 823 . 12 1 1 A 66 66 LEU C C 126 179.200 179.326 -0.126 1
1 824 . 12 1 1 A 66 66 LEU CA C 126 58.700 58.052 0.648 1
1 825 . 12 1 1 A 66 66 LEU CB C 126 41.300 41.282 0.018 1
1 829 . 12 1 1 A 66 66 LEU N N 126 121.200 121.405 -0.205 1
1 830 . 12 1 1 A 67 67 LYS H H 127 8.380 7.872 0.508 1
1 831 . 12 1 1 A 67 67 LYS HA H 127 3.740 4.062 -0.322 1
1 840 . 12 1 1 A 67 67 LYS C C 127 178.300 179.171 -0.871 1
1 841 . 12 1 1 A 67 67 LYS CA C 127 60.100 59.449 0.651 1
1 842 . 12 1 1 A 67 67 LYS CB C 127 32.400 32.158 0.242 1
1 846 . 12 1 1 A 67 67 LYS N N 127 117.000 118.023 -1.023 1
1 847 . 12 1 1 A 68 68 ALA H H 128 7.480 7.873 -0.393 1
1 848 . 12 1 1 A 68 68 ALA HA H 128 4.210 3.895 0.315 1
1 852 . 12 1 1 A 68 68 ALA C C 128 181.200 179.778 1.422 1
1 853 . 12 1 1 A 68 68 ALA CA C 128 55.200 55.078 0.122 1
1 854 . 12 1 1 A 68 68 ALA CB C 128 18.600 17.832 0.768 1
1 855 . 12 1 1 A 68 68 ALA N N 128 122.900 121.706 1.194 1
1 856 . 12 1 1 A 69 69 ILE H H 129 8.250 7.557 0.693 1
1 857 . 12 1 1 A 69 69 ILE HA H 129 3.130 3.289 -0.159 1
1 867 . 12 1 1 A 69 69 ILE C C 129 177.400 177.854 -0.454 1
1 868 . 12 1 1 A 69 69 ILE CA C 129 66.700 65.367 1.333 1
1 869 . 12 1 1 A 69 69 ILE CB C 129 37.900 37.478 0.422 1
1 873 . 12 1 1 A 69 69 ILE N N 129 122.800 118.018 4.782 1
1 874 . 12 1 1 A 70 70 ARG H H 130 8.040 7.793 0.247 1
1 875 . 12 1 1 A 70 70 ARG HA H 130 3.620 3.901 -0.281 1
1 882 . 12 1 1 A 70 70 ARG C C 130 177.800 178.233 -0.433 1
1 883 . 12 1 1 A 70 70 ARG CA C 130 60.700 59.816 0.884 1
1 884 . 12 1 1 A 70 70 ARG CB C 130 29.600 29.768 -0.168 1
1 887 . 12 1 1 A 70 70 ARG N N 130 119.700 120.639 -0.939 1
1 888 . 12 1 1 A 71 71 ASN H H 131 8.920 8.581 0.339 1
1 889 . 12 1 1 A 71 71 ASN HA H 131 4.430 4.462 -0.032 1
1 894 . 12 1 1 A 71 71 ASN C C 131 177.500 177.726 -0.226 1
1 895 . 12 1 1 A 71 71 ASN CA C 131 56.100 56.450 -0.350 1
1 896 . 12 1 1 A 71 71 ASN CB C 131 38.600 38.984 -0.384 1
1 898 . 12 1 1 A 71 71 ASN N N 131 117.200 118.061 -0.861 1
1 900 . 12 1 1 A 72 72 THR H H 132 8.300 8.177 0.123 1
1 901 . 12 1 1 A 72 72 THR HA H 132 4.430 3.956 0.474 1
1 906 . 12 1 1 A 72 72 THR C C 132 175.100 176.762 -1.662 1
1 907 . 12 1 1 A 72 72 THR CA C 132 68.200 66.537 1.663 1
1 908 . 12 1 1 A 72 72 THR CB C 132 68.500 68.841 -0.341 1
1 910 . 12 1 1 A 72 72 THR N N 132 119.200 116.177 3.023 1
1 911 . 12 1 1 A 73 73 ALA H H 133 7.950 8.218 -0.268 1
1 912 . 12 1 1 A 73 73 ALA HA H 133 4.040 4.110 -0.070 1
1 916 . 12 1 1 A 73 73 ALA C C 133 178.200 179.789 -1.589 1
1 917 . 12 1 1 A 73 73 ALA CA C 133 55.900 55.398 0.502 1
1 918 . 12 1 1 A 73 73 ALA CB C 133 16.700 18.232 -1.532 1
1 919 . 12 1 1 A 73 73 ALA N N 133 120.900 124.094 -3.194 1
1 920 . 12 1 1 A 74 74 SER H H 134 8.440 8.354 0.086 1
1 921 . 12 1 1 A 74 74 SER HA H 134 4.430 4.227 0.203 1
1 924 . 12 1 1 A 74 74 SER C C 134 178.800 177.343 1.457 1
1 925 . 12 1 1 A 74 74 SER CA C 134 61.300 60.894 0.406 1
1 926 . 12 1 1 A 74 74 SER CB C 134 62.600 63.071 -0.471 1
1 927 . 12 1 1 A 74 74 SER N N 134 110.100 113.396 -3.296 1
1 928 . 12 1 1 A 75 75 GLN H H 135 8.340 7.793 0.547 1
1 929 . 12 1 1 A 75 75 GLN HA H 135 3.880 4.113 -0.233 1
1 936 . 12 1 1 A 75 75 GLN C C 135 178.800 178.924 -0.124 1
1 937 . 12 1 1 A 75 75 GLN CA C 135 59.600 58.598 1.002 1
1 938 . 12 1 1 A 75 75 GLN CB C 135 29.900 28.433 1.467 1
1 941 . 12 1 1 A 75 75 GLN N N 135 118.100 121.121 -3.021 1
1 943 . 12 1 1 A 76 76 ILE H H 136 7.670 7.434 0.236 1
1 944 . 12 1 1 A 76 76 ILE HA H 136 3.200 3.273 -0.073 1
1 954 . 12 1 1 A 76 76 ILE C C 136 177.500 177.909 -0.409 1
1 955 . 12 1 1 A 76 76 ILE CA C 136 66.100 64.954 1.146 1
1 956 . 12 1 1 A 76 76 ILE CB C 136 37.400 37.789 -0.389 1
1 960 . 12 1 1 A 76 76 ILE N N 136 122.500 120.299 2.201 1
1 961 . 12 1 1 A 77 77 PHE H H 137 7.930 8.104 -0.174 1
1 962 . 12 1 1 A 77 77 PHE HA H 137 3.890 4.086 -0.196 1
1 969 . 12 1 1 A 77 77 PHE C C 137 178.200 177.992 0.208 1
1 970 . 12 1 1 A 77 77 PHE CA C 137 63.600 60.395 3.205 1
1 971 . 12 1 1 A 77 77 PHE CB C 137 39.300 38.388 0.912 1
1 976 . 12 1 1 A 77 77 PHE N N 137 116.100 118.419 -2.319 1
1 977 . 12 1 1 A 78 78 ARG H H 138 8.900 8.487 0.413 1
1 978 . 12 1 1 A 78 78 ARG HA H 138 3.910 3.990 -0.080 1
1 986 . 12 1 1 A 78 78 ARG C C 138 178.300 178.293 0.007 1
1 987 . 12 1 1 A 78 78 ARG CA C 138 60.100 59.394 0.706 1
1 988 . 12 1 1 A 78 78 ARG CB C 138 29.600 30.024 -0.424 1
1 991 . 12 1 1 A 78 78 ARG N N 138 118.600 120.093 -1.493 1
1 993 . 12 1 1 A 79 79 LEU H H 139 7.730 8.099 -0.369 1
1 994 . 12 1 1 A 79 79 LEU HA H 139 4.280 4.069 0.211 1
1 1004 . 12 1 1 A 79 79 LEU C C 139 179.000 178.347 0.653 1
1 1005 . 12 1 1 A 79 79 LEU CA C 139 57.800 57.676 0.124 1
1 1006 . 12 1 1 A 79 79 LEU CB C 139 41.900 41.563 0.337 1
1 1010 . 12 1 1 A 79 79 LEU N N 139 121.900 120.711 1.189 1
1 1011 . 12 1 1 A 80 80 ALA H H 140 7.590 7.278 0.312 1
1 1012 . 12 1 1 A 80 80 ALA HA H 140 2.710 3.111 -0.401 1
1 1016 . 12 1 1 A 80 80 ALA C C 140 179.900 179.874 0.026 1
1 1017 . 12 1 1 A 80 80 ALA CA C 140 55.100 54.375 0.725 1
1 1018 . 12 1 1 A 80 80 ALA CB C 140 17.600 17.697 -0.097 1
1 1019 . 12 1 1 A 80 80 ALA N N 140 123.400 120.290 3.110 1
1 1020 . 12 1 1 A 81 81 ILE H H 141 8.910 7.740 1.170 1
1 1021 . 12 1 1 A 81 81 ILE HA H 141 4.110 4.061 0.049 1
1 1031 . 12 1 1 A 81 81 ILE C C 141 181.700 178.134 3.566 1
1 1032 . 12 1 1 A 81 81 ILE CA C 141 64.800 65.450 -0.650 1
1 1033 . 12 1 1 A 81 81 ILE CB C 141 38.600 37.903 0.697 1
1 1037 . 12 1 1 A 81 81 ILE N N 141 122.400 118.859 3.541 1
1 1038 . 12 1 1 A 82 82 GLU H H 142 8.560 8.722 -0.162 1
1 1039 . 12 1 1 A 82 82 GLU HA H 142 4.100 4.149 -0.049 1
1 1044 . 12 1 1 A 82 82 GLU C C 142 177.700 177.304 0.396 1
1 1045 . 12 1 1 A 82 82 GLU CA C 142 59.100 58.216 0.884 1
1 1046 . 12 1 1 A 82 82 GLU CB C 142 29.200 27.585 1.615 1
1 1048 . 12 1 1 A 82 82 GLU N N 142 123.200 119.875 3.325 1
1 1049 . 12 1 1 A 83 83 ASN H H 143 7.310 7.460 -0.150 1
1 1050 . 12 1 1 A 83 83 ASN HA H 143 4.750 4.879 -0.129 1
1 1055 . 12 1 1 A 83 83 ASN C C 143 173.200 174.202 -1.002 1
1 1056 . 12 1 1 A 83 83 ASN CA C 143 54.200 52.703 1.497 1
1 1057 . 12 1 1 A 83 83 ASN CB C 143 41.300 38.719 2.581 1
1 1059 . 12 1 1 A 83 83 ASN N N 143 114.900 116.895 -1.995 1
1 1061 . 12 1 1 A 84 84 ARG H H 144 8.320 7.950 0.370 1
1 1062 . 12 1 1 A 84 84 ARG HA H 144 4.120 3.993 0.127 1
1 1069 . 12 1 1 A 84 84 ARG C C 144 175.300 175.713 -0.413 1
1 1070 . 12 1 1 A 84 84 ARG CA C 144 57.100 56.982 0.118 1
1 1071 . 12 1 1 A 84 84 ARG CB C 144 26.000 26.904 -0.904 1
1 1074 . 12 1 1 A 84 84 ARG N N 144 114.400 115.155 -0.755 1
1 1075 . 12 1 1 A 85 85 ALA H H 145 8.350 8.462 -0.112 1
1 1076 . 12 1 1 A 85 85 ALA HA H 145 4.320 4.290 0.030 1
1 1080 . 12 1 1 A 85 85 ALA C C 145 176.500 177.126 -0.626 1
1 1081 . 12 1 1 A 85 85 ALA CA C 145 53.400 53.362 0.038 1
1 1082 . 12 1 1 A 85 85 ALA CB C 145 19.900 19.586 0.314 1
1 1083 . 12 1 1 A 85 85 ALA N N 145 120.600 118.644 1.956 1
1 1084 . 12 1 1 A 86 86 ILE H H 146 7.290 7.072 0.218 1
1 1085 . 12 1 1 A 86 86 ILE HA H 146 4.400 4.507 -0.107 1
1 1095 . 12 1 1 A 86 86 ILE C C 146 173.600 174.760 -1.160 1
1 1096 . 12 1 1 A 86 86 ILE CA C 146 59.200 59.544 -0.344 1
1 1097 . 12 1 1 A 86 86 ILE CB C 146 41.600 41.445 0.155 1
1 1101 . 12 1 1 A 86 86 ILE N N 146 111.500 116.072 -4.572 1
1 1102 . 12 1 1 A 87 87 ASP H H 147 8.270 8.769 -0.499 1
1 1103 . 12 1 1 A 87 87 ASP HA H 147 4.940 4.736 0.204 1
1 1106 . 12 1 1 A 87 87 ASP C C 147 174.700 175.934 -1.234 1
1 1107 . 12 1 1 A 87 87 ASP CA C 147 53.700 54.129 -0.429 1
1 1108 . 12 1 1 A 87 87 ASP CB C 147 41.800 41.963 -0.163 1
1 1109 . 12 1 1 A 87 87 ASP N N 147 119.400 127.129 -7.729 1
1 1110 . 12 1 1 A 88 88 PHE H H 148 7.230 7.227 0.003 1
1 1111 . 12 1 1 A 88 88 PHE HA H 148 4.690 5.264 -0.574 1
1 1119 . 12 1 1 A 88 88 PHE C C 148 171.500 172.359 -0.859 1
1 1120 . 12 1 1 A 88 88 PHE CA C 148 56.400 55.589 0.811 1
1 1121 . 12 1 1 A 88 88 PHE CB C 148 42.000 42.518 -0.518 1
1 1127 . 12 1 1 A 88 88 PHE N N 148 119.700 115.915 3.785 1
1 1128 . 12 1 1 A 89 89 ASN H H 149 8.060 9.012 -0.952 1
1 1129 . 12 1 1 A 89 89 ASN HA H 149 4.490 5.199 -0.709 1
1 1134 . 12 1 1 A 89 89 ASN CA C 149 48.100 49.623 -1.523 1
1 1135 . 12 1 1 A 89 89 ASN CB C 149 39.200 39.900 -0.700 1
1 1137 . 12 1 1 A 89 89 ASN N N 149 119.700 119.878 -0.178 1
1 1139 . 12 1 1 A 90 90 PRO HA H 150 3.970 4.362 -0.392 1
1 1146 . 12 1 1 A 90 90 PRO C C 150 177.700 177.639 0.061 1
1 1147 . 12 1 1 A 90 90 PRO CA C 150 63.900 64.322 -0.422 1
1 1148 . 12 1 1 A 90 90 PRO CB C 150 31.700 31.753 -0.053 1
1 1151 . 12 1 1 A 91 91 ALA H H 151 7.240 7.326 -0.086 1
1 1152 . 12 1 1 A 91 91 ALA HA H 151 3.900 3.991 -0.091 1
1 1156 . 12 1 1 A 91 91 ALA C C 151 178.000 179.838 -1.838 1
1 1157 . 12 1 1 A 91 91 ALA CA C 151 53.900 54.635 -0.735 1
1 1158 . 12 1 1 A 91 91 ALA CB C 151 17.700 18.287 -0.587 1
1 1159 . 12 1 1 A 91 91 ALA N N 151 115.700 119.047 -3.347 1
1 1160 . 12 1 1 A 92 92 ASP H H 152 7.080 7.787 -0.707 1
1 1161 . 12 1 1 A 92 92 ASP HA H 152 4.220 4.402 -0.182 1
1 1164 . 12 1 1 A 92 92 ASP C C 152 176.200 178.053 -1.853 1
1 1165 . 12 1 1 A 92 92 ASP CA C 152 55.800 56.481 -0.681 1
1 1166 . 12 1 1 A 92 92 ASP CB C 152 39.500 40.788 -1.288 1
1 1167 . 12 1 1 A 92 92 ASP N N 152 117.100 119.242 -2.142 1
1 1168 . 12 1 1 A 93 93 TYR H H 153 7.060 7.785 -0.725 1
1 1169 . 12 1 1 A 93 93 TYR HA H 153 4.490 4.225 0.265 1
1 1176 . 12 1 1 A 93 93 TYR C C 153 174.700 176.142 -1.442 1
1 1177 . 12 1 1 A 93 93 TYR CA C 153 57.600 59.709 -2.109 1
1 1178 . 12 1 1 A 93 93 TYR CB C 153 38.500 39.518 -1.018 1
1 1183 . 12 1 1 A 93 93 TYR N N 153 116.800 121.104 -4.304 1
1 1184 . 12 1 1 A 94 94 VAL H H 154 7.000 7.358 -0.358 1
1 1185 . 12 1 1 A 94 94 VAL HA H 154 4.040 3.757 0.283 1
1 1193 . 12 1 1 A 94 94 VAL C C 154 174.700 175.169 -0.469 1
1 1194 . 12 1 1 A 94 94 VAL CA C 154 62.100 62.769 -0.669 1
1 1195 . 12 1 1 A 94 94 VAL CB C 154 32.700 31.995 0.705 1
1 1198 . 12 1 1 A 94 94 VAL N N 154 120.600 120.619 -0.019 1
1 1199 . 12 1 1 A 95 95 ARG H H 155 9.430 8.722 0.708 1
1 1200 . 12 1 1 A 95 95 ARG HA H 155 4.640 4.690 -0.050 1
1 1207 . 12 1 1 A 95 95 ARG C C 155 175.400 175.162 0.238 1
1 1208 . 12 1 1 A 95 95 ARG CA C 155 54.200 54.951 -0.751 1
1 1209 . 12 1 1 A 95 95 ARG CB C 155 32.400 32.302 0.098 1
1 1212 . 12 1 1 A 95 95 ARG N N 155 128.200 127.051 1.149 1
1 1213 . 12 1 1 A 96 96 ILE H H 156 8.700 8.799 -0.099 1
1 1214 . 12 1 1 A 96 96 ILE HA H 156 4.440 4.591 -0.151 1
1 1224 . 12 1 1 A 96 96 ILE CA C 156 56.500 57.985 -1.485 1
1 1225 . 12 1 1 A 96 96 ILE CB C 156 36.700 38.634 -1.934 1
1 1229 . 12 1 1 A 96 96 ILE N N 156 124.100 123.176 0.924 1
1 1230 . 12 1 1 A 97 97 PRO HA H 157 4.370 4.674 -0.304 1
1 1237 . 12 1 1 A 97 97 PRO C C 157 176.000 176.597 -0.597 1
1 1238 . 12 1 1 A 97 97 PRO CA C 157 63.200 62.583 0.617 1
1 1239 . 12 1 1 A 97 97 PRO CB C 157 32.400 32.090 0.310 1
1 1242 . 12 1 1 A 98 98 LYS H H 158 8.380 8.272 0.108 1
1 1243 . 12 1 1 A 98 98 LYS HA H 158 4.190 4.680 -0.490 1
1 1252 . 12 1 1 A 98 98 LYS C C 158 176.800 177.294 -0.494 1
1 1253 . 12 1 1 A 98 98 LYS CA C 158 57.100 55.447 1.653 1
1 1254 . 12 1 1 A 98 98 LYS CB C 158 32.800 32.903 -0.103 1
1 1258 . 12 1 1 A 98 98 LYS N N 158 120.800 117.307 3.493 1
1 1259 . 12 1 1 A 99 99 ILE H H 159 7.930 8.095 -0.165 1
1 1260 . 12 1 1 A 99 99 ILE HA H 159 4.200 4.335 -0.135 1
1 1270 . 12 1 1 A 99 99 ILE C C 159 175.400 176.059 -0.659 1
1 1271 . 12 1 1 A 99 99 ILE CA C 159 60.600 62.091 -1.491 1
1 1272 . 12 1 1 A 99 99 ILE CB C 159 39.100 39.789 -0.689 1
1 1276 . 12 1 1 A 99 99 ILE N N 159 120.200 120.080 0.120 1
1 1277 . 12 1 1 A 100 100 ALA H H 160 8.370 7.518 0.852 1
1 1278 . 12 1 1 A 100 100 ALA HA H 160 4.370 4.349 0.021 1
1 1282 . 12 1 1 A 100 100 ALA C C 160 177.200 177.446 -0.246 1
1 1283 . 12 1 1 A 100 100 ALA CA C 160 52.200 51.811 0.389 1
1 1284 . 12 1 1 A 100 100 ALA CB C 160 19.400 20.042 -0.642 1
1 1285 . 12 1 1 A 100 100 ALA N N 160 128.300 123.816 4.484 1
1 1286 . 12 1 1 A 101 101 LEU H H 161 8.250 8.533 -0.283 1
1 1287 . 12 1 1 A 101 101 LEU HA H 161 4.280 4.126 0.154 1
1 1297 . 12 1 1 A 101 101 LEU C C 161 177.200 177.052 0.148 1
1 1298 . 12 1 1 A 101 101 LEU CA C 161 55.200 55.677 -0.477 1
1 1299 . 12 1 1 A 101 101 LEU CB C 161 42.400 41.688 0.712 1
1 1303 . 12 1 1 A 101 101 LEU N N 161 121.900 119.819 2.081 1
1 1304 . 12 1 1 A 102 102 GLU H H 162 8.390 8.581 -0.191 1
1 1305 . 12 1 1 A 102 102 GLU HA H 162 4.230 4.495 -0.265 1
1 1310 . 12 1 1 A 102 102 GLU C C 162 176.100 175.954 0.146 1
1 1311 . 12 1 1 A 102 102 GLU CA C 162 56.400 55.838 0.562 1
1 1312 . 12 1 1 A 102 102 GLU CB C 162 30.500 30.563 -0.063 1
1 1314 . 12 1 1 A 102 102 GLU N N 162 121.300 124.133 -2.833 1
1 1315 . 12 1 1 A 103 103 HIS H H 163 8.330 8.377 -0.047 1
1 1316 . 12 1 1 A 103 103 HIS HA H 163 4.590 4.751 -0.161 1
1 1319 . 12 1 1 A 103 103 HIS C C 163 176.100 174.978 1.122 1
1 1320 . 12 1 1 A 103 103 HIS CA C 163 56.000 55.595 0.405 1
1 1321 . 12 1 1 A 103 103 HIS CB C 163 30.500 31.468 -0.968 1
1 1322 . 12 1 1 A 103 103 HIS N N 163 120.000 118.880 1.120 1
1 1323 . 12 1 1 A 107 107 HIS HA H 167 4.620 4.901 -0.281 1
1 1326 . 12 1 1 A 107 107 HIS C C 167 173.900 174.803 -0.903 1
1 1327 . 12 1 1 A 107 107 HIS CA C 167 56.000 54.593 1.407 1
1 1328 . 12 1 1 A 107 107 HIS CB C 167 30.300 30.641 -0.341 1
1 15 . 13 1 1 A 2 2 ASP H H 62 8.760 9.007 -0.247 1
1 16 . 13 1 1 A 2 2 ASP HA H 62 4.810 5.224 -0.414 1
1 19 . 13 1 1 A 2 2 ASP C C 62 175.800 175.398 0.402 1
1 20 . 13 1 1 A 2 2 ASP CA C 62 54.800 52.871 1.929 1
1 21 . 13 1 1 A 2 2 ASP CB C 62 41.600 43.859 -2.259 1
1 22 . 13 1 1 A 2 2 ASP N N 62 120.900 126.742 -5.842 1
1 23 . 13 1 1 A 3 3 SER H H 63 8.710 8.592 0.118 1
1 24 . 13 1 1 A 3 3 SER HA H 63 4.970 4.684 0.286 1
1 27 . 13 1 1 A 3 3 SER C C 63 175.600 175.895 -0.295 1
1 28 . 13 1 1 A 3 3 SER CA C 63 57.500 58.098 -0.598 1
1 29 . 13 1 1 A 3 3 SER CB C 63 65.900 64.705 1.195 1
1 30 . 13 1 1 A 3 3 SER N N 63 116.300 116.338 -0.038 1
1 31 . 13 1 1 A 4 4 PHE H H 64 9.370 9.719 -0.349 1
1 32 . 13 1 1 A 4 4 PHE HA H 64 4.010 4.104 -0.094 1
1 39 . 13 1 1 A 4 4 PHE C C 64 176.700 177.381 -0.681 1
1 40 . 13 1 1 A 4 4 PHE CA C 64 62.200 61.571 0.629 1
1 41 . 13 1 1 A 4 4 PHE CB C 64 38.500 39.398 -0.898 1
1 46 . 13 1 1 A 4 4 PHE N N 64 121.400 124.108 -2.708 1
1 47 . 13 1 1 A 5 5 GLY H H 65 8.930 7.993 0.937 1
1 48 . 13 1 1 A 5 5 GLY HA2 H 65 2.020 2.623 -0.603 1
1 49 . 13 1 1 A 5 5 GLY HA3 H 65 3.250 3.038 0.212 1
1 50 . 13 1 1 A 5 5 GLY C C 65 175.200 175.251 -0.051 1
1 51 . 13 1 1 A 5 5 GLY CA C 65 46.300 46.552 -0.252 1
1 52 . 13 1 1 A 5 5 GLY N N 65 106.500 104.577 1.923 1
1 53 . 13 1 1 A 6 6 ASP H H 66 7.630 7.812 -0.182 1
1 54 . 13 1 1 A 6 6 ASP HA H 66 4.100 4.209 -0.109 1
1 57 . 13 1 1 A 6 6 ASP C C 66 179.500 178.819 0.681 1
1 58 . 13 1 1 A 6 6 ASP CA C 66 57.400 56.778 0.622 1
1 59 . 13 1 1 A 6 6 ASP CB C 66 40.500 40.433 0.067 1
1 60 . 13 1 1 A 6 6 ASP N N 66 120.500 121.107 -0.607 1
1 61 . 13 1 1 A 7 7 TRP H H 67 7.190 7.638 -0.448 1
1 62 . 13 1 1 A 7 7 TRP HA H 67 3.860 4.289 -0.429 1
1 71 . 13 1 1 A 7 7 TRP C C 67 177.200 178.222 -1.022 1
1 72 . 13 1 1 A 7 7 TRP CA C 67 61.100 59.337 1.763 1
1 73 . 13 1 1 A 7 7 TRP CB C 67 28.300 28.544 -0.244 1
1 79 . 13 1 1 A 7 7 TRP N N 67 120.700 120.306 0.394 1
1 81 . 13 1 1 A 8 8 ALA H H 68 9.040 8.273 0.767 1
1 82 . 13 1 1 A 8 8 ALA HA H 68 3.730 3.731 -0.001 1
1 86 . 13 1 1 A 8 8 ALA C C 68 179.500 179.589 -0.089 1
1 87 . 13 1 1 A 8 8 ALA CA C 68 55.200 55.123 0.077 1
1 88 . 13 1 1 A 8 8 ALA CB C 68 18.600 17.840 0.760 1
1 89 . 13 1 1 A 8 8 ALA N N 68 125.700 122.580 3.120 1
1 90 . 13 1 1 A 9 9 GLU H H 69 8.060 7.766 0.294 1
1 91 . 13 1 1 A 9 9 GLU HA H 69 4.020 4.102 -0.082 1
1 96 . 13 1 1 A 9 9 GLU C C 69 180.400 179.299 1.101 1
1 97 . 13 1 1 A 9 9 GLU CA C 69 58.800 58.553 0.247 1
1 98 . 13 1 1 A 9 9 GLU CB C 69 28.500 29.139 -0.639 1
1 99 . 13 1 1 A 9 9 GLU N N 69 115.400 117.994 -2.594 1
1 100 . 13 1 1 A 10 10 LYS H H 70 7.740 7.504 0.236 1
1 101 . 13 1 1 A 10 10 LYS HA H 70 3.910 3.945 -0.035 1
1 110 . 13 1 1 A 10 10 LYS C C 70 179.500 178.976 0.524 1
1 111 . 13 1 1 A 10 10 LYS CA C 70 60.000 58.610 1.390 1
1 112 . 13 1 1 A 10 10 LYS CB C 70 32.400 31.931 0.469 1
1 116 . 13 1 1 A 10 10 LYS N N 70 122.700 120.911 1.789 1
1 117 . 13 1 1 A 11 11 PHE H H 71 8.750 8.062 0.688 1
1 118 . 13 1 1 A 11 11 PHE HA H 71 4.080 4.158 -0.078 1
1 126 . 13 1 1 A 11 11 PHE C C 71 177.100 177.270 -0.170 1
1 127 . 13 1 1 A 11 11 PHE CA C 71 61.200 61.298 -0.098 1
1 128 . 13 1 1 A 11 11 PHE CB C 71 38.900 39.135 -0.235 1
1 134 . 13 1 1 A 11 11 PHE N N 71 123.500 120.592 2.908 1
1 135 . 13 1 1 A 12 12 LEU H H 72 8.400 8.633 -0.233 1
1 136 . 13 1 1 A 12 12 LEU HA H 72 3.520 3.643 -0.123 1
1 146 . 13 1 1 A 12 12 LEU C C 72 180.000 179.158 0.842 1
1 147 . 13 1 1 A 12 12 LEU CA C 72 58.200 58.109 0.091 1
1 148 . 13 1 1 A 12 12 LEU CB C 72 41.700 41.355 0.345 1
1 152 . 13 1 1 A 12 12 LEU N N 72 121.100 118.883 2.217 1
1 153 . 13 1 1 A 13 13 LYS H H 73 7.810 8.137 -0.327 1
1 154 . 13 1 1 A 13 13 LYS HA H 73 4.080 4.025 0.055 1
1 156 . 13 1 1 A 13 13 LYS C C 73 179.300 178.933 0.367 1
1 157 . 13 1 1 A 13 13 LYS CA C 73 59.000 58.894 0.106 1
1 158 . 13 1 1 A 13 13 LYS CB C 73 31.900 31.964 -0.064 1
1 159 . 13 1 1 A 13 13 LYS N N 73 119.400 120.996 -1.596 1
1 160 . 13 1 1 A 14 14 SER H H 74 8.210 8.174 0.036 1
1 161 . 13 1 1 A 14 14 SER HA H 74 4.210 4.131 0.079 1
1 164 . 13 1 1 A 14 14 SER C C 74 176.300 176.984 -0.684 1
1 165 . 13 1 1 A 14 14 SER CA C 74 61.400 61.210 0.190 1
1 166 . 13 1 1 A 14 14 SER CB C 74 62.600 62.219 0.381 1
1 167 . 13 1 1 A 14 14 SER N N 74 117.600 115.494 2.106 1
1 168 . 13 1 1 A 15 15 LYS H H 75 7.760 7.323 0.437 1
1 169 . 13 1 1 A 15 15 LYS HA H 75 4.040 3.952 0.088 1
1 178 . 13 1 1 A 15 15 LYS C C 75 178.500 178.619 -0.119 1
1 179 . 13 1 1 A 15 15 LYS CA C 75 56.500 59.328 -2.828 1
1 180 . 13 1 1 A 15 15 LYS CB C 75 30.600 31.828 -1.228 1
1 184 . 13 1 1 A 15 15 LYS N N 75 120.100 122.727 -2.627 1
1 185 . 13 1 1 A 16 16 GLU H H 76 7.680 8.541 -0.861 1
1 186 . 13 1 1 A 16 16 GLU HA H 76 4.030 4.029 0.001 1
1 191 . 13 1 1 A 16 16 GLU C C 76 179.900 178.572 1.328 1
1 192 . 13 1 1 A 16 16 GLU CA C 76 59.200 59.533 -0.333 1
1 193 . 13 1 1 A 16 16 GLU CB C 76 29.600 29.299 0.301 1
1 195 . 13 1 1 A 16 16 GLU N N 76 119.700 119.693 0.007 1
1 196 . 13 1 1 A 17 17 ALA H H 77 8.030 7.951 0.079 1
1 197 . 13 1 1 A 17 17 ALA HA H 77 4.200 4.089 0.111 1
1 201 . 13 1 1 A 17 17 ALA C C 77 178.900 179.429 -0.529 1
1 202 . 13 1 1 A 17 17 ALA CA C 77 54.400 53.700 0.700 1
1 203 . 13 1 1 A 17 17 ALA CB C 77 18.100 18.671 -0.571 1
1 204 . 13 1 1 A 17 17 ALA N N 77 123.000 120.390 2.610 1
1 205 . 13 1 1 A 18 18 ASP H H 78 7.860 7.820 0.040 1
1 206 . 13 1 1 A 18 18 ASP HA H 78 4.600 4.458 0.142 1
1 209 . 13 1 1 A 18 18 ASP C C 78 177.500 176.191 1.309 1
1 210 . 13 1 1 A 18 18 ASP CA C 78 55.100 55.589 -0.489 1
1 211 . 13 1 1 A 18 18 ASP CB C 78 41.400 41.561 -0.161 1
1 212 . 13 1 1 A 18 18 ASP N N 78 117.700 117.509 0.191 1
1 213 . 13 1 1 A 19 19 GLY H H 79 7.910 7.611 0.299 1
1 214 . 13 1 1 A 19 19 GLY HA2 H 79 3.860 4.054 -0.194 1
1 215 . 13 1 1 A 19 19 GLY HA3 H 79 4.080 4.056 0.024 1
1 216 . 13 1 1 A 19 19 GLY C C 79 175.300 173.735 1.565 1
1 217 . 13 1 1 A 19 19 GLY CA C 79 46.200 45.651 0.549 1
1 218 . 13 1 1 A 19 19 GLY N N 79 107.100 106.197 0.903 1
1 219 . 13 1 1 A 20 20 VAL H H 80 7.150 7.986 -0.836 1
1 220 . 13 1 1 A 20 20 VAL HA H 80 4.250 4.990 -0.740 1
1 228 . 13 1 1 A 20 20 VAL C C 80 175.100 174.696 0.404 1
1 229 . 13 1 1 A 20 20 VAL CA C 80 61.800 59.244 2.556 1
1 230 . 13 1 1 A 20 20 VAL CB C 80 32.200 35.080 -2.880 1
1 233 . 13 1 1 A 20 20 VAL N N 80 114.600 114.528 0.072 1
1 234 . 13 1 1 A 21 21 SER H H 81 8.560 8.601 -0.041 1
1 235 . 13 1 1 A 21 21 SER HA H 81 4.390 4.679 -0.289 1
1 238 . 13 1 1 A 21 21 SER C C 81 174.600 175.413 -0.813 1
1 239 . 13 1 1 A 21 21 SER CA C 81 57.900 57.976 -0.076 1
1 240 . 13 1 1 A 21 21 SER CB C 81 64.700 64.184 0.516 1
1 241 . 13 1 1 A 21 21 SER N N 81 118.700 118.861 -0.161 1
1 242 . 13 1 1 A 22 22 VAL H H 82 8.690 8.793 -0.103 1
1 243 . 13 1 1 A 22 22 VAL HA H 82 3.700 3.671 0.029 1
1 251 . 13 1 1 A 22 22 VAL C C 82 178.000 177.289 0.711 1
1 252 . 13 1 1 A 22 22 VAL CA C 82 66.500 66.863 -0.363 1
1 253 . 13 1 1 A 22 22 VAL CB C 82 31.700 31.824 -0.124 1
1 256 . 13 1 1 A 22 22 VAL N N 82 122.100 126.795 -4.695 1
1 257 . 13 1 1 A 23 23 SER H H 83 8.300 8.076 0.224 1
1 258 . 13 1 1 A 23 23 SER HA H 83 4.210 4.116 0.094 1
1 261 . 13 1 1 A 23 23 SER C C 83 177.600 175.947 1.653 1
1 262 . 13 1 1 A 23 23 SER CA C 83 61.400 62.407 -1.007 1
1 263 . 13 1 1 A 23 23 SER CB C 83 62.400 62.804 -0.404 1
1 264 . 13 1 1 A 23 23 SER N N 83 113.600 114.318 -0.718 1
1 265 . 13 1 1 A 24 24 GLN H H 84 7.820 7.641 0.179 1
1 266 . 13 1 1 A 24 24 GLN HA H 84 3.970 3.981 -0.011 1
1 273 . 13 1 1 A 24 24 GLN C C 84 178.400 177.804 0.596 1
1 274 . 13 1 1 A 24 24 GLN CA C 84 58.400 58.385 0.015 1
1 275 . 13 1 1 A 24 24 GLN CB C 84 28.900 28.552 0.348 1
1 278 . 13 1 1 A 24 24 GLN N N 84 122.900 120.829 2.071 1
1 280 . 13 1 1 A 25 25 LEU H H 85 8.920 8.484 0.436 1
1 281 . 13 1 1 A 25 25 LEU HA H 85 4.130 4.290 -0.160 1
1 291 . 13 1 1 A 25 25 LEU C C 85 178.800 178.439 0.361 1
1 292 . 13 1 1 A 25 25 LEU CA C 85 58.300 57.782 0.518 1
1 293 . 13 1 1 A 25 25 LEU CB C 85 41.200 41.715 -0.515 1
1 297 . 13 1 1 A 25 25 LEU N N 85 122.200 121.383 0.817 1
1 298 . 13 1 1 A 26 26 ASN H H 86 8.860 8.800 0.060 1
1 299 . 13 1 1 A 26 26 ASN HA H 86 4.420 4.520 -0.100 1
1 304 . 13 1 1 A 26 26 ASN C C 86 179.000 177.613 1.387 1
1 305 . 13 1 1 A 26 26 ASN CA C 86 55.900 56.455 -0.555 1
1 306 . 13 1 1 A 26 26 ASN CB C 86 37.200 39.377 -2.177 1
1 308 . 13 1 1 A 26 26 ASN N N 86 117.600 118.087 -0.487 1
1 310 . 13 1 1 A 27 27 SER H H 87 7.840 7.691 0.149 1
1 311 . 13 1 1 A 27 27 SER HA H 87 4.100 4.139 -0.039 1
1 314 . 13 1 1 A 27 27 SER C C 87 179.000 177.074 1.926 1
1 315 . 13 1 1 A 27 27 SER CA C 87 62.100 61.205 0.895 1
1 316 . 13 1 1 A 27 27 SER CB C 87 62.100 62.913 -0.813 1
1 317 . 13 1 1 A 27 27 SER N N 87 118.500 114.178 4.322 1
1 318 . 13 1 1 A 28 28 TYR H H 88 8.180 7.963 0.217 1
1 319 . 13 1 1 A 28 28 TYR HA H 88 4.600 4.518 0.082 1
1 326 . 13 1 1 A 28 28 TYR C C 88 174.800 178.633 -3.833 1
1 327 . 13 1 1 A 28 28 TYR CA C 88 61.200 62.335 -1.135 1
1 328 . 13 1 1 A 28 28 TYR CB C 88 37.800 37.930 -0.130 1
1 333 . 13 1 1 A 28 28 TYR N N 88 119.300 119.376 -0.076 1
1 334 . 13 1 1 A 29 29 LYS H H 89 9.040 8.332 0.708 1
1 335 . 13 1 1 A 29 29 LYS HA H 89 3.890 4.100 -0.210 1
1 344 . 13 1 1 A 29 29 LYS C C 89 179.000 178.713 0.287 1
1 345 . 13 1 1 A 29 29 LYS CA C 89 61.300 59.440 1.860 1
1 346 . 13 1 1 A 29 29 LYS CB C 89 32.800 32.114 0.686 1
1 350 . 13 1 1 A 29 29 LYS N N 89 119.300 118.997 0.303 1
1 351 . 13 1 1 A 30 30 ASN H H 90 7.770 8.425 -0.655 1
1 352 . 13 1 1 A 30 30 ASN HA H 90 4.560 4.388 0.172 1
1 357 . 13 1 1 A 30 30 ASN C C 90 178.300 177.542 0.758 1
1 358 . 13 1 1 A 30 30 ASN CA C 90 56.200 56.316 -0.116 1
1 359 . 13 1 1 A 30 30 ASN CB C 90 38.900 39.187 -0.287 1
1 361 . 13 1 1 A 30 30 ASN N N 90 117.800 118.217 -0.417 1
1 363 . 13 1 1 A 31 31 TYR H H 91 8.860 7.990 0.870 1
1 364 . 13 1 1 A 31 31 TYR HA H 91 4.910 4.579 0.331 1
1 371 . 13 1 1 A 31 31 TYR C C 91 178.300 179.040 -0.740 1
1 372 . 13 1 1 A 31 31 TYR CA C 91 59.700 60.936 -1.236 1
1 373 . 13 1 1 A 31 31 TYR CB C 91 37.500 37.696 -0.196 1
1 378 . 13 1 1 A 31 31 TYR N N 91 119.400 118.487 0.913 1
1 379 . 13 1 1 A 32 32 CYS H H 92 8.640 8.452 0.188 1
1 380 . 13 1 1 A 32 32 CYS HA H 92 4.410 4.343 0.067 1
1 383 . 13 1 1 A 32 32 CYS C C 92 173.700 177.012 -3.312 1
1 384 . 13 1 1 A 32 32 CYS CA C 92 65.500 63.947 1.553 1
1 385 . 13 1 1 A 32 32 CYS CB C 92 28.300 27.323 0.977 1
1 386 . 13 1 1 A 32 32 CYS N N 92 113.500 118.318 -4.818 1
1 387 . 13 1 1 A 33 33 ARG H H 93 8.440 8.176 0.264 1
1 388 . 13 1 1 A 33 33 ARG HA H 93 3.740 3.755 -0.015 1
1 391 . 13 1 1 A 33 33 ARG C C 93 177.200 178.209 -1.009 1
1 392 . 13 1 1 A 33 33 ARG CA C 93 58.300 58.440 -0.140 1
1 393 . 13 1 1 A 33 33 ARG CB C 93 30.200 30.194 0.006 1
1 394 . 13 1 1 A 33 33 ARG N N 93 111.400 120.650 -9.250 1
1 395 . 13 1 1 A 34 34 ASN H H 94 8.020 8.185 -0.165 1
1 396 . 13 1 1 A 34 34 ASN HA H 94 4.980 4.571 0.409 1
1 401 . 13 1 1 A 34 34 ASN C C 94 176.700 177.241 -0.541 1
1 402 . 13 1 1 A 34 34 ASN CA C 94 53.400 55.641 -2.241 1
1 403 . 13 1 1 A 34 34 ASN CB C 94 38.000 38.865 -0.865 1
1 405 . 13 1 1 A 34 34 ASN N N 94 113.600 118.299 -4.699 1
1 407 . 13 1 1 A 35 35 HIS H H 95 7.200 7.745 -0.545 1
1 408 . 13 1 1 A 35 35 HIS HA H 95 4.470 4.511 -0.041 1
1 411 . 13 1 1 A 35 35 HIS C C 95 176.600 176.074 0.526 1
1 412 . 13 1 1 A 35 35 HIS CA C 95 60.000 59.131 0.869 1
1 413 . 13 1 1 A 35 35 HIS CB C 95 30.500 31.321 -0.821 1
1 414 . 13 1 1 A 35 35 HIS N N 95 115.600 117.014 -1.414 1
1 415 . 13 1 1 A 36 36 LEU H H 96 8.170 7.773 0.397 1
1 416 . 13 1 1 A 36 36 LEU HA H 96 4.730 4.653 0.077 1
1 426 . 13 1 1 A 36 36 LEU C C 96 176.800 177.362 -0.562 1
1 427 . 13 1 1 A 36 36 LEU CA C 96 54.400 54.609 -0.209 1
1 428 . 13 1 1 A 36 36 LEU CB C 96 40.600 42.131 -1.531 1
1 432 . 13 1 1 A 36 36 LEU N N 96 114.000 118.755 -4.755 1
1 433 . 13 1 1 A 37 37 SER H H 97 7.140 8.032 -0.892 1
1 434 . 13 1 1 A 37 37 SER HA H 97 4.730 4.281 0.449 1
1 437 . 13 1 1 A 37 37 SER CA C 97 62.700 63.596 -0.896 1
1 438 . 13 1 1 A 37 37 SER CB C 97 62.600 61.257 1.343 1
1 439 . 13 1 1 A 37 37 SER N N 97 117.200 116.521 0.679 1
1 440 . 13 1 1 A 38 38 PRO HA H 98 4.560 4.425 0.135 1
1 447 . 13 1 1 A 38 38 PRO C C 98 177.900 178.105 -0.205 1
1 448 . 13 1 1 A 38 38 PRO CA C 98 65.700 65.307 0.393 1
1 449 . 13 1 1 A 38 38 PRO CB C 98 31.800 31.390 0.410 1
1 452 . 13 1 1 A 39 39 LEU H H 99 8.090 7.724 0.366 1
1 453 . 13 1 1 A 39 39 LEU HA H 99 4.260 4.138 0.122 1
1 463 . 13 1 1 A 39 39 LEU C C 99 178.700 178.544 0.156 1
1 464 . 13 1 1 A 39 39 LEU CA C 99 54.300 57.100 -2.800 1
1 465 . 13 1 1 A 39 39 LEU CB C 99 42.400 41.954 0.446 1
1 469 . 13 1 1 A 39 39 LEU N N 99 112.400 116.909 -4.509 1
1 470 . 13 1 1 A 40 40 TYR H H 100 8.350 8.498 -0.148 1
1 471 . 13 1 1 A 40 40 TYR HA H 100 4.170 4.472 -0.302 1
1 478 . 13 1 1 A 40 40 TYR C C 100 178.300 176.884 1.416 1
1 479 . 13 1 1 A 40 40 TYR CA C 100 63.400 61.898 1.502 1
1 480 . 13 1 1 A 40 40 TYR CB C 100 38.600 39.222 -0.622 1
1 485 . 13 1 1 A 40 40 TYR N N 100 119.400 120.911 -1.511 1
1 486 . 13 1 1 A 41 41 MET H H 101 8.640 8.049 0.591 1
1 487 . 13 1 1 A 41 41 MET HA H 101 4.260 4.732 -0.472 1
1 488 . 13 1 1 A 41 41 MET C C 101 177.000 175.354 1.646 1
1 489 . 13 1 1 A 41 41 MET CA C 101 54.600 54.403 0.197 1
1 490 . 13 1 1 A 41 41 MET N N 101 111.800 115.866 -4.066 1
1 491 . 13 1 1 A 42 42 LYS H H 102 7.880 7.914 -0.034 1
1 492 . 13 1 1 A 42 42 LYS HA H 102 4.430 4.808 -0.378 1
1 501 . 13 1 1 A 42 42 LYS C C 102 176.300 176.155 0.145 1
1 502 . 13 1 1 A 42 42 LYS CA C 102 56.000 54.387 1.613 1
1 503 . 13 1 1 A 42 42 LYS CB C 102 33.400 34.494 -1.094 1
1 507 . 13 1 1 A 42 42 LYS N N 102 121.700 119.351 2.349 1
1 508 . 13 1 1 A 43 43 SER H H 103 9.160 8.893 0.267 1
1 509 . 13 1 1 A 43 43 SER HA H 103 4.620 4.683 -0.063 1
1 513 . 13 1 1 A 43 43 SER C C 103 176.300 175.666 0.634 1
1 514 . 13 1 1 A 43 43 SER CA C 103 58.700 58.163 0.537 1
1 515 . 13 1 1 A 43 43 SER CB C 103 63.700 64.043 -0.343 1
1 516 . 13 1 1 A 43 43 SER N N 103 118.800 116.978 1.822 1
1 517 . 13 1 1 A 44 44 LEU H H 104 8.860 8.699 0.161 1
1 518 . 13 1 1 A 44 44 LEU HA H 104 4.130 4.309 -0.179 1
1 528 . 13 1 1 A 44 44 LEU C C 104 178.700 177.731 0.969 1
1 529 . 13 1 1 A 44 44 LEU CA C 104 58.800 57.694 1.106 1
1 530 . 13 1 1 A 44 44 LEU CB C 104 42.600 41.750 0.850 1
1 534 . 13 1 1 A 44 44 LEU N N 104 124.200 128.393 -4.193 1
1 535 . 13 1 1 A 45 45 SER H H 105 8.330 8.113 0.217 1
1 536 . 13 1 1 A 45 45 SER HA H 105 4.310 4.393 -0.083 1
1 539 . 13 1 1 A 45 45 SER C C 105 175.000 175.337 -0.337 1
1 540 . 13 1 1 A 45 45 SER CA C 105 60.100 59.603 0.497 1
1 541 . 13 1 1 A 45 45 SER CB C 105 63.400 63.235 0.165 1
1 542 . 13 1 1 A 45 45 SER N N 105 107.700 114.237 -6.537 1
1 543 . 13 1 1 A 46 46 GLU H H 106 7.800 7.985 -0.185 1
1 544 . 13 1 1 A 46 46 GLU HA H 106 4.570 4.355 0.215 1
1 549 . 13 1 1 A 46 46 GLU C C 106 174.100 176.058 -1.958 1
1 550 . 13 1 1 A 46 46 GLU CA C 106 55.600 56.323 -0.723 1
1 551 . 13 1 1 A 46 46 GLU CB C 106 31.200 30.148 1.052 1
1 553 . 13 1 1 A 46 46 GLU N N 106 119.600 118.474 1.126 1
1 554 . 13 1 1 A 47 47 ILE H H 107 7.100 7.560 -0.460 1
1 555 . 13 1 1 A 47 47 ILE HA H 107 4.040 4.264 -0.224 1
1 565 . 13 1 1 A 47 47 ILE C C 107 174.100 174.863 -0.763 1
1 566 . 13 1 1 A 47 47 ILE CA C 107 62.300 60.347 1.953 1
1 567 . 13 1 1 A 47 47 ILE CB C 107 38.500 38.456 0.044 1
1 571 . 13 1 1 A 47 47 ILE N N 107 120.600 121.143 -0.543 1
1 572 . 13 1 1 A 48 48 LEU H H 108 9.180 8.831 0.349 1
1 573 . 13 1 1 A 48 48 LEU HA H 108 4.940 4.672 0.268 1
1 583 . 13 1 1 A 48 48 LEU CA C 108 51.900 52.261 -0.361 1
1 584 . 13 1 1 A 48 48 LEU CB C 108 42.000 42.054 -0.054 1
1 588 . 13 1 1 A 48 48 LEU N N 108 129.400 128.685 0.715 1
1 589 . 13 1 1 A 49 49 PRO HA H 109 3.910 4.184 -0.274 1
1 596 . 13 1 1 A 49 49 PRO C C 109 178.500 178.128 0.372 1
1 597 . 13 1 1 A 49 49 PRO CA C 109 66.600 65.610 0.990 1
1 598 . 13 1 1 A 49 49 PRO CB C 109 31.300 31.554 -0.254 1
1 601 . 13 1 1 A 50 50 ALA H H 110 8.280 8.154 0.126 1
1 602 . 13 1 1 A 50 50 ALA HA H 110 4.110 4.101 0.009 1
1 606 . 13 1 1 A 50 50 ALA C C 110 179.700 179.585 0.115 1
1 607 . 13 1 1 A 50 50 ALA CA C 110 55.100 54.564 0.536 1
1 608 . 13 1 1 A 50 50 ALA CB C 110 19.200 18.249 0.951 1
1 609 . 13 1 1 A 50 50 ALA N N 110 116.100 118.833 -2.733 1
1 610 . 13 1 1 A 51 51 ASP H H 111 7.790 8.063 -0.273 1
1 611 . 13 1 1 A 51 51 ASP HA H 111 4.440 4.331 0.109 1
1 614 . 13 1 1 A 51 51 ASP C C 111 178.200 178.821 -0.621 1
1 615 . 13 1 1 A 51 51 ASP CA C 111 57.600 57.616 -0.016 1
1 616 . 13 1 1 A 51 51 ASP CB C 111 41.800 41.194 0.606 1
1 617 . 13 1 1 A 51 51 ASP N N 111 116.500 117.874 -1.374 1
1 618 . 13 1 1 A 52 52 ILE H H 112 7.020 7.593 -0.573 1
1 619 . 13 1 1 A 52 52 ILE HA H 112 3.750 3.668 0.082 1
1 629 . 13 1 1 A 52 52 ILE C C 112 177.300 177.703 -0.403 1
1 630 . 13 1 1 A 52 52 ILE CA C 112 63.500 65.114 -1.614 1
1 631 . 13 1 1 A 52 52 ILE CB C 112 37.500 37.095 0.405 1
1 635 . 13 1 1 A 52 52 ILE N N 112 116.700 119.383 -2.683 1
1 636 . 13 1 1 A 53 53 GLN H H 113 9.150 8.351 0.799 1
1 637 . 13 1 1 A 53 53 GLN HA H 113 3.720 3.945 -0.225 1
1 644 . 13 1 1 A 53 53 GLN C C 113 177.500 177.836 -0.336 1
1 645 . 13 1 1 A 53 53 GLN CA C 113 58.200 58.978 -0.778 1
1 646 . 13 1 1 A 53 53 GLN CB C 113 30.200 28.846 1.354 1
1 649 . 13 1 1 A 53 53 GLN N N 113 121.200 121.168 0.032 1
1 651 . 13 1 1 A 54 54 SER H H 114 8.150 8.056 0.094 1
1 652 . 13 1 1 A 54 54 SER HA H 114 4.180 4.179 0.001 1
1 655 . 13 1 1 A 54 54 SER C C 114 175.900 177.428 -1.528 1
1 656 . 13 1 1 A 54 54 SER CA C 114 62.100 61.909 0.191 1
1 657 . 13 1 1 A 54 54 SER CB C 114 62.800 64.152 -1.352 1
1 658 . 13 1 1 A 54 54 SER N N 114 112.200 114.009 -1.809 1
1 659 . 13 1 1 A 55 55 ILE H H 115 6.760 7.497 -0.737 1
1 660 . 13 1 1 A 55 55 ILE HA H 115 3.860 3.733 0.127 1
1 670 . 13 1 1 A 55 55 ILE C C 115 179.200 178.472 0.728 1
1 671 . 13 1 1 A 55 55 ILE CA C 115 64.700 64.564 0.136 1
1 672 . 13 1 1 A 55 55 ILE CB C 115 38.900 37.934 0.966 1
1 676 . 13 1 1 A 55 55 ILE N N 115 119.500 120.324 -0.824 1
1 677 . 13 1 1 A 56 56 ILE H H 116 7.750 8.364 -0.614 1
1 678 . 13 1 1 A 56 56 ILE HA H 116 3.690 3.558 0.132 1
1 688 . 13 1 1 A 56 56 ILE C C 116 176.900 178.206 -1.306 1
1 689 . 13 1 1 A 56 56 ILE CA C 116 62.800 65.257 -2.457 1
1 690 . 13 1 1 A 56 56 ILE CB C 116 36.200 37.578 -1.378 1
1 694 . 13 1 1 A 56 56 ILE N N 116 120.200 121.151 -0.951 1
1 695 . 13 1 1 A 57 57 ASN H H 117 8.690 8.542 0.148 1
1 696 . 13 1 1 A 57 57 ASN HA H 117 4.440 4.439 0.001 1
1 701 . 13 1 1 A 57 57 ASN C C 117 177.200 177.675 -0.475 1
1 702 . 13 1 1 A 57 57 ASN CA C 117 54.800 56.385 -1.585 1
1 703 . 13 1 1 A 57 57 ASN CB C 117 38.100 38.417 -0.317 1
1 705 . 13 1 1 A 57 57 ASN N N 117 117.000 119.711 -2.711 1
1 707 . 13 1 1 A 58 58 GLU H H 118 7.630 7.945 -0.315 1
1 708 . 13 1 1 A 58 58 GLU HA H 118 4.450 4.348 0.102 1
1 713 . 13 1 1 A 58 58 GLU C C 118 176.500 177.097 -0.597 1
1 714 . 13 1 1 A 58 58 GLU CA C 118 56.200 57.994 -1.794 1
1 715 . 13 1 1 A 58 58 GLU CB C 118 30.200 30.216 -0.016 1
1 717 . 13 1 1 A 58 58 GLU N N 118 116.300 116.722 -0.422 1
1 718 . 13 1 1 A 59 59 THR H H 119 7.540 7.641 -0.101 1
1 719 . 13 1 1 A 59 59 THR HA H 119 4.230 4.273 -0.043 1
1 724 . 13 1 1 A 59 59 THR C C 119 174.200 174.053 0.147 1
1 725 . 13 1 1 A 59 59 THR CA C 119 63.800 63.232 0.568 1
1 726 . 13 1 1 A 59 59 THR CB C 119 68.900 68.718 0.182 1
1 728 . 13 1 1 A 59 59 THR N N 119 117.600 115.983 1.617 1
1 729 . 13 1 1 A 60 60 LYS H H 120 8.860 9.022 -0.162 1
1 730 . 13 1 1 A 60 60 LYS HA H 120 4.490 4.666 -0.176 1
1 739 . 13 1 1 A 60 60 LYS C C 120 175.800 175.224 0.576 1
1 740 . 13 1 1 A 60 60 LYS CA C 120 54.900 55.127 -0.227 1
1 741 . 13 1 1 A 60 60 LYS CB C 120 29.800 32.587 -2.787 1
1 745 . 13 1 1 A 60 60 LYS N N 120 128.500 127.632 0.868 1
1 746 . 13 1 1 A 61 61 LEU H H 121 7.150 8.277 -1.127 1
1 747 . 13 1 1 A 61 61 LEU HA H 121 4.710 4.881 -0.171 1
1 757 . 13 1 1 A 61 61 LEU C C 121 175.000 175.796 -0.796 1
1 758 . 13 1 1 A 61 61 LEU CA C 121 52.800 53.167 -0.367 1
1 759 . 13 1 1 A 61 61 LEU CB C 121 46.400 45.436 0.964 1
1 763 . 13 1 1 A 61 61 LEU N N 121 120.700 125.370 -4.670 1
1 764 . 13 1 1 A 62 62 ALA H H 122 8.000 8.399 -0.399 1
1 765 . 13 1 1 A 62 62 ALA HA H 122 4.250 4.329 -0.079 1
1 769 . 13 1 1 A 62 62 ALA CA C 122 52.100 52.465 -0.365 1
1 770 . 13 1 1 A 62 62 ALA CB C 122 19.500 19.073 0.427 1
1 771 . 13 1 1 A 62 62 ALA N N 122 119.900 123.146 -3.246 1
1 772 . 13 1 1 A 63 63 LYS H H 123 8.770 8.945 -0.175 1
1 773 . 13 1 1 A 63 63 LYS HA H 123 3.800 3.944 -0.144 1
1 782 . 13 1 1 A 63 63 LYS C C 123 178.300 179.073 -0.773 1
1 783 . 13 1 1 A 63 63 LYS CA C 123 60.700 59.559 1.141 1
1 784 . 13 1 1 A 63 63 LYS CB C 123 32.300 31.943 0.357 1
1 788 . 13 1 1 A 63 63 LYS N N 123 121.400 122.878 -1.478 1
1 789 . 13 1 1 A 64 64 ASN H H 124 9.020 8.145 0.875 1
1 790 . 13 1 1 A 64 64 ASN HA H 124 4.430 4.504 -0.074 1
1 795 . 13 1 1 A 64 64 ASN C C 124 178.300 178.002 0.298 1
1 796 . 13 1 1 A 64 64 ASN CA C 124 56.200 56.113 0.087 1
1 797 . 13 1 1 A 64 64 ASN CB C 124 37.300 39.466 -2.166 1
1 799 . 13 1 1 A 64 64 ASN N N 124 115.000 118.079 -3.079 1
1 801 . 13 1 1 A 65 65 THR H H 125 7.620 7.901 -0.281 1
1 802 . 13 1 1 A 65 65 THR HA H 125 4.030 4.081 -0.051 1
1 807 . 13 1 1 A 65 65 THR C C 125 175.500 176.795 -1.295 1
1 808 . 13 1 1 A 65 65 THR CA C 125 66.000 67.019 -1.019 1
1 809 . 13 1 1 A 65 65 THR CB C 125 67.600 67.993 -0.393 1
1 811 . 13 1 1 A 65 65 THR N N 125 119.800 116.019 3.781 1
1 812 . 13 1 1 A 66 66 LEU H H 126 8.020 8.118 -0.098 1
1 813 . 13 1 1 A 66 66 LEU HA H 126 3.790 3.915 -0.125 1
1 823 . 13 1 1 A 66 66 LEU C C 126 179.200 179.429 -0.229 1
1 824 . 13 1 1 A 66 66 LEU CA C 126 58.700 58.022 0.678 1
1 825 . 13 1 1 A 66 66 LEU CB C 126 41.300 41.211 0.089 1
1 829 . 13 1 1 A 66 66 LEU N N 126 121.200 121.587 -0.387 1
1 830 . 13 1 1 A 67 67 LYS H H 127 8.380 8.248 0.132 1
1 831 . 13 1 1 A 67 67 LYS HA H 127 3.740 4.097 -0.357 1
1 840 . 13 1 1 A 67 67 LYS C C 127 178.300 179.316 -1.016 1
1 841 . 13 1 1 A 67 67 LYS CA C 127 60.100 59.316 0.784 1
1 842 . 13 1 1 A 67 67 LYS CB C 127 32.400 32.032 0.368 1
1 846 . 13 1 1 A 67 67 LYS N N 127 117.000 118.167 -1.167 1
1 847 . 13 1 1 A 68 68 ALA H H 128 7.480 7.801 -0.321 1
1 848 . 13 1 1 A 68 68 ALA HA H 128 4.210 3.951 0.259 1
1 852 . 13 1 1 A 68 68 ALA C C 128 181.200 179.538 1.662 1
1 853 . 13 1 1 A 68 68 ALA CA C 128 55.200 54.929 0.271 1
1 854 . 13 1 1 A 68 68 ALA CB C 128 18.600 17.740 0.860 1
1 855 . 13 1 1 A 68 68 ALA N N 128 122.900 121.655 1.245 1
1 856 . 13 1 1 A 69 69 ILE H H 129 8.250 7.442 0.808 1
1 857 . 13 1 1 A 69 69 ILE HA H 129 3.130 3.339 -0.209 1
1 867 . 13 1 1 A 69 69 ILE C C 129 177.400 177.643 -0.243 1
1 868 . 13 1 1 A 69 69 ILE CA C 129 66.700 65.343 1.357 1
1 869 . 13 1 1 A 69 69 ILE CB C 129 37.900 37.557 0.343 1
1 873 . 13 1 1 A 69 69 ILE N N 129 122.800 118.159 4.641 1
1 874 . 13 1 1 A 70 70 ARG H H 130 8.040 8.082 -0.042 1
1 875 . 13 1 1 A 70 70 ARG HA H 130 3.620 3.903 -0.283 1
1 882 . 13 1 1 A 70 70 ARG C C 130 177.800 179.024 -1.224 1
1 883 . 13 1 1 A 70 70 ARG CA C 130 60.700 59.969 0.731 1
1 884 . 13 1 1 A 70 70 ARG CB C 130 29.600 30.108 -0.508 1
1 887 . 13 1 1 A 70 70 ARG N N 130 119.700 120.707 -1.007 1
1 888 . 13 1 1 A 71 71 ASN H H 131 8.920 8.551 0.369 1
1 889 . 13 1 1 A 71 71 ASN HA H 131 4.430 4.496 -0.066 1
1 894 . 13 1 1 A 71 71 ASN C C 131 177.500 177.900 -0.400 1
1 895 . 13 1 1 A 71 71 ASN CA C 131 56.100 56.267 -0.167 1
1 896 . 13 1 1 A 71 71 ASN CB C 131 38.600 38.815 -0.215 1
1 898 . 13 1 1 A 71 71 ASN N N 131 117.200 117.498 -0.298 1
1 900 . 13 1 1 A 72 72 THR H H 132 8.300 8.127 0.173 1
1 901 . 13 1 1 A 72 72 THR HA H 132 4.430 3.664 0.766 1
1 906 . 13 1 1 A 72 72 THR C C 132 175.100 176.430 -1.330 1
1 907 . 13 1 1 A 72 72 THR CA C 132 68.200 66.382 1.818 1
1 908 . 13 1 1 A 72 72 THR CB C 132 68.500 68.686 -0.186 1
1 910 . 13 1 1 A 72 72 THR N N 132 119.200 114.875 4.325 1
1 911 . 13 1 1 A 73 73 ALA H H 133 7.950 8.307 -0.357 1
1 912 . 13 1 1 A 73 73 ALA HA H 133 4.040 4.108 -0.068 1
1 916 . 13 1 1 A 73 73 ALA C C 133 178.200 179.610 -1.410 1
1 917 . 13 1 1 A 73 73 ALA CA C 133 55.900 55.464 0.436 1
1 918 . 13 1 1 A 73 73 ALA CB C 133 16.700 18.305 -1.605 1
1 919 . 13 1 1 A 73 73 ALA N N 133 120.900 123.659 -2.759 1
1 920 . 13 1 1 A 74 74 SER H H 134 8.440 8.365 0.075 1
1 921 . 13 1 1 A 74 74 SER HA H 134 4.430 4.327 0.103 1
1 924 . 13 1 1 A 74 74 SER C C 134 178.800 177.294 1.506 1
1 925 . 13 1 1 A 74 74 SER CA C 134 61.300 61.539 -0.239 1
1 926 . 13 1 1 A 74 74 SER CB C 134 62.600 62.426 0.174 1
1 927 . 13 1 1 A 74 74 SER N N 134 110.100 113.156 -3.056 1
1 928 . 13 1 1 A 75 75 GLN H H 135 8.340 7.570 0.770 1
1 929 . 13 1 1 A 75 75 GLN HA H 135 3.880 3.989 -0.109 1
1 936 . 13 1 1 A 75 75 GLN C C 135 178.800 179.005 -0.205 1
1 937 . 13 1 1 A 75 75 GLN CA C 135 59.600 58.621 0.979 1
1 938 . 13 1 1 A 75 75 GLN CB C 135 29.900 28.154 1.746 1
1 941 . 13 1 1 A 75 75 GLN N N 135 118.100 121.490 -3.390 1
1 943 . 13 1 1 A 76 76 ILE H H 136 7.670 7.351 0.319 1
1 944 . 13 1 1 A 76 76 ILE HA H 136 3.200 3.405 -0.205 1
1 954 . 13 1 1 A 76 76 ILE C C 136 177.500 178.016 -0.516 1
1 955 . 13 1 1 A 76 76 ILE CA C 136 66.100 64.997 1.103 1
1 956 . 13 1 1 A 76 76 ILE CB C 136 37.400 37.343 0.057 1
1 960 . 13 1 1 A 76 76 ILE N N 136 122.500 120.241 2.259 1
1 961 . 13 1 1 A 77 77 PHE H H 137 7.930 7.558 0.372 1
1 962 . 13 1 1 A 77 77 PHE HA H 137 3.890 4.070 -0.180 1
1 969 . 13 1 1 A 77 77 PHE C C 137 178.200 178.809 -0.609 1
1 970 . 13 1 1 A 77 77 PHE CA C 137 63.600 60.636 2.964 1
1 971 . 13 1 1 A 77 77 PHE CB C 137 39.300 38.280 1.020 1
1 976 . 13 1 1 A 77 77 PHE N N 137 116.100 118.987 -2.887 1
1 977 . 13 1 1 A 78 78 ARG H H 138 8.900 8.219 0.681 1
1 978 . 13 1 1 A 78 78 ARG HA H 138 3.910 4.091 -0.181 1
1 986 . 13 1 1 A 78 78 ARG C C 138 178.300 178.434 -0.134 1
1 987 . 13 1 1 A 78 78 ARG CA C 138 60.100 58.927 1.173 1
1 988 . 13 1 1 A 78 78 ARG CB C 138 29.600 29.711 -0.111 1
1 991 . 13 1 1 A 78 78 ARG N N 138 118.600 118.269 0.331 1
1 993 . 13 1 1 A 79 79 LEU H H 139 7.730 7.800 -0.070 1
1 994 . 13 1 1 A 79 79 LEU HA H 139 4.280 4.112 0.168 1
1 1004 . 13 1 1 A 79 79 LEU C C 139 179.000 178.367 0.633 1
1 1005 . 13 1 1 A 79 79 LEU CA C 139 57.800 57.730 0.070 1
1 1006 . 13 1 1 A 79 79 LEU CB C 139 41.900 41.553 0.347 1
1 1010 . 13 1 1 A 79 79 LEU N N 139 121.900 122.564 -0.664 1
1 1011 . 13 1 1 A 80 80 ALA H H 140 7.590 7.659 -0.069 1
1 1012 . 13 1 1 A 80 80 ALA HA H 140 2.710 3.054 -0.344 1
1 1016 . 13 1 1 A 80 80 ALA C C 140 179.900 180.244 -0.344 1
1 1017 . 13 1 1 A 80 80 ALA CA C 140 55.100 54.624 0.476 1
1 1018 . 13 1 1 A 80 80 ALA CB C 140 17.600 17.697 -0.097 1
1 1019 . 13 1 1 A 80 80 ALA N N 140 123.400 119.846 3.554 1
1 1020 . 13 1 1 A 81 81 ILE H H 141 8.910 7.860 1.050 1
1 1021 . 13 1 1 A 81 81 ILE HA H 141 4.110 3.936 0.174 1
1 1031 . 13 1 1 A 81 81 ILE C C 141 181.700 178.304 3.396 1
1 1032 . 13 1 1 A 81 81 ILE CA C 141 64.800 65.316 -0.516 1
1 1033 . 13 1 1 A 81 81 ILE CB C 141 38.600 37.600 1.000 1
1 1037 . 13 1 1 A 81 81 ILE N N 141 122.400 118.787 3.613 1
1 1038 . 13 1 1 A 82 82 GLU H H 142 8.560 8.526 0.034 1
1 1039 . 13 1 1 A 82 82 GLU HA H 142 4.100 4.217 -0.117 1
1 1044 . 13 1 1 A 82 82 GLU C C 142 177.700 177.572 0.128 1
1 1045 . 13 1 1 A 82 82 GLU CA C 142 59.100 58.589 0.511 1
1 1046 . 13 1 1 A 82 82 GLU CB C 142 29.200 29.292 -0.092 1
1 1048 . 13 1 1 A 82 82 GLU N N 142 123.200 119.861 3.339 1
1 1049 . 13 1 1 A 83 83 ASN H H 143 7.310 7.530 -0.220 1
1 1050 . 13 1 1 A 83 83 ASN HA H 143 4.750 4.930 -0.180 1
1 1055 . 13 1 1 A 83 83 ASN C C 143 173.200 174.149 -0.949 1
1 1056 . 13 1 1 A 83 83 ASN CA C 143 54.200 52.906 1.294 1
1 1057 . 13 1 1 A 83 83 ASN CB C 143 41.300 38.537 2.763 1
1 1059 . 13 1 1 A 83 83 ASN N N 143 114.900 115.714 -0.814 1
1 1061 . 13 1 1 A 84 84 ARG H H 144 8.320 7.939 0.381 1
1 1062 . 13 1 1 A 84 84 ARG HA H 144 4.120 4.003 0.117 1
1 1069 . 13 1 1 A 84 84 ARG C C 144 175.300 175.507 -0.207 1
1 1070 . 13 1 1 A 84 84 ARG CA C 144 57.100 56.984 0.116 1
1 1071 . 13 1 1 A 84 84 ARG CB C 144 26.000 26.672 -0.672 1
1 1074 . 13 1 1 A 84 84 ARG N N 144 114.400 115.046 -0.646 1
1 1075 . 13 1 1 A 85 85 ALA H H 145 8.350 8.375 -0.025 1
1 1076 . 13 1 1 A 85 85 ALA HA H 145 4.320 4.312 0.008 1
1 1080 . 13 1 1 A 85 85 ALA C C 145 176.500 177.056 -0.556 1
1 1081 . 13 1 1 A 85 85 ALA CA C 145 53.400 52.704 0.696 1
1 1082 . 13 1 1 A 85 85 ALA CB C 145 19.900 19.862 0.038 1
1 1083 . 13 1 1 A 85 85 ALA N N 145 120.600 118.925 1.675 1
1 1084 . 13 1 1 A 86 86 ILE H H 146 7.290 7.514 -0.224 1
1 1085 . 13 1 1 A 86 86 ILE HA H 146 4.400 4.484 -0.084 1
1 1095 . 13 1 1 A 86 86 ILE C C 146 173.600 173.386 0.214 1
1 1096 . 13 1 1 A 86 86 ILE CA C 146 59.200 59.703 -0.503 1
1 1097 . 13 1 1 A 86 86 ILE CB C 146 41.600 40.553 1.047 1
1 1101 . 13 1 1 A 86 86 ILE N N 146 111.500 115.751 -4.251 1
1 1102 . 13 1 1 A 87 87 ASP H H 147 8.270 8.895 -0.625 1
1 1103 . 13 1 1 A 87 87 ASP HA H 147 4.940 5.008 -0.068 1
1 1106 . 13 1 1 A 87 87 ASP C C 147 174.700 175.133 -0.433 1
1 1107 . 13 1 1 A 87 87 ASP CA C 147 53.700 52.945 0.755 1
1 1108 . 13 1 1 A 87 87 ASP CB C 147 41.800 41.618 0.182 1
1 1109 . 13 1 1 A 87 87 ASP N N 147 119.400 127.757 -8.357 1
1 1110 . 13 1 1 A 88 88 PHE H H 148 7.230 7.642 -0.412 1
1 1111 . 13 1 1 A 88 88 PHE HA H 148 4.690 4.831 -0.141 1
1 1119 . 13 1 1 A 88 88 PHE C C 148 171.500 172.801 -1.301 1
1 1120 . 13 1 1 A 88 88 PHE CA C 148 56.400 57.019 -0.619 1
1 1121 . 13 1 1 A 88 88 PHE CB C 148 42.000 42.553 -0.553 1
1 1127 . 13 1 1 A 88 88 PHE N N 148 119.700 120.556 -0.856 1
1 1128 . 13 1 1 A 89 89 ASN H H 149 8.060 8.263 -0.203 1
1 1129 . 13 1 1 A 89 89 ASN HA H 149 4.490 4.946 -0.456 1
1 1134 . 13 1 1 A 89 89 ASN CA C 149 48.100 49.016 -0.916 1
1 1135 . 13 1 1 A 89 89 ASN CB C 149 39.200 39.624 -0.424 1
1 1137 . 13 1 1 A 89 89 ASN N N 149 119.700 125.133 -5.433 1
1 1139 . 13 1 1 A 90 90 PRO HA H 150 3.970 3.909 0.061 1
1 1146 . 13 1 1 A 90 90 PRO C C 150 177.700 177.634 0.066 1
1 1147 . 13 1 1 A 90 90 PRO CA C 150 63.900 64.333 -0.433 1
1 1148 . 13 1 1 A 90 90 PRO CB C 150 31.700 31.517 0.183 1
1 1151 . 13 1 1 A 91 91 ALA H H 151 7.240 7.288 -0.048 1
1 1152 . 13 1 1 A 91 91 ALA HA H 151 3.900 4.122 -0.222 1
1 1156 . 13 1 1 A 91 91 ALA C C 151 178.000 179.534 -1.534 1
1 1157 . 13 1 1 A 91 91 ALA CA C 151 53.900 54.121 -0.221 1
1 1158 . 13 1 1 A 91 91 ALA CB C 151 17.700 18.531 -0.831 1
1 1159 . 13 1 1 A 91 91 ALA N N 151 115.700 118.976 -3.276 1
1 1160 . 13 1 1 A 92 92 ASP H H 152 7.080 7.776 -0.696 1
1 1161 . 13 1 1 A 92 92 ASP HA H 152 4.220 4.320 -0.100 1
1 1164 . 13 1 1 A 92 92 ASP C C 152 176.200 176.910 -0.710 1
1 1165 . 13 1 1 A 92 92 ASP CA C 152 55.800 56.180 -0.380 1
1 1166 . 13 1 1 A 92 92 ASP CB C 152 39.500 40.605 -1.105 1
1 1167 . 13 1 1 A 92 92 ASP N N 152 117.100 119.471 -2.371 1
1 1168 . 13 1 1 A 93 93 TYR H H 153 7.060 7.549 -0.489 1
1 1169 . 13 1 1 A 93 93 TYR HA H 153 4.490 4.554 -0.064 1
1 1176 . 13 1 1 A 93 93 TYR C C 153 174.700 175.480 -0.780 1
1 1177 . 13 1 1 A 93 93 TYR CA C 153 57.600 58.230 -0.630 1
1 1178 . 13 1 1 A 93 93 TYR CB C 153 38.500 38.583 -0.083 1
1 1183 . 13 1 1 A 93 93 TYR N N 153 116.800 116.909 -0.109 1
1 1184 . 13 1 1 A 94 94 VAL H H 154 7.000 7.106 -0.106 1
1 1185 . 13 1 1 A 94 94 VAL HA H 154 4.040 4.122 -0.082 1
1 1193 . 13 1 1 A 94 94 VAL C C 154 174.700 175.114 -0.414 1
1 1194 . 13 1 1 A 94 94 VAL CA C 154 62.100 62.501 -0.401 1
1 1195 . 13 1 1 A 94 94 VAL CB C 154 32.700 32.305 0.395 1
1 1198 . 13 1 1 A 94 94 VAL N N 154 120.600 120.894 -0.294 1
1 1199 . 13 1 1 A 95 95 ARG H H 155 9.430 8.784 0.646 1
1 1200 . 13 1 1 A 95 95 ARG HA H 155 4.640 4.617 0.023 1
1 1207 . 13 1 1 A 95 95 ARG C C 155 175.400 175.735 -0.335 1
1 1208 . 13 1 1 A 95 95 ARG CA C 155 54.200 56.174 -1.974 1
1 1209 . 13 1 1 A 95 95 ARG CB C 155 32.400 31.094 1.306 1
1 1212 . 13 1 1 A 95 95 ARG N N 155 128.200 127.542 0.658 1
1 1213 . 13 1 1 A 96 96 ILE H H 156 8.700 8.580 0.120 1
1 1214 . 13 1 1 A 96 96 ILE HA H 156 4.440 4.564 -0.124 1
1 1224 . 13 1 1 A 96 96 ILE CA C 156 56.500 57.581 -1.081 1
1 1225 . 13 1 1 A 96 96 ILE CB C 156 36.700 38.393 -1.693 1
1 1229 . 13 1 1 A 96 96 ILE N N 156 124.100 126.570 -2.470 1
1 1230 . 13 1 1 A 97 97 PRO HA H 157 4.370 4.596 -0.226 1
1 1237 . 13 1 1 A 97 97 PRO C C 157 176.000 177.252 -1.252 1
1 1238 . 13 1 1 A 97 97 PRO CA C 157 63.200 63.271 -0.071 1
1 1239 . 13 1 1 A 97 97 PRO CB C 157 32.400 31.954 0.446 1
1 1242 . 13 1 1 A 98 98 LYS H H 158 8.380 8.731 -0.351 1
1 1243 . 13 1 1 A 98 98 LYS HA H 158 4.190 4.395 -0.205 1
1 1252 . 13 1 1 A 98 98 LYS C C 158 176.800 176.382 0.418 1
1 1253 . 13 1 1 A 98 98 LYS CA C 158 57.100 56.259 0.841 1
1 1254 . 13 1 1 A 98 98 LYS CB C 158 32.800 32.587 0.213 1
1 1258 . 13 1 1 A 98 98 LYS N N 158 120.800 119.945 0.855 1
1 1259 . 13 1 1 A 99 99 ILE H H 159 7.930 7.323 0.607 1
1 1260 . 13 1 1 A 99 99 ILE HA H 159 4.200 4.070 0.130 1
1 1270 . 13 1 1 A 99 99 ILE C C 159 175.400 175.052 0.348 1
1 1271 . 13 1 1 A 99 99 ILE CA C 159 60.600 60.628 -0.028 1
1 1272 . 13 1 1 A 99 99 ILE CB C 159 39.100 37.448 1.652 1
1 1276 . 13 1 1 A 99 99 ILE N N 159 120.200 121.301 -1.101 1
1 1277 . 13 1 1 A 100 100 ALA H H 160 8.370 8.645 -0.275 1
1 1278 . 13 1 1 A 100 100 ALA HA H 160 4.370 4.860 -0.490 1
1 1282 . 13 1 1 A 100 100 ALA C C 160 177.200 177.730 -0.530 1
1 1283 . 13 1 1 A 100 100 ALA CA C 160 52.200 50.542 1.658 1
1 1284 . 13 1 1 A 100 100 ALA CB C 160 19.400 20.909 -1.509 1
1 1285 . 13 1 1 A 100 100 ALA N N 160 128.300 130.994 -2.694 1
1 1286 . 13 1 1 A 101 101 LEU H H 161 8.250 8.985 -0.735 1
1 1287 . 13 1 1 A 101 101 LEU HA H 161 4.280 4.469 -0.189 1
1 1297 . 13 1 1 A 101 101 LEU C C 161 177.200 176.462 0.738 1
1 1298 . 13 1 1 A 101 101 LEU CA C 161 55.200 54.450 0.750 1
1 1299 . 13 1 1 A 101 101 LEU CB C 161 42.400 42.016 0.384 1
1 1303 . 13 1 1 A 101 101 LEU N N 161 121.900 122.107 -0.207 1
1 1304 . 13 1 1 A 102 102 GLU H H 162 8.390 8.120 0.270 1
1 1305 . 13 1 1 A 102 102 GLU HA H 162 4.230 4.428 -0.198 1
1 1310 . 13 1 1 A 102 102 GLU C C 162 176.100 176.138 -0.038 1
1 1311 . 13 1 1 A 102 102 GLU CA C 162 56.400 57.132 -0.732 1
1 1312 . 13 1 1 A 102 102 GLU CB C 162 30.500 29.426 1.074 1
1 1314 . 13 1 1 A 102 102 GLU N N 162 121.300 119.430 1.870 1
1 1315 . 13 1 1 A 103 103 HIS H H 163 8.330 8.731 -0.401 1
1 1316 . 13 1 1 A 103 103 HIS HA H 163 4.590 4.788 -0.198 1
1 1319 . 13 1 1 A 103 103 HIS C C 163 176.100 175.584 0.516 1
1 1320 . 13 1 1 A 103 103 HIS CA C 163 56.000 54.530 1.470 1
1 1321 . 13 1 1 A 103 103 HIS CB C 163 30.500 27.408 3.092 1
1 1322 . 13 1 1 A 103 103 HIS N N 163 120.000 120.722 -0.722 1
1 1323 . 13 1 1 A 107 107 HIS HA H 167 4.620 4.691 -0.071 1
1 1326 . 13 1 1 A 107 107 HIS C C 167 173.900 174.917 -1.017 1
1 1327 . 13 1 1 A 107 107 HIS CA C 167 56.000 55.487 0.513 1
1 1328 . 13 1 1 A 107 107 HIS CB C 167 30.300 29.938 0.362 1
1 15 . 14 1 1 A 2 2 ASP H H 62 8.760 8.101 0.659 1
1 16 . 14 1 1 A 2 2 ASP HA H 62 4.810 4.815 -0.005 1
1 19 . 14 1 1 A 2 2 ASP C C 62 175.800 175.383 0.417 1
1 20 . 14 1 1 A 2 2 ASP CA C 62 54.800 53.578 1.222 1
1 21 . 14 1 1 A 2 2 ASP CB C 62 41.600 42.289 -0.689 1
1 22 . 14 1 1 A 2 2 ASP N N 62 120.900 117.582 3.318 1
1 23 . 14 1 1 A 3 3 SER H H 63 8.710 7.626 1.084 1
1 24 . 14 1 1 A 3 3 SER HA H 63 4.970 4.508 0.462 1
1 27 . 14 1 1 A 3 3 SER C C 63 175.600 175.148 0.452 1
1 28 . 14 1 1 A 3 3 SER CA C 63 57.500 57.252 0.248 1
1 29 . 14 1 1 A 3 3 SER CB C 63 65.900 65.335 0.565 1
1 30 . 14 1 1 A 3 3 SER N N 63 116.300 113.600 2.700 1
1 31 . 14 1 1 A 4 4 PHE H H 64 9.370 9.531 -0.161 1
1 32 . 14 1 1 A 4 4 PHE HA H 64 4.010 4.160 -0.150 1
1 39 . 14 1 1 A 4 4 PHE C C 64 176.700 177.347 -0.647 1
1 40 . 14 1 1 A 4 4 PHE CA C 64 62.200 61.597 0.603 1
1 41 . 14 1 1 A 4 4 PHE CB C 64 38.500 39.337 -0.837 1
1 46 . 14 1 1 A 4 4 PHE N N 64 121.400 122.154 -0.754 1
1 47 . 14 1 1 A 5 5 GLY H H 65 8.930 8.034 0.896 1
1 48 . 14 1 1 A 5 5 GLY HA2 H 65 2.020 2.634 -0.614 1
1 49 . 14 1 1 A 5 5 GLY HA3 H 65 3.250 2.826 0.424 1
1 50 . 14 1 1 A 5 5 GLY C C 65 175.200 175.639 -0.439 1
1 51 . 14 1 1 A 5 5 GLY CA C 65 46.300 46.440 -0.140 1
1 52 . 14 1 1 A 5 5 GLY N N 65 106.500 105.155 1.345 1
1 53 . 14 1 1 A 6 6 ASP H H 66 7.630 7.432 0.198 1
1 54 . 14 1 1 A 6 6 ASP HA H 66 4.100 4.139 -0.039 1
1 57 . 14 1 1 A 6 6 ASP C C 66 179.500 178.454 1.046 1
1 58 . 14 1 1 A 6 6 ASP CA C 66 57.400 56.730 0.670 1
1 59 . 14 1 1 A 6 6 ASP CB C 66 40.500 40.639 -0.139 1
1 60 . 14 1 1 A 6 6 ASP N N 66 120.500 121.679 -1.179 1
1 61 . 14 1 1 A 7 7 TRP H H 67 7.190 7.654 -0.464 1
1 62 . 14 1 1 A 7 7 TRP HA H 67 3.860 4.217 -0.357 1
1 71 . 14 1 1 A 7 7 TRP C C 67 177.200 178.244 -1.044 1
1 72 . 14 1 1 A 7 7 TRP CA C 67 61.100 59.975 1.125 1
1 73 . 14 1 1 A 7 7 TRP CB C 67 28.300 29.069 -0.769 1
1 79 . 14 1 1 A 7 7 TRP N N 67 120.700 120.450 0.250 1
1 81 . 14 1 1 A 8 8 ALA H H 68 9.040 8.531 0.509 1
1 82 . 14 1 1 A 8 8 ALA HA H 68 3.730 3.794 -0.064 1
1 86 . 14 1 1 A 8 8 ALA C C 68 179.500 179.436 0.064 1
1 87 . 14 1 1 A 8 8 ALA CA C 68 55.200 55.170 0.030 1
1 88 . 14 1 1 A 8 8 ALA CB C 68 18.600 17.952 0.648 1
1 89 . 14 1 1 A 8 8 ALA N N 68 125.700 122.351 3.349 1
1 90 . 14 1 1 A 9 9 GLU H H 69 8.060 7.836 0.224 1
1 91 . 14 1 1 A 9 9 GLU HA H 69 4.020 4.080 -0.060 1
1 96 . 14 1 1 A 9 9 GLU C C 69 180.400 178.586 1.814 1
1 97 . 14 1 1 A 9 9 GLU CA C 69 58.800 59.349 -0.549 1
1 98 . 14 1 1 A 9 9 GLU CB C 69 28.500 29.337 -0.837 1
1 99 . 14 1 1 A 9 9 GLU N N 69 115.400 118.478 -3.078 1
1 100 . 14 1 1 A 10 10 LYS H H 70 7.740 8.021 -0.281 1
1 101 . 14 1 1 A 10 10 LYS HA H 70 3.910 4.036 -0.126 1
1 110 . 14 1 1 A 10 10 LYS C C 70 179.500 178.727 0.773 1
1 111 . 14 1 1 A 10 10 LYS CA C 70 60.000 59.160 0.840 1
1 112 . 14 1 1 A 10 10 LYS CB C 70 32.400 32.271 0.129 1
1 116 . 14 1 1 A 10 10 LYS N N 70 122.700 119.646 3.054 1
1 117 . 14 1 1 A 11 11 PHE H H 71 8.750 8.372 0.378 1
1 118 . 14 1 1 A 11 11 PHE HA H 71 4.080 4.182 -0.102 1
1 126 . 14 1 1 A 11 11 PHE C C 71 177.100 177.129 -0.029 1
1 127 . 14 1 1 A 11 11 PHE CA C 71 61.200 61.258 -0.058 1
1 128 . 14 1 1 A 11 11 PHE CB C 71 38.900 39.318 -0.418 1
1 134 . 14 1 1 A 11 11 PHE N N 71 123.500 120.496 3.004 1
1 135 . 14 1 1 A 12 12 LEU H H 72 8.400 8.952 -0.552 1
1 136 . 14 1 1 A 12 12 LEU HA H 72 3.520 3.616 -0.096 1
1 146 . 14 1 1 A 12 12 LEU C C 72 180.000 179.317 0.683 1
1 147 . 14 1 1 A 12 12 LEU CA C 72 58.200 58.096 0.104 1
1 148 . 14 1 1 A 12 12 LEU CB C 72 41.700 41.492 0.208 1
1 152 . 14 1 1 A 12 12 LEU N N 72 121.100 119.310 1.790 1
1 153 . 14 1 1 A 13 13 LYS H H 73 7.810 8.241 -0.431 1
1 154 . 14 1 1 A 13 13 LYS HA H 73 4.080 4.012 0.068 1
1 156 . 14 1 1 A 13 13 LYS C C 73 179.300 179.091 0.209 1
1 157 . 14 1 1 A 13 13 LYS CA C 73 59.000 58.559 0.441 1
1 158 . 14 1 1 A 13 13 LYS CB C 73 31.900 31.858 0.042 1
1 159 . 14 1 1 A 13 13 LYS N N 73 119.400 120.723 -1.323 1
1 160 . 14 1 1 A 14 14 SER H H 74 8.210 7.922 0.288 1
1 161 . 14 1 1 A 14 14 SER HA H 74 4.210 4.128 0.082 1
1 164 . 14 1 1 A 14 14 SER C C 74 176.300 176.855 -0.555 1
1 165 . 14 1 1 A 14 14 SER CA C 74 61.400 61.965 -0.565 1
1 166 . 14 1 1 A 14 14 SER CB C 74 62.600 62.782 -0.182 1
1 167 . 14 1 1 A 14 14 SER N N 74 117.600 117.332 0.268 1
1 168 . 14 1 1 A 15 15 LYS H H 75 7.760 7.351 0.409 1
1 169 . 14 1 1 A 15 15 LYS HA H 75 4.040 3.846 0.194 1
1 178 . 14 1 1 A 15 15 LYS C C 75 178.500 178.691 -0.191 1
1 179 . 14 1 1 A 15 15 LYS CA C 75 56.500 59.349 -2.849 1
1 180 . 14 1 1 A 15 15 LYS CB C 75 30.600 31.764 -1.164 1
1 184 . 14 1 1 A 15 15 LYS N N 75 120.100 121.653 -1.553 1
1 185 . 14 1 1 A 16 16 GLU H H 76 7.680 8.332 -0.652 1
1 186 . 14 1 1 A 16 16 GLU HA H 76 4.030 4.024 0.006 1
1 191 . 14 1 1 A 16 16 GLU C C 76 179.900 178.534 1.366 1
1 192 . 14 1 1 A 16 16 GLU CA C 76 59.200 59.620 -0.420 1
1 193 . 14 1 1 A 16 16 GLU CB C 76 29.600 29.302 0.298 1
1 195 . 14 1 1 A 16 16 GLU N N 76 119.700 119.552 0.148 1
1 196 . 14 1 1 A 17 17 ALA H H 77 8.030 7.643 0.387 1
1 197 . 14 1 1 A 17 17 ALA HA H 77 4.200 4.122 0.078 1
1 201 . 14 1 1 A 17 17 ALA C C 77 178.900 179.731 -0.831 1
1 202 . 14 1 1 A 17 17 ALA CA C 77 54.400 53.474 0.926 1
1 203 . 14 1 1 A 17 17 ALA CB C 77 18.100 18.817 -0.717 1
1 204 . 14 1 1 A 17 17 ALA N N 77 123.000 120.940 2.060 1
1 205 . 14 1 1 A 18 18 ASP H H 78 7.860 7.737 0.123 1
1 206 . 14 1 1 A 18 18 ASP HA H 78 4.600 4.557 0.043 1
1 209 . 14 1 1 A 18 18 ASP C C 78 177.500 176.267 1.233 1
1 210 . 14 1 1 A 18 18 ASP CA C 78 55.100 54.607 0.493 1
1 211 . 14 1 1 A 18 18 ASP CB C 78 41.400 41.179 0.221 1
1 212 . 14 1 1 A 18 18 ASP N N 78 117.700 117.175 0.525 1
1 213 . 14 1 1 A 19 19 GLY H H 79 7.910 7.604 0.306 1
1 214 . 14 1 1 A 19 19 GLY HA2 H 79 3.860 4.016 -0.156 1
1 215 . 14 1 1 A 19 19 GLY HA3 H 79 4.080 4.017 0.063 1
1 216 . 14 1 1 A 19 19 GLY C C 79 175.300 174.764 0.536 1
1 217 . 14 1 1 A 19 19 GLY CA C 79 46.200 45.423 0.777 1
1 218 . 14 1 1 A 19 19 GLY N N 79 107.100 107.254 -0.154 1
1 219 . 14 1 1 A 20 20 VAL H H 80 7.150 7.264 -0.114 1
1 220 . 14 1 1 A 20 20 VAL HA H 80 4.250 4.285 -0.035 1
1 228 . 14 1 1 A 20 20 VAL C C 80 175.100 175.654 -0.554 1
1 229 . 14 1 1 A 20 20 VAL CA C 80 61.800 61.097 0.703 1
1 230 . 14 1 1 A 20 20 VAL CB C 80 32.200 32.871 -0.671 1
1 233 . 14 1 1 A 20 20 VAL N N 80 114.600 118.153 -3.553 1
1 234 . 14 1 1 A 21 21 SER H H 81 8.560 8.741 -0.181 1
1 235 . 14 1 1 A 21 21 SER HA H 81 4.390 4.507 -0.117 1
1 238 . 14 1 1 A 21 21 SER C C 81 174.600 175.741 -1.141 1
1 239 . 14 1 1 A 21 21 SER CA C 81 57.900 58.768 -0.868 1
1 240 . 14 1 1 A 21 21 SER CB C 81 64.700 64.220 0.480 1
1 241 . 14 1 1 A 21 21 SER N N 81 118.700 119.705 -1.005 1
1 242 . 14 1 1 A 22 22 VAL H H 82 8.690 8.765 -0.075 1
1 243 . 14 1 1 A 22 22 VAL HA H 82 3.700 3.670 0.030 1
1 251 . 14 1 1 A 22 22 VAL C C 82 178.000 177.447 0.553 1
1 252 . 14 1 1 A 22 22 VAL CA C 82 66.500 66.642 -0.142 1
1 253 . 14 1 1 A 22 22 VAL CB C 82 31.700 31.416 0.284 1
1 256 . 14 1 1 A 22 22 VAL N N 82 122.100 124.396 -2.296 1
1 257 . 14 1 1 A 23 23 SER H H 83 8.300 8.085 0.215 1
1 258 . 14 1 1 A 23 23 SER HA H 83 4.210 4.034 0.176 1
1 261 . 14 1 1 A 23 23 SER C C 83 177.600 176.590 1.010 1
1 262 . 14 1 1 A 23 23 SER CA C 83 61.400 62.163 -0.763 1
1 263 . 14 1 1 A 23 23 SER CB C 83 62.400 62.753 -0.353 1
1 264 . 14 1 1 A 23 23 SER N N 83 113.600 116.327 -2.727 1
1 265 . 14 1 1 A 24 24 GLN H H 84 7.820 7.621 0.199 1
1 266 . 14 1 1 A 24 24 GLN HA H 84 3.970 3.800 0.170 1
1 273 . 14 1 1 A 24 24 GLN C C 84 178.400 178.231 0.169 1
1 274 . 14 1 1 A 24 24 GLN CA C 84 58.400 58.761 -0.361 1
1 275 . 14 1 1 A 24 24 GLN CB C 84 28.900 28.428 0.472 1
1 278 . 14 1 1 A 24 24 GLN N N 84 122.900 121.291 1.609 1
1 280 . 14 1 1 A 25 25 LEU H H 85 8.920 7.944 0.976 1
1 281 . 14 1 1 A 25 25 LEU HA H 85 4.130 4.357 -0.227 1
1 291 . 14 1 1 A 25 25 LEU C C 85 178.800 178.550 0.250 1
1 292 . 14 1 1 A 25 25 LEU CA C 85 58.300 57.847 0.453 1
1 293 . 14 1 1 A 25 25 LEU CB C 85 41.200 41.511 -0.311 1
1 297 . 14 1 1 A 25 25 LEU N N 85 122.200 121.892 0.308 1
1 298 . 14 1 1 A 26 26 ASN H H 86 8.860 8.565 0.295 1
1 299 . 14 1 1 A 26 26 ASN HA H 86 4.420 4.433 -0.013 1
1 304 . 14 1 1 A 26 26 ASN C C 86 179.000 177.751 1.249 1
1 305 . 14 1 1 A 26 26 ASN CA C 86 55.900 56.990 -1.090 1
1 306 . 14 1 1 A 26 26 ASN CB C 86 37.200 39.009 -1.809 1
1 308 . 14 1 1 A 26 26 ASN N N 86 117.600 118.246 -0.646 1
1 310 . 14 1 1 A 27 27 SER H H 87 7.840 8.192 -0.352 1
1 311 . 14 1 1 A 27 27 SER HA H 87 4.100 4.370 -0.270 1
1 314 . 14 1 1 A 27 27 SER C C 87 179.000 176.396 2.604 1
1 315 . 14 1 1 A 27 27 SER CA C 87 62.100 61.875 0.225 1
1 316 . 14 1 1 A 27 27 SER CB C 87 62.100 63.298 -1.198 1
1 317 . 14 1 1 A 27 27 SER N N 87 118.500 116.337 2.163 1
1 318 . 14 1 1 A 28 28 TYR H H 88 8.180 8.368 -0.188 1
1 319 . 14 1 1 A 28 28 TYR HA H 88 4.600 4.299 0.301 1
1 326 . 14 1 1 A 28 28 TYR C C 88 174.800 178.301 -3.501 1
1 327 . 14 1 1 A 28 28 TYR CA C 88 61.200 61.733 -0.533 1
1 328 . 14 1 1 A 28 28 TYR CB C 88 37.800 38.148 -0.348 1
1 333 . 14 1 1 A 28 28 TYR N N 88 119.300 120.134 -0.834 1
1 334 . 14 1 1 A 29 29 LYS H H 89 9.040 8.155 0.885 1
1 335 . 14 1 1 A 29 29 LYS HA H 89 3.890 4.182 -0.292 1
1 344 . 14 1 1 A 29 29 LYS C C 89 179.000 178.380 0.620 1
1 345 . 14 1 1 A 29 29 LYS CA C 89 61.300 59.621 1.679 1
1 346 . 14 1 1 A 29 29 LYS CB C 89 32.800 31.867 0.933 1
1 350 . 14 1 1 A 29 29 LYS N N 89 119.300 121.145 -1.845 1
1 351 . 14 1 1 A 30 30 ASN H H 90 7.770 8.451 -0.681 1
1 352 . 14 1 1 A 30 30 ASN HA H 90 4.560 4.543 0.017 1
1 357 . 14 1 1 A 30 30 ASN C C 90 178.300 177.716 0.584 1
1 358 . 14 1 1 A 30 30 ASN CA C 90 56.200 56.446 -0.246 1
1 359 . 14 1 1 A 30 30 ASN CB C 90 38.900 38.931 -0.031 1
1 361 . 14 1 1 A 30 30 ASN N N 90 117.800 117.811 -0.011 1
1 363 . 14 1 1 A 31 31 TYR H H 91 8.860 8.858 0.002 1
1 364 . 14 1 1 A 31 31 TYR HA H 91 4.910 4.590 0.320 1
1 371 . 14 1 1 A 31 31 TYR C C 91 178.300 178.459 -0.159 1
1 372 . 14 1 1 A 31 31 TYR CA C 91 59.700 60.691 -0.991 1
1 373 . 14 1 1 A 31 31 TYR CB C 91 37.500 37.561 -0.061 1
1 378 . 14 1 1 A 31 31 TYR N N 91 119.400 118.301 1.099 1
1 379 . 14 1 1 A 32 32 CYS H H 92 8.640 8.136 0.504 1
1 380 . 14 1 1 A 32 32 CYS HA H 92 4.410 4.329 0.081 1
1 383 . 14 1 1 A 32 32 CYS C C 92 173.700 177.294 -3.594 1
1 384 . 14 1 1 A 32 32 CYS CA C 92 65.500 63.205 2.295 1
1 385 . 14 1 1 A 32 32 CYS CB C 92 28.300 26.490 1.810 1
1 386 . 14 1 1 A 32 32 CYS N N 92 113.500 121.164 -7.664 1
1 387 . 14 1 1 A 33 33 ARG H H 93 8.440 8.282 0.158 1
1 388 . 14 1 1 A 33 33 ARG HA H 93 3.740 4.037 -0.297 1
1 391 . 14 1 1 A 33 33 ARG C C 93 177.200 178.624 -1.424 1
1 392 . 14 1 1 A 33 33 ARG CA C 93 58.300 58.920 -0.620 1
1 393 . 14 1 1 A 33 33 ARG CB C 93 30.200 29.894 0.306 1
1 394 . 14 1 1 A 33 33 ARG N N 93 111.400 121.434 -10.034 1
1 395 . 14 1 1 A 34 34 ASN H H 94 8.020 8.157 -0.137 1
1 396 . 14 1 1 A 34 34 ASN HA H 94 4.980 4.464 0.516 1
1 401 . 14 1 1 A 34 34 ASN C C 94 176.700 177.137 -0.437 1
1 402 . 14 1 1 A 34 34 ASN CA C 94 53.400 55.448 -2.048 1
1 403 . 14 1 1 A 34 34 ASN CB C 94 38.000 38.764 -0.764 1
1 405 . 14 1 1 A 34 34 ASN N N 94 113.600 117.373 -3.773 1
1 407 . 14 1 1 A 35 35 HIS H H 95 7.200 7.898 -0.698 1
1 408 . 14 1 1 A 35 35 HIS HA H 95 4.470 4.458 0.012 1
1 411 . 14 1 1 A 35 35 HIS C C 95 176.600 176.149 0.451 1
1 412 . 14 1 1 A 35 35 HIS CA C 95 60.000 59.657 0.343 1
1 413 . 14 1 1 A 35 35 HIS CB C 95 30.500 31.108 -0.608 1
1 414 . 14 1 1 A 35 35 HIS N N 95 115.600 117.499 -1.899 1
1 415 . 14 1 1 A 36 36 LEU H H 96 8.170 7.736 0.434 1
1 416 . 14 1 1 A 36 36 LEU HA H 96 4.730 4.436 0.294 1
1 426 . 14 1 1 A 36 36 LEU C C 96 176.800 177.557 -0.757 1
1 427 . 14 1 1 A 36 36 LEU CA C 96 54.400 54.689 -0.289 1
1 428 . 14 1 1 A 36 36 LEU CB C 96 40.600 41.597 -0.997 1
1 432 . 14 1 1 A 36 36 LEU N N 96 114.000 119.476 -5.476 1
1 433 . 14 1 1 A 37 37 SER H H 97 7.140 8.334 -1.194 1
1 434 . 14 1 1 A 37 37 SER HA H 97 4.730 4.284 0.446 1
1 437 . 14 1 1 A 37 37 SER CA C 97 62.700 62.646 0.054 1
1 438 . 14 1 1 A 37 37 SER CB C 97 62.600 61.706 0.894 1
1 439 . 14 1 1 A 37 37 SER N N 97 117.200 116.084 1.116 1
1 440 . 14 1 1 A 38 38 PRO HA H 98 4.560 4.398 0.162 1
1 447 . 14 1 1 A 38 38 PRO C C 98 177.900 179.176 -1.276 1
1 448 . 14 1 1 A 38 38 PRO CA C 98 65.700 65.644 0.056 1
1 449 . 14 1 1 A 38 38 PRO CB C 98 31.800 30.735 1.065 1
1 452 . 14 1 1 A 39 39 LEU H H 99 8.090 7.463 0.627 1
1 453 . 14 1 1 A 39 39 LEU HA H 99 4.260 3.982 0.278 1
1 463 . 14 1 1 A 39 39 LEU C C 99 178.700 178.623 0.077 1
1 464 . 14 1 1 A 39 39 LEU CA C 99 54.300 57.371 -3.071 1
1 465 . 14 1 1 A 39 39 LEU CB C 99 42.400 41.353 1.047 1
1 469 . 14 1 1 A 39 39 LEU N N 99 112.400 117.673 -5.273 1
1 470 . 14 1 1 A 40 40 TYR H H 100 8.350 8.853 -0.503 1
1 471 . 14 1 1 A 40 40 TYR HA H 100 4.170 4.383 -0.213 1
1 478 . 14 1 1 A 40 40 TYR C C 100 178.300 176.941 1.359 1
1 479 . 14 1 1 A 40 40 TYR CA C 100 63.400 62.151 1.249 1
1 480 . 14 1 1 A 40 40 TYR CB C 100 38.600 39.096 -0.496 1
1 485 . 14 1 1 A 40 40 TYR N N 100 119.400 121.262 -1.862 1
1 486 . 14 1 1 A 41 41 MET H H 101 8.640 7.709 0.931 1
1 487 . 14 1 1 A 41 41 MET HA H 101 4.260 4.745 -0.485 1
1 488 . 14 1 1 A 41 41 MET C C 101 177.000 175.232 1.768 1
1 489 . 14 1 1 A 41 41 MET CA C 101 54.600 54.587 0.013 1
1 490 . 14 1 1 A 41 41 MET N N 101 111.800 116.003 -4.203 1
1 491 . 14 1 1 A 42 42 LYS H H 102 7.880 7.969 -0.089 1
1 492 . 14 1 1 A 42 42 LYS HA H 102 4.430 4.900 -0.470 1
1 501 . 14 1 1 A 42 42 LYS C C 102 176.300 176.044 0.256 1
1 502 . 14 1 1 A 42 42 LYS CA C 102 56.000 54.442 1.558 1
1 503 . 14 1 1 A 42 42 LYS CB C 102 33.400 34.610 -1.210 1
1 507 . 14 1 1 A 42 42 LYS N N 102 121.700 119.454 2.246 1
1 508 . 14 1 1 A 43 43 SER H H 103 9.160 8.875 0.285 1
1 509 . 14 1 1 A 43 43 SER HA H 103 4.620 4.611 0.009 1
1 513 . 14 1 1 A 43 43 SER C C 103 176.300 175.579 0.721 1
1 514 . 14 1 1 A 43 43 SER CA C 103 58.700 58.484 0.216 1
1 515 . 14 1 1 A 43 43 SER CB C 103 63.700 63.754 -0.054 1
1 516 . 14 1 1 A 43 43 SER N N 103 118.800 117.221 1.579 1
1 517 . 14 1 1 A 44 44 LEU H H 104 8.860 8.815 0.045 1
1 518 . 14 1 1 A 44 44 LEU HA H 104 4.130 4.313 -0.183 1
1 528 . 14 1 1 A 44 44 LEU C C 104 178.700 178.031 0.669 1
1 529 . 14 1 1 A 44 44 LEU CA C 104 58.800 58.391 0.409 1
1 530 . 14 1 1 A 44 44 LEU CB C 104 42.600 41.708 0.892 1
1 534 . 14 1 1 A 44 44 LEU N N 104 124.200 130.136 -5.936 1
1 535 . 14 1 1 A 45 45 SER H H 105 8.330 8.215 0.115 1
1 536 . 14 1 1 A 45 45 SER HA H 105 4.310 4.287 0.023 1
1 539 . 14 1 1 A 45 45 SER C C 105 175.000 175.554 -0.554 1
1 540 . 14 1 1 A 45 45 SER CA C 105 60.100 60.846 -0.746 1
1 541 . 14 1 1 A 45 45 SER CB C 105 63.400 63.235 0.165 1
1 542 . 14 1 1 A 45 45 SER N N 105 107.700 114.082 -6.382 1
1 543 . 14 1 1 A 46 46 GLU H H 106 7.800 8.333 -0.533 1
1 544 . 14 1 1 A 46 46 GLU HA H 106 4.570 4.369 0.201 1
1 549 . 14 1 1 A 46 46 GLU C C 106 174.100 176.237 -2.137 1
1 550 . 14 1 1 A 46 46 GLU CA C 106 55.600 56.089 -0.489 1
1 551 . 14 1 1 A 46 46 GLU CB C 106 31.200 29.093 2.107 1
1 553 . 14 1 1 A 46 46 GLU N N 106 119.600 115.682 3.918 1
1 554 . 14 1 1 A 47 47 ILE H H 107 7.100 7.484 -0.384 1
1 555 . 14 1 1 A 47 47 ILE HA H 107 4.040 4.097 -0.057 1
1 565 . 14 1 1 A 47 47 ILE C C 107 174.100 174.992 -0.892 1
1 566 . 14 1 1 A 47 47 ILE CA C 107 62.300 60.890 1.410 1
1 567 . 14 1 1 A 47 47 ILE CB C 107 38.500 37.919 0.581 1
1 571 . 14 1 1 A 47 47 ILE N N 107 120.600 122.912 -2.312 1
1 572 . 14 1 1 A 48 48 LEU H H 108 9.180 8.900 0.280 1
1 573 . 14 1 1 A 48 48 LEU HA H 108 4.940 4.640 0.300 1
1 583 . 14 1 1 A 48 48 LEU CA C 108 51.900 52.333 -0.433 1
1 584 . 14 1 1 A 48 48 LEU CB C 108 42.000 42.216 -0.216 1
1 588 . 14 1 1 A 48 48 LEU N N 108 129.400 128.705 0.695 1
1 589 . 14 1 1 A 49 49 PRO HA H 109 3.910 4.212 -0.302 1
1 596 . 14 1 1 A 49 49 PRO C C 109 178.500 178.160 0.340 1
1 597 . 14 1 1 A 49 49 PRO CA C 109 66.600 64.857 1.743 1
1 598 . 14 1 1 A 49 49 PRO CB C 109 31.300 31.705 -0.405 1
1 601 . 14 1 1 A 50 50 ALA H H 110 8.280 8.225 0.055 1
1 602 . 14 1 1 A 50 50 ALA HA H 110 4.110 4.022 0.088 1
1 606 . 14 1 1 A 50 50 ALA C C 110 179.700 180.187 -0.487 1
1 607 . 14 1 1 A 50 50 ALA CA C 110 55.100 55.355 -0.255 1
1 608 . 14 1 1 A 50 50 ALA CB C 110 19.200 18.326 0.874 1
1 609 . 14 1 1 A 50 50 ALA N N 110 116.100 118.889 -2.789 1
1 610 . 14 1 1 A 51 51 ASP H H 111 7.790 8.135 -0.345 1
1 611 . 14 1 1 A 51 51 ASP HA H 111 4.440 4.235 0.205 1
1 614 . 14 1 1 A 51 51 ASP C C 111 178.200 179.146 -0.946 1
1 615 . 14 1 1 A 51 51 ASP CA C 111 57.600 57.433 0.167 1
1 616 . 14 1 1 A 51 51 ASP CB C 111 41.800 40.545 1.255 1
1 617 . 14 1 1 A 51 51 ASP N N 111 116.500 118.962 -2.462 1
1 618 . 14 1 1 A 52 52 ILE H H 112 7.020 7.474 -0.454 1
1 619 . 14 1 1 A 52 52 ILE HA H 112 3.750 3.658 0.092 1
1 629 . 14 1 1 A 52 52 ILE C C 112 177.300 177.848 -0.548 1
1 630 . 14 1 1 A 52 52 ILE CA C 112 63.500 65.136 -1.636 1
1 631 . 14 1 1 A 52 52 ILE CB C 112 37.500 37.159 0.341 1
1 635 . 14 1 1 A 52 52 ILE N N 112 116.700 119.865 -3.165 1
1 636 . 14 1 1 A 53 53 GLN H H 113 9.150 8.271 0.879 1
1 637 . 14 1 1 A 53 53 GLN HA H 113 3.720 4.006 -0.286 1
1 644 . 14 1 1 A 53 53 GLN C C 113 177.500 178.216 -0.716 1
1 645 . 14 1 1 A 53 53 GLN CA C 113 58.200 58.591 -0.391 1
1 646 . 14 1 1 A 53 53 GLN CB C 113 30.200 28.525 1.675 1
1 649 . 14 1 1 A 53 53 GLN N N 113 121.200 121.279 -0.079 1
1 651 . 14 1 1 A 54 54 SER H H 114 8.150 8.186 -0.036 1
1 652 . 14 1 1 A 54 54 SER HA H 114 4.180 4.096 0.084 1
1 655 . 14 1 1 A 54 54 SER C C 114 175.900 175.990 -0.090 1
1 656 . 14 1 1 A 54 54 SER CA C 114 62.100 62.686 -0.586 1
1 657 . 14 1 1 A 54 54 SER CB C 114 62.800 62.808 -0.008 1
1 658 . 14 1 1 A 54 54 SER N N 114 112.200 116.969 -4.769 1
1 659 . 14 1 1 A 55 55 ILE H H 115 6.760 7.504 -0.744 1
1 660 . 14 1 1 A 55 55 ILE HA H 115 3.860 3.651 0.209 1
1 670 . 14 1 1 A 55 55 ILE C C 115 179.200 178.372 0.828 1
1 671 . 14 1 1 A 55 55 ILE CA C 115 64.700 64.739 -0.039 1
1 672 . 14 1 1 A 55 55 ILE CB C 115 38.900 37.818 1.082 1
1 676 . 14 1 1 A 55 55 ILE N N 115 119.500 120.548 -1.048 1
1 677 . 14 1 1 A 56 56 ILE H H 116 7.750 8.172 -0.422 1
1 678 . 14 1 1 A 56 56 ILE HA H 116 3.690 3.571 0.119 1
1 688 . 14 1 1 A 56 56 ILE C C 116 176.900 178.486 -1.586 1
1 689 . 14 1 1 A 56 56 ILE CA C 116 62.800 65.082 -2.282 1
1 690 . 14 1 1 A 56 56 ILE CB C 116 36.200 37.452 -1.252 1
1 694 . 14 1 1 A 56 56 ILE N N 116 120.200 120.552 -0.352 1
1 695 . 14 1 1 A 57 57 ASN H H 117 8.690 8.182 0.508 1
1 696 . 14 1 1 A 57 57 ASN HA H 117 4.440 4.465 -0.025 1
1 701 . 14 1 1 A 57 57 ASN C C 117 177.200 178.089 -0.889 1
1 702 . 14 1 1 A 57 57 ASN CA C 117 54.800 56.810 -2.010 1
1 703 . 14 1 1 A 57 57 ASN CB C 117 38.100 37.744 0.356 1
1 705 . 14 1 1 A 57 57 ASN N N 117 117.000 119.487 -2.487 1
1 707 . 14 1 1 A 58 58 GLU H H 118 7.630 7.570 0.060 1
1 708 . 14 1 1 A 58 58 GLU HA H 118 4.450 4.380 0.070 1
1 713 . 14 1 1 A 58 58 GLU C C 118 176.500 176.798 -0.298 1
1 714 . 14 1 1 A 58 58 GLU CA C 118 56.200 57.737 -1.537 1
1 715 . 14 1 1 A 58 58 GLU CB C 118 30.200 30.363 -0.163 1
1 717 . 14 1 1 A 58 58 GLU N N 118 116.300 116.855 -0.555 1
1 718 . 14 1 1 A 59 59 THR H H 119 7.540 7.551 -0.011 1
1 719 . 14 1 1 A 59 59 THR HA H 119 4.230 4.389 -0.159 1
1 724 . 14 1 1 A 59 59 THR C C 119 174.200 173.852 0.348 1
1 725 . 14 1 1 A 59 59 THR CA C 119 63.800 62.152 1.648 1
1 726 . 14 1 1 A 59 59 THR CB C 119 68.900 68.950 -0.050 1
1 728 . 14 1 1 A 59 59 THR N N 119 117.600 116.087 1.513 1
1 729 . 14 1 1 A 60 60 LYS H H 120 8.860 9.028 -0.168 1
1 730 . 14 1 1 A 60 60 LYS HA H 120 4.490 4.632 -0.142 1
1 739 . 14 1 1 A 60 60 LYS C C 120 175.800 175.269 0.531 1
1 740 . 14 1 1 A 60 60 LYS CA C 120 54.900 55.259 -0.359 1
1 741 . 14 1 1 A 60 60 LYS CB C 120 29.800 32.140 -2.340 1
1 745 . 14 1 1 A 60 60 LYS N N 120 128.500 127.339 1.161 1
1 746 . 14 1 1 A 61 61 LEU H H 121 7.150 8.410 -1.260 1
1 747 . 14 1 1 A 61 61 LEU HA H 121 4.710 4.939 -0.229 1
1 757 . 14 1 1 A 61 61 LEU C C 121 175.000 175.846 -0.846 1
1 758 . 14 1 1 A 61 61 LEU CA C 121 52.800 53.230 -0.430 1
1 759 . 14 1 1 A 61 61 LEU CB C 121 46.400 45.419 0.981 1
1 763 . 14 1 1 A 61 61 LEU N N 121 120.700 125.684 -4.984 1
1 764 . 14 1 1 A 62 62 ALA H H 122 8.000 8.535 -0.535 1
1 765 . 14 1 1 A 62 62 ALA HA H 122 4.250 4.395 -0.145 1
1 769 . 14 1 1 A 62 62 ALA CA C 122 52.100 52.297 -0.197 1
1 770 . 14 1 1 A 62 62 ALA CB C 122 19.500 19.354 0.146 1
1 771 . 14 1 1 A 62 62 ALA N N 122 119.900 123.271 -3.371 1
1 772 . 14 1 1 A 63 63 LYS H H 123 8.770 9.025 -0.255 1
1 773 . 14 1 1 A 63 63 LYS HA H 123 3.800 3.879 -0.079 1
1 782 . 14 1 1 A 63 63 LYS C C 123 178.300 178.387 -0.087 1
1 783 . 14 1 1 A 63 63 LYS CA C 123 60.700 60.038 0.662 1
1 784 . 14 1 1 A 63 63 LYS CB C 123 32.300 32.148 0.152 1
1 788 . 14 1 1 A 63 63 LYS N N 123 121.400 122.108 -0.708 1
1 789 . 14 1 1 A 64 64 ASN H H 124 9.020 8.250 0.770 1
1 790 . 14 1 1 A 64 64 ASN HA H 124 4.430 4.519 -0.089 1
1 795 . 14 1 1 A 64 64 ASN C C 124 178.300 177.760 0.540 1
1 796 . 14 1 1 A 64 64 ASN CA C 124 56.200 56.172 0.028 1
1 797 . 14 1 1 A 64 64 ASN CB C 124 37.300 38.039 -0.739 1
1 799 . 14 1 1 A 64 64 ASN N N 124 115.000 117.808 -2.808 1
1 801 . 14 1 1 A 65 65 THR H H 125 7.620 8.082 -0.462 1
1 802 . 14 1 1 A 65 65 THR HA H 125 4.030 4.115 -0.085 1
1 807 . 14 1 1 A 65 65 THR C C 125 175.500 176.743 -1.243 1
1 808 . 14 1 1 A 65 65 THR CA C 125 66.000 67.109 -1.109 1
1 809 . 14 1 1 A 65 65 THR CB C 125 67.600 67.990 -0.390 1
1 811 . 14 1 1 A 65 65 THR N N 125 119.800 117.831 1.969 1
1 812 . 14 1 1 A 66 66 LEU H H 126 8.020 8.394 -0.374 1
1 813 . 14 1 1 A 66 66 LEU HA H 126 3.790 3.903 -0.113 1
1 823 . 14 1 1 A 66 66 LEU C C 126 179.200 178.990 0.210 1
1 824 . 14 1 1 A 66 66 LEU CA C 126 58.700 58.071 0.629 1
1 825 . 14 1 1 A 66 66 LEU CB C 126 41.300 41.259 0.041 1
1 829 . 14 1 1 A 66 66 LEU N N 126 121.200 121.359 -0.159 1
1 830 . 14 1 1 A 67 67 LYS H H 127 8.380 8.283 0.097 1
1 831 . 14 1 1 A 67 67 LYS HA H 127 3.740 4.100 -0.360 1
1 840 . 14 1 1 A 67 67 LYS C C 127 178.300 179.394 -1.094 1
1 841 . 14 1 1 A 67 67 LYS CA C 127 60.100 59.413 0.687 1
1 842 . 14 1 1 A 67 67 LYS CB C 127 32.400 31.936 0.464 1
1 846 . 14 1 1 A 67 67 LYS N N 127 117.000 118.172 -1.172 1
1 847 . 14 1 1 A 68 68 ALA H H 128 7.480 8.032 -0.552 1
1 848 . 14 1 1 A 68 68 ALA HA H 128 4.210 4.077 0.133 1
1 852 . 14 1 1 A 68 68 ALA C C 128 181.200 179.807 1.393 1
1 853 . 14 1 1 A 68 68 ALA CA C 128 55.200 55.015 0.185 1
1 854 . 14 1 1 A 68 68 ALA CB C 128 18.600 18.387 0.213 1
1 855 . 14 1 1 A 68 68 ALA N N 128 122.900 122.083 0.817 1
1 856 . 14 1 1 A 69 69 ILE H H 129 8.250 8.052 0.198 1
1 857 . 14 1 1 A 69 69 ILE HA H 129 3.130 3.732 -0.602 1
1 867 . 14 1 1 A 69 69 ILE C C 129 177.400 178.088 -0.688 1
1 868 . 14 1 1 A 69 69 ILE CA C 129 66.700 65.639 1.061 1
1 869 . 14 1 1 A 69 69 ILE CB C 129 37.900 37.676 0.224 1
1 873 . 14 1 1 A 69 69 ILE N N 129 122.800 118.474 4.326 1
1 874 . 14 1 1 A 70 70 ARG H H 130 8.040 8.051 -0.011 1
1 875 . 14 1 1 A 70 70 ARG HA H 130 3.620 3.935 -0.315 1
1 882 . 14 1 1 A 70 70 ARG C C 130 177.800 178.342 -0.542 1
1 883 . 14 1 1 A 70 70 ARG CA C 130 60.700 59.822 0.878 1
1 884 . 14 1 1 A 70 70 ARG CB C 130 29.600 29.695 -0.095 1
1 887 . 14 1 1 A 70 70 ARG N N 130 119.700 120.485 -0.785 1
1 888 . 14 1 1 A 71 71 ASN H H 131 8.920 8.443 0.477 1
1 889 . 14 1 1 A 71 71 ASN HA H 131 4.430 4.485 -0.055 1
1 894 . 14 1 1 A 71 71 ASN C C 131 177.500 177.695 -0.195 1
1 895 . 14 1 1 A 71 71 ASN CA C 131 56.100 56.484 -0.384 1
1 896 . 14 1 1 A 71 71 ASN CB C 131 38.600 39.058 -0.458 1
1 898 . 14 1 1 A 71 71 ASN N N 131 117.200 118.077 -0.877 1
1 900 . 14 1 1 A 72 72 THR H H 132 8.300 8.400 -0.100 1
1 901 . 14 1 1 A 72 72 THR HA H 132 4.430 3.861 0.569 1
1 906 . 14 1 1 A 72 72 THR C C 132 175.100 176.812 -1.712 1
1 907 . 14 1 1 A 72 72 THR CA C 132 68.200 66.531 1.669 1
1 908 . 14 1 1 A 72 72 THR CB C 132 68.500 68.922 -0.422 1
1 910 . 14 1 1 A 72 72 THR N N 132 119.200 116.059 3.141 1
1 911 . 14 1 1 A 73 73 ALA H H 133 7.950 8.257 -0.307 1
1 912 . 14 1 1 A 73 73 ALA HA H 133 4.040 4.129 -0.089 1
1 916 . 14 1 1 A 73 73 ALA C C 133 178.200 179.655 -1.455 1
1 917 . 14 1 1 A 73 73 ALA CA C 133 55.900 55.373 0.527 1
1 918 . 14 1 1 A 73 73 ALA CB C 133 16.700 18.142 -1.442 1
1 919 . 14 1 1 A 73 73 ALA N N 133 120.900 124.377 -3.477 1
1 920 . 14 1 1 A 74 74 SER H H 134 8.440 8.511 -0.071 1
1 921 . 14 1 1 A 74 74 SER HA H 134 4.430 4.331 0.099 1
1 924 . 14 1 1 A 74 74 SER C C 134 178.800 177.274 1.526 1
1 925 . 14 1 1 A 74 74 SER CA C 134 61.300 60.906 0.394 1
1 926 . 14 1 1 A 74 74 SER CB C 134 62.600 63.077 -0.477 1
1 927 . 14 1 1 A 74 74 SER N N 134 110.100 113.401 -3.301 1
1 928 . 14 1 1 A 75 75 GLN H H 135 8.340 7.919 0.421 1
1 929 . 14 1 1 A 75 75 GLN HA H 135 3.880 4.037 -0.157 1
1 936 . 14 1 1 A 75 75 GLN C C 135 178.800 178.900 -0.100 1
1 937 . 14 1 1 A 75 75 GLN CA C 135 59.600 58.514 1.086 1
1 938 . 14 1 1 A 75 75 GLN CB C 135 29.900 28.161 1.739 1
1 941 . 14 1 1 A 75 75 GLN N N 135 118.100 121.033 -2.933 1
1 943 . 14 1 1 A 76 76 ILE H H 136 7.670 7.273 0.397 1
1 944 . 14 1 1 A 76 76 ILE HA H 136 3.200 3.365 -0.165 1
1 954 . 14 1 1 A 76 76 ILE C C 136 177.500 177.873 -0.373 1
1 955 . 14 1 1 A 76 76 ILE CA C 136 66.100 65.036 1.064 1
1 956 . 14 1 1 A 76 76 ILE CB C 136 37.400 37.298 0.102 1
1 960 . 14 1 1 A 76 76 ILE N N 136 122.500 120.375 2.125 1
1 961 . 14 1 1 A 77 77 PHE H H 137 7.930 7.848 0.082 1
1 962 . 14 1 1 A 77 77 PHE HA H 137 3.890 4.083 -0.193 1
1 969 . 14 1 1 A 77 77 PHE C C 137 178.200 178.225 -0.025 1
1 970 . 14 1 1 A 77 77 PHE CA C 137 63.600 60.731 2.869 1
1 971 . 14 1 1 A 77 77 PHE CB C 137 39.300 38.334 0.966 1
1 976 . 14 1 1 A 77 77 PHE N N 137 116.100 118.949 -2.849 1
1 977 . 14 1 1 A 78 78 ARG H H 138 8.900 8.560 0.340 1
1 978 . 14 1 1 A 78 78 ARG HA H 138 3.910 3.894 0.016 1
1 986 . 14 1 1 A 78 78 ARG C C 138 178.300 178.839 -0.539 1
1 987 . 14 1 1 A 78 78 ARG CA C 138 60.100 59.186 0.914 1
1 988 . 14 1 1 A 78 78 ARG CB C 138 29.600 29.802 -0.202 1
1 991 . 14 1 1 A 78 78 ARG N N 138 118.600 118.818 -0.218 1
1 993 . 14 1 1 A 79 79 LEU H H 139 7.730 8.119 -0.389 1
1 994 . 14 1 1 A 79 79 LEU HA H 139 4.280 4.051 0.229 1
1 1004 . 14 1 1 A 79 79 LEU C C 139 179.000 178.116 0.884 1
1 1005 . 14 1 1 A 79 79 LEU CA C 139 57.800 57.797 0.003 1
1 1006 . 14 1 1 A 79 79 LEU CB C 139 41.900 41.226 0.674 1
1 1010 . 14 1 1 A 79 79 LEU N N 139 121.900 121.313 0.587 1
1 1011 . 14 1 1 A 80 80 ALA H H 140 7.590 7.495 0.095 1
1 1012 . 14 1 1 A 80 80 ALA HA H 140 2.710 3.004 -0.294 1
1 1016 . 14 1 1 A 80 80 ALA C C 140 179.900 180.202 -0.302 1
1 1017 . 14 1 1 A 80 80 ALA CA C 140 55.100 54.340 0.760 1
1 1018 . 14 1 1 A 80 80 ALA CB C 140 17.600 17.566 0.034 1
1 1019 . 14 1 1 A 80 80 ALA N N 140 123.400 119.576 3.824 1
1 1020 . 14 1 1 A 81 81 ILE H H 141 8.910 7.769 1.141 1
1 1021 . 14 1 1 A 81 81 ILE HA H 141 4.110 4.213 -0.103 1
1 1031 . 14 1 1 A 81 81 ILE C C 141 181.700 178.071 3.629 1
1 1032 . 14 1 1 A 81 81 ILE CA C 141 64.800 65.322 -0.522 1
1 1033 . 14 1 1 A 81 81 ILE CB C 141 38.600 37.754 0.846 1
1 1037 . 14 1 1 A 81 81 ILE N N 141 122.400 118.791 3.609 1
1 1038 . 14 1 1 A 82 82 GLU H H 142 8.560 8.916 -0.356 1
1 1039 . 14 1 1 A 82 82 GLU HA H 142 4.100 4.103 -0.003 1
1 1044 . 14 1 1 A 82 82 GLU C C 142 177.700 177.931 -0.231 1
1 1045 . 14 1 1 A 82 82 GLU CA C 142 59.100 59.142 -0.042 1
1 1046 . 14 1 1 A 82 82 GLU CB C 142 29.200 29.190 0.010 1
1 1048 . 14 1 1 A 82 82 GLU N N 142 123.200 119.785 3.415 1
1 1049 . 14 1 1 A 83 83 ASN H H 143 7.310 7.645 -0.335 1
1 1050 . 14 1 1 A 83 83 ASN HA H 143 4.750 4.850 -0.100 1
1 1055 . 14 1 1 A 83 83 ASN C C 143 173.200 174.266 -1.066 1
1 1056 . 14 1 1 A 83 83 ASN CA C 143 54.200 52.803 1.397 1
1 1057 . 14 1 1 A 83 83 ASN CB C 143 41.300 38.822 2.478 1
1 1059 . 14 1 1 A 83 83 ASN N N 143 114.900 115.451 -0.551 1
1 1061 . 14 1 1 A 84 84 ARG H H 144 8.320 7.964 0.356 1
1 1062 . 14 1 1 A 84 84 ARG HA H 144 4.120 3.994 0.126 1
1 1069 . 14 1 1 A 84 84 ARG C C 144 175.300 175.747 -0.447 1
1 1070 . 14 1 1 A 84 84 ARG CA C 144 57.100 56.862 0.238 1
1 1071 . 14 1 1 A 84 84 ARG CB C 144 26.000 27.091 -1.091 1
1 1074 . 14 1 1 A 84 84 ARG N N 144 114.400 115.346 -0.946 1
1 1075 . 14 1 1 A 85 85 ALA H H 145 8.350 8.653 -0.303 1
1 1076 . 14 1 1 A 85 85 ALA HA H 145 4.320 4.363 -0.043 1
1 1080 . 14 1 1 A 85 85 ALA C C 145 176.500 177.175 -0.675 1
1 1081 . 14 1 1 A 85 85 ALA CA C 145 53.400 52.864 0.536 1
1 1082 . 14 1 1 A 85 85 ALA CB C 145 19.900 20.181 -0.281 1
1 1083 . 14 1 1 A 85 85 ALA N N 145 120.600 118.283 2.317 1
1 1084 . 14 1 1 A 86 86 ILE H H 146 7.290 7.094 0.196 1
1 1085 . 14 1 1 A 86 86 ILE HA H 146 4.400 4.527 -0.127 1
1 1095 . 14 1 1 A 86 86 ILE C C 146 173.600 173.567 0.033 1
1 1096 . 14 1 1 A 86 86 ILE CA C 146 59.200 59.716 -0.516 1
1 1097 . 14 1 1 A 86 86 ILE CB C 146 41.600 40.765 0.835 1
1 1101 . 14 1 1 A 86 86 ILE N N 146 111.500 115.797 -4.297 1
1 1102 . 14 1 1 A 87 87 ASP H H 147 8.270 8.302 -0.032 1
1 1103 . 14 1 1 A 87 87 ASP HA H 147 4.940 4.836 0.104 1
1 1106 . 14 1 1 A 87 87 ASP C C 147 174.700 175.369 -0.669 1
1 1107 . 14 1 1 A 87 87 ASP CA C 147 53.700 52.771 0.929 1
1 1108 . 14 1 1 A 87 87 ASP CB C 147 41.800 40.874 0.926 1
1 1109 . 14 1 1 A 87 87 ASP N N 147 119.400 125.904 -6.504 1
1 1110 . 14 1 1 A 88 88 PHE H H 148 7.230 7.586 -0.356 1
1 1111 . 14 1 1 A 88 88 PHE HA H 148 4.690 5.208 -0.518 1
1 1119 . 14 1 1 A 88 88 PHE C C 148 171.500 174.390 -2.890 1
1 1120 . 14 1 1 A 88 88 PHE CA C 148 56.400 56.548 -0.148 1
1 1121 . 14 1 1 A 88 88 PHE CB C 148 42.000 42.969 -0.969 1
1 1127 . 14 1 1 A 88 88 PHE N N 148 119.700 119.324 0.376 1
1 1128 . 14 1 1 A 89 89 ASN H H 149 8.060 8.955 -0.895 1
1 1129 . 14 1 1 A 89 89 ASN HA H 149 4.490 5.167 -0.677 1
1 1134 . 14 1 1 A 89 89 ASN CA C 149 48.100 49.834 -1.734 1
1 1135 . 14 1 1 A 89 89 ASN CB C 149 39.200 39.685 -0.485 1
1 1137 . 14 1 1 A 89 89 ASN N N 149 119.700 121.619 -1.919 1
1 1139 . 14 1 1 A 90 90 PRO HA H 150 3.970 4.400 -0.430 1
1 1146 . 14 1 1 A 90 90 PRO C C 150 177.700 177.943 -0.243 1
1 1147 . 14 1 1 A 90 90 PRO CA C 150 63.900 65.092 -1.192 1
1 1148 . 14 1 1 A 90 90 PRO CB C 150 31.700 31.530 0.170 1
1 1151 . 14 1 1 A 91 91 ALA H H 151 7.240 7.343 -0.103 1
1 1152 . 14 1 1 A 91 91 ALA HA H 151 3.900 4.115 -0.215 1
1 1156 . 14 1 1 A 91 91 ALA C C 151 178.000 179.764 -1.764 1
1 1157 . 14 1 1 A 91 91 ALA CA C 151 53.900 54.508 -0.608 1
1 1158 . 14 1 1 A 91 91 ALA CB C 151 17.700 18.440 -0.740 1
1 1159 . 14 1 1 A 91 91 ALA N N 151 115.700 118.664 -2.964 1
1 1160 . 14 1 1 A 92 92 ASP H H 152 7.080 8.028 -0.948 1
1 1161 . 14 1 1 A 92 92 ASP HA H 152 4.220 4.353 -0.133 1
1 1164 . 14 1 1 A 92 92 ASP C C 152 176.200 177.047 -0.847 1
1 1165 . 14 1 1 A 92 92 ASP CA C 152 55.800 56.557 -0.757 1
1 1166 . 14 1 1 A 92 92 ASP CB C 152 39.500 40.595 -1.095 1
1 1167 . 14 1 1 A 92 92 ASP N N 152 117.100 119.455 -2.355 1
1 1168 . 14 1 1 A 93 93 TYR H H 153 7.060 7.386 -0.326 1
1 1169 . 14 1 1 A 93 93 TYR HA H 153 4.490 4.449 0.041 1
1 1176 . 14 1 1 A 93 93 TYR C C 153 174.700 176.085 -1.385 1
1 1177 . 14 1 1 A 93 93 TYR CA C 153 57.600 59.117 -1.517 1
1 1178 . 14 1 1 A 93 93 TYR CB C 153 38.500 38.382 0.118 1
1 1183 . 14 1 1 A 93 93 TYR N N 153 116.800 116.737 0.063 1
1 1184 . 14 1 1 A 94 94 VAL H H 154 7.000 7.112 -0.112 1
1 1185 . 14 1 1 A 94 94 VAL HA H 154 4.040 3.941 0.099 1
1 1193 . 14 1 1 A 94 94 VAL C C 154 174.700 175.467 -0.767 1
1 1194 . 14 1 1 A 94 94 VAL CA C 154 62.100 62.795 -0.695 1
1 1195 . 14 1 1 A 94 94 VAL CB C 154 32.700 32.053 0.647 1
1 1198 . 14 1 1 A 94 94 VAL N N 154 120.600 121.203 -0.603 1
1 1199 . 14 1 1 A 95 95 ARG H H 155 9.430 8.527 0.903 1
1 1200 . 14 1 1 A 95 95 ARG HA H 155 4.640 4.616 0.024 1
1 1207 . 14 1 1 A 95 95 ARG C C 155 175.400 175.619 -0.219 1
1 1208 . 14 1 1 A 95 95 ARG CA C 155 54.200 56.131 -1.931 1
1 1209 . 14 1 1 A 95 95 ARG CB C 155 32.400 30.715 1.685 1
1 1212 . 14 1 1 A 95 95 ARG N N 155 128.200 127.255 0.945 1
1 1213 . 14 1 1 A 96 96 ILE H H 156 8.700 8.548 0.152 1
1 1214 . 14 1 1 A 96 96 ILE HA H 156 4.440 4.586 -0.146 1
1 1224 . 14 1 1 A 96 96 ILE CA C 156 56.500 57.677 -1.177 1
1 1225 . 14 1 1 A 96 96 ILE CB C 156 36.700 38.370 -1.670 1
1 1229 . 14 1 1 A 96 96 ILE N N 156 124.100 126.524 -2.424 1
1 1230 . 14 1 1 A 97 97 PRO HA H 157 4.370 4.658 -0.288 1
1 1237 . 14 1 1 A 97 97 PRO C C 157 176.000 176.433 -0.433 1
1 1238 . 14 1 1 A 97 97 PRO CA C 157 63.200 62.984 0.216 1
1 1239 . 14 1 1 A 97 97 PRO CB C 157 32.400 31.956 0.444 1
1 1242 . 14 1 1 A 98 98 LYS H H 158 8.380 8.427 -0.047 1
1 1243 . 14 1 1 A 98 98 LYS HA H 158 4.190 4.451 -0.261 1
1 1252 . 14 1 1 A 98 98 LYS C C 158 176.800 175.379 1.421 1
1 1253 . 14 1 1 A 98 98 LYS CA C 158 57.100 55.205 1.895 1
1 1254 . 14 1 1 A 98 98 LYS CB C 158 32.800 30.802 1.998 1
1 1258 . 14 1 1 A 98 98 LYS N N 158 120.800 121.775 -0.975 1
1 1259 . 14 1 1 A 99 99 ILE H H 159 7.930 7.994 -0.064 1
1 1260 . 14 1 1 A 99 99 ILE HA H 159 4.200 4.016 0.184 1
1 1270 . 14 1 1 A 99 99 ILE C C 159 175.400 176.809 -1.409 1
1 1271 . 14 1 1 A 99 99 ILE CA C 159 60.600 62.306 -1.706 1
1 1272 . 14 1 1 A 99 99 ILE CB C 159 39.100 37.090 2.010 1
1 1276 . 14 1 1 A 99 99 ILE N N 159 120.200 124.465 -4.265 1
1 1277 . 14 1 1 A 100 100 ALA H H 160 8.370 8.391 -0.021 1
1 1278 . 14 1 1 A 100 100 ALA HA H 160 4.370 4.620 -0.250 1
1 1282 . 14 1 1 A 100 100 ALA C C 160 177.200 177.315 -0.115 1
1 1283 . 14 1 1 A 100 100 ALA CA C 160 52.200 51.294 0.906 1
1 1284 . 14 1 1 A 100 100 ALA CB C 160 19.400 20.122 -0.722 1
1 1285 . 14 1 1 A 100 100 ALA N N 160 128.300 128.855 -0.555 1
1 1286 . 14 1 1 A 101 101 LEU H H 161 8.250 7.416 0.834 1
1 1287 . 14 1 1 A 101 101 LEU HA H 161 4.280 4.440 -0.160 1
1 1297 . 14 1 1 A 101 101 LEU C C 161 177.200 177.443 -0.243 1
1 1298 . 14 1 1 A 101 101 LEU CA C 161 55.200 54.561 0.639 1
1 1299 . 14 1 1 A 101 101 LEU CB C 161 42.400 40.772 1.628 1
1 1303 . 14 1 1 A 101 101 LEU N N 161 121.900 119.656 2.244 1
1 1304 . 14 1 1 A 102 102 GLU H H 162 8.390 8.884 -0.494 1
1 1305 . 14 1 1 A 102 102 GLU HA H 162 4.230 3.937 0.293 1
1 1310 . 14 1 1 A 102 102 GLU C C 162 176.100 175.599 0.501 1
1 1311 . 14 1 1 A 102 102 GLU CA C 162 56.400 57.261 -0.861 1
1 1312 . 14 1 1 A 102 102 GLU CB C 162 30.500 28.134 2.366 1
1 1314 . 14 1 1 A 102 102 GLU N N 162 121.300 122.955 -1.655 1
1 1315 . 14 1 1 A 103 103 HIS H H 163 8.330 7.946 0.384 1
1 1316 . 14 1 1 A 103 103 HIS HA H 163 4.590 5.043 -0.453 1
1 1319 . 14 1 1 A 103 103 HIS C C 163 176.100 173.655 2.445 1
1 1320 . 14 1 1 A 103 103 HIS CA C 163 56.000 54.718 1.282 1
1 1321 . 14 1 1 A 103 103 HIS CB C 163 30.500 33.232 -2.732 1
1 1322 . 14 1 1 A 103 103 HIS N N 163 120.000 122.148 -2.148 1
1 1323 . 14 1 1 A 107 107 HIS HA H 167 4.620 4.681 -0.061 1
1 1326 . 14 1 1 A 107 107 HIS C C 167 173.900 172.385 1.515 1
1 1327 . 14 1 1 A 107 107 HIS CA C 167 56.000 56.153 -0.153 1
1 1328 . 14 1 1 A 107 107 HIS CB C 167 30.300 32.582 -2.282 1
1 15 . 15 1 1 A 2 2 ASP H H 62 8.760 7.880 0.880 1
1 16 . 15 1 1 A 2 2 ASP HA H 62 4.810 5.025 -0.215 1
1 19 . 15 1 1 A 2 2 ASP C C 62 175.800 175.734 0.066 1
1 20 . 15 1 1 A 2 2 ASP CA C 62 54.800 52.777 2.023 1
1 21 . 15 1 1 A 2 2 ASP CB C 62 41.600 41.800 -0.200 1
1 22 . 15 1 1 A 2 2 ASP N N 62 120.900 120.689 0.211 1
1 23 . 15 1 1 A 3 3 SER H H 63 8.710 8.633 0.077 1
1 24 . 15 1 1 A 3 3 SER HA H 63 4.970 4.708 0.262 1
1 27 . 15 1 1 A 3 3 SER C C 63 175.600 175.263 0.337 1
1 28 . 15 1 1 A 3 3 SER CA C 63 57.500 57.479 0.021 1
1 29 . 15 1 1 A 3 3 SER CB C 63 65.900 64.324 1.576 1
1 30 . 15 1 1 A 3 3 SER N N 63 116.300 116.592 -0.292 1
1 31 . 15 1 1 A 4 4 PHE H H 64 9.370 9.228 0.142 1
1 32 . 15 1 1 A 4 4 PHE HA H 64 4.010 4.156 -0.146 1
1 39 . 15 1 1 A 4 4 PHE C C 64 176.700 177.188 -0.488 1
1 40 . 15 1 1 A 4 4 PHE CA C 64 62.200 61.598 0.602 1
1 41 . 15 1 1 A 4 4 PHE CB C 64 38.500 39.299 -0.799 1
1 46 . 15 1 1 A 4 4 PHE N N 64 121.400 128.333 -6.933 1
1 47 . 15 1 1 A 5 5 GLY H H 65 8.930 7.890 1.040 1
1 48 . 15 1 1 A 5 5 GLY HA2 H 65 2.020 2.743 -0.723 1
1 49 . 15 1 1 A 5 5 GLY HA3 H 65 3.250 2.787 0.463 1
1 50 . 15 1 1 A 5 5 GLY C C 65 175.200 175.208 -0.008 1
1 51 . 15 1 1 A 5 5 GLY CA C 65 46.300 46.492 -0.192 1
1 52 . 15 1 1 A 5 5 GLY N N 65 106.500 105.300 1.200 1
1 53 . 15 1 1 A 6 6 ASP H H 66 7.630 7.968 -0.338 1
1 54 . 15 1 1 A 6 6 ASP HA H 66 4.100 4.234 -0.134 1
1 57 . 15 1 1 A 6 6 ASP C C 66 179.500 178.526 0.974 1
1 58 . 15 1 1 A 6 6 ASP CA C 66 57.400 56.761 0.639 1
1 59 . 15 1 1 A 6 6 ASP CB C 66 40.500 40.889 -0.389 1
1 60 . 15 1 1 A 6 6 ASP N N 66 120.500 120.981 -0.481 1
1 61 . 15 1 1 A 7 7 TRP H H 67 7.190 7.481 -0.291 1
1 62 . 15 1 1 A 7 7 TRP HA H 67 3.860 4.241 -0.381 1
1 71 . 15 1 1 A 7 7 TRP C C 67 177.200 178.260 -1.060 1
1 72 . 15 1 1 A 7 7 TRP CA C 67 61.100 59.603 1.497 1
1 73 . 15 1 1 A 7 7 TRP CB C 67 28.300 28.818 -0.518 1
1 79 . 15 1 1 A 7 7 TRP N N 67 120.700 120.017 0.683 1
1 81 . 15 1 1 A 8 8 ALA H H 68 9.040 8.297 0.743 1
1 82 . 15 1 1 A 8 8 ALA HA H 68 3.730 3.874 -0.144 1
1 86 . 15 1 1 A 8 8 ALA C C 68 179.500 179.411 0.089 1
1 87 . 15 1 1 A 8 8 ALA CA C 68 55.200 55.165 0.035 1
1 88 . 15 1 1 A 8 8 ALA CB C 68 18.600 18.176 0.424 1
1 89 . 15 1 1 A 8 8 ALA N N 68 125.700 122.883 2.817 1
1 90 . 15 1 1 A 9 9 GLU H H 69 8.060 8.099 -0.039 1
1 91 . 15 1 1 A 9 9 GLU HA H 69 4.020 4.078 -0.058 1
1 96 . 15 1 1 A 9 9 GLU C C 69 180.400 179.004 1.396 1
1 97 . 15 1 1 A 9 9 GLU CA C 69 58.800 59.927 -1.127 1
1 98 . 15 1 1 A 9 9 GLU CB C 69 28.500 29.151 -0.651 1
1 99 . 15 1 1 A 9 9 GLU N N 69 115.400 118.482 -3.082 1
1 100 . 15 1 1 A 10 10 LYS H H 70 7.740 8.019 -0.279 1
1 101 . 15 1 1 A 10 10 LYS HA H 70 3.910 4.029 -0.119 1
1 110 . 15 1 1 A 10 10 LYS C C 70 179.500 178.742 0.758 1
1 111 . 15 1 1 A 10 10 LYS CA C 70 60.000 58.432 1.568 1
1 112 . 15 1 1 A 10 10 LYS CB C 70 32.400 32.023 0.377 1
1 116 . 15 1 1 A 10 10 LYS N N 70 122.700 119.103 3.597 1
1 117 . 15 1 1 A 11 11 PHE H H 71 8.750 8.389 0.361 1
1 118 . 15 1 1 A 11 11 PHE HA H 71 4.080 4.352 -0.272 1
1 126 . 15 1 1 A 11 11 PHE C C 71 177.100 177.172 -0.072 1
1 127 . 15 1 1 A 11 11 PHE CA C 71 61.200 61.312 -0.112 1
1 128 . 15 1 1 A 11 11 PHE CB C 71 38.900 39.319 -0.419 1
1 134 . 15 1 1 A 11 11 PHE N N 71 123.500 121.969 1.531 1
1 135 . 15 1 1 A 12 12 LEU H H 72 8.400 8.499 -0.099 1
1 136 . 15 1 1 A 12 12 LEU HA H 72 3.520 3.594 -0.074 1
1 146 . 15 1 1 A 12 12 LEU C C 72 180.000 179.233 0.767 1
1 147 . 15 1 1 A 12 12 LEU CA C 72 58.200 57.999 0.201 1
1 148 . 15 1 1 A 12 12 LEU CB C 72 41.700 41.465 0.235 1
1 152 . 15 1 1 A 12 12 LEU N N 72 121.100 119.269 1.831 1
1 153 . 15 1 1 A 13 13 LYS H H 73 7.810 8.000 -0.190 1
1 154 . 15 1 1 A 13 13 LYS HA H 73 4.080 3.970 0.110 1
1 156 . 15 1 1 A 13 13 LYS C C 73 179.300 179.276 0.024 1
1 157 . 15 1 1 A 13 13 LYS CA C 73 59.000 59.321 -0.321 1
1 158 . 15 1 1 A 13 13 LYS CB C 73 31.900 32.238 -0.338 1
1 159 . 15 1 1 A 13 13 LYS N N 73 119.400 118.918 0.482 1
1 160 . 15 1 1 A 14 14 SER H H 74 8.210 8.545 -0.335 1
1 161 . 15 1 1 A 14 14 SER HA H 74 4.210 4.130 0.080 1
1 164 . 15 1 1 A 14 14 SER C C 74 176.300 177.129 -0.829 1
1 165 . 15 1 1 A 14 14 SER CA C 74 61.400 61.316 0.084 1
1 166 . 15 1 1 A 14 14 SER CB C 74 62.600 62.321 0.279 1
1 167 . 15 1 1 A 14 14 SER N N 74 117.600 114.545 3.055 1
1 168 . 15 1 1 A 15 15 LYS H H 75 7.760 7.329 0.431 1
1 169 . 15 1 1 A 15 15 LYS HA H 75 4.040 4.006 0.034 1
1 178 . 15 1 1 A 15 15 LYS C C 75 178.500 179.325 -0.825 1
1 179 . 15 1 1 A 15 15 LYS CA C 75 56.500 59.267 -2.767 1
1 180 . 15 1 1 A 15 15 LYS CB C 75 30.600 31.979 -1.379 1
1 184 . 15 1 1 A 15 15 LYS N N 75 120.100 122.388 -2.288 1
1 185 . 15 1 1 A 16 16 GLU H H 76 7.680 8.100 -0.420 1
1 186 . 15 1 1 A 16 16 GLU HA H 76 4.030 4.028 0.002 1
1 191 . 15 1 1 A 16 16 GLU C C 76 179.900 178.284 1.616 1
1 192 . 15 1 1 A 16 16 GLU CA C 76 59.200 59.363 -0.163 1
1 193 . 15 1 1 A 16 16 GLU CB C 76 29.600 29.162 0.438 1
1 195 . 15 1 1 A 16 16 GLU N N 76 119.700 119.562 0.138 1
1 196 . 15 1 1 A 17 17 ALA H H 77 8.030 8.234 -0.204 1
1 197 . 15 1 1 A 17 17 ALA HA H 77 4.200 4.110 0.090 1
1 201 . 15 1 1 A 17 17 ALA C C 77 178.900 179.193 -0.293 1
1 202 . 15 1 1 A 17 17 ALA CA C 77 54.400 54.576 -0.176 1
1 203 . 15 1 1 A 17 17 ALA CB C 77 18.100 18.288 -0.188 1
1 204 . 15 1 1 A 17 17 ALA N N 77 123.000 120.961 2.039 1
1 205 . 15 1 1 A 18 18 ASP H H 78 7.860 7.975 -0.115 1
1 206 . 15 1 1 A 18 18 ASP HA H 78 4.600 4.521 0.079 1
1 209 . 15 1 1 A 18 18 ASP C C 78 177.500 176.271 1.229 1
1 210 . 15 1 1 A 18 18 ASP CA C 78 55.100 55.078 0.022 1
1 211 . 15 1 1 A 18 18 ASP CB C 78 41.400 41.196 0.204 1
1 212 . 15 1 1 A 18 18 ASP N N 78 117.700 116.863 0.837 1
1 213 . 15 1 1 A 19 19 GLY H H 79 7.910 8.222 -0.312 1
1 214 . 15 1 1 A 19 19 GLY HA2 H 79 3.860 4.049 -0.189 1
1 215 . 15 1 1 A 19 19 GLY HA3 H 79 4.080 4.053 0.027 1
1 216 . 15 1 1 A 19 19 GLY C C 79 175.300 174.608 0.692 1
1 217 . 15 1 1 A 19 19 GLY CA C 79 46.200 45.728 0.472 1
1 218 . 15 1 1 A 19 19 GLY N N 79 107.100 106.707 0.393 1
1 219 . 15 1 1 A 20 20 VAL H H 80 7.150 7.381 -0.231 1
1 220 . 15 1 1 A 20 20 VAL HA H 80 4.250 4.623 -0.373 1
1 228 . 15 1 1 A 20 20 VAL C C 80 175.100 175.589 -0.489 1
1 229 . 15 1 1 A 20 20 VAL CA C 80 61.800 60.404 1.396 1
1 230 . 15 1 1 A 20 20 VAL CB C 80 32.200 33.546 -1.346 1
1 233 . 15 1 1 A 20 20 VAL N N 80 114.600 116.013 -1.413 1
1 234 . 15 1 1 A 21 21 SER H H 81 8.560 8.623 -0.063 1
1 235 . 15 1 1 A 21 21 SER HA H 81 4.390 4.462 -0.072 1
1 238 . 15 1 1 A 21 21 SER C C 81 174.600 175.178 -0.578 1
1 239 . 15 1 1 A 21 21 SER CA C 81 57.900 59.415 -1.515 1
1 240 . 15 1 1 A 21 21 SER CB C 81 64.700 64.081 0.619 1
1 241 . 15 1 1 A 21 21 SER N N 81 118.700 119.972 -1.272 1
1 242 . 15 1 1 A 22 22 VAL H H 82 8.690 8.579 0.111 1
1 243 . 15 1 1 A 22 22 VAL HA H 82 3.700 3.854 -0.154 1
1 251 . 15 1 1 A 22 22 VAL C C 82 178.000 177.661 0.339 1
1 252 . 15 1 1 A 22 22 VAL CA C 82 66.500 65.391 1.109 1
1 253 . 15 1 1 A 22 22 VAL CB C 82 31.700 31.651 0.049 1
1 256 . 15 1 1 A 22 22 VAL N N 82 122.100 126.400 -4.300 1
1 257 . 15 1 1 A 23 23 SER H H 83 8.300 8.101 0.199 1
1 258 . 15 1 1 A 23 23 SER HA H 83 4.210 4.094 0.116 1
1 261 . 15 1 1 A 23 23 SER C C 83 177.600 175.926 1.674 1
1 262 . 15 1 1 A 23 23 SER CA C 83 61.400 61.937 -0.537 1
1 263 . 15 1 1 A 23 23 SER CB C 83 62.400 62.896 -0.496 1
1 264 . 15 1 1 A 23 23 SER N N 83 113.600 118.596 -4.996 1
1 265 . 15 1 1 A 24 24 GLN H H 84 7.820 8.072 -0.252 1
1 266 . 15 1 1 A 24 24 GLN HA H 84 3.970 4.253 -0.283 1
1 273 . 15 1 1 A 24 24 GLN C C 84 178.400 178.014 0.386 1
1 274 . 15 1 1 A 24 24 GLN CA C 84 58.400 58.689 -0.289 1
1 275 . 15 1 1 A 24 24 GLN CB C 84 28.900 28.244 0.656 1
1 278 . 15 1 1 A 24 24 GLN N N 84 122.900 120.891 2.009 1
1 280 . 15 1 1 A 25 25 LEU H H 85 8.920 8.198 0.722 1
1 281 . 15 1 1 A 25 25 LEU HA H 85 4.130 4.345 -0.215 1
1 291 . 15 1 1 A 25 25 LEU C C 85 178.800 178.945 -0.145 1
1 292 . 15 1 1 A 25 25 LEU CA C 85 58.300 57.702 0.598 1
1 293 . 15 1 1 A 25 25 LEU CB C 85 41.200 41.532 -0.332 1
1 297 . 15 1 1 A 25 25 LEU N N 85 122.200 121.232 0.968 1
1 298 . 15 1 1 A 26 26 ASN H H 86 8.860 8.108 0.752 1
1 299 . 15 1 1 A 26 26 ASN HA H 86 4.420 4.499 -0.079 1
1 304 . 15 1 1 A 26 26 ASN C C 86 179.000 177.839 1.161 1
1 305 . 15 1 1 A 26 26 ASN CA C 86 55.900 55.764 0.136 1
1 306 . 15 1 1 A 26 26 ASN CB C 86 37.200 38.123 -0.923 1
1 308 . 15 1 1 A 26 26 ASN N N 86 117.600 118.618 -1.018 1
1 310 . 15 1 1 A 27 27 SER H H 87 7.840 8.410 -0.570 1
1 311 . 15 1 1 A 27 27 SER HA H 87 4.100 3.988 0.112 1
1 314 . 15 1 1 A 27 27 SER C C 87 179.000 176.397 2.603 1
1 315 . 15 1 1 A 27 27 SER CA C 87 62.100 61.276 0.824 1
1 316 . 15 1 1 A 27 27 SER CB C 87 62.100 62.264 -0.164 1
1 317 . 15 1 1 A 27 27 SER N N 87 118.500 114.534 3.966 1
1 318 . 15 1 1 A 28 28 TYR H H 88 8.180 7.725 0.455 1
1 319 . 15 1 1 A 28 28 TYR HA H 88 4.600 4.494 0.106 1
1 326 . 15 1 1 A 28 28 TYR C C 88 174.800 178.204 -3.404 1
1 327 . 15 1 1 A 28 28 TYR CA C 88 61.200 62.303 -1.103 1
1 328 . 15 1 1 A 28 28 TYR CB C 88 37.800 38.006 -0.206 1
1 333 . 15 1 1 A 28 28 TYR N N 88 119.300 119.694 -0.394 1
1 334 . 15 1 1 A 29 29 LYS H H 89 9.040 8.411 0.629 1
1 335 . 15 1 1 A 29 29 LYS HA H 89 3.890 4.039 -0.149 1
1 344 . 15 1 1 A 29 29 LYS C C 89 179.000 178.799 0.201 1
1 345 . 15 1 1 A 29 29 LYS CA C 89 61.300 60.122 1.178 1
1 346 . 15 1 1 A 29 29 LYS CB C 89 32.800 32.130 0.670 1
1 350 . 15 1 1 A 29 29 LYS N N 89 119.300 121.197 -1.897 1
1 351 . 15 1 1 A 30 30 ASN H H 90 7.770 7.917 -0.147 1
1 352 . 15 1 1 A 30 30 ASN HA H 90 4.560 4.385 0.175 1
1 357 . 15 1 1 A 30 30 ASN C C 90 178.300 177.560 0.740 1
1 358 . 15 1 1 A 30 30 ASN CA C 90 56.200 56.297 -0.097 1
1 359 . 15 1 1 A 30 30 ASN CB C 90 38.900 38.931 -0.031 1
1 361 . 15 1 1 A 30 30 ASN N N 90 117.800 117.566 0.234 1
1 363 . 15 1 1 A 31 31 TYR H H 91 8.860 7.998 0.862 1
1 364 . 15 1 1 A 31 31 TYR HA H 91 4.910 4.618 0.292 1
1 371 . 15 1 1 A 31 31 TYR C C 91 178.300 178.713 -0.413 1
1 372 . 15 1 1 A 31 31 TYR CA C 91 59.700 60.484 -0.784 1
1 373 . 15 1 1 A 31 31 TYR CB C 91 37.500 38.181 -0.681 1
1 378 . 15 1 1 A 31 31 TYR N N 91 119.400 118.044 1.356 1
1 379 . 15 1 1 A 32 32 CYS H H 92 8.640 8.379 0.261 1
1 380 . 15 1 1 A 32 32 CYS HA H 92 4.410 4.291 0.119 1
1 383 . 15 1 1 A 32 32 CYS C C 92 173.700 177.024 -3.324 1
1 384 . 15 1 1 A 32 32 CYS CA C 92 65.500 63.701 1.799 1
1 385 . 15 1 1 A 32 32 CYS CB C 92 28.300 27.878 0.422 1
1 386 . 15 1 1 A 32 32 CYS N N 92 113.500 118.324 -4.824 1
1 387 . 15 1 1 A 33 33 ARG H H 93 8.440 7.669 0.771 1
1 388 . 15 1 1 A 33 33 ARG HA H 93 3.740 4.122 -0.382 1
1 391 . 15 1 1 A 33 33 ARG C C 93 177.200 178.308 -1.108 1
1 392 . 15 1 1 A 33 33 ARG CA C 93 58.300 58.438 -0.138 1
1 393 . 15 1 1 A 33 33 ARG CB C 93 30.200 30.104 0.096 1
1 394 . 15 1 1 A 33 33 ARG N N 93 111.400 120.270 -8.870 1
1 395 . 15 1 1 A 34 34 ASN H H 94 8.020 8.396 -0.376 1
1 396 . 15 1 1 A 34 34 ASN HA H 94 4.980 4.530 0.450 1
1 401 . 15 1 1 A 34 34 ASN C C 94 176.700 177.374 -0.674 1
1 402 . 15 1 1 A 34 34 ASN CA C 94 53.400 55.811 -2.411 1
1 403 . 15 1 1 A 34 34 ASN CB C 94 38.000 39.109 -1.109 1
1 405 . 15 1 1 A 34 34 ASN N N 94 113.600 117.660 -4.060 1
1 407 . 15 1 1 A 35 35 HIS H H 95 7.200 7.578 -0.378 1
1 408 . 15 1 1 A 35 35 HIS HA H 95 4.470 4.490 -0.020 1
1 411 . 15 1 1 A 35 35 HIS C C 95 176.600 176.341 0.259 1
1 412 . 15 1 1 A 35 35 HIS CA C 95 60.000 59.575 0.425 1
1 413 . 15 1 1 A 35 35 HIS CB C 95 30.500 31.208 -0.708 1
1 414 . 15 1 1 A 35 35 HIS N N 95 115.600 116.408 -0.808 1
1 415 . 15 1 1 A 36 36 LEU H H 96 8.170 7.998 0.172 1
1 416 . 15 1 1 A 36 36 LEU HA H 96 4.730 4.504 0.226 1
1 426 . 15 1 1 A 36 36 LEU C C 96 176.800 177.603 -0.803 1
1 427 . 15 1 1 A 36 36 LEU CA C 96 54.400 54.605 -0.205 1
1 428 . 15 1 1 A 36 36 LEU CB C 96 40.600 41.471 -0.871 1
1 432 . 15 1 1 A 36 36 LEU N N 96 114.000 119.469 -5.469 1
1 433 . 15 1 1 A 37 37 SER H H 97 7.140 8.354 -1.214 1
1 434 . 15 1 1 A 37 37 SER HA H 97 4.730 4.319 0.411 1
1 437 . 15 1 1 A 37 37 SER CA C 97 62.700 62.689 0.011 1
1 438 . 15 1 1 A 37 37 SER CB C 97 62.600 61.586 1.014 1
1 439 . 15 1 1 A 37 37 SER N N 97 117.200 116.071 1.129 1
1 440 . 15 1 1 A 38 38 PRO HA H 98 4.560 4.412 0.148 1
1 447 . 15 1 1 A 38 38 PRO C C 98 177.900 179.019 -1.119 1
1 448 . 15 1 1 A 38 38 PRO CA C 98 65.700 65.829 -0.129 1
1 449 . 15 1 1 A 38 38 PRO CB C 98 31.800 30.710 1.090 1
1 452 . 15 1 1 A 39 39 LEU H H 99 8.090 7.524 0.566 1
1 453 . 15 1 1 A 39 39 LEU HA H 99 4.260 3.978 0.282 1
1 463 . 15 1 1 A 39 39 LEU C C 99 178.700 178.638 0.062 1
1 464 . 15 1 1 A 39 39 LEU CA C 99 54.300 57.377 -3.077 1
1 465 . 15 1 1 A 39 39 LEU CB C 99 42.400 41.397 1.003 1
1 469 . 15 1 1 A 39 39 LEU N N 99 112.400 117.330 -4.930 1
1 470 . 15 1 1 A 40 40 TYR H H 100 8.350 8.503 -0.153 1
1 471 . 15 1 1 A 40 40 TYR HA H 100 4.170 4.442 -0.272 1
1 478 . 15 1 1 A 40 40 TYR C C 100 178.300 176.882 1.418 1
1 479 . 15 1 1 A 40 40 TYR CA C 100 63.400 61.861 1.539 1
1 480 . 15 1 1 A 40 40 TYR CB C 100 38.600 39.184 -0.584 1
1 485 . 15 1 1 A 40 40 TYR N N 100 119.400 120.776 -1.376 1
1 486 . 15 1 1 A 41 41 MET H H 101 8.640 8.138 0.502 1
1 487 . 15 1 1 A 41 41 MET HA H 101 4.260 4.708 -0.448 1
1 488 . 15 1 1 A 41 41 MET C C 101 177.000 176.026 0.974 1
1 489 . 15 1 1 A 41 41 MET CA C 101 54.600 54.324 0.276 1
1 490 . 15 1 1 A 41 41 MET N N 101 111.800 116.622 -4.822 1
1 491 . 15 1 1 A 42 42 LYS H H 102 7.880 7.854 0.026 1
1 492 . 15 1 1 A 42 42 LYS HA H 102 4.430 4.805 -0.375 1
1 501 . 15 1 1 A 42 42 LYS C C 102 176.300 175.079 1.221 1
1 502 . 15 1 1 A 42 42 LYS CA C 102 56.000 54.359 1.641 1
1 503 . 15 1 1 A 42 42 LYS CB C 102 33.400 34.187 -0.787 1
1 507 . 15 1 1 A 42 42 LYS N N 102 121.700 118.905 2.795 1
1 508 . 15 1 1 A 43 43 SER H H 103 9.160 8.636 0.524 1
1 509 . 15 1 1 A 43 43 SER HA H 103 4.620 4.835 -0.215 1
1 513 . 15 1 1 A 43 43 SER C C 103 176.300 175.250 1.050 1
1 514 . 15 1 1 A 43 43 SER CA C 103 58.700 56.536 2.164 1
1 515 . 15 1 1 A 43 43 SER CB C 103 63.700 64.874 -1.174 1
1 516 . 15 1 1 A 43 43 SER N N 103 118.800 116.652 2.148 1
1 517 . 15 1 1 A 44 44 LEU H H 104 8.860 9.281 -0.421 1
1 518 . 15 1 1 A 44 44 LEU HA H 104 4.130 4.152 -0.022 1
1 528 . 15 1 1 A 44 44 LEU C C 104 178.700 178.798 -0.098 1
1 529 . 15 1 1 A 44 44 LEU CA C 104 58.800 58.720 0.080 1
1 530 . 15 1 1 A 44 44 LEU CB C 104 42.600 41.685 0.915 1
1 534 . 15 1 1 A 44 44 LEU N N 104 124.200 130.203 -6.003 1
1 535 . 15 1 1 A 45 45 SER H H 105 8.330 8.181 0.149 1
1 536 . 15 1 1 A 45 45 SER HA H 105 4.310 4.607 -0.297 1
1 539 . 15 1 1 A 45 45 SER C C 105 175.000 175.217 -0.217 1
1 540 . 15 1 1 A 45 45 SER CA C 105 60.100 59.895 0.205 1
1 541 . 15 1 1 A 45 45 SER CB C 105 63.400 63.585 -0.185 1
1 542 . 15 1 1 A 45 45 SER N N 105 107.700 114.557 -6.857 1
1 543 . 15 1 1 A 46 46 GLU H H 106 7.800 8.333 -0.533 1
1 544 . 15 1 1 A 46 46 GLU HA H 106 4.570 4.369 0.201 1
1 549 . 15 1 1 A 46 46 GLU C C 106 174.100 175.843 -1.743 1
1 550 . 15 1 1 A 46 46 GLU CA C 106 55.600 55.969 -0.369 1
1 551 . 15 1 1 A 46 46 GLU CB C 106 31.200 29.227 1.973 1
1 553 . 15 1 1 A 46 46 GLU N N 106 119.600 116.553 3.047 1
1 554 . 15 1 1 A 47 47 ILE H H 107 7.100 7.572 -0.472 1
1 555 . 15 1 1 A 47 47 ILE HA H 107 4.040 4.142 -0.102 1
1 565 . 15 1 1 A 47 47 ILE C C 107 174.100 175.336 -1.236 1
1 566 . 15 1 1 A 47 47 ILE CA C 107 62.300 61.200 1.100 1
1 567 . 15 1 1 A 47 47 ILE CB C 107 38.500 38.678 -0.178 1
1 571 . 15 1 1 A 47 47 ILE N N 107 120.600 122.560 -1.960 1
1 572 . 15 1 1 A 48 48 LEU H H 108 9.180 8.714 0.466 1
1 573 . 15 1 1 A 48 48 LEU HA H 108 4.940 4.772 0.168 1
1 583 . 15 1 1 A 48 48 LEU CA C 108 51.900 52.274 -0.374 1
1 584 . 15 1 1 A 48 48 LEU CB C 108 42.000 42.438 -0.438 1
1 588 . 15 1 1 A 48 48 LEU N N 108 129.400 128.312 1.088 1
1 589 . 15 1 1 A 49 49 PRO HA H 109 3.910 4.235 -0.325 1
1 596 . 15 1 1 A 49 49 PRO C C 109 178.500 178.016 0.484 1
1 597 . 15 1 1 A 49 49 PRO CA C 109 66.600 64.804 1.796 1
1 598 . 15 1 1 A 49 49 PRO CB C 109 31.300 31.736 -0.436 1
1 601 . 15 1 1 A 50 50 ALA H H 110 8.280 8.238 0.042 1
1 602 . 15 1 1 A 50 50 ALA HA H 110 4.110 4.044 0.066 1
1 606 . 15 1 1 A 50 50 ALA C C 110 179.700 180.086 -0.386 1
1 607 . 15 1 1 A 50 50 ALA CA C 110 55.100 55.207 -0.107 1
1 608 . 15 1 1 A 50 50 ALA CB C 110 19.200 18.479 0.721 1
1 609 . 15 1 1 A 50 50 ALA N N 110 116.100 118.809 -2.709 1
1 610 . 15 1 1 A 51 51 ASP H H 111 7.790 8.170 -0.380 1
1 611 . 15 1 1 A 51 51 ASP HA H 111 4.440 4.312 0.128 1
1 614 . 15 1 1 A 51 51 ASP C C 111 178.200 178.881 -0.681 1
1 615 . 15 1 1 A 51 51 ASP CA C 111 57.600 57.368 0.232 1
1 616 . 15 1 1 A 51 51 ASP CB C 111 41.800 40.825 0.975 1
1 617 . 15 1 1 A 51 51 ASP N N 111 116.500 118.825 -2.325 1
1 618 . 15 1 1 A 52 52 ILE H H 112 7.020 7.547 -0.527 1
1 619 . 15 1 1 A 52 52 ILE HA H 112 3.750 3.629 0.121 1
1 629 . 15 1 1 A 52 52 ILE C C 112 177.300 177.766 -0.466 1
1 630 . 15 1 1 A 52 52 ILE CA C 112 63.500 65.126 -1.626 1
1 631 . 15 1 1 A 52 52 ILE CB C 112 37.500 37.720 -0.220 1
1 635 . 15 1 1 A 52 52 ILE N N 112 116.700 120.567 -3.867 1
1 636 . 15 1 1 A 53 53 GLN H H 113 9.150 8.432 0.718 1
1 637 . 15 1 1 A 53 53 GLN HA H 113 3.720 3.995 -0.275 1
1 644 . 15 1 1 A 53 53 GLN C C 113 177.500 178.346 -0.846 1
1 645 . 15 1 1 A 53 53 GLN CA C 113 58.200 58.608 -0.408 1
1 646 . 15 1 1 A 53 53 GLN CB C 113 30.200 28.328 1.872 1
1 649 . 15 1 1 A 53 53 GLN N N 113 121.200 120.900 0.300 1
1 651 . 15 1 1 A 54 54 SER H H 114 8.150 8.057 0.093 1
1 652 . 15 1 1 A 54 54 SER HA H 114 4.180 4.138 0.042 1
1 655 . 15 1 1 A 54 54 SER C C 114 175.900 175.904 -0.004 1
1 656 . 15 1 1 A 54 54 SER CA C 114 62.100 62.767 -0.667 1
1 657 . 15 1 1 A 54 54 SER CB C 114 62.800 62.900 -0.100 1
1 658 . 15 1 1 A 54 54 SER N N 114 112.200 116.890 -4.690 1
1 659 . 15 1 1 A 55 55 ILE H H 115 6.760 7.757 -0.997 1
1 660 . 15 1 1 A 55 55 ILE HA H 115 3.860 3.666 0.194 1
1 670 . 15 1 1 A 55 55 ILE C C 115 179.200 178.185 1.015 1
1 671 . 15 1 1 A 55 55 ILE CA C 115 64.700 64.516 0.184 1
1 672 . 15 1 1 A 55 55 ILE CB C 115 38.900 37.849 1.051 1
1 676 . 15 1 1 A 55 55 ILE N N 115 119.500 120.236 -0.736 1
1 677 . 15 1 1 A 56 56 ILE H H 116 7.750 8.308 -0.558 1
1 678 . 15 1 1 A 56 56 ILE HA H 116 3.690 3.470 0.220 1
1 688 . 15 1 1 A 56 56 ILE C C 116 176.900 177.702 -0.802 1
1 689 . 15 1 1 A 56 56 ILE CA C 116 62.800 65.453 -2.653 1
1 690 . 15 1 1 A 56 56 ILE CB C 116 36.200 37.818 -1.618 1
1 694 . 15 1 1 A 56 56 ILE N N 116 120.200 121.281 -1.081 1
1 695 . 15 1 1 A 57 57 ASN H H 117 8.690 8.295 0.395 1
1 696 . 15 1 1 A 57 57 ASN HA H 117 4.440 4.487 -0.047 1
1 701 . 15 1 1 A 57 57 ASN C C 117 177.200 177.202 -0.002 1
1 702 . 15 1 1 A 57 57 ASN CA C 117 54.800 55.555 -0.755 1
1 703 . 15 1 1 A 57 57 ASN CB C 117 38.100 38.474 -0.374 1
1 705 . 15 1 1 A 57 57 ASN N N 117 117.000 119.038 -2.038 1
1 707 . 15 1 1 A 58 58 GLU H H 118 7.630 7.922 -0.292 1
1 708 . 15 1 1 A 58 58 GLU HA H 118 4.450 4.373 0.077 1
1 713 . 15 1 1 A 58 58 GLU C C 118 176.500 177.168 -0.668 1
1 714 . 15 1 1 A 58 58 GLU CA C 118 56.200 57.726 -1.526 1
1 715 . 15 1 1 A 58 58 GLU CB C 118 30.200 30.192 0.008 1
1 717 . 15 1 1 A 58 58 GLU N N 118 116.300 116.640 -0.340 1
1 718 . 15 1 1 A 59 59 THR H H 119 7.540 7.565 -0.025 1
1 719 . 15 1 1 A 59 59 THR HA H 119 4.230 4.345 -0.115 1
1 724 . 15 1 1 A 59 59 THR C C 119 174.200 174.857 -0.657 1
1 725 . 15 1 1 A 59 59 THR CA C 119 63.800 63.715 0.085 1
1 726 . 15 1 1 A 59 59 THR CB C 119 68.900 68.565 0.335 1
1 728 . 15 1 1 A 59 59 THR N N 119 117.600 115.857 1.743 1
1 729 . 15 1 1 A 60 60 LYS H H 120 8.860 8.693 0.167 1
1 730 . 15 1 1 A 60 60 LYS HA H 120 4.490 4.449 0.041 1
1 739 . 15 1 1 A 60 60 LYS C C 120 175.800 175.959 -0.159 1
1 740 . 15 1 1 A 60 60 LYS CA C 120 54.900 56.184 -1.284 1
1 741 . 15 1 1 A 60 60 LYS CB C 120 29.800 32.039 -2.239 1
1 745 . 15 1 1 A 60 60 LYS N N 120 128.500 121.940 6.560 1
1 746 . 15 1 1 A 61 61 LEU H H 121 7.150 7.464 -0.314 1
1 747 . 15 1 1 A 61 61 LEU HA H 121 4.710 4.619 0.091 1
1 757 . 15 1 1 A 61 61 LEU C C 121 175.000 176.649 -1.649 1
1 758 . 15 1 1 A 61 61 LEU CA C 121 52.800 53.940 -1.140 1
1 759 . 15 1 1 A 61 61 LEU CB C 121 46.400 42.742 3.658 1
1 763 . 15 1 1 A 61 61 LEU N N 121 120.700 122.120 -1.420 1
1 764 . 15 1 1 A 62 62 ALA H H 122 8.000 8.864 -0.864 1
1 765 . 15 1 1 A 62 62 ALA HA H 122 4.250 4.603 -0.353 1
1 769 . 15 1 1 A 62 62 ALA CA C 122 52.100 50.959 1.141 1
1 770 . 15 1 1 A 62 62 ALA CB C 122 19.500 20.838 -1.338 1
1 771 . 15 1 1 A 62 62 ALA N N 122 119.900 123.339 -3.439 1
1 772 . 15 1 1 A 63 63 LYS H H 123 8.770 9.067 -0.297 1
1 773 . 15 1 1 A 63 63 LYS HA H 123 3.800 3.922 -0.122 1
1 782 . 15 1 1 A 63 63 LYS C C 123 178.300 178.258 0.042 1
1 783 . 15 1 1 A 63 63 LYS CA C 123 60.700 60.386 0.314 1
1 784 . 15 1 1 A 63 63 LYS CB C 123 32.300 32.141 0.159 1
1 788 . 15 1 1 A 63 63 LYS N N 123 121.400 120.503 0.897 1
1 789 . 15 1 1 A 64 64 ASN H H 124 9.020 8.293 0.727 1
1 790 . 15 1 1 A 64 64 ASN HA H 124 4.430 4.531 -0.101 1
1 795 . 15 1 1 A 64 64 ASN C C 124 178.300 177.999 0.301 1
1 796 . 15 1 1 A 64 64 ASN CA C 124 56.200 56.056 0.144 1
1 797 . 15 1 1 A 64 64 ASN CB C 124 37.300 38.041 -0.741 1
1 799 . 15 1 1 A 64 64 ASN N N 124 115.000 117.862 -2.862 1
1 801 . 15 1 1 A 65 65 THR H H 125 7.620 8.051 -0.431 1
1 802 . 15 1 1 A 65 65 THR HA H 125 4.030 4.037 -0.007 1
1 807 . 15 1 1 A 65 65 THR C C 125 175.500 176.703 -1.203 1
1 808 . 15 1 1 A 65 65 THR CA C 125 66.000 67.038 -1.038 1
1 809 . 15 1 1 A 65 65 THR CB C 125 67.600 67.902 -0.302 1
1 811 . 15 1 1 A 65 65 THR N N 125 119.800 117.553 2.247 1
1 812 . 15 1 1 A 66 66 LEU H H 126 8.020 8.298 -0.278 1
1 813 . 15 1 1 A 66 66 LEU HA H 126 3.790 3.814 -0.024 1
1 823 . 15 1 1 A 66 66 LEU C C 126 179.200 178.886 0.314 1
1 824 . 15 1 1 A 66 66 LEU CA C 126 58.700 58.185 0.515 1
1 825 . 15 1 1 A 66 66 LEU CB C 126 41.300 41.456 -0.156 1
1 829 . 15 1 1 A 66 66 LEU N N 126 121.200 121.404 -0.204 1
1 830 . 15 1 1 A 67 67 LYS H H 127 8.380 8.001 0.379 1
1 831 . 15 1 1 A 67 67 LYS HA H 127 3.740 4.055 -0.315 1
1 840 . 15 1 1 A 67 67 LYS C C 127 178.300 179.395 -1.095 1
1 841 . 15 1 1 A 67 67 LYS CA C 127 60.100 59.319 0.781 1
1 842 . 15 1 1 A 67 67 LYS CB C 127 32.400 31.730 0.670 1
1 846 . 15 1 1 A 67 67 LYS N N 127 117.000 117.783 -0.783 1
1 847 . 15 1 1 A 68 68 ALA H H 128 7.480 7.955 -0.475 1
1 848 . 15 1 1 A 68 68 ALA HA H 128 4.210 3.931 0.279 1
1 852 . 15 1 1 A 68 68 ALA C C 128 181.200 179.681 1.519 1
1 853 . 15 1 1 A 68 68 ALA CA C 128 55.200 54.870 0.330 1
1 854 . 15 1 1 A 68 68 ALA CB C 128 18.600 18.092 0.508 1
1 855 . 15 1 1 A 68 68 ALA N N 128 122.900 121.659 1.241 1
1 856 . 15 1 1 A 69 69 ILE H H 129 8.250 7.565 0.685 1
1 857 . 15 1 1 A 69 69 ILE HA H 129 3.130 3.237 -0.107 1
1 867 . 15 1 1 A 69 69 ILE C C 129 177.400 177.667 -0.267 1
1 868 . 15 1 1 A 69 69 ILE CA C 129 66.700 65.159 1.541 1
1 869 . 15 1 1 A 69 69 ILE CB C 129 37.900 37.499 0.401 1
1 873 . 15 1 1 A 69 69 ILE N N 129 122.800 117.865 4.935 1
1 874 . 15 1 1 A 70 70 ARG H H 130 8.040 8.042 -0.002 1
1 875 . 15 1 1 A 70 70 ARG HA H 130 3.620 3.919 -0.299 1
1 882 . 15 1 1 A 70 70 ARG C C 130 177.800 178.530 -0.730 1
1 883 . 15 1 1 A 70 70 ARG CA C 130 60.700 59.843 0.857 1
1 884 . 15 1 1 A 70 70 ARG CB C 130 29.600 29.985 -0.385 1
1 887 . 15 1 1 A 70 70 ARG N N 130 119.700 120.897 -1.197 1
1 888 . 15 1 1 A 71 71 ASN H H 131 8.920 8.499 0.421 1
1 889 . 15 1 1 A 71 71 ASN HA H 131 4.430 4.452 -0.022 1
1 894 . 15 1 1 A 71 71 ASN C C 131 177.500 177.734 -0.234 1
1 895 . 15 1 1 A 71 71 ASN CA C 131 56.100 56.523 -0.423 1
1 896 . 15 1 1 A 71 71 ASN CB C 131 38.600 39.199 -0.599 1
1 898 . 15 1 1 A 71 71 ASN N N 131 117.200 117.817 -0.617 1
1 900 . 15 1 1 A 72 72 THR H H 132 8.300 8.129 0.171 1
1 901 . 15 1 1 A 72 72 THR HA H 132 4.430 3.919 0.511 1
1 906 . 15 1 1 A 72 72 THR C C 132 175.100 176.835 -1.735 1
1 907 . 15 1 1 A 72 72 THR CA C 132 68.200 66.543 1.657 1
1 908 . 15 1 1 A 72 72 THR CB C 132 68.500 68.968 -0.468 1
1 910 . 15 1 1 A 72 72 THR N N 132 119.200 115.852 3.348 1
1 911 . 15 1 1 A 73 73 ALA H H 133 7.950 8.451 -0.501 1
1 912 . 15 1 1 A 73 73 ALA HA H 133 4.040 4.028 0.012 1
1 916 . 15 1 1 A 73 73 ALA C C 133 178.200 179.988 -1.788 1
1 917 . 15 1 1 A 73 73 ALA CA C 133 55.900 55.254 0.646 1
1 918 . 15 1 1 A 73 73 ALA CB C 133 16.700 18.192 -1.492 1
1 919 . 15 1 1 A 73 73 ALA N N 133 120.900 123.990 -3.090 1
1 920 . 15 1 1 A 74 74 SER H H 134 8.440 8.023 0.417 1
1 921 . 15 1 1 A 74 74 SER HA H 134 4.430 4.227 0.203 1
1 924 . 15 1 1 A 74 74 SER C C 134 178.800 177.441 1.359 1
1 925 . 15 1 1 A 74 74 SER CA C 134 61.300 61.427 -0.127 1
1 926 . 15 1 1 A 74 74 SER CB C 134 62.600 62.927 -0.327 1
1 927 . 15 1 1 A 74 74 SER N N 134 110.100 113.691 -3.591 1
1 928 . 15 1 1 A 75 75 GLN H H 135 8.340 7.926 0.414 1
1 929 . 15 1 1 A 75 75 GLN HA H 135 3.880 4.014 -0.134 1
1 936 . 15 1 1 A 75 75 GLN C C 135 178.800 178.602 0.198 1
1 937 . 15 1 1 A 75 75 GLN CA C 135 59.600 58.864 0.736 1
1 938 . 15 1 1 A 75 75 GLN CB C 135 29.900 28.202 1.698 1
1 941 . 15 1 1 A 75 75 GLN N N 135 118.100 121.187 -3.087 1
1 943 . 15 1 1 A 76 76 ILE H H 136 7.670 7.227 0.443 1
1 944 . 15 1 1 A 76 76 ILE HA H 136 3.200 3.339 -0.139 1
1 954 . 15 1 1 A 76 76 ILE C C 136 177.500 178.025 -0.525 1
1 955 . 15 1 1 A 76 76 ILE CA C 136 66.100 65.099 1.001 1
1 956 . 15 1 1 A 76 76 ILE CB C 136 37.400 37.441 -0.041 1
1 960 . 15 1 1 A 76 76 ILE N N 136 122.500 119.849 2.651 1
1 961 . 15 1 1 A 77 77 PHE H H 137 7.930 7.687 0.243 1
1 962 . 15 1 1 A 77 77 PHE HA H 137 3.890 4.148 -0.258 1
1 969 . 15 1 1 A 77 77 PHE C C 137 178.200 178.183 0.017 1
1 970 . 15 1 1 A 77 77 PHE CA C 137 63.600 60.615 2.985 1
1 971 . 15 1 1 A 77 77 PHE CB C 137 39.300 38.488 0.812 1
1 976 . 15 1 1 A 77 77 PHE N N 137 116.100 118.568 -2.468 1
1 977 . 15 1 1 A 78 78 ARG H H 138 8.900 8.179 0.721 1
1 978 . 15 1 1 A 78 78 ARG HA H 138 3.910 3.892 0.018 1
1 986 . 15 1 1 A 78 78 ARG C C 138 178.300 178.911 -0.611 1
1 987 . 15 1 1 A 78 78 ARG CA C 138 60.100 59.118 0.982 1
1 988 . 15 1 1 A 78 78 ARG CB C 138 29.600 29.733 -0.133 1
1 991 . 15 1 1 A 78 78 ARG N N 138 118.600 119.290 -0.690 1
1 993 . 15 1 1 A 79 79 LEU H H 139 7.730 8.269 -0.539 1
1 994 . 15 1 1 A 79 79 LEU HA H 139 4.280 4.036 0.244 1
1 1004 . 15 1 1 A 79 79 LEU C C 139 179.000 178.311 0.689 1
1 1005 . 15 1 1 A 79 79 LEU CA C 139 57.800 57.663 0.137 1
1 1006 . 15 1 1 A 79 79 LEU CB C 139 41.900 41.348 0.552 1
1 1010 . 15 1 1 A 79 79 LEU N N 139 121.900 121.200 0.700 1
1 1011 . 15 1 1 A 80 80 ALA H H 140 7.590 7.407 0.183 1
1 1012 . 15 1 1 A 80 80 ALA HA H 140 2.710 2.610 0.100 1
1 1016 . 15 1 1 A 80 80 ALA C C 140 179.900 179.774 0.126 1
1 1017 . 15 1 1 A 80 80 ALA CA C 140 55.100 54.321 0.779 1
1 1018 . 15 1 1 A 80 80 ALA CB C 140 17.600 17.208 0.392 1
1 1019 . 15 1 1 A 80 80 ALA N N 140 123.400 120.042 3.358 1
1 1020 . 15 1 1 A 81 81 ILE H H 141 8.910 7.861 1.049 1
1 1021 . 15 1 1 A 81 81 ILE HA H 141 4.110 4.057 0.053 1
1 1031 . 15 1 1 A 81 81 ILE C C 141 181.700 177.911 3.789 1
1 1032 . 15 1 1 A 81 81 ILE CA C 141 64.800 65.198 -0.398 1
1 1033 . 15 1 1 A 81 81 ILE CB C 141 38.600 37.559 1.041 1
1 1037 . 15 1 1 A 81 81 ILE N N 141 122.400 119.040 3.360 1
1 1038 . 15 1 1 A 82 82 GLU H H 142 8.560 8.462 0.098 1
1 1039 . 15 1 1 A 82 82 GLU HA H 142 4.100 3.922 0.178 1
1 1044 . 15 1 1 A 82 82 GLU C C 142 177.700 178.661 -0.961 1
1 1045 . 15 1 1 A 82 82 GLU CA C 142 59.100 59.935 -0.835 1
1 1046 . 15 1 1 A 82 82 GLU CB C 142 29.200 29.319 -0.119 1
1 1048 . 15 1 1 A 82 82 GLU N N 142 123.200 120.091 3.109 1
1 1049 . 15 1 1 A 83 83 ASN H H 143 7.310 7.560 -0.250 1
1 1050 . 15 1 1 A 83 83 ASN HA H 143 4.750 4.882 -0.132 1
1 1055 . 15 1 1 A 83 83 ASN C C 143 173.200 174.302 -1.102 1
1 1056 . 15 1 1 A 83 83 ASN CA C 143 54.200 52.921 1.279 1
1 1057 . 15 1 1 A 83 83 ASN CB C 143 41.300 38.841 2.459 1
1 1059 . 15 1 1 A 83 83 ASN N N 143 114.900 115.118 -0.218 1
1 1061 . 15 1 1 A 84 84 ARG H H 144 8.320 8.023 0.297 1
1 1062 . 15 1 1 A 84 84 ARG HA H 144 4.120 4.010 0.110 1
1 1069 . 15 1 1 A 84 84 ARG C C 144 175.300 176.281 -0.981 1
1 1070 . 15 1 1 A 84 84 ARG CA C 144 57.100 56.960 0.140 1
1 1071 . 15 1 1 A 84 84 ARG CB C 144 26.000 26.867 -0.867 1
1 1074 . 15 1 1 A 84 84 ARG N N 144 114.400 115.016 -0.616 1
1 1075 . 15 1 1 A 85 85 ALA H H 145 8.350 8.014 0.336 1
1 1076 . 15 1 1 A 85 85 ALA HA H 145 4.320 4.317 0.003 1
1 1080 . 15 1 1 A 85 85 ALA C C 145 176.500 177.400 -0.900 1
1 1081 . 15 1 1 A 85 85 ALA CA C 145 53.400 53.633 -0.233 1
1 1082 . 15 1 1 A 85 85 ALA CB C 145 19.900 19.250 0.650 1
1 1083 . 15 1 1 A 85 85 ALA N N 145 120.600 119.112 1.488 1
1 1084 . 15 1 1 A 86 86 ILE H H 146 7.290 7.590 -0.300 1
1 1085 . 15 1 1 A 86 86 ILE HA H 146 4.400 4.682 -0.282 1
1 1095 . 15 1 1 A 86 86 ILE C C 146 173.600 173.640 -0.040 1
1 1096 . 15 1 1 A 86 86 ILE CA C 146 59.200 59.972 -0.772 1
1 1097 . 15 1 1 A 86 86 ILE CB C 146 41.600 41.706 -0.106 1
1 1101 . 15 1 1 A 86 86 ILE N N 146 111.500 115.821 -4.321 1
1 1102 . 15 1 1 A 87 87 ASP H H 147 8.270 9.038 -0.768 1
1 1103 . 15 1 1 A 87 87 ASP HA H 147 4.940 4.940 0.000 1
1 1106 . 15 1 1 A 87 87 ASP C C 147 174.700 175.186 -0.486 1
1 1107 . 15 1 1 A 87 87 ASP CA C 147 53.700 53.193 0.507 1
1 1108 . 15 1 1 A 87 87 ASP CB C 147 41.800 41.456 0.344 1
1 1109 . 15 1 1 A 87 87 ASP N N 147 119.400 128.487 -9.087 1
1 1110 . 15 1 1 A 88 88 PHE H H 148 7.230 7.697 -0.467 1
1 1111 . 15 1 1 A 88 88 PHE HA H 148 4.690 4.880 -0.190 1
1 1119 . 15 1 1 A 88 88 PHE C C 148 171.500 172.893 -1.393 1
1 1120 . 15 1 1 A 88 88 PHE CA C 148 56.400 56.699 -0.299 1
1 1121 . 15 1 1 A 88 88 PHE CB C 148 42.000 42.715 -0.715 1
1 1127 . 15 1 1 A 88 88 PHE N N 148 119.700 120.598 -0.898 1
1 1128 . 15 1 1 A 89 89 ASN H H 149 8.060 8.352 -0.292 1
1 1129 . 15 1 1 A 89 89 ASN HA H 149 4.490 4.991 -0.501 1
1 1134 . 15 1 1 A 89 89 ASN CA C 149 48.100 49.230 -1.130 1
1 1135 . 15 1 1 A 89 89 ASN CB C 149 39.200 39.654 -0.454 1
1 1137 . 15 1 1 A 89 89 ASN N N 149 119.700 125.483 -5.783 1
1 1139 . 15 1 1 A 90 90 PRO HA H 150 3.970 4.151 -0.181 1
1 1146 . 15 1 1 A 90 90 PRO C C 150 177.700 177.321 0.379 1
1 1147 . 15 1 1 A 90 90 PRO CA C 150 63.900 64.089 -0.189 1
1 1148 . 15 1 1 A 90 90 PRO CB C 150 31.700 31.529 0.171 1
1 1151 . 15 1 1 A 91 91 ALA H H 151 7.240 7.668 -0.428 1
1 1152 . 15 1 1 A 91 91 ALA HA H 151 3.900 3.909 -0.009 1
1 1156 . 15 1 1 A 91 91 ALA C C 151 178.000 179.702 -1.702 1
1 1157 . 15 1 1 A 91 91 ALA CA C 151 53.900 54.494 -0.594 1
1 1158 . 15 1 1 A 91 91 ALA CB C 151 17.700 18.139 -0.439 1
1 1159 . 15 1 1 A 91 91 ALA N N 151 115.700 118.648 -2.948 1
1 1160 . 15 1 1 A 92 92 ASP H H 152 7.080 7.711 -0.631 1
1 1161 . 15 1 1 A 92 92 ASP HA H 152 4.220 4.209 0.011 1
1 1164 . 15 1 1 A 92 92 ASP C C 152 176.200 176.938 -0.738 1
1 1165 . 15 1 1 A 92 92 ASP CA C 152 55.800 56.718 -0.918 1
1 1166 . 15 1 1 A 92 92 ASP CB C 152 39.500 40.285 -0.785 1
1 1167 . 15 1 1 A 92 92 ASP N N 152 117.100 119.221 -2.121 1
1 1168 . 15 1 1 A 93 93 TYR H H 153 7.060 7.189 -0.129 1
1 1169 . 15 1 1 A 93 93 TYR HA H 153 4.490 4.543 -0.053 1
1 1176 . 15 1 1 A 93 93 TYR C C 153 174.700 175.426 -0.726 1
1 1177 . 15 1 1 A 93 93 TYR CA C 153 57.600 58.563 -0.963 1
1 1178 . 15 1 1 A 93 93 TYR CB C 153 38.500 38.640 -0.140 1
1 1183 . 15 1 1 A 93 93 TYR N N 153 116.800 116.729 0.071 1
1 1184 . 15 1 1 A 94 94 VAL H H 154 7.000 7.108 -0.108 1
1 1185 . 15 1 1 A 94 94 VAL HA H 154 4.040 4.202 -0.162 1
1 1193 . 15 1 1 A 94 94 VAL C C 154 174.700 174.987 -0.287 1
1 1194 . 15 1 1 A 94 94 VAL CA C 154 62.100 62.289 -0.189 1
1 1195 . 15 1 1 A 94 94 VAL CB C 154 32.700 31.534 1.166 1
1 1198 . 15 1 1 A 94 94 VAL N N 154 120.600 120.728 -0.128 1
1 1199 . 15 1 1 A 95 95 ARG H H 155 9.430 8.707 0.723 1
1 1200 . 15 1 1 A 95 95 ARG HA H 155 4.640 4.715 -0.075 1
1 1207 . 15 1 1 A 95 95 ARG C C 155 175.400 175.228 0.172 1
1 1208 . 15 1 1 A 95 95 ARG CA C 155 54.200 55.279 -1.079 1
1 1209 . 15 1 1 A 95 95 ARG CB C 155 32.400 31.491 0.909 1
1 1212 . 15 1 1 A 95 95 ARG N N 155 128.200 128.074 0.126 1
1 1213 . 15 1 1 A 96 96 ILE H H 156 8.700 8.628 0.072 1
1 1214 . 15 1 1 A 96 96 ILE HA H 156 4.440 4.599 -0.159 1
1 1224 . 15 1 1 A 96 96 ILE CA C 156 56.500 57.753 -1.253 1
1 1225 . 15 1 1 A 96 96 ILE CB C 156 36.700 38.423 -1.723 1
1 1229 . 15 1 1 A 96 96 ILE N N 156 124.100 127.265 -3.165 1
1 1230 . 15 1 1 A 97 97 PRO HA H 157 4.370 5.123 -0.753 1
1 1237 . 15 1 1 A 97 97 PRO C C 157 176.000 177.261 -1.261 1
1 1238 . 15 1 1 A 97 97 PRO CA C 157 63.200 62.312 0.888 1
1 1239 . 15 1 1 A 97 97 PRO CB C 157 32.400 32.637 -0.237 1
1 1242 . 15 1 1 A 98 98 LYS H H 158 8.380 9.464 -1.084 1
1 1243 . 15 1 1 A 98 98 LYS HA H 158 4.190 4.340 -0.150 1
1 1252 . 15 1 1 A 98 98 LYS C C 158 176.800 176.150 0.650 1
1 1253 . 15 1 1 A 98 98 LYS CA C 158 57.100 55.654 1.446 1
1 1254 . 15 1 1 A 98 98 LYS CB C 158 32.800 32.077 0.723 1
1 1258 . 15 1 1 A 98 98 LYS N N 158 120.800 120.700 0.100 1
1 1259 . 15 1 1 A 99 99 ILE H H 159 7.930 7.933 -0.003 1
1 1260 . 15 1 1 A 99 99 ILE HA H 159 4.200 3.693 0.507 1
1 1270 . 15 1 1 A 99 99 ILE C C 159 175.400 175.222 0.178 1
1 1271 . 15 1 1 A 99 99 ILE CA C 159 60.600 63.387 -2.787 1
1 1272 . 15 1 1 A 99 99 ILE CB C 159 39.100 35.812 3.288 1
1 1276 . 15 1 1 A 99 99 ILE N N 159 120.200 116.338 3.862 1
1 1277 . 15 1 1 A 100 100 ALA H H 160 8.370 7.832 0.538 1
1 1278 . 15 1 1 A 100 100 ALA HA H 160 4.370 4.349 0.021 1
1 1282 . 15 1 1 A 100 100 ALA C C 160 177.200 177.380 -0.180 1
1 1283 . 15 1 1 A 100 100 ALA CA C 160 52.200 52.240 -0.040 1
1 1284 . 15 1 1 A 100 100 ALA CB C 160 19.400 20.369 -0.969 1
1 1285 . 15 1 1 A 100 100 ALA N N 160 128.300 125.560 2.740 1
1 1286 . 15 1 1 A 101 101 LEU H H 161 8.250 8.813 -0.563 1
1 1287 . 15 1 1 A 101 101 LEU HA H 161 4.280 4.388 -0.108 1
1 1297 . 15 1 1 A 101 101 LEU C C 161 177.200 176.818 0.382 1
1 1298 . 15 1 1 A 101 101 LEU CA C 161 55.200 54.026 1.174 1
1 1299 . 15 1 1 A 101 101 LEU CB C 161 42.400 40.116 2.284 1
1 1303 . 15 1 1 A 101 101 LEU N N 161 121.900 120.757 1.143 1
1 1304 . 15 1 1 A 102 102 GLU H H 162 8.390 8.126 0.264 1
1 1305 . 15 1 1 A 102 102 GLU HA H 162 4.230 4.060 0.170 1
1 1310 . 15 1 1 A 102 102 GLU C C 162 176.100 177.020 -0.920 1
1 1311 . 15 1 1 A 102 102 GLU CA C 162 56.400 59.622 -3.222 1
1 1312 . 15 1 1 A 102 102 GLU CB C 162 30.500 29.874 0.626 1
1 1314 . 15 1 1 A 102 102 GLU N N 162 121.300 120.968 0.332 1
1 1315 . 15 1 1 A 103 103 HIS H H 163 8.330 7.491 0.839 1
1 1316 . 15 1 1 A 103 103 HIS HA H 163 4.590 4.716 -0.126 1
1 1319 . 15 1 1 A 103 103 HIS C C 163 176.100 173.898 2.202 1
1 1320 . 15 1 1 A 103 103 HIS CA C 163 56.000 53.614 2.386 1
1 1321 . 15 1 1 A 103 103 HIS CB C 163 30.500 30.915 -0.415 1
1 1322 . 15 1 1 A 103 103 HIS N N 163 120.000 115.183 4.817 1
1 1323 . 15 1 1 A 107 107 HIS HA H 167 4.620 4.680 -0.060 1
1 1326 . 15 1 1 A 107 107 HIS C C 167 173.900 173.653 0.247 1
1 1327 . 15 1 1 A 107 107 HIS CA C 167 56.000 54.658 1.342 1
1 1328 . 15 1 1 A 107 107 HIS CB C 167 30.300 33.921 -3.621 1
1 15 . 16 1 1 A 2 2 ASP H H 62 8.760 7.891 0.869 1
1 16 . 16 1 1 A 2 2 ASP HA H 62 4.810 4.698 0.112 1
1 19 . 16 1 1 A 2 2 ASP C C 62 175.800 176.167 -0.367 1
1 20 . 16 1 1 A 2 2 ASP CA C 62 54.800 53.301 1.499 1
1 21 . 16 1 1 A 2 2 ASP CB C 62 41.600 42.299 -0.699 1
1 22 . 16 1 1 A 2 2 ASP N N 62 120.900 120.202 0.698 1
1 23 . 16 1 1 A 3 3 SER H H 63 8.710 8.992 -0.282 1
1 24 . 16 1 1 A 3 3 SER HA H 63 4.970 4.701 0.269 1
1 27 . 16 1 1 A 3 3 SER C C 63 175.600 175.968 -0.368 1
1 28 . 16 1 1 A 3 3 SER CA C 63 57.500 58.717 -1.217 1
1 29 . 16 1 1 A 3 3 SER CB C 63 65.900 64.281 1.619 1
1 30 . 16 1 1 A 3 3 SER N N 63 116.300 119.449 -3.149 1
1 31 . 16 1 1 A 4 4 PHE H H 64 9.370 9.074 0.296 1
1 32 . 16 1 1 A 4 4 PHE HA H 64 4.010 4.322 -0.312 1
1 39 . 16 1 1 A 4 4 PHE C C 64 176.700 177.507 -0.807 1
1 40 . 16 1 1 A 4 4 PHE CA C 64 62.200 61.714 0.486 1
1 41 . 16 1 1 A 4 4 PHE CB C 64 38.500 39.404 -0.904 1
1 46 . 16 1 1 A 4 4 PHE N N 64 121.400 124.160 -2.760 1
1 47 . 16 1 1 A 5 5 GLY H H 65 8.930 8.482 0.448 1
1 48 . 16 1 1 A 5 5 GLY HA2 H 65 2.020 2.839 -0.819 1
1 49 . 16 1 1 A 5 5 GLY HA3 H 65 3.250 3.275 -0.025 1
1 50 . 16 1 1 A 5 5 GLY C C 65 175.200 175.224 -0.024 1
1 51 . 16 1 1 A 5 5 GLY CA C 65 46.300 46.687 -0.387 1
1 52 . 16 1 1 A 5 5 GLY N N 65 106.500 105.206 1.294 1
1 53 . 16 1 1 A 6 6 ASP H H 66 7.630 7.831 -0.201 1
1 54 . 16 1 1 A 6 6 ASP HA H 66 4.100 4.314 -0.214 1
1 57 . 16 1 1 A 6 6 ASP C C 66 179.500 178.835 0.665 1
1 58 . 16 1 1 A 6 6 ASP CA C 66 57.400 56.726 0.674 1
1 59 . 16 1 1 A 6 6 ASP CB C 66 40.500 40.877 -0.377 1
1 60 . 16 1 1 A 6 6 ASP N N 66 120.500 120.683 -0.183 1
1 61 . 16 1 1 A 7 7 TRP H H 67 7.190 8.030 -0.840 1
1 62 . 16 1 1 A 7 7 TRP HA H 67 3.860 4.379 -0.519 1
1 71 . 16 1 1 A 7 7 TRP C C 67 177.200 178.574 -1.374 1
1 72 . 16 1 1 A 7 7 TRP CA C 67 61.100 60.080 1.020 1
1 73 . 16 1 1 A 7 7 TRP CB C 67 28.300 28.903 -0.603 1
1 79 . 16 1 1 A 7 7 TRP N N 67 120.700 120.596 0.104 1
1 81 . 16 1 1 A 8 8 ALA H H 68 9.040 8.314 0.726 1
1 82 . 16 1 1 A 8 8 ALA HA H 68 3.730 3.835 -0.105 1
1 86 . 16 1 1 A 8 8 ALA C C 68 179.500 179.504 -0.004 1
1 87 . 16 1 1 A 8 8 ALA CA C 68 55.200 55.249 -0.049 1
1 88 . 16 1 1 A 8 8 ALA CB C 68 18.600 18.051 0.549 1
1 89 . 16 1 1 A 8 8 ALA N N 68 125.700 121.907 3.793 1
1 90 . 16 1 1 A 9 9 GLU H H 69 8.060 7.944 0.116 1
1 91 . 16 1 1 A 9 9 GLU HA H 69 4.020 4.099 -0.079 1
1 96 . 16 1 1 A 9 9 GLU C C 69 180.400 178.536 1.864 1
1 97 . 16 1 1 A 9 9 GLU CA C 69 58.800 59.484 -0.684 1
1 98 . 16 1 1 A 9 9 GLU CB C 69 28.500 29.356 -0.856 1
1 99 . 16 1 1 A 9 9 GLU N N 69 115.400 118.571 -3.171 1
1 100 . 16 1 1 A 10 10 LYS H H 70 7.740 8.042 -0.302 1
1 101 . 16 1 1 A 10 10 LYS HA H 70 3.910 4.034 -0.124 1
1 110 . 16 1 1 A 10 10 LYS C C 70 179.500 178.848 0.652 1
1 111 . 16 1 1 A 10 10 LYS CA C 70 60.000 59.271 0.729 1
1 112 . 16 1 1 A 10 10 LYS CB C 70 32.400 32.069 0.331 1
1 116 . 16 1 1 A 10 10 LYS N N 70 122.700 119.197 3.503 1
1 117 . 16 1 1 A 11 11 PHE H H 71 8.750 8.030 0.720 1
1 118 . 16 1 1 A 11 11 PHE HA H 71 4.080 4.219 -0.139 1
1 126 . 16 1 1 A 11 11 PHE C C 71 177.100 177.159 -0.059 1
1 127 . 16 1 1 A 11 11 PHE CA C 71 61.200 61.202 -0.002 1
1 128 . 16 1 1 A 11 11 PHE CB C 71 38.900 38.937 -0.037 1
1 134 . 16 1 1 A 11 11 PHE N N 71 123.500 120.335 3.165 1
1 135 . 16 1 1 A 12 12 LEU H H 72 8.400 8.632 -0.232 1
1 136 . 16 1 1 A 12 12 LEU HA H 72 3.520 3.811 -0.291 1
1 146 . 16 1 1 A 12 12 LEU C C 72 180.000 178.999 1.001 1
1 147 . 16 1 1 A 12 12 LEU CA C 72 58.200 57.997 0.203 1
1 148 . 16 1 1 A 12 12 LEU CB C 72 41.700 41.572 0.128 1
1 152 . 16 1 1 A 12 12 LEU N N 72 121.100 119.302 1.798 1
1 153 . 16 1 1 A 13 13 LYS H H 73 7.810 8.605 -0.795 1
1 154 . 16 1 1 A 13 13 LYS HA H 73 4.080 3.863 0.217 1
1 156 . 16 1 1 A 13 13 LYS C C 73 179.300 178.878 0.422 1
1 157 . 16 1 1 A 13 13 LYS CA C 73 59.000 59.711 -0.711 1
1 158 . 16 1 1 A 13 13 LYS CB C 73 31.900 32.291 -0.391 1
1 159 . 16 1 1 A 13 13 LYS N N 73 119.400 120.697 -1.297 1
1 160 . 16 1 1 A 14 14 SER H H 74 8.210 8.305 -0.095 1
1 161 . 16 1 1 A 14 14 SER HA H 74 4.210 4.024 0.186 1
1 164 . 16 1 1 A 14 14 SER C C 74 176.300 176.752 -0.452 1
1 165 . 16 1 1 A 14 14 SER CA C 74 61.400 62.046 -0.646 1
1 166 . 16 1 1 A 14 14 SER CB C 74 62.600 62.822 -0.222 1
1 167 . 16 1 1 A 14 14 SER N N 74 117.600 117.655 -0.055 1
1 168 . 16 1 1 A 15 15 LYS H H 75 7.760 7.912 -0.152 1
1 169 . 16 1 1 A 15 15 LYS HA H 75 4.040 3.888 0.152 1
1 178 . 16 1 1 A 15 15 LYS C C 75 178.500 178.768 -0.268 1
1 179 . 16 1 1 A 15 15 LYS CA C 75 56.500 59.321 -2.821 1
1 180 . 16 1 1 A 15 15 LYS CB C 75 30.600 31.684 -1.084 1
1 184 . 16 1 1 A 15 15 LYS N N 75 120.100 121.647 -1.547 1
1 185 . 16 1 1 A 16 16 GLU H H 76 7.680 8.695 -1.015 1
1 186 . 16 1 1 A 16 16 GLU HA H 76 4.030 4.040 -0.010 1
1 191 . 16 1 1 A 16 16 GLU C C 76 179.900 178.529 1.371 1
1 192 . 16 1 1 A 16 16 GLU CA C 76 59.200 59.704 -0.504 1
1 193 . 16 1 1 A 16 16 GLU CB C 76 29.600 29.300 0.300 1
1 195 . 16 1 1 A 16 16 GLU N N 76 119.700 119.451 0.249 1
1 196 . 16 1 1 A 17 17 ALA H H 77 8.030 7.489 0.541 1
1 197 . 16 1 1 A 17 17 ALA HA H 77 4.200 4.165 0.035 1
1 201 . 16 1 1 A 17 17 ALA C C 77 178.900 178.864 0.036 1
1 202 . 16 1 1 A 17 17 ALA CA C 77 54.400 53.572 0.828 1
1 203 . 16 1 1 A 17 17 ALA CB C 77 18.100 18.334 -0.234 1
1 204 . 16 1 1 A 17 17 ALA N N 77 123.000 120.955 2.045 1
1 205 . 16 1 1 A 18 18 ASP H H 78 7.860 7.526 0.334 1
1 206 . 16 1 1 A 18 18 ASP HA H 78 4.600 4.684 -0.084 1
1 209 . 16 1 1 A 18 18 ASP C C 78 177.500 176.255 1.245 1
1 210 . 16 1 1 A 18 18 ASP CA C 78 55.100 54.046 1.054 1
1 211 . 16 1 1 A 18 18 ASP CB C 78 41.400 41.215 0.185 1
1 212 . 16 1 1 A 18 18 ASP N N 78 117.700 116.758 0.942 1
1 213 . 16 1 1 A 19 19 GLY H H 79 7.910 7.567 0.343 1
1 214 . 16 1 1 A 19 19 GLY HA2 H 79 3.860 3.993 -0.133 1
1 215 . 16 1 1 A 19 19 GLY HA3 H 79 4.080 3.994 0.086 1
1 216 . 16 1 1 A 19 19 GLY C C 79 175.300 174.551 0.749 1
1 217 . 16 1 1 A 19 19 GLY CA C 79 46.200 45.605 0.595 1
1 218 . 16 1 1 A 19 19 GLY N N 79 107.100 107.618 -0.518 1
1 219 . 16 1 1 A 20 20 VAL H H 80 7.150 7.774 -0.624 1
1 220 . 16 1 1 A 20 20 VAL HA H 80 4.250 4.517 -0.267 1
1 228 . 16 1 1 A 20 20 VAL C C 80 175.100 175.653 -0.553 1
1 229 . 16 1 1 A 20 20 VAL CA C 80 61.800 60.200 1.600 1
1 230 . 16 1 1 A 20 20 VAL CB C 80 32.200 33.659 -1.459 1
1 233 . 16 1 1 A 20 20 VAL N N 80 114.600 117.724 -3.124 1
1 234 . 16 1 1 A 21 21 SER H H 81 8.560 8.644 -0.084 1
1 235 . 16 1 1 A 21 21 SER HA H 81 4.390 4.787 -0.397 1
1 238 . 16 1 1 A 21 21 SER C C 81 174.600 175.870 -1.270 1
1 239 . 16 1 1 A 21 21 SER CA C 81 57.900 57.191 0.709 1
1 240 . 16 1 1 A 21 21 SER CB C 81 64.700 65.642 -0.942 1
1 241 . 16 1 1 A 21 21 SER N N 81 118.700 116.888 1.812 1
1 242 . 16 1 1 A 22 22 VAL H H 82 8.690 8.800 -0.110 1
1 243 . 16 1 1 A 22 22 VAL HA H 82 3.700 3.634 0.066 1
1 251 . 16 1 1 A 22 22 VAL C C 82 178.000 177.864 0.136 1
1 252 . 16 1 1 A 22 22 VAL CA C 82 66.500 66.563 -0.063 1
1 253 . 16 1 1 A 22 22 VAL CB C 82 31.700 31.659 0.041 1
1 256 . 16 1 1 A 22 22 VAL N N 82 122.100 121.914 0.186 1
1 257 . 16 1 1 A 23 23 SER H H 83 8.300 8.186 0.114 1
1 258 . 16 1 1 A 23 23 SER HA H 83 4.210 4.044 0.166 1
1 261 . 16 1 1 A 23 23 SER C C 83 177.600 176.496 1.104 1
1 262 . 16 1 1 A 23 23 SER CA C 83 61.400 61.773 -0.373 1
1 263 . 16 1 1 A 23 23 SER CB C 83 62.400 62.295 0.105 1
1 264 . 16 1 1 A 23 23 SER N N 83 113.600 114.518 -0.918 1
1 265 . 16 1 1 A 24 24 GLN H H 84 7.820 7.911 -0.091 1
1 266 . 16 1 1 A 24 24 GLN HA H 84 3.970 3.871 0.099 1
1 273 . 16 1 1 A 24 24 GLN C C 84 178.400 177.846 0.554 1
1 274 . 16 1 1 A 24 24 GLN CA C 84 58.400 58.793 -0.393 1
1 275 . 16 1 1 A 24 24 GLN CB C 84 28.900 28.102 0.798 1
1 278 . 16 1 1 A 24 24 GLN N N 84 122.900 121.030 1.870 1
1 280 . 16 1 1 A 25 25 LEU H H 85 8.920 8.108 0.812 1
1 281 . 16 1 1 A 25 25 LEU HA H 85 4.130 4.255 -0.125 1
1 291 . 16 1 1 A 25 25 LEU C C 85 178.800 178.682 0.118 1
1 292 . 16 1 1 A 25 25 LEU CA C 85 58.300 57.802 0.498 1
1 293 . 16 1 1 A 25 25 LEU CB C 85 41.200 41.698 -0.498 1
1 297 . 16 1 1 A 25 25 LEU N N 85 122.200 121.111 1.089 1
1 298 . 16 1 1 A 26 26 ASN H H 86 8.860 8.939 -0.079 1
1 299 . 16 1 1 A 26 26 ASN HA H 86 4.420 4.368 0.052 1
1 304 . 16 1 1 A 26 26 ASN C C 86 179.000 178.241 0.759 1
1 305 . 16 1 1 A 26 26 ASN CA C 86 55.900 56.237 -0.337 1
1 306 . 16 1 1 A 26 26 ASN CB C 86 37.200 37.537 -0.337 1
1 308 . 16 1 1 A 26 26 ASN N N 86 117.600 117.211 0.389 1
1 310 . 16 1 1 A 27 27 SER H H 87 7.840 7.781 0.059 1
1 311 . 16 1 1 A 27 27 SER HA H 87 4.100 3.911 0.189 1
1 314 . 16 1 1 A 27 27 SER C C 87 179.000 176.131 2.869 1
1 315 . 16 1 1 A 27 27 SER CA C 87 62.100 62.079 0.021 1
1 316 . 16 1 1 A 27 27 SER CB C 87 62.100 62.887 -0.787 1
1 317 . 16 1 1 A 27 27 SER N N 87 118.500 116.319 2.181 1
1 318 . 16 1 1 A 28 28 TYR H H 88 8.180 7.504 0.676 1
1 319 . 16 1 1 A 28 28 TYR HA H 88 4.600 4.540 0.060 1
1 326 . 16 1 1 A 28 28 TYR C C 88 174.800 178.606 -3.806 1
1 327 . 16 1 1 A 28 28 TYR CA C 88 61.200 61.952 -0.752 1
1 328 . 16 1 1 A 28 28 TYR CB C 88 37.800 38.199 -0.399 1
1 333 . 16 1 1 A 28 28 TYR N N 88 119.300 119.846 -0.546 1
1 334 . 16 1 1 A 29 29 LYS H H 89 9.040 8.107 0.933 1
1 335 . 16 1 1 A 29 29 LYS HA H 89 3.890 4.379 -0.489 1
1 344 . 16 1 1 A 29 29 LYS C C 89 179.000 179.348 -0.348 1
1 345 . 16 1 1 A 29 29 LYS CA C 89 61.300 59.248 2.052 1
1 346 . 16 1 1 A 29 29 LYS CB C 89 32.800 31.995 0.805 1
1 350 . 16 1 1 A 29 29 LYS N N 89 119.300 119.819 -0.519 1
1 351 . 16 1 1 A 30 30 ASN H H 90 7.770 8.229 -0.459 1
1 352 . 16 1 1 A 30 30 ASN HA H 90 4.560 4.451 0.109 1
1 357 . 16 1 1 A 30 30 ASN C C 90 178.300 177.725 0.575 1
1 358 . 16 1 1 A 30 30 ASN CA C 90 56.200 56.264 -0.064 1
1 359 . 16 1 1 A 30 30 ASN CB C 90 38.900 38.703 0.197 1
1 361 . 16 1 1 A 30 30 ASN N N 90 117.800 117.834 -0.034 1
1 363 . 16 1 1 A 31 31 TYR H H 91 8.860 7.473 1.387 1
1 364 . 16 1 1 A 31 31 TYR HA H 91 4.910 4.526 0.384 1
1 371 . 16 1 1 A 31 31 TYR C C 91 178.300 178.965 -0.665 1
1 372 . 16 1 1 A 31 31 TYR CA C 91 59.700 60.893 -1.193 1
1 373 . 16 1 1 A 31 31 TYR CB C 91 37.500 37.542 -0.042 1
1 378 . 16 1 1 A 31 31 TYR N N 91 119.400 118.643 0.757 1
1 379 . 16 1 1 A 32 32 CYS H H 92 8.640 8.375 0.265 1
1 380 . 16 1 1 A 32 32 CYS HA H 92 4.410 4.477 -0.067 1
1 383 . 16 1 1 A 32 32 CYS C C 92 173.700 176.602 -2.902 1
1 384 . 16 1 1 A 32 32 CYS CA C 92 65.500 62.092 3.408 1
1 385 . 16 1 1 A 32 32 CYS CB C 92 28.300 27.633 0.667 1
1 386 . 16 1 1 A 32 32 CYS N N 92 113.500 119.624 -6.124 1
1 387 . 16 1 1 A 33 33 ARG H H 93 8.440 8.485 -0.045 1
1 388 . 16 1 1 A 33 33 ARG HA H 93 3.740 3.991 -0.251 1
1 391 . 16 1 1 A 33 33 ARG C C 93 177.200 178.714 -1.514 1
1 392 . 16 1 1 A 33 33 ARG CA C 93 58.300 58.583 -0.283 1
1 393 . 16 1 1 A 33 33 ARG CB C 93 30.200 30.281 -0.081 1
1 394 . 16 1 1 A 33 33 ARG N N 93 111.400 121.616 -10.216 1
1 395 . 16 1 1 A 34 34 ASN H H 94 8.020 7.740 0.280 1
1 396 . 16 1 1 A 34 34 ASN HA H 94 4.980 4.502 0.478 1
1 401 . 16 1 1 A 34 34 ASN C C 94 176.700 177.484 -0.784 1
1 402 . 16 1 1 A 34 34 ASN CA C 94 53.400 55.629 -2.229 1
1 403 . 16 1 1 A 34 34 ASN CB C 94 38.000 38.598 -0.598 1
1 405 . 16 1 1 A 34 34 ASN N N 94 113.600 117.677 -4.077 1
1 407 . 16 1 1 A 35 35 HIS H H 95 7.200 7.504 -0.304 1
1 408 . 16 1 1 A 35 35 HIS HA H 95 4.470 4.497 -0.027 1
1 411 . 16 1 1 A 35 35 HIS C C 95 176.600 176.292 0.308 1
1 412 . 16 1 1 A 35 35 HIS CA C 95 60.000 58.983 1.017 1
1 413 . 16 1 1 A 35 35 HIS CB C 95 30.500 31.159 -0.659 1
1 414 . 16 1 1 A 35 35 HIS N N 95 115.600 117.958 -2.358 1
1 415 . 16 1 1 A 36 36 LEU H H 96 8.170 8.387 -0.217 1
1 416 . 16 1 1 A 36 36 LEU HA H 96 4.730 4.522 0.208 1
1 426 . 16 1 1 A 36 36 LEU C C 96 176.800 177.364 -0.564 1
1 427 . 16 1 1 A 36 36 LEU CA C 96 54.400 54.599 -0.199 1
1 428 . 16 1 1 A 36 36 LEU CB C 96 40.600 41.880 -1.280 1
1 432 . 16 1 1 A 36 36 LEU N N 96 114.000 118.814 -4.814 1
1 433 . 16 1 1 A 37 37 SER H H 97 7.140 8.311 -1.171 1
1 434 . 16 1 1 A 37 37 SER HA H 97 4.730 4.233 0.497 1
1 437 . 16 1 1 A 37 37 SER CA C 97 62.700 62.789 -0.089 1
1 438 . 16 1 1 A 37 37 SER CB C 97 62.600 61.604 0.996 1
1 439 . 16 1 1 A 37 37 SER N N 97 117.200 116.038 1.162 1
1 440 . 16 1 1 A 38 38 PRO HA H 98 4.560 4.406 0.154 1
1 447 . 16 1 1 A 38 38 PRO C C 98 177.900 179.324 -1.424 1
1 448 . 16 1 1 A 38 38 PRO CA C 98 65.700 65.971 -0.271 1
1 449 . 16 1 1 A 38 38 PRO CB C 98 31.800 30.805 0.995 1
1 452 . 16 1 1 A 39 39 LEU H H 99 8.090 7.610 0.480 1
1 453 . 16 1 1 A 39 39 LEU HA H 99 4.260 4.016 0.244 1
1 463 . 16 1 1 A 39 39 LEU C C 99 178.700 178.781 -0.081 1
1 464 . 16 1 1 A 39 39 LEU CA C 99 54.300 57.476 -3.176 1
1 465 . 16 1 1 A 39 39 LEU CB C 99 42.400 41.460 0.940 1
1 469 . 16 1 1 A 39 39 LEU N N 99 112.400 116.930 -4.530 1
1 470 . 16 1 1 A 40 40 TYR H H 100 8.350 8.555 -0.205 1
1 471 . 16 1 1 A 40 40 TYR HA H 100 4.170 4.326 -0.156 1
1 478 . 16 1 1 A 40 40 TYR C C 100 178.300 178.453 -0.153 1
1 479 . 16 1 1 A 40 40 TYR CA C 100 63.400 61.835 1.565 1
1 480 . 16 1 1 A 40 40 TYR CB C 100 38.600 39.047 -0.447 1
1 485 . 16 1 1 A 40 40 TYR N N 100 119.400 120.598 -1.198 1
1 486 . 16 1 1 A 41 41 MET H H 101 8.640 7.926 0.714 1
1 487 . 16 1 1 A 41 41 MET HA H 101 4.260 4.541 -0.281 1
1 488 . 16 1 1 A 41 41 MET C C 101 177.000 176.264 0.736 1
1 489 . 16 1 1 A 41 41 MET CA C 101 54.600 57.350 -2.750 1
1 490 . 16 1 1 A 41 41 MET N N 101 111.800 118.092 -6.292 1
1 491 . 16 1 1 A 42 42 LYS H H 102 7.880 7.726 0.154 1
1 492 . 16 1 1 A 42 42 LYS HA H 102 4.430 4.702 -0.272 1
1 501 . 16 1 1 A 42 42 LYS C C 102 176.300 176.009 0.291 1
1 502 . 16 1 1 A 42 42 LYS CA C 102 56.000 54.929 1.071 1
1 503 . 16 1 1 A 42 42 LYS CB C 102 33.400 33.458 -0.058 1
1 507 . 16 1 1 A 42 42 LYS N N 102 121.700 120.659 1.041 1
1 508 . 16 1 1 A 43 43 SER H H 103 9.160 8.527 0.633 1
1 509 . 16 1 1 A 43 43 SER HA H 103 4.620 4.912 -0.292 1
1 513 . 16 1 1 A 43 43 SER C C 103 176.300 175.368 0.932 1
1 514 . 16 1 1 A 43 43 SER CA C 103 58.700 56.487 2.213 1
1 515 . 16 1 1 A 43 43 SER CB C 103 63.700 65.479 -1.779 1
1 516 . 16 1 1 A 43 43 SER N N 103 118.800 116.614 2.186 1
1 517 . 16 1 1 A 44 44 LEU H H 104 8.860 8.984 -0.124 1
1 518 . 16 1 1 A 44 44 LEU HA H 104 4.130 4.198 -0.068 1
1 528 . 16 1 1 A 44 44 LEU C C 104 178.700 177.801 0.899 1
1 529 . 16 1 1 A 44 44 LEU CA C 104 58.800 57.987 0.813 1
1 530 . 16 1 1 A 44 44 LEU CB C 104 42.600 41.439 1.161 1
1 534 . 16 1 1 A 44 44 LEU N N 104 124.200 127.175 -2.975 1
1 535 . 16 1 1 A 45 45 SER H H 105 8.330 8.178 0.152 1
1 536 . 16 1 1 A 45 45 SER HA H 105 4.310 4.400 -0.090 1
1 539 . 16 1 1 A 45 45 SER C C 105 175.000 175.566 -0.566 1
1 540 . 16 1 1 A 45 45 SER CA C 105 60.100 59.151 0.949 1
1 541 . 16 1 1 A 45 45 SER CB C 105 63.400 63.097 0.303 1
1 542 . 16 1 1 A 45 45 SER N N 105 107.700 113.515 -5.815 1
1 543 . 16 1 1 A 46 46 GLU H H 106 7.800 8.185 -0.385 1
1 544 . 16 1 1 A 46 46 GLU HA H 106 4.570 4.462 0.108 1
1 549 . 16 1 1 A 46 46 GLU C C 106 174.100 176.733 -2.633 1
1 550 . 16 1 1 A 46 46 GLU CA C 106 55.600 57.241 -1.641 1
1 551 . 16 1 1 A 46 46 GLU CB C 106 31.200 30.399 0.801 1
1 553 . 16 1 1 A 46 46 GLU N N 106 119.600 120.116 -0.516 1
1 554 . 16 1 1 A 47 47 ILE H H 107 7.100 7.465 -0.365 1
1 555 . 16 1 1 A 47 47 ILE HA H 107 4.040 4.044 -0.004 1
1 565 . 16 1 1 A 47 47 ILE C C 107 174.100 175.227 -1.127 1
1 566 . 16 1 1 A 47 47 ILE CA C 107 62.300 61.864 0.436 1
1 567 . 16 1 1 A 47 47 ILE CB C 107 38.500 38.506 -0.006 1
1 571 . 16 1 1 A 47 47 ILE N N 107 120.600 122.650 -2.050 1
1 572 . 16 1 1 A 48 48 LEU H H 108 9.180 9.072 0.108 1
1 573 . 16 1 1 A 48 48 LEU HA H 108 4.940 4.721 0.219 1
1 583 . 16 1 1 A 48 48 LEU CA C 108 51.900 51.968 -0.068 1
1 584 . 16 1 1 A 48 48 LEU CB C 108 42.000 43.154 -1.154 1
1 588 . 16 1 1 A 48 48 LEU N N 108 129.400 127.362 2.038 1
1 589 . 16 1 1 A 49 49 PRO HA H 109 3.910 4.293 -0.383 1
1 596 . 16 1 1 A 49 49 PRO C C 109 178.500 177.727 0.773 1
1 597 . 16 1 1 A 49 49 PRO CA C 109 66.600 64.820 1.780 1
1 598 . 16 1 1 A 49 49 PRO CB C 109 31.300 31.760 -0.460 1
1 601 . 16 1 1 A 50 50 ALA H H 110 8.280 8.152 0.128 1
1 602 . 16 1 1 A 50 50 ALA HA H 110 4.110 4.109 0.001 1
1 606 . 16 1 1 A 50 50 ALA C C 110 179.700 179.802 -0.102 1
1 607 . 16 1 1 A 50 50 ALA CA C 110 55.100 54.647 0.453 1
1 608 . 16 1 1 A 50 50 ALA CB C 110 19.200 18.315 0.885 1
1 609 . 16 1 1 A 50 50 ALA N N 110 116.100 119.166 -3.066 1
1 610 . 16 1 1 A 51 51 ASP H H 111 7.790 8.042 -0.252 1
1 611 . 16 1 1 A 51 51 ASP HA H 111 4.440 4.313 0.127 1
1 614 . 16 1 1 A 51 51 ASP C C 111 178.200 178.986 -0.786 1
1 615 . 16 1 1 A 51 51 ASP CA C 111 57.600 57.503 0.097 1
1 616 . 16 1 1 A 51 51 ASP CB C 111 41.800 40.769 1.031 1
1 617 . 16 1 1 A 51 51 ASP N N 111 116.500 118.476 -1.976 1
1 618 . 16 1 1 A 52 52 ILE H H 112 7.020 8.006 -0.986 1
1 619 . 16 1 1 A 52 52 ILE HA H 112 3.750 3.696 0.054 1
1 629 . 16 1 1 A 52 52 ILE C C 112 177.300 177.746 -0.446 1
1 630 . 16 1 1 A 52 52 ILE CA C 112 63.500 65.090 -1.590 1
1 631 . 16 1 1 A 52 52 ILE CB C 112 37.500 36.943 0.557 1
1 635 . 16 1 1 A 52 52 ILE N N 112 116.700 120.018 -3.318 1
1 636 . 16 1 1 A 53 53 GLN H H 113 9.150 8.262 0.888 1
1 637 . 16 1 1 A 53 53 GLN HA H 113 3.720 3.965 -0.245 1
1 644 . 16 1 1 A 53 53 GLN C C 113 177.500 178.091 -0.591 1
1 645 . 16 1 1 A 53 53 GLN CA C 113 58.200 58.934 -0.734 1
1 646 . 16 1 1 A 53 53 GLN CB C 113 30.200 28.636 1.564 1
1 649 . 16 1 1 A 53 53 GLN N N 113 121.200 121.556 -0.356 1
1 651 . 16 1 1 A 54 54 SER H H 114 8.150 8.603 -0.453 1
1 652 . 16 1 1 A 54 54 SER HA H 114 4.180 4.172 0.008 1
1 655 . 16 1 1 A 54 54 SER C C 114 175.900 177.657 -1.757 1
1 656 . 16 1 1 A 54 54 SER CA C 114 62.100 61.530 0.570 1
1 657 . 16 1 1 A 54 54 SER CB C 114 62.800 62.500 0.300 1
1 658 . 16 1 1 A 54 54 SER N N 114 112.200 115.117 -2.917 1
1 659 . 16 1 1 A 55 55 ILE H H 115 6.760 7.574 -0.814 1
1 660 . 16 1 1 A 55 55 ILE HA H 115 3.860 3.680 0.180 1
1 670 . 16 1 1 A 55 55 ILE C C 115 179.200 178.245 0.955 1
1 671 . 16 1 1 A 55 55 ILE CA C 115 64.700 65.322 -0.622 1
1 672 . 16 1 1 A 55 55 ILE CB C 115 38.900 38.075 0.825 1
1 676 . 16 1 1 A 55 55 ILE N N 115 119.500 122.406 -2.906 1
1 677 . 16 1 1 A 56 56 ILE H H 116 7.750 8.290 -0.540 1
1 678 . 16 1 1 A 56 56 ILE HA H 116 3.690 3.564 0.126 1
1 688 . 16 1 1 A 56 56 ILE C C 116 176.900 178.128 -1.228 1
1 689 . 16 1 1 A 56 56 ILE CA C 116 62.800 65.205 -2.405 1
1 690 . 16 1 1 A 56 56 ILE CB C 116 36.200 37.668 -1.468 1
1 694 . 16 1 1 A 56 56 ILE N N 116 120.200 120.002 0.198 1
1 695 . 16 1 1 A 57 57 ASN H H 117 8.690 8.371 0.319 1
1 696 . 16 1 1 A 57 57 ASN HA H 117 4.440 4.461 -0.021 1
1 701 . 16 1 1 A 57 57 ASN C C 117 177.200 176.646 0.554 1
1 702 . 16 1 1 A 57 57 ASN CA C 117 54.800 56.295 -1.495 1
1 703 . 16 1 1 A 57 57 ASN CB C 117 38.100 38.694 -0.594 1
1 705 . 16 1 1 A 57 57 ASN N N 117 117.000 119.365 -2.365 1
1 707 . 16 1 1 A 58 58 GLU H H 118 7.630 7.578 0.052 1
1 708 . 16 1 1 A 58 58 GLU HA H 118 4.450 4.411 0.039 1
1 713 . 16 1 1 A 58 58 GLU C C 118 176.500 175.286 1.214 1
1 714 . 16 1 1 A 58 58 GLU CA C 118 56.200 56.075 0.125 1
1 715 . 16 1 1 A 58 58 GLU CB C 118 30.200 30.578 -0.378 1
1 717 . 16 1 1 A 58 58 GLU N N 118 116.300 116.132 0.168 1
1 718 . 16 1 1 A 59 59 THR H H 119 7.540 7.422 0.118 1
1 719 . 16 1 1 A 59 59 THR HA H 119 4.230 4.564 -0.334 1
1 724 . 16 1 1 A 59 59 THR C C 119 174.200 173.535 0.665 1
1 725 . 16 1 1 A 59 59 THR CA C 119 63.800 62.196 1.604 1
1 726 . 16 1 1 A 59 59 THR CB C 119 68.900 69.280 -0.380 1
1 728 . 16 1 1 A 59 59 THR N N 119 117.600 116.386 1.214 1
1 729 . 16 1 1 A 60 60 LYS H H 120 8.860 9.002 -0.142 1
1 730 . 16 1 1 A 60 60 LYS HA H 120 4.490 4.690 -0.200 1
1 739 . 16 1 1 A 60 60 LYS C C 120 175.800 175.168 0.632 1
1 740 . 16 1 1 A 60 60 LYS CA C 120 54.900 55.809 -0.909 1
1 741 . 16 1 1 A 60 60 LYS CB C 120 29.800 31.671 -1.871 1
1 745 . 16 1 1 A 60 60 LYS N N 120 128.500 127.898 0.602 1
1 746 . 16 1 1 A 61 61 LEU H H 121 7.150 7.972 -0.822 1
1 747 . 16 1 1 A 61 61 LEU HA H 121 4.710 4.928 -0.218 1
1 757 . 16 1 1 A 61 61 LEU C C 121 175.000 175.876 -0.876 1
1 758 . 16 1 1 A 61 61 LEU CA C 121 52.800 53.245 -0.445 1
1 759 . 16 1 1 A 61 61 LEU CB C 121 46.400 45.618 0.782 1
1 763 . 16 1 1 A 61 61 LEU N N 121 120.700 125.820 -5.120 1
1 764 . 16 1 1 A 62 62 ALA H H 122 8.000 8.523 -0.523 1
1 765 . 16 1 1 A 62 62 ALA HA H 122 4.250 4.395 -0.145 1
1 769 . 16 1 1 A 62 62 ALA CA C 122 52.100 52.356 -0.256 1
1 770 . 16 1 1 A 62 62 ALA CB C 122 19.500 19.208 0.292 1
1 771 . 16 1 1 A 62 62 ALA N N 122 119.900 123.373 -3.473 1
1 772 . 16 1 1 A 63 63 LYS H H 123 8.770 8.959 -0.189 1
1 773 . 16 1 1 A 63 63 LYS HA H 123 3.800 3.954 -0.154 1
1 782 . 16 1 1 A 63 63 LYS C C 123 178.300 179.002 -0.702 1
1 783 . 16 1 1 A 63 63 LYS CA C 123 60.700 59.664 1.036 1
1 784 . 16 1 1 A 63 63 LYS CB C 123 32.300 32.078 0.222 1
1 788 . 16 1 1 A 63 63 LYS N N 123 121.400 122.534 -1.134 1
1 789 . 16 1 1 A 64 64 ASN H H 124 9.020 8.015 1.005 1
1 790 . 16 1 1 A 64 64 ASN HA H 124 4.430 4.522 -0.092 1
1 795 . 16 1 1 A 64 64 ASN C C 124 178.300 177.827 0.473 1
1 796 . 16 1 1 A 64 64 ASN CA C 124 56.200 56.218 -0.018 1
1 797 . 16 1 1 A 64 64 ASN CB C 124 37.300 38.914 -1.614 1
1 799 . 16 1 1 A 64 64 ASN N N 124 115.000 117.989 -2.989 1
1 801 . 16 1 1 A 65 65 THR H H 125 7.620 7.869 -0.249 1
1 802 . 16 1 1 A 65 65 THR HA H 125 4.030 4.054 -0.024 1
1 807 . 16 1 1 A 65 65 THR C C 125 175.500 176.832 -1.332 1
1 808 . 16 1 1 A 65 65 THR CA C 125 66.000 66.993 -0.993 1
1 809 . 16 1 1 A 65 65 THR CB C 125 67.600 67.878 -0.278 1
1 811 . 16 1 1 A 65 65 THR N N 125 119.800 116.328 3.472 1
1 812 . 16 1 1 A 66 66 LEU H H 126 8.020 8.080 -0.060 1
1 813 . 16 1 1 A 66 66 LEU HA H 126 3.790 3.848 -0.058 1
1 823 . 16 1 1 A 66 66 LEU C C 126 179.200 179.314 -0.114 1
1 824 . 16 1 1 A 66 66 LEU CA C 126 58.700 57.993 0.707 1
1 825 . 16 1 1 A 66 66 LEU CB C 126 41.300 41.249 0.051 1
1 829 . 16 1 1 A 66 66 LEU N N 126 121.200 121.721 -0.521 1
1 830 . 16 1 1 A 67 67 LYS H H 127 8.380 7.974 0.406 1
1 831 . 16 1 1 A 67 67 LYS HA H 127 3.740 4.010 -0.270 1
1 840 . 16 1 1 A 67 67 LYS C C 127 178.300 179.416 -1.116 1
1 841 . 16 1 1 A 67 67 LYS CA C 127 60.100 59.725 0.375 1
1 842 . 16 1 1 A 67 67 LYS CB C 127 32.400 32.298 0.102 1
1 846 . 16 1 1 A 67 67 LYS N N 127 117.000 118.169 -1.169 1
1 847 . 16 1 1 A 68 68 ALA H H 128 7.480 7.918 -0.438 1
1 848 . 16 1 1 A 68 68 ALA HA H 128 4.210 3.918 0.292 1
1 852 . 16 1 1 A 68 68 ALA C C 128 181.200 180.063 1.137 1
1 853 . 16 1 1 A 68 68 ALA CA C 128 55.200 54.968 0.232 1
1 854 . 16 1 1 A 68 68 ALA CB C 128 18.600 17.944 0.656 1
1 855 . 16 1 1 A 68 68 ALA N N 128 122.900 121.905 0.995 1
1 856 . 16 1 1 A 69 69 ILE H H 129 8.250 7.590 0.660 1
1 857 . 16 1 1 A 69 69 ILE HA H 129 3.130 3.060 0.070 1
1 867 . 16 1 1 A 69 69 ILE C C 129 177.400 177.773 -0.373 1
1 868 . 16 1 1 A 69 69 ILE CA C 129 66.700 65.154 1.546 1
1 869 . 16 1 1 A 69 69 ILE CB C 129 37.900 37.418 0.482 1
1 873 . 16 1 1 A 69 69 ILE N N 129 122.800 118.525 4.275 1
1 874 . 16 1 1 A 70 70 ARG H H 130 8.040 7.738 0.302 1
1 875 . 16 1 1 A 70 70 ARG HA H 130 3.620 3.841 -0.221 1
1 882 . 16 1 1 A 70 70 ARG C C 130 177.800 178.768 -0.968 1
1 883 . 16 1 1 A 70 70 ARG CA C 130 60.700 59.881 0.819 1
1 884 . 16 1 1 A 70 70 ARG CB C 130 29.600 29.895 -0.295 1
1 887 . 16 1 1 A 70 70 ARG N N 130 119.700 120.440 -0.740 1
1 888 . 16 1 1 A 71 71 ASN H H 131 8.920 8.594 0.326 1
1 889 . 16 1 1 A 71 71 ASN HA H 131 4.430 4.445 -0.015 1
1 894 . 16 1 1 A 71 71 ASN C C 131 177.500 177.901 -0.401 1
1 895 . 16 1 1 A 71 71 ASN CA C 131 56.100 56.157 -0.057 1
1 896 . 16 1 1 A 71 71 ASN CB C 131 38.600 38.584 0.016 1
1 898 . 16 1 1 A 71 71 ASN N N 131 117.200 117.959 -0.759 1
1 900 . 16 1 1 A 72 72 THR H H 132 8.300 8.350 -0.050 1
1 901 . 16 1 1 A 72 72 THR HA H 132 4.430 3.701 0.729 1
1 906 . 16 1 1 A 72 72 THR C C 132 175.100 176.490 -1.390 1
1 907 . 16 1 1 A 72 72 THR CA C 132 68.200 66.352 1.848 1
1 908 . 16 1 1 A 72 72 THR CB C 132 68.500 68.718 -0.218 1
1 910 . 16 1 1 A 72 72 THR N N 132 119.200 115.530 3.670 1
1 911 . 16 1 1 A 73 73 ALA H H 133 7.950 8.080 -0.130 1
1 912 . 16 1 1 A 73 73 ALA HA H 133 4.040 3.952 0.088 1
1 916 . 16 1 1 A 73 73 ALA C C 133 178.200 179.069 -0.869 1
1 917 . 16 1 1 A 73 73 ALA CA C 133 55.900 55.319 0.581 1
1 918 . 16 1 1 A 73 73 ALA CB C 133 16.700 17.925 -1.225 1
1 919 . 16 1 1 A 73 73 ALA N N 133 120.900 123.475 -2.575 1
1 920 . 16 1 1 A 74 74 SER H H 134 8.440 8.440 0.000 1
1 921 . 16 1 1 A 74 74 SER HA H 134 4.430 4.328 0.102 1
1 924 . 16 1 1 A 74 74 SER C C 134 178.800 176.906 1.894 1
1 925 . 16 1 1 A 74 74 SER CA C 134 61.300 61.520 -0.220 1
1 926 . 16 1 1 A 74 74 SER CB C 134 62.600 62.826 -0.226 1
1 927 . 16 1 1 A 74 74 SER N N 134 110.100 113.299 -3.199 1
1 928 . 16 1 1 A 75 75 GLN H H 135 8.340 7.788 0.552 1
1 929 . 16 1 1 A 75 75 GLN HA H 135 3.880 4.096 -0.216 1
1 936 . 16 1 1 A 75 75 GLN C C 135 178.800 179.047 -0.247 1
1 937 . 16 1 1 A 75 75 GLN CA C 135 59.600 58.745 0.855 1
1 938 . 16 1 1 A 75 75 GLN CB C 135 29.900 28.472 1.428 1
1 941 . 16 1 1 A 75 75 GLN N N 135 118.100 120.510 -2.410 1
1 943 . 16 1 1 A 76 76 ILE H H 136 7.670 7.451 0.219 1
1 944 . 16 1 1 A 76 76 ILE HA H 136 3.200 3.510 -0.310 1
1 954 . 16 1 1 A 76 76 ILE C C 136 177.500 177.825 -0.325 1
1 955 . 16 1 1 A 76 76 ILE CA C 136 66.100 65.127 0.973 1
1 956 . 16 1 1 A 76 76 ILE CB C 136 37.400 37.368 0.032 1
1 960 . 16 1 1 A 76 76 ILE N N 136 122.500 120.543 1.957 1
1 961 . 16 1 1 A 77 77 PHE H H 137 7.930 7.812 0.118 1
1 962 . 16 1 1 A 77 77 PHE HA H 137 3.890 4.192 -0.302 1
1 969 . 16 1 1 A 77 77 PHE C C 137 178.200 178.351 -0.151 1
1 970 . 16 1 1 A 77 77 PHE CA C 137 63.600 60.648 2.952 1
1 971 . 16 1 1 A 77 77 PHE CB C 137 39.300 38.566 0.734 1
1 976 . 16 1 1 A 77 77 PHE N N 137 116.100 119.084 -2.984 1
1 977 . 16 1 1 A 78 78 ARG H H 138 8.900 8.178 0.722 1
1 978 . 16 1 1 A 78 78 ARG HA H 138 3.910 4.025 -0.115 1
1 986 . 16 1 1 A 78 78 ARG C C 138 178.300 178.829 -0.529 1
1 987 . 16 1 1 A 78 78 ARG CA C 138 60.100 59.039 1.061 1
1 988 . 16 1 1 A 78 78 ARG CB C 138 29.600 29.824 -0.224 1
1 991 . 16 1 1 A 78 78 ARG N N 138 118.600 119.758 -1.158 1
1 993 . 16 1 1 A 79 79 LEU H H 139 7.730 8.078 -0.348 1
1 994 . 16 1 1 A 79 79 LEU HA H 139 4.280 4.109 0.171 1
1 1004 . 16 1 1 A 79 79 LEU C C 139 179.000 178.320 0.680 1
1 1005 . 16 1 1 A 79 79 LEU CA C 139 57.800 57.863 -0.063 1
1 1006 . 16 1 1 A 79 79 LEU CB C 139 41.900 41.236 0.664 1
1 1010 . 16 1 1 A 79 79 LEU N N 139 121.900 121.544 0.356 1
1 1011 . 16 1 1 A 80 80 ALA H H 140 7.590 7.641 -0.051 1
1 1012 . 16 1 1 A 80 80 ALA HA H 140 2.710 3.097 -0.387 1
1 1016 . 16 1 1 A 80 80 ALA C C 140 179.900 180.319 -0.419 1
1 1017 . 16 1 1 A 80 80 ALA CA C 140 55.100 54.481 0.619 1
1 1018 . 16 1 1 A 80 80 ALA CB C 140 17.600 17.613 -0.013 1
1 1019 . 16 1 1 A 80 80 ALA N N 140 123.400 119.920 3.480 1
1 1020 . 16 1 1 A 81 81 ILE H H 141 8.910 7.829 1.081 1
1 1021 . 16 1 1 A 81 81 ILE HA H 141 4.110 4.173 -0.063 1
1 1031 . 16 1 1 A 81 81 ILE C C 141 181.700 177.898 3.802 1
1 1032 . 16 1 1 A 81 81 ILE CA C 141 64.800 65.406 -0.606 1
1 1033 . 16 1 1 A 81 81 ILE CB C 141 38.600 37.706 0.894 1
1 1037 . 16 1 1 A 81 81 ILE N N 141 122.400 118.674 3.726 1
1 1038 . 16 1 1 A 82 82 GLU H H 142 8.560 8.575 -0.015 1
1 1039 . 16 1 1 A 82 82 GLU HA H 142 4.100 4.098 0.002 1
1 1044 . 16 1 1 A 82 82 GLU C C 142 177.700 178.225 -0.525 1
1 1045 . 16 1 1 A 82 82 GLU CA C 142 59.100 59.682 -0.582 1
1 1046 . 16 1 1 A 82 82 GLU CB C 142 29.200 29.227 -0.027 1
1 1048 . 16 1 1 A 82 82 GLU N N 142 123.200 119.757 3.443 1
1 1049 . 16 1 1 A 83 83 ASN H H 143 7.310 7.621 -0.311 1
1 1050 . 16 1 1 A 83 83 ASN HA H 143 4.750 4.943 -0.193 1
1 1055 . 16 1 1 A 83 83 ASN C C 143 173.200 174.195 -0.995 1
1 1056 . 16 1 1 A 83 83 ASN CA C 143 54.200 52.736 1.464 1
1 1057 . 16 1 1 A 83 83 ASN CB C 143 41.300 38.732 2.568 1
1 1059 . 16 1 1 A 83 83 ASN N N 143 114.900 115.407 -0.507 1
1 1061 . 16 1 1 A 84 84 ARG H H 144 8.320 8.081 0.239 1
1 1062 . 16 1 1 A 84 84 ARG HA H 144 4.120 4.050 0.070 1
1 1069 . 16 1 1 A 84 84 ARG C C 144 175.300 175.835 -0.535 1
1 1070 . 16 1 1 A 84 84 ARG CA C 144 57.100 57.026 0.074 1
1 1071 . 16 1 1 A 84 84 ARG CB C 144 26.000 26.829 -0.829 1
1 1074 . 16 1 1 A 84 84 ARG N N 144 114.400 115.109 -0.709 1
1 1075 . 16 1 1 A 85 85 ALA H H 145 8.350 8.248 0.102 1
1 1076 . 16 1 1 A 85 85 ALA HA H 145 4.320 4.294 0.026 1
1 1080 . 16 1 1 A 85 85 ALA C C 145 176.500 177.344 -0.844 1
1 1081 . 16 1 1 A 85 85 ALA CA C 145 53.400 53.980 -0.580 1
1 1082 . 16 1 1 A 85 85 ALA CB C 145 19.900 19.854 0.046 1
1 1083 . 16 1 1 A 85 85 ALA N N 145 120.600 119.615 0.985 1
1 1084 . 16 1 1 A 86 86 ILE H H 146 7.290 7.774 -0.484 1
1 1085 . 16 1 1 A 86 86 ILE HA H 146 4.400 4.640 -0.240 1
1 1095 . 16 1 1 A 86 86 ILE C C 146 173.600 172.870 0.730 1
1 1096 . 16 1 1 A 86 86 ILE CA C 146 59.200 59.761 -0.561 1
1 1097 . 16 1 1 A 86 86 ILE CB C 146 41.600 41.871 -0.271 1
1 1101 . 16 1 1 A 86 86 ILE N N 146 111.500 115.832 -4.332 1
1 1102 . 16 1 1 A 87 87 ASP H H 147 8.270 8.886 -0.616 1
1 1103 . 16 1 1 A 87 87 ASP HA H 147 4.940 5.092 -0.152 1
1 1106 . 16 1 1 A 87 87 ASP C C 147 174.700 174.578 0.122 1
1 1107 . 16 1 1 A 87 87 ASP CA C 147 53.700 52.914 0.786 1
1 1108 . 16 1 1 A 87 87 ASP CB C 147 41.800 41.070 0.730 1
1 1109 . 16 1 1 A 87 87 ASP N N 147 119.400 128.136 -8.736 1
1 1110 . 16 1 1 A 88 88 PHE H H 148 7.230 8.140 -0.910 1
1 1111 . 16 1 1 A 88 88 PHE HA H 148 4.690 4.684 0.006 1
1 1119 . 16 1 1 A 88 88 PHE C C 148 171.500 172.689 -1.189 1
1 1120 . 16 1 1 A 88 88 PHE CA C 148 56.400 58.235 -1.835 1
1 1121 . 16 1 1 A 88 88 PHE CB C 148 42.000 42.557 -0.557 1
1 1127 . 16 1 1 A 88 88 PHE N N 148 119.700 124.516 -4.816 1
1 1128 . 16 1 1 A 89 89 ASN H H 149 8.060 8.186 -0.126 1
1 1129 . 16 1 1 A 89 89 ASN HA H 149 4.490 4.905 -0.415 1
1 1134 . 16 1 1 A 89 89 ASN CA C 149 48.100 48.843 -0.743 1
1 1135 . 16 1 1 A 89 89 ASN CB C 149 39.200 39.697 -0.497 1
1 1137 . 16 1 1 A 89 89 ASN N N 149 119.700 125.490 -5.790 1
1 1139 . 16 1 1 A 90 90 PRO HA H 150 3.970 4.419 -0.449 1
1 1146 . 16 1 1 A 90 90 PRO C C 150 177.700 177.135 0.565 1
1 1147 . 16 1 1 A 90 90 PRO CA C 150 63.900 64.194 -0.294 1
1 1148 . 16 1 1 A 90 90 PRO CB C 150 31.700 31.573 0.127 1
1 1151 . 16 1 1 A 91 91 ALA H H 151 7.240 7.894 -0.654 1
1 1152 . 16 1 1 A 91 91 ALA HA H 151 3.900 4.162 -0.262 1
1 1156 . 16 1 1 A 91 91 ALA C C 151 178.000 179.216 -1.216 1
1 1157 . 16 1 1 A 91 91 ALA CA C 151 53.900 53.922 -0.022 1
1 1158 . 16 1 1 A 91 91 ALA CB C 151 17.700 18.486 -0.786 1
1 1159 . 16 1 1 A 91 91 ALA N N 151 115.700 119.221 -3.521 1
1 1160 . 16 1 1 A 92 92 ASP H H 152 7.080 7.863 -0.783 1
1 1161 . 16 1 1 A 92 92 ASP HA H 152 4.220 4.259 -0.039 1
1 1164 . 16 1 1 A 92 92 ASP C C 152 176.200 176.863 -0.663 1
1 1165 . 16 1 1 A 92 92 ASP CA C 152 55.800 56.309 -0.509 1
1 1166 . 16 1 1 A 92 92 ASP CB C 152 39.500 40.320 -0.820 1
1 1167 . 16 1 1 A 92 92 ASP N N 152 117.100 119.158 -2.058 1
1 1168 . 16 1 1 A 93 93 TYR H H 153 7.060 7.459 -0.399 1
1 1169 . 16 1 1 A 93 93 TYR HA H 153 4.490 4.558 -0.068 1
1 1176 . 16 1 1 A 93 93 TYR C C 153 174.700 175.776 -1.076 1
1 1177 . 16 1 1 A 93 93 TYR CA C 153 57.600 58.391 -0.791 1
1 1178 . 16 1 1 A 93 93 TYR CB C 153 38.500 38.504 -0.004 1
1 1183 . 16 1 1 A 93 93 TYR N N 153 116.800 116.688 0.112 1
1 1184 . 16 1 1 A 94 94 VAL H H 154 7.000 7.046 -0.046 1
1 1185 . 16 1 1 A 94 94 VAL HA H 154 4.040 4.036 0.004 1
1 1193 . 16 1 1 A 94 94 VAL C C 154 174.700 175.321 -0.621 1
1 1194 . 16 1 1 A 94 94 VAL CA C 154 62.100 62.549 -0.449 1
1 1195 . 16 1 1 A 94 94 VAL CB C 154 32.700 31.938 0.762 1
1 1198 . 16 1 1 A 94 94 VAL N N 154 120.600 121.410 -0.810 1
1 1199 . 16 1 1 A 95 95 ARG H H 155 9.430 9.156 0.274 1
1 1200 . 16 1 1 A 95 95 ARG HA H 155 4.640 4.558 0.082 1
1 1207 . 16 1 1 A 95 95 ARG C C 155 175.400 175.896 -0.496 1
1 1208 . 16 1 1 A 95 95 ARG CA C 155 54.200 56.195 -1.995 1
1 1209 . 16 1 1 A 95 95 ARG CB C 155 32.400 30.907 1.493 1
1 1212 . 16 1 1 A 95 95 ARG N N 155 128.200 127.059 1.141 1
1 1213 . 16 1 1 A 96 96 ILE H H 156 8.700 8.707 -0.007 1
1 1214 . 16 1 1 A 96 96 ILE HA H 156 4.440 4.572 -0.132 1
1 1224 . 16 1 1 A 96 96 ILE CA C 156 56.500 58.072 -1.572 1
1 1225 . 16 1 1 A 96 96 ILE CB C 156 36.700 38.734 -2.034 1
1 1229 . 16 1 1 A 96 96 ILE N N 156 124.100 123.470 0.630 1
1 1230 . 16 1 1 A 97 97 PRO HA H 157 4.370 4.721 -0.351 1
1 1237 . 16 1 1 A 97 97 PRO C C 157 176.000 176.501 -0.501 1
1 1238 . 16 1 1 A 97 97 PRO CA C 157 63.200 62.688 0.512 1
1 1239 . 16 1 1 A 97 97 PRO CB C 157 32.400 32.074 0.326 1
1 1242 . 16 1 1 A 98 98 LYS H H 158 8.380 8.993 -0.613 1
1 1243 . 16 1 1 A 98 98 LYS HA H 158 4.190 4.292 -0.102 1
1 1252 . 16 1 1 A 98 98 LYS C C 158 176.800 176.598 0.202 1
1 1253 . 16 1 1 A 98 98 LYS CA C 158 57.100 58.257 -1.157 1
1 1254 . 16 1 1 A 98 98 LYS CB C 158 32.800 33.438 -0.638 1
1 1258 . 16 1 1 A 98 98 LYS N N 158 120.800 119.589 1.211 1
1 1259 . 16 1 1 A 99 99 ILE H H 159 7.930 7.905 0.025 1
1 1260 . 16 1 1 A 99 99 ILE HA H 159 4.200 3.870 0.330 1
1 1270 . 16 1 1 A 99 99 ILE C C 159 175.400 175.828 -0.428 1
1 1271 . 16 1 1 A 99 99 ILE CA C 159 60.600 61.874 -1.274 1
1 1272 . 16 1 1 A 99 99 ILE CB C 159 39.100 36.520 2.580 1
1 1276 . 16 1 1 A 99 99 ILE N N 159 120.200 116.759 3.441 1
1 1277 . 16 1 1 A 100 100 ALA H H 160 8.370 8.620 -0.250 1
1 1278 . 16 1 1 A 100 100 ALA HA H 160 4.370 4.624 -0.254 1
1 1282 . 16 1 1 A 100 100 ALA C C 160 177.200 177.622 -0.422 1
1 1283 . 16 1 1 A 100 100 ALA CA C 160 52.200 51.620 0.580 1
1 1284 . 16 1 1 A 100 100 ALA CB C 160 19.400 19.345 0.055 1
1 1285 . 16 1 1 A 100 100 ALA N N 160 128.300 128.929 -0.629 1
1 1286 . 16 1 1 A 101 101 LEU H H 161 8.250 7.588 0.662 1
1 1287 . 16 1 1 A 101 101 LEU HA H 161 4.280 4.475 -0.195 1
1 1297 . 16 1 1 A 101 101 LEU C C 161 177.200 176.456 0.744 1
1 1298 . 16 1 1 A 101 101 LEU CA C 161 55.200 53.168 2.032 1
1 1299 . 16 1 1 A 101 101 LEU CB C 161 42.400 42.099 0.301 1
1 1303 . 16 1 1 A 101 101 LEU N N 161 121.900 115.440 6.460 1
1 1304 . 16 1 1 A 102 102 GLU H H 162 8.390 7.922 0.468 1
1 1305 . 16 1 1 A 102 102 GLU HA H 162 4.230 4.112 0.118 1
1 1310 . 16 1 1 A 102 102 GLU C C 162 176.100 176.516 -0.416 1
1 1311 . 16 1 1 A 102 102 GLU CA C 162 56.400 56.809 -0.409 1
1 1312 . 16 1 1 A 102 102 GLU CB C 162 30.500 29.902 0.598 1
1 1314 . 16 1 1 A 102 102 GLU N N 162 121.300 120.733 0.567 1
1 1315 . 16 1 1 A 103 103 HIS H H 163 8.330 8.595 -0.265 1
1 1316 . 16 1 1 A 103 103 HIS HA H 163 4.590 5.117 -0.527 1
1 1319 . 16 1 1 A 103 103 HIS C C 163 176.100 174.258 1.842 1
1 1320 . 16 1 1 A 103 103 HIS CA C 163 56.000 53.941 2.059 1
1 1321 . 16 1 1 A 103 103 HIS CB C 163 30.500 32.660 -2.160 1
1 1322 . 16 1 1 A 103 103 HIS N N 163 120.000 121.785 -1.785 1
1 1323 . 16 1 1 A 107 107 HIS HA H 167 4.620 5.111 -0.491 1
1 1326 . 16 1 1 A 107 107 HIS C C 167 173.900 173.408 0.492 1
1 1327 . 16 1 1 A 107 107 HIS CA C 167 56.000 54.445 1.555 1
1 1328 . 16 1 1 A 107 107 HIS CB C 167 30.300 31.006 -0.706 1
1 15 . 17 1 1 A 2 2 ASP H H 62 8.760 8.614 0.146 1
1 16 . 17 1 1 A 2 2 ASP HA H 62 4.810 5.322 -0.512 1
1 19 . 17 1 1 A 2 2 ASP C C 62 175.800 175.967 -0.167 1
1 20 . 17 1 1 A 2 2 ASP CA C 62 54.800 53.048 1.752 1
1 21 . 17 1 1 A 2 2 ASP CB C 62 41.600 43.269 -1.669 1
1 22 . 17 1 1 A 2 2 ASP N N 62 120.900 120.514 0.386 1
1 23 . 17 1 1 A 3 3 SER H H 63 8.710 8.665 0.045 1
1 24 . 17 1 1 A 3 3 SER HA H 63 4.970 5.166 -0.196 1
1 27 . 17 1 1 A 3 3 SER C C 63 175.600 175.278 0.322 1
1 28 . 17 1 1 A 3 3 SER CA C 63 57.500 55.586 1.914 1
1 29 . 17 1 1 A 3 3 SER CB C 63 65.900 66.341 -0.441 1
1 30 . 17 1 1 A 3 3 SER N N 63 116.300 114.969 1.331 1
1 31 . 17 1 1 A 4 4 PHE H H 64 9.370 9.226 0.144 1
1 32 . 17 1 1 A 4 4 PHE HA H 64 4.010 4.027 -0.017 1
1 39 . 17 1 1 A 4 4 PHE C C 64 176.700 177.672 -0.972 1
1 40 . 17 1 1 A 4 4 PHE CA C 64 62.200 61.544 0.656 1
1 41 . 17 1 1 A 4 4 PHE CB C 64 38.500 39.353 -0.853 1
1 46 . 17 1 1 A 4 4 PHE N N 64 121.400 122.583 -1.183 1
1 47 . 17 1 1 A 5 5 GLY H H 65 8.930 8.032 0.898 1
1 48 . 17 1 1 A 5 5 GLY HA2 H 65 2.020 2.523 -0.503 1
1 49 . 17 1 1 A 5 5 GLY HA3 H 65 3.250 3.179 0.071 1
1 50 . 17 1 1 A 5 5 GLY C C 65 175.200 175.061 0.139 1
1 51 . 17 1 1 A 5 5 GLY CA C 65 46.300 46.512 -0.212 1
1 52 . 17 1 1 A 5 5 GLY N N 65 106.500 104.907 1.593 1
1 53 . 17 1 1 A 6 6 ASP H H 66 7.630 7.902 -0.272 1
1 54 . 17 1 1 A 6 6 ASP HA H 66 4.100 4.223 -0.123 1
1 57 . 17 1 1 A 6 6 ASP C C 66 179.500 178.487 1.013 1
1 58 . 17 1 1 A 6 6 ASP CA C 66 57.400 56.737 0.663 1
1 59 . 17 1 1 A 6 6 ASP CB C 66 40.500 41.036 -0.536 1
1 60 . 17 1 1 A 6 6 ASP N N 66 120.500 121.141 -0.641 1
1 61 . 17 1 1 A 7 7 TRP H H 67 7.190 7.600 -0.410 1
1 62 . 17 1 1 A 7 7 TRP HA H 67 3.860 4.288 -0.428 1
1 71 . 17 1 1 A 7 7 TRP C C 67 177.200 178.459 -1.259 1
1 72 . 17 1 1 A 7 7 TRP CA C 67 61.100 59.478 1.622 1
1 73 . 17 1 1 A 7 7 TRP CB C 67 28.300 28.863 -0.563 1
1 79 . 17 1 1 A 7 7 TRP N N 67 120.700 119.898 0.802 1
1 81 . 17 1 1 A 8 8 ALA H H 68 9.040 8.374 0.666 1
1 82 . 17 1 1 A 8 8 ALA HA H 68 3.730 3.892 -0.162 1
1 86 . 17 1 1 A 8 8 ALA C C 68 179.500 179.249 0.251 1
1 87 . 17 1 1 A 8 8 ALA CA C 68 55.200 55.054 0.146 1
1 88 . 17 1 1 A 8 8 ALA CB C 68 18.600 17.916 0.684 1
1 89 . 17 1 1 A 8 8 ALA N N 68 125.700 123.119 2.581 1
1 90 . 17 1 1 A 9 9 GLU H H 69 8.060 8.051 0.009 1
1 91 . 17 1 1 A 9 9 GLU HA H 69 4.020 4.059 -0.039 1
1 96 . 17 1 1 A 9 9 GLU C C 69 180.400 179.055 1.345 1
1 97 . 17 1 1 A 9 9 GLU CA C 69 58.800 59.764 -0.964 1
1 98 . 17 1 1 A 9 9 GLU CB C 69 28.500 29.129 -0.629 1
1 99 . 17 1 1 A 9 9 GLU N N 69 115.400 118.726 -3.326 1
1 100 . 17 1 1 A 10 10 LYS H H 70 7.740 7.545 0.195 1
1 101 . 17 1 1 A 10 10 LYS HA H 70 3.910 4.027 -0.117 1
1 110 . 17 1 1 A 10 10 LYS C C 70 179.500 178.836 0.664 1
1 111 . 17 1 1 A 10 10 LYS CA C 70 60.000 58.434 1.566 1
1 112 . 17 1 1 A 10 10 LYS CB C 70 32.400 32.035 0.365 1
1 116 . 17 1 1 A 10 10 LYS N N 70 122.700 118.905 3.795 1
1 117 . 17 1 1 A 11 11 PHE H H 71 8.750 8.236 0.514 1
1 118 . 17 1 1 A 11 11 PHE HA H 71 4.080 4.122 -0.042 1
1 126 . 17 1 1 A 11 11 PHE C C 71 177.100 177.130 -0.030 1
1 127 . 17 1 1 A 11 11 PHE CA C 71 61.200 61.353 -0.153 1
1 128 . 17 1 1 A 11 11 PHE CB C 71 38.900 39.314 -0.414 1
1 134 . 17 1 1 A 11 11 PHE N N 71 123.500 122.484 1.016 1
1 135 . 17 1 1 A 12 12 LEU H H 72 8.400 8.707 -0.307 1
1 136 . 17 1 1 A 12 12 LEU HA H 72 3.520 3.728 -0.208 1
1 146 . 17 1 1 A 12 12 LEU C C 72 180.000 179.128 0.872 1
1 147 . 17 1 1 A 12 12 LEU CA C 72 58.200 58.071 0.129 1
1 148 . 17 1 1 A 12 12 LEU CB C 72 41.700 41.471 0.229 1
1 152 . 17 1 1 A 12 12 LEU N N 72 121.100 119.361 1.739 1
1 153 . 17 1 1 A 13 13 LYS H H 73 7.810 7.921 -0.111 1
1 154 . 17 1 1 A 13 13 LYS HA H 73 4.080 4.130 -0.050 1
1 156 . 17 1 1 A 13 13 LYS C C 73 179.300 179.108 0.192 1
1 157 . 17 1 1 A 13 13 LYS CA C 73 59.000 59.040 -0.040 1
1 158 . 17 1 1 A 13 13 LYS CB C 73 31.900 31.852 0.048 1
1 159 . 17 1 1 A 13 13 LYS N N 73 119.400 118.419 0.981 1
1 160 . 17 1 1 A 14 14 SER H H 74 8.210 7.706 0.504 1
1 161 . 17 1 1 A 14 14 SER HA H 74 4.210 4.138 0.072 1
1 164 . 17 1 1 A 14 14 SER C C 74 176.300 177.373 -1.073 1
1 165 . 17 1 1 A 14 14 SER CA C 74 61.400 61.277 0.123 1
1 166 . 17 1 1 A 14 14 SER CB C 74 62.600 62.870 -0.270 1
1 167 . 17 1 1 A 14 14 SER N N 74 117.600 115.170 2.430 1
1 168 . 17 1 1 A 15 15 LYS H H 75 7.760 7.524 0.236 1
1 169 . 17 1 1 A 15 15 LYS HA H 75 4.040 3.862 0.178 1
1 178 . 17 1 1 A 15 15 LYS C C 75 178.500 178.985 -0.485 1
1 179 . 17 1 1 A 15 15 LYS CA C 75 56.500 59.288 -2.788 1
1 180 . 17 1 1 A 15 15 LYS CB C 75 30.600 31.769 -1.169 1
1 184 . 17 1 1 A 15 15 LYS N N 75 120.100 121.401 -1.301 1
1 185 . 17 1 1 A 16 16 GLU H H 76 7.680 8.181 -0.501 1
1 186 . 17 1 1 A 16 16 GLU HA H 76 4.030 3.986 0.044 1
1 191 . 17 1 1 A 16 16 GLU C C 76 179.900 178.677 1.223 1
1 192 . 17 1 1 A 16 16 GLU CA C 76 59.200 59.617 -0.417 1
1 193 . 17 1 1 A 16 16 GLU CB C 76 29.600 29.355 0.245 1
1 195 . 17 1 1 A 16 16 GLU N N 76 119.700 119.364 0.336 1
1 196 . 17 1 1 A 17 17 ALA H H 77 8.030 7.767 0.263 1
1 197 . 17 1 1 A 17 17 ALA HA H 77 4.200 4.094 0.106 1
1 201 . 17 1 1 A 17 17 ALA C C 77 178.900 179.782 -0.882 1
1 202 . 17 1 1 A 17 17 ALA CA C 77 54.400 54.237 0.163 1
1 203 . 17 1 1 A 17 17 ALA CB C 77 18.100 18.249 -0.149 1
1 204 . 17 1 1 A 17 17 ALA N N 77 123.000 120.857 2.143 1
1 205 . 17 1 1 A 18 18 ASP H H 78 7.860 7.969 -0.109 1
1 206 . 17 1 1 A 18 18 ASP HA H 78 4.600 4.553 0.047 1
1 209 . 17 1 1 A 18 18 ASP C C 78 177.500 176.173 1.327 1
1 210 . 17 1 1 A 18 18 ASP CA C 78 55.100 54.555 0.545 1
1 211 . 17 1 1 A 18 18 ASP CB C 78 41.400 41.142 0.258 1
1 212 . 17 1 1 A 18 18 ASP N N 78 117.700 116.733 0.967 1
1 213 . 17 1 1 A 19 19 GLY H H 79 7.910 7.556 0.354 1
1 214 . 17 1 1 A 19 19 GLY HA2 H 79 3.860 3.994 -0.134 1
1 215 . 17 1 1 A 19 19 GLY HA3 H 79 4.080 3.997 0.083 1
1 216 . 17 1 1 A 19 19 GLY C C 79 175.300 174.968 0.332 1
1 217 . 17 1 1 A 19 19 GLY CA C 79 46.200 45.141 1.059 1
1 218 . 17 1 1 A 19 19 GLY N N 79 107.100 107.466 -0.366 1
1 219 . 17 1 1 A 20 20 VAL H H 80 7.150 7.421 -0.271 1
1 220 . 17 1 1 A 20 20 VAL HA H 80 4.250 4.249 0.001 1
1 228 . 17 1 1 A 20 20 VAL C C 80 175.100 175.867 -0.767 1
1 229 . 17 1 1 A 20 20 VAL CA C 80 61.800 61.602 0.198 1
1 230 . 17 1 1 A 20 20 VAL CB C 80 32.200 32.663 -0.463 1
1 233 . 17 1 1 A 20 20 VAL N N 80 114.600 119.520 -4.920 1
1 234 . 17 1 1 A 21 21 SER H H 81 8.560 8.692 -0.132 1
1 235 . 17 1 1 A 21 21 SER HA H 81 4.390 4.700 -0.310 1
1 238 . 17 1 1 A 21 21 SER C C 81 174.600 175.305 -0.705 1
1 239 . 17 1 1 A 21 21 SER CA C 81 57.900 57.557 0.343 1
1 240 . 17 1 1 A 21 21 SER CB C 81 64.700 65.370 -0.670 1
1 241 . 17 1 1 A 21 21 SER N N 81 118.700 117.478 1.222 1
1 242 . 17 1 1 A 22 22 VAL H H 82 8.690 8.611 0.079 1
1 243 . 17 1 1 A 22 22 VAL HA H 82 3.700 3.921 -0.221 1
1 251 . 17 1 1 A 22 22 VAL C C 82 178.000 177.529 0.471 1
1 252 . 17 1 1 A 22 22 VAL CA C 82 66.500 65.187 1.313 1
1 253 . 17 1 1 A 22 22 VAL CB C 82 31.700 31.556 0.144 1
1 256 . 17 1 1 A 22 22 VAL N N 82 122.100 122.040 0.060 1
1 257 . 17 1 1 A 23 23 SER H H 83 8.300 8.244 0.056 1
1 258 . 17 1 1 A 23 23 SER HA H 83 4.210 4.084 0.126 1
1 261 . 17 1 1 A 23 23 SER C C 83 177.600 176.482 1.118 1
1 262 . 17 1 1 A 23 23 SER CA C 83 61.400 61.661 -0.261 1
1 263 . 17 1 1 A 23 23 SER CB C 83 62.400 62.310 0.090 1
1 264 . 17 1 1 A 23 23 SER N N 83 113.600 117.225 -3.625 1
1 265 . 17 1 1 A 24 24 GLN H H 84 7.820 7.608 0.212 1
1 266 . 17 1 1 A 24 24 GLN HA H 84 3.970 3.892 0.078 1
1 273 . 17 1 1 A 24 24 GLN C C 84 178.400 178.114 0.286 1
1 274 . 17 1 1 A 24 24 GLN CA C 84 58.400 58.794 -0.394 1
1 275 . 17 1 1 A 24 24 GLN CB C 84 28.900 28.154 0.746 1
1 278 . 17 1 1 A 24 24 GLN N N 84 122.900 121.168 1.732 1
1 280 . 17 1 1 A 25 25 LEU H H 85 8.920 8.521 0.399 1
1 281 . 17 1 1 A 25 25 LEU HA H 85 4.130 4.368 -0.238 1
1 291 . 17 1 1 A 25 25 LEU C C 85 178.800 178.633 0.167 1
1 292 . 17 1 1 A 25 25 LEU CA C 85 58.300 57.879 0.421 1
1 293 . 17 1 1 A 25 25 LEU CB C 85 41.200 41.660 -0.460 1
1 297 . 17 1 1 A 25 25 LEU N N 85 122.200 121.273 0.927 1
1 298 . 17 1 1 A 26 26 ASN H H 86 8.860 8.986 -0.126 1
1 299 . 17 1 1 A 26 26 ASN HA H 86 4.420 4.425 -0.005 1
1 304 . 17 1 1 A 26 26 ASN C C 86 179.000 178.229 0.771 1
1 305 . 17 1 1 A 26 26 ASN CA C 86 55.900 56.319 -0.419 1
1 306 . 17 1 1 A 26 26 ASN CB C 86 37.200 37.761 -0.561 1
1 308 . 17 1 1 A 26 26 ASN N N 86 117.600 117.166 0.434 1
1 310 . 17 1 1 A 27 27 SER H H 87 7.840 7.834 0.006 1
1 311 . 17 1 1 A 27 27 SER HA H 87 4.100 3.837 0.263 1
1 314 . 17 1 1 A 27 27 SER C C 87 179.000 176.032 2.968 1
1 315 . 17 1 1 A 27 27 SER CA C 87 62.100 62.026 0.074 1
1 316 . 17 1 1 A 27 27 SER CB C 87 62.100 62.762 -0.662 1
1 317 . 17 1 1 A 27 27 SER N N 87 118.500 116.649 1.851 1
1 318 . 17 1 1 A 28 28 TYR H H 88 8.180 7.503 0.677 1
1 319 . 17 1 1 A 28 28 TYR HA H 88 4.600 4.498 0.102 1
1 326 . 17 1 1 A 28 28 TYR C C 88 174.800 178.589 -3.789 1
1 327 . 17 1 1 A 28 28 TYR CA C 88 61.200 61.839 -0.639 1
1 328 . 17 1 1 A 28 28 TYR CB C 88 37.800 38.095 -0.295 1
1 333 . 17 1 1 A 28 28 TYR N N 88 119.300 119.906 -0.606 1
1 334 . 17 1 1 A 29 29 LYS H H 89 9.040 8.337 0.703 1
1 335 . 17 1 1 A 29 29 LYS HA H 89 3.890 4.113 -0.223 1
1 344 . 17 1 1 A 29 29 LYS C C 89 179.000 179.881 -0.881 1
1 345 . 17 1 1 A 29 29 LYS CA C 89 61.300 59.245 2.055 1
1 346 . 17 1 1 A 29 29 LYS CB C 89 32.800 31.898 0.902 1
1 350 . 17 1 1 A 29 29 LYS N N 89 119.300 119.665 -0.365 1
1 351 . 17 1 1 A 30 30 ASN H H 90 7.770 8.519 -0.749 1
1 352 . 17 1 1 A 30 30 ASN HA H 90 4.560 4.490 0.070 1
1 357 . 17 1 1 A 30 30 ASN C C 90 178.300 178.264 0.036 1
1 358 . 17 1 1 A 30 30 ASN CA C 90 56.200 56.248 -0.048 1
1 359 . 17 1 1 A 30 30 ASN CB C 90 38.900 38.231 0.669 1
1 361 . 17 1 1 A 30 30 ASN N N 90 117.800 117.756 0.044 1
1 363 . 17 1 1 A 31 31 TYR H H 91 8.860 7.591 1.269 1
1 364 . 17 1 1 A 31 31 TYR HA H 91 4.910 4.469 0.441 1
1 371 . 17 1 1 A 31 31 TYR C C 91 178.300 178.634 -0.334 1
1 372 . 17 1 1 A 31 31 TYR CA C 91 59.700 61.028 -1.328 1
1 373 . 17 1 1 A 31 31 TYR CB C 91 37.500 37.718 -0.218 1
1 378 . 17 1 1 A 31 31 TYR N N 91 119.400 118.784 0.616 1
1 379 . 17 1 1 A 32 32 CYS H H 92 8.640 8.553 0.087 1
1 380 . 17 1 1 A 32 32 CYS HA H 92 4.410 4.285 0.125 1
1 383 . 17 1 1 A 32 32 CYS C C 92 173.700 177.370 -3.670 1
1 384 . 17 1 1 A 32 32 CYS CA C 92 65.500 62.710 2.790 1
1 385 . 17 1 1 A 32 32 CYS CB C 92 28.300 27.005 1.295 1
1 386 . 17 1 1 A 32 32 CYS N N 92 113.500 119.061 -5.561 1
1 387 . 17 1 1 A 33 33 ARG H H 93 8.440 8.796 -0.356 1
1 388 . 17 1 1 A 33 33 ARG HA H 93 3.740 3.981 -0.241 1
1 391 . 17 1 1 A 33 33 ARG C C 93 177.200 178.306 -1.106 1
1 392 . 17 1 1 A 33 33 ARG CA C 93 58.300 59.520 -1.220 1
1 393 . 17 1 1 A 33 33 ARG CB C 93 30.200 29.955 0.245 1
1 394 . 17 1 1 A 33 33 ARG N N 93 111.400 120.540 -9.140 1
1 395 . 17 1 1 A 34 34 ASN H H 94 8.020 8.164 -0.144 1
1 396 . 17 1 1 A 34 34 ASN HA H 94 4.980 4.675 0.305 1
1 401 . 17 1 1 A 34 34 ASN C C 94 176.700 176.961 -0.261 1
1 402 . 17 1 1 A 34 34 ASN CA C 94 53.400 55.041 -1.641 1
1 403 . 17 1 1 A 34 34 ASN CB C 94 38.000 39.377 -1.377 1
1 405 . 17 1 1 A 34 34 ASN N N 94 113.600 116.196 -2.596 1
1 407 . 17 1 1 A 35 35 HIS H H 95 7.200 7.880 -0.680 1
1 408 . 17 1 1 A 35 35 HIS HA H 95 4.470 4.480 -0.010 1
1 411 . 17 1 1 A 35 35 HIS C C 95 176.600 176.292 0.308 1
1 412 . 17 1 1 A 35 35 HIS CA C 95 60.000 59.319 0.681 1
1 413 . 17 1 1 A 35 35 HIS CB C 95 30.500 31.291 -0.791 1
1 414 . 17 1 1 A 35 35 HIS N N 95 115.600 117.806 -2.206 1
1 415 . 17 1 1 A 36 36 LEU H H 96 8.170 8.579 -0.409 1
1 416 . 17 1 1 A 36 36 LEU HA H 96 4.730 4.445 0.285 1
1 426 . 17 1 1 A 36 36 LEU C C 96 176.800 177.706 -0.906 1
1 427 . 17 1 1 A 36 36 LEU CA C 96 54.400 54.637 -0.237 1
1 428 . 17 1 1 A 36 36 LEU CB C 96 40.600 41.435 -0.835 1
1 432 . 17 1 1 A 36 36 LEU N N 96 114.000 119.018 -5.018 1
1 433 . 17 1 1 A 37 37 SER H H 97 7.140 8.367 -1.227 1
1 434 . 17 1 1 A 37 37 SER HA H 97 4.730 4.335 0.395 1
1 437 . 17 1 1 A 37 37 SER CA C 97 62.700 62.715 -0.015 1
1 438 . 17 1 1 A 37 37 SER CB C 97 62.600 61.810 0.790 1
1 439 . 17 1 1 A 37 37 SER N N 97 117.200 116.091 1.109 1
1 440 . 17 1 1 A 38 38 PRO HA H 98 4.560 4.411 0.149 1
1 447 . 17 1 1 A 38 38 PRO C C 98 177.900 178.573 -0.673 1
1 448 . 17 1 1 A 38 38 PRO CA C 98 65.700 65.625 0.075 1
1 449 . 17 1 1 A 38 38 PRO CB C 98 31.800 30.842 0.958 1
1 452 . 17 1 1 A 39 39 LEU H H 99 8.090 7.608 0.482 1
1 453 . 17 1 1 A 39 39 LEU HA H 99 4.260 4.033 0.227 1
1 463 . 17 1 1 A 39 39 LEU C C 99 178.700 178.401 0.299 1
1 464 . 17 1 1 A 39 39 LEU CA C 99 54.300 57.339 -3.039 1
1 465 . 17 1 1 A 39 39 LEU CB C 99 42.400 41.582 0.818 1
1 469 . 17 1 1 A 39 39 LEU N N 99 112.400 117.719 -5.319 1
1 470 . 17 1 1 A 40 40 TYR H H 100 8.350 8.583 -0.233 1
1 471 . 17 1 1 A 40 40 TYR HA H 100 4.170 4.350 -0.180 1
1 478 . 17 1 1 A 40 40 TYR C C 100 178.300 177.666 0.634 1
1 479 . 17 1 1 A 40 40 TYR CA C 100 63.400 62.180 1.220 1
1 480 . 17 1 1 A 40 40 TYR CB C 100 38.600 39.153 -0.553 1
1 485 . 17 1 1 A 40 40 TYR N N 100 119.400 120.943 -1.543 1
1 486 . 17 1 1 A 41 41 MET H H 101 8.640 8.310 0.330 1
1 487 . 17 1 1 A 41 41 MET HA H 101 4.260 4.550 -0.290 1
1 488 . 17 1 1 A 41 41 MET C C 101 177.000 175.492 1.508 1
1 489 . 17 1 1 A 41 41 MET CA C 101 54.600 54.843 -0.243 1
1 490 . 17 1 1 A 41 41 MET N N 101 111.800 114.329 -2.529 1
1 491 . 17 1 1 A 42 42 LYS H H 102 7.880 7.844 0.036 1
1 492 . 17 1 1 A 42 42 LYS HA H 102 4.430 4.856 -0.426 1
1 501 . 17 1 1 A 42 42 LYS C C 102 176.300 176.009 0.291 1
1 502 . 17 1 1 A 42 42 LYS CA C 102 56.000 54.355 1.645 1
1 503 . 17 1 1 A 42 42 LYS CB C 102 33.400 34.506 -1.106 1
1 507 . 17 1 1 A 42 42 LYS N N 102 121.700 120.177 1.523 1
1 508 . 17 1 1 A 43 43 SER H H 103 9.160 9.479 -0.319 1
1 509 . 17 1 1 A 43 43 SER HA H 103 4.620 4.611 0.009 1
1 513 . 17 1 1 A 43 43 SER C C 103 176.300 175.592 0.708 1
1 514 . 17 1 1 A 43 43 SER CA C 103 58.700 58.670 0.030 1
1 515 . 17 1 1 A 43 43 SER CB C 103 63.700 63.683 0.017 1
1 516 . 17 1 1 A 43 43 SER N N 103 118.800 117.068 1.732 1
1 517 . 17 1 1 A 44 44 LEU H H 104 8.860 9.253 -0.393 1
1 518 . 17 1 1 A 44 44 LEU HA H 104 4.130 4.327 -0.197 1
1 528 . 17 1 1 A 44 44 LEU C C 104 178.700 178.155 0.545 1
1 529 . 17 1 1 A 44 44 LEU CA C 104 58.800 58.471 0.329 1
1 530 . 17 1 1 A 44 44 LEU CB C 104 42.600 41.550 1.050 1
1 534 . 17 1 1 A 44 44 LEU N N 104 124.200 130.675 -6.475 1
1 535 . 17 1 1 A 45 45 SER H H 105 8.330 8.019 0.311 1
1 536 . 17 1 1 A 45 45 SER HA H 105 4.310 4.466 -0.156 1
1 539 . 17 1 1 A 45 45 SER C C 105 175.000 175.891 -0.891 1
1 540 . 17 1 1 A 45 45 SER CA C 105 60.100 60.303 -0.203 1
1 541 . 17 1 1 A 45 45 SER CB C 105 63.400 63.569 -0.169 1
1 542 . 17 1 1 A 45 45 SER N N 105 107.700 114.431 -6.731 1
1 543 . 17 1 1 A 46 46 GLU H H 106 7.800 8.243 -0.443 1
1 544 . 17 1 1 A 46 46 GLU HA H 106 4.570 4.320 0.250 1
1 549 . 17 1 1 A 46 46 GLU C C 106 174.100 176.619 -2.519 1
1 550 . 17 1 1 A 46 46 GLU CA C 106 55.600 57.667 -2.067 1
1 551 . 17 1 1 A 46 46 GLU CB C 106 31.200 29.323 1.877 1
1 553 . 17 1 1 A 46 46 GLU N N 106 119.600 117.956 1.644 1
1 554 . 17 1 1 A 47 47 ILE H H 107 7.100 6.987 0.113 1
1 555 . 17 1 1 A 47 47 ILE HA H 107 4.040 4.026 0.014 1
1 565 . 17 1 1 A 47 47 ILE C C 107 174.100 175.387 -1.287 1
1 566 . 17 1 1 A 47 47 ILE CA C 107 62.300 61.367 0.933 1
1 567 . 17 1 1 A 47 47 ILE CB C 107 38.500 37.765 0.735 1
1 571 . 17 1 1 A 47 47 ILE N N 107 120.600 123.560 -2.960 1
1 572 . 17 1 1 A 48 48 LEU H H 108 9.180 8.606 0.574 1
1 573 . 17 1 1 A 48 48 LEU HA H 108 4.940 4.978 -0.038 1
1 583 . 17 1 1 A 48 48 LEU CA C 108 51.900 52.040 -0.140 1
1 584 . 17 1 1 A 48 48 LEU CB C 108 42.000 42.885 -0.885 1
1 588 . 17 1 1 A 48 48 LEU N N 108 129.400 127.152 2.248 1
1 589 . 17 1 1 A 49 49 PRO HA H 109 3.910 4.258 -0.348 1
1 596 . 17 1 1 A 49 49 PRO C C 109 178.500 177.769 0.731 1
1 597 . 17 1 1 A 49 49 PRO CA C 109 66.600 65.264 1.336 1
1 598 . 17 1 1 A 49 49 PRO CB C 109 31.300 31.909 -0.609 1
1 601 . 17 1 1 A 50 50 ALA H H 110 8.280 8.441 -0.161 1
1 602 . 17 1 1 A 50 50 ALA HA H 110 4.110 4.015 0.095 1
1 606 . 17 1 1 A 50 50 ALA C C 110 179.700 179.759 -0.059 1
1 607 . 17 1 1 A 50 50 ALA CA C 110 55.100 55.176 -0.076 1
1 608 . 17 1 1 A 50 50 ALA CB C 110 19.200 18.502 0.698 1
1 609 . 17 1 1 A 50 50 ALA N N 110 116.100 119.106 -3.006 1
1 610 . 17 1 1 A 51 51 ASP H H 111 7.790 7.856 -0.066 1
1 611 . 17 1 1 A 51 51 ASP HA H 111 4.440 4.337 0.103 1
1 614 . 17 1 1 A 51 51 ASP C C 111 178.200 178.471 -0.271 1
1 615 . 17 1 1 A 51 51 ASP CA C 111 57.600 57.303 0.297 1
1 616 . 17 1 1 A 51 51 ASP CB C 111 41.800 41.008 0.792 1
1 617 . 17 1 1 A 51 51 ASP N N 111 116.500 117.818 -1.318 1
1 618 . 17 1 1 A 52 52 ILE H H 112 7.020 7.491 -0.471 1
1 619 . 17 1 1 A 52 52 ILE HA H 112 3.750 3.623 0.127 1
1 629 . 17 1 1 A 52 52 ILE C C 112 177.300 177.883 -0.583 1
1 630 . 17 1 1 A 52 52 ILE CA C 112 63.500 65.160 -1.660 1
1 631 . 17 1 1 A 52 52 ILE CB C 112 37.500 37.481 0.019 1
1 635 . 17 1 1 A 52 52 ILE N N 112 116.700 119.262 -2.562 1
1 636 . 17 1 1 A 53 53 GLN H H 113 9.150 8.273 0.877 1
1 637 . 17 1 1 A 53 53 GLN HA H 113 3.720 3.951 -0.231 1
1 644 . 17 1 1 A 53 53 GLN C C 113 177.500 178.273 -0.773 1
1 645 . 17 1 1 A 53 53 GLN CA C 113 58.200 58.545 -0.345 1
1 646 . 17 1 1 A 53 53 GLN CB C 113 30.200 28.681 1.519 1
1 649 . 17 1 1 A 53 53 GLN N N 113 121.200 120.999 0.201 1
1 651 . 17 1 1 A 54 54 SER H H 114 8.150 7.939 0.211 1
1 652 . 17 1 1 A 54 54 SER HA H 114 4.180 4.123 0.057 1
1 655 . 17 1 1 A 54 54 SER C C 114 175.900 176.264 -0.364 1
1 656 . 17 1 1 A 54 54 SER CA C 114 62.100 62.608 -0.508 1
1 657 . 17 1 1 A 54 54 SER CB C 114 62.800 62.895 -0.095 1
1 658 . 17 1 1 A 54 54 SER N N 114 112.200 117.113 -4.913 1
1 659 . 17 1 1 A 55 55 ILE H H 115 6.760 7.695 -0.935 1
1 660 . 17 1 1 A 55 55 ILE HA H 115 3.860 3.735 0.125 1
1 670 . 17 1 1 A 55 55 ILE C C 115 179.200 178.317 0.883 1
1 671 . 17 1 1 A 55 55 ILE CA C 115 64.700 64.630 0.070 1
1 672 . 17 1 1 A 55 55 ILE CB C 115 38.900 37.383 1.517 1
1 676 . 17 1 1 A 55 55 ILE N N 115 119.500 120.120 -0.620 1
1 677 . 17 1 1 A 56 56 ILE H H 116 7.750 8.049 -0.299 1
1 678 . 17 1 1 A 56 56 ILE HA H 116 3.690 3.520 0.170 1
1 688 . 17 1 1 A 56 56 ILE C C 116 176.900 178.152 -1.252 1
1 689 . 17 1 1 A 56 56 ILE CA C 116 62.800 65.180 -2.380 1
1 690 . 17 1 1 A 56 56 ILE CB C 116 36.200 37.510 -1.310 1
1 694 . 17 1 1 A 56 56 ILE N N 116 120.200 121.997 -1.797 1
1 695 . 17 1 1 A 57 57 ASN H H 117 8.690 8.115 0.575 1
1 696 . 17 1 1 A 57 57 ASN HA H 117 4.440 4.472 -0.032 1
1 701 . 17 1 1 A 57 57 ASN C C 117 177.200 178.059 -0.859 1
1 702 . 17 1 1 A 57 57 ASN CA C 117 54.800 56.294 -1.494 1
1 703 . 17 1 1 A 57 57 ASN CB C 117 38.100 37.803 0.297 1
1 705 . 17 1 1 A 57 57 ASN N N 117 117.000 117.612 -0.612 1
1 707 . 17 1 1 A 58 58 GLU H H 118 7.630 7.863 -0.233 1
1 708 . 17 1 1 A 58 58 GLU HA H 118 4.450 4.366 0.084 1
1 713 . 17 1 1 A 58 58 GLU C C 118 176.500 176.891 -0.391 1
1 714 . 17 1 1 A 58 58 GLU CA C 118 56.200 57.603 -1.403 1
1 715 . 17 1 1 A 58 58 GLU CB C 118 30.200 30.278 -0.078 1
1 717 . 17 1 1 A 58 58 GLU N N 118 116.300 117.251 -0.951 1
1 718 . 17 1 1 A 59 59 THR H H 119 7.540 7.354 0.186 1
1 719 . 17 1 1 A 59 59 THR HA H 119 4.230 4.453 -0.223 1
1 724 . 17 1 1 A 59 59 THR C C 119 174.200 174.700 -0.500 1
1 725 . 17 1 1 A 59 59 THR CA C 119 63.800 62.575 1.225 1
1 726 . 17 1 1 A 59 59 THR CB C 119 68.900 68.958 -0.058 1
1 728 . 17 1 1 A 59 59 THR N N 119 117.600 115.745 1.855 1
1 729 . 17 1 1 A 60 60 LYS H H 120 8.860 8.734 0.126 1
1 730 . 17 1 1 A 60 60 LYS HA H 120 4.490 4.375 0.115 1
1 739 . 17 1 1 A 60 60 LYS C C 120 175.800 175.972 -0.172 1
1 740 . 17 1 1 A 60 60 LYS CA C 120 54.900 56.121 -1.221 1
1 741 . 17 1 1 A 60 60 LYS CB C 120 29.800 31.824 -2.024 1
1 745 . 17 1 1 A 60 60 LYS N N 120 128.500 122.417 6.083 1
1 746 . 17 1 1 A 61 61 LEU H H 121 7.150 7.336 -0.186 1
1 747 . 17 1 1 A 61 61 LEU HA H 121 4.710 4.357 0.353 1
1 757 . 17 1 1 A 61 61 LEU C C 121 175.000 176.991 -1.991 1
1 758 . 17 1 1 A 61 61 LEU CA C 121 52.800 54.200 -1.400 1
1 759 . 17 1 1 A 61 61 LEU CB C 121 46.400 42.746 3.654 1
1 763 . 17 1 1 A 61 61 LEU N N 121 120.700 122.400 -1.700 1
1 764 . 17 1 1 A 62 62 ALA H H 122 8.000 8.661 -0.661 1
1 765 . 17 1 1 A 62 62 ALA HA H 122 4.250 4.404 -0.154 1
1 769 . 17 1 1 A 62 62 ALA CA C 122 52.100 51.989 0.111 1
1 770 . 17 1 1 A 62 62 ALA CB C 122 19.500 20.158 -0.658 1
1 771 . 17 1 1 A 62 62 ALA N N 122 119.900 123.596 -3.696 1
1 772 . 17 1 1 A 63 63 LYS H H 123 8.770 8.807 -0.037 1
1 773 . 17 1 1 A 63 63 LYS HA H 123 3.800 4.007 -0.207 1
1 782 . 17 1 1 A 63 63 LYS C C 123 178.300 178.537 -0.237 1
1 783 . 17 1 1 A 63 63 LYS CA C 123 60.700 59.178 1.522 1
1 784 . 17 1 1 A 63 63 LYS CB C 123 32.300 31.947 0.353 1
1 788 . 17 1 1 A 63 63 LYS N N 123 121.400 120.226 1.174 1
1 789 . 17 1 1 A 64 64 ASN H H 124 9.020 8.122 0.898 1
1 790 . 17 1 1 A 64 64 ASN HA H 124 4.430 4.450 -0.020 1
1 795 . 17 1 1 A 64 64 ASN C C 124 178.300 177.825 0.475 1
1 796 . 17 1 1 A 64 64 ASN CA C 124 56.200 56.574 -0.374 1
1 797 . 17 1 1 A 64 64 ASN CB C 124 37.300 39.378 -2.078 1
1 799 . 17 1 1 A 64 64 ASN N N 124 115.000 118.374 -3.374 1
1 801 . 17 1 1 A 65 65 THR H H 125 7.620 8.021 -0.401 1
1 802 . 17 1 1 A 65 65 THR HA H 125 4.030 3.995 0.035 1
1 807 . 17 1 1 A 65 65 THR C C 125 175.500 176.723 -1.223 1
1 808 . 17 1 1 A 65 65 THR CA C 125 66.000 66.976 -0.976 1
1 809 . 17 1 1 A 65 65 THR CB C 125 67.600 67.757 -0.157 1
1 811 . 17 1 1 A 65 65 THR N N 125 119.800 115.458 4.342 1
1 812 . 17 1 1 A 66 66 LEU H H 126 8.020 8.314 -0.294 1
1 813 . 17 1 1 A 66 66 LEU HA H 126 3.790 3.810 -0.020 1
1 823 . 17 1 1 A 66 66 LEU C C 126 179.200 179.294 -0.094 1
1 824 . 17 1 1 A 66 66 LEU CA C 126 58.700 58.031 0.669 1
1 825 . 17 1 1 A 66 66 LEU CB C 126 41.300 41.221 0.079 1
1 829 . 17 1 1 A 66 66 LEU N N 126 121.200 121.672 -0.472 1
1 830 . 17 1 1 A 67 67 LYS H H 127 8.380 8.370 0.010 1
1 831 . 17 1 1 A 67 67 LYS HA H 127 3.740 4.028 -0.288 1
1 840 . 17 1 1 A 67 67 LYS C C 127 178.300 179.400 -1.100 1
1 841 . 17 1 1 A 67 67 LYS CA C 127 60.100 59.584 0.516 1
1 842 . 17 1 1 A 67 67 LYS CB C 127 32.400 32.152 0.248 1
1 846 . 17 1 1 A 67 67 LYS N N 127 117.000 117.935 -0.935 1
1 847 . 17 1 1 A 68 68 ALA H H 128 7.480 7.802 -0.322 1
1 848 . 17 1 1 A 68 68 ALA HA H 128 4.210 3.986 0.224 1
1 852 . 17 1 1 A 68 68 ALA C C 128 181.200 179.649 1.551 1
1 853 . 17 1 1 A 68 68 ALA CA C 128 55.200 55.061 0.139 1
1 854 . 17 1 1 A 68 68 ALA CB C 128 18.600 17.928 0.672 1
1 855 . 17 1 1 A 68 68 ALA N N 128 122.900 121.883 1.017 1
1 856 . 17 1 1 A 69 69 ILE H H 129 8.250 7.737 0.513 1
1 857 . 17 1 1 A 69 69 ILE HA H 129 3.130 2.991 0.139 1
1 867 . 17 1 1 A 69 69 ILE C C 129 177.400 177.800 -0.400 1
1 868 . 17 1 1 A 69 69 ILE CA C 129 66.700 65.194 1.506 1
1 869 . 17 1 1 A 69 69 ILE CB C 129 37.900 37.381 0.519 1
1 873 . 17 1 1 A 69 69 ILE N N 129 122.800 117.841 4.959 1
1 874 . 17 1 1 A 70 70 ARG H H 130 8.040 7.874 0.166 1
1 875 . 17 1 1 A 70 70 ARG HA H 130 3.620 3.871 -0.251 1
1 882 . 17 1 1 A 70 70 ARG C C 130 177.800 178.481 -0.681 1
1 883 . 17 1 1 A 70 70 ARG CA C 130 60.700 59.708 0.992 1
1 884 . 17 1 1 A 70 70 ARG CB C 130 29.600 29.446 0.154 1
1 887 . 17 1 1 A 70 70 ARG N N 130 119.700 120.631 -0.931 1
1 888 . 17 1 1 A 71 71 ASN H H 131 8.920 8.563 0.357 1
1 889 . 17 1 1 A 71 71 ASN HA H 131 4.430 4.678 -0.248 1
1 894 . 17 1 1 A 71 71 ASN C C 131 177.500 177.882 -0.382 1
1 895 . 17 1 1 A 71 71 ASN CA C 131 56.100 56.235 -0.135 1
1 896 . 17 1 1 A 71 71 ASN CB C 131 38.600 38.825 -0.225 1
1 898 . 17 1 1 A 71 71 ASN N N 131 117.200 118.358 -1.158 1
1 900 . 17 1 1 A 72 72 THR H H 132 8.300 8.457 -0.157 1
1 901 . 17 1 1 A 72 72 THR HA H 132 4.430 3.847 0.583 1
1 906 . 17 1 1 A 72 72 THR C C 132 175.100 176.618 -1.518 1
1 907 . 17 1 1 A 72 72 THR CA C 132 68.200 66.427 1.773 1
1 908 . 17 1 1 A 72 72 THR CB C 132 68.500 68.705 -0.205 1
1 910 . 17 1 1 A 72 72 THR N N 132 119.200 115.078 4.122 1
1 911 . 17 1 1 A 73 73 ALA H H 133 7.950 8.315 -0.365 1
1 912 . 17 1 1 A 73 73 ALA HA H 133 4.040 4.093 -0.053 1
1 916 . 17 1 1 A 73 73 ALA C C 133 178.200 179.805 -1.605 1
1 917 . 17 1 1 A 73 73 ALA CA C 133 55.900 55.447 0.453 1
1 918 . 17 1 1 A 73 73 ALA CB C 133 16.700 17.989 -1.289 1
1 919 . 17 1 1 A 73 73 ALA N N 133 120.900 123.845 -2.945 1
1 920 . 17 1 1 A 74 74 SER H H 134 8.440 8.518 -0.078 1
1 921 . 17 1 1 A 74 74 SER HA H 134 4.430 4.328 0.102 1
1 924 . 17 1 1 A 74 74 SER C C 134 178.800 177.269 1.531 1
1 925 . 17 1 1 A 74 74 SER CA C 134 61.300 61.364 -0.064 1
1 926 . 17 1 1 A 74 74 SER CB C 134 62.600 62.535 0.065 1
1 927 . 17 1 1 A 74 74 SER N N 134 110.100 113.186 -3.086 1
1 928 . 17 1 1 A 75 75 GLN H H 135 8.340 7.319 1.021 1
1 929 . 17 1 1 A 75 75 GLN HA H 135 3.880 4.184 -0.304 1
1 936 . 17 1 1 A 75 75 GLN C C 135 178.800 178.870 -0.070 1
1 937 . 17 1 1 A 75 75 GLN CA C 135 59.600 58.554 1.046 1
1 938 . 17 1 1 A 75 75 GLN CB C 135 29.900 28.468 1.432 1
1 941 . 17 1 1 A 75 75 GLN N N 135 118.100 121.570 -3.470 1
1 943 . 17 1 1 A 76 76 ILE H H 136 7.670 7.363 0.307 1
1 944 . 17 1 1 A 76 76 ILE HA H 136 3.200 3.422 -0.222 1
1 954 . 17 1 1 A 76 76 ILE C C 136 177.500 177.931 -0.431 1
1 955 . 17 1 1 A 76 76 ILE CA C 136 66.100 65.094 1.006 1
1 956 . 17 1 1 A 76 76 ILE CB C 136 37.400 37.203 0.197 1
1 960 . 17 1 1 A 76 76 ILE N N 136 122.500 120.592 1.908 1
1 961 . 17 1 1 A 77 77 PHE H H 137 7.930 7.797 0.133 1
1 962 . 17 1 1 A 77 77 PHE HA H 137 3.890 4.168 -0.278 1
1 969 . 17 1 1 A 77 77 PHE C C 137 178.200 178.187 0.013 1
1 970 . 17 1 1 A 77 77 PHE CA C 137 63.600 60.721 2.879 1
1 971 . 17 1 1 A 77 77 PHE CB C 137 39.300 38.465 0.835 1
1 976 . 17 1 1 A 77 77 PHE N N 137 116.100 118.367 -2.267 1
1 977 . 17 1 1 A 78 78 ARG H H 138 8.900 8.214 0.686 1
1 978 . 17 1 1 A 78 78 ARG HA H 138 3.910 3.914 -0.004 1
1 986 . 17 1 1 A 78 78 ARG C C 138 178.300 178.898 -0.598 1
1 987 . 17 1 1 A 78 78 ARG CA C 138 60.100 59.254 0.846 1
1 988 . 17 1 1 A 78 78 ARG CB C 138 29.600 29.733 -0.133 1
1 991 . 17 1 1 A 78 78 ARG N N 138 118.600 119.309 -0.709 1
1 993 . 17 1 1 A 79 79 LEU H H 139 7.730 8.135 -0.405 1
1 994 . 17 1 1 A 79 79 LEU HA H 139 4.280 4.089 0.191 1
1 1004 . 17 1 1 A 79 79 LEU C C 139 179.000 178.365 0.635 1
1 1005 . 17 1 1 A 79 79 LEU CA C 139 57.800 57.646 0.154 1
1 1006 . 17 1 1 A 79 79 LEU CB C 139 41.900 41.514 0.386 1
1 1010 . 17 1 1 A 79 79 LEU N N 139 121.900 121.123 0.777 1
1 1011 . 17 1 1 A 80 80 ALA H H 140 7.590 7.316 0.274 1
1 1012 . 17 1 1 A 80 80 ALA HA H 140 2.710 2.742 -0.032 1
1 1016 . 17 1 1 A 80 80 ALA C C 140 179.900 179.959 -0.059 1
1 1017 . 17 1 1 A 80 80 ALA CA C 140 55.100 54.312 0.788 1
1 1018 . 17 1 1 A 80 80 ALA CB C 140 17.600 17.347 0.253 1
1 1019 . 17 1 1 A 80 80 ALA N N 140 123.400 120.282 3.118 1
1 1020 . 17 1 1 A 81 81 ILE H H 141 8.910 7.848 1.062 1
1 1021 . 17 1 1 A 81 81 ILE HA H 141 4.110 4.186 -0.076 1
1 1031 . 17 1 1 A 81 81 ILE C C 141 181.700 178.259 3.441 1
1 1032 . 17 1 1 A 81 81 ILE CA C 141 64.800 65.387 -0.587 1
1 1033 . 17 1 1 A 81 81 ILE CB C 141 38.600 37.780 0.820 1
1 1037 . 17 1 1 A 81 81 ILE N N 141 122.400 118.492 3.908 1
1 1038 . 17 1 1 A 82 82 GLU H H 142 8.560 9.306 -0.746 1
1 1039 . 17 1 1 A 82 82 GLU HA H 142 4.100 4.080 0.020 1
1 1044 . 17 1 1 A 82 82 GLU C C 142 177.700 177.347 0.353 1
1 1045 . 17 1 1 A 82 82 GLU CA C 142 59.100 58.562 0.538 1
1 1046 . 17 1 1 A 82 82 GLU CB C 142 29.200 28.092 1.108 1
1 1048 . 17 1 1 A 82 82 GLU N N 142 123.200 119.970 3.230 1
1 1049 . 17 1 1 A 83 83 ASN H H 143 7.310 7.379 -0.069 1
1 1050 . 17 1 1 A 83 83 ASN HA H 143 4.750 4.910 -0.160 1
1 1055 . 17 1 1 A 83 83 ASN C C 143 173.200 174.258 -1.058 1
1 1056 . 17 1 1 A 83 83 ASN CA C 143 54.200 52.569 1.631 1
1 1057 . 17 1 1 A 83 83 ASN CB C 143 41.300 38.551 2.749 1
1 1059 . 17 1 1 A 83 83 ASN N N 143 114.900 117.152 -2.252 1
1 1061 . 17 1 1 A 84 84 ARG H H 144 8.320 7.938 0.382 1
1 1062 . 17 1 1 A 84 84 ARG HA H 144 4.120 3.975 0.145 1
1 1069 . 17 1 1 A 84 84 ARG C C 144 175.300 175.466 -0.166 1
1 1070 . 17 1 1 A 84 84 ARG CA C 144 57.100 56.881 0.219 1
1 1071 . 17 1 1 A 84 84 ARG CB C 144 26.000 27.074 -1.074 1
1 1074 . 17 1 1 A 84 84 ARG N N 144 114.400 115.160 -0.760 1
1 1075 . 17 1 1 A 85 85 ALA H H 145 8.350 8.692 -0.342 1
1 1076 . 17 1 1 A 85 85 ALA HA H 145 4.320 4.440 -0.120 1
1 1080 . 17 1 1 A 85 85 ALA C C 145 176.500 177.075 -0.575 1
1 1081 . 17 1 1 A 85 85 ALA CA C 145 53.400 53.065 0.335 1
1 1082 . 17 1 1 A 85 85 ALA CB C 145 19.900 20.758 -0.858 1
1 1083 . 17 1 1 A 85 85 ALA N N 145 120.600 118.415 2.185 1
1 1084 . 17 1 1 A 86 86 ILE H H 146 7.290 7.667 -0.377 1
1 1085 . 17 1 1 A 86 86 ILE HA H 146 4.400 4.648 -0.248 1
1 1095 . 17 1 1 A 86 86 ILE C C 146 173.600 173.845 -0.245 1
1 1096 . 17 1 1 A 86 86 ILE CA C 146 59.200 59.562 -0.362 1
1 1097 . 17 1 1 A 86 86 ILE CB C 146 41.600 41.557 0.043 1
1 1101 . 17 1 1 A 86 86 ILE N N 146 111.500 115.863 -4.363 1
1 1102 . 17 1 1 A 87 87 ASP H H 147 8.270 8.582 -0.312 1
1 1103 . 17 1 1 A 87 87 ASP HA H 147 4.940 4.996 -0.056 1
1 1106 . 17 1 1 A 87 87 ASP C C 147 174.700 175.457 -0.757 1
1 1107 . 17 1 1 A 87 87 ASP CA C 147 53.700 53.101 0.599 1
1 1108 . 17 1 1 A 87 87 ASP CB C 147 41.800 41.577 0.223 1
1 1109 . 17 1 1 A 87 87 ASP N N 147 119.400 126.124 -6.724 1
1 1110 . 17 1 1 A 88 88 PHE H H 148 7.230 7.654 -0.424 1
1 1111 . 17 1 1 A 88 88 PHE HA H 148 4.690 4.756 -0.066 1
1 1119 . 17 1 1 A 88 88 PHE C C 148 171.500 172.904 -1.404 1
1 1120 . 17 1 1 A 88 88 PHE CA C 148 56.400 56.606 -0.206 1
1 1121 . 17 1 1 A 88 88 PHE CB C 148 42.000 42.606 -0.606 1
1 1127 . 17 1 1 A 88 88 PHE N N 148 119.700 119.740 -0.040 1
1 1128 . 17 1 1 A 89 89 ASN H H 149 8.060 8.197 -0.137 1
1 1129 . 17 1 1 A 89 89 ASN HA H 149 4.490 4.830 -0.340 1
1 1134 . 17 1 1 A 89 89 ASN CA C 149 48.100 48.983 -0.883 1
1 1135 . 17 1 1 A 89 89 ASN CB C 149 39.200 39.550 -0.350 1
1 1137 . 17 1 1 A 89 89 ASN N N 149 119.700 125.247 -5.547 1
1 1139 . 17 1 1 A 90 90 PRO HA H 150 3.970 3.923 0.047 1
1 1146 . 17 1 1 A 90 90 PRO C C 150 177.700 177.796 -0.096 1
1 1147 . 17 1 1 A 90 90 PRO CA C 150 63.900 64.483 -0.583 1
1 1148 . 17 1 1 A 90 90 PRO CB C 150 31.700 31.549 0.151 1
1 1151 . 17 1 1 A 91 91 ALA H H 151 7.240 7.544 -0.304 1
1 1152 . 17 1 1 A 91 91 ALA HA H 151 3.900 3.974 -0.074 1
1 1156 . 17 1 1 A 91 91 ALA C C 151 178.000 179.818 -1.818 1
1 1157 . 17 1 1 A 91 91 ALA CA C 151 53.900 54.743 -0.843 1
1 1158 . 17 1 1 A 91 91 ALA CB C 151 17.700 18.319 -0.619 1
1 1159 . 17 1 1 A 91 91 ALA N N 151 115.700 118.787 -3.087 1
1 1160 . 17 1 1 A 92 92 ASP H H 152 7.080 7.727 -0.647 1
1 1161 . 17 1 1 A 92 92 ASP HA H 152 4.220 4.333 -0.113 1
1 1164 . 17 1 1 A 92 92 ASP C C 152 176.200 177.715 -1.515 1
1 1165 . 17 1 1 A 92 92 ASP CA C 152 55.800 56.688 -0.888 1
1 1166 . 17 1 1 A 92 92 ASP CB C 152 39.500 40.573 -1.073 1
1 1167 . 17 1 1 A 92 92 ASP N N 152 117.100 119.251 -2.151 1
1 1168 . 17 1 1 A 93 93 TYR H H 153 7.060 7.208 -0.148 1
1 1169 . 17 1 1 A 93 93 TYR HA H 153 4.490 4.360 0.130 1
1 1176 . 17 1 1 A 93 93 TYR C C 153 174.700 176.090 -1.390 1
1 1177 . 17 1 1 A 93 93 TYR CA C 153 57.600 59.463 -1.863 1
1 1178 . 17 1 1 A 93 93 TYR CB C 153 38.500 38.996 -0.496 1
1 1183 . 17 1 1 A 93 93 TYR N N 153 116.800 120.561 -3.761 1
1 1184 . 17 1 1 A 94 94 VAL H H 154 7.000 6.981 0.019 1
1 1185 . 17 1 1 A 94 94 VAL HA H 154 4.040 3.800 0.240 1
1 1193 . 17 1 1 A 94 94 VAL C C 154 174.700 174.999 -0.299 1
1 1194 . 17 1 1 A 94 94 VAL CA C 154 62.100 62.621 -0.521 1
1 1195 . 17 1 1 A 94 94 VAL CB C 154 32.700 32.097 0.603 1
1 1198 . 17 1 1 A 94 94 VAL N N 154 120.600 121.563 -0.963 1
1 1199 . 17 1 1 A 95 95 ARG H H 155 9.430 8.648 0.782 1
1 1200 . 17 1 1 A 95 95 ARG HA H 155 4.640 4.620 0.020 1
1 1207 . 17 1 1 A 95 95 ARG C C 155 175.400 174.930 0.470 1
1 1208 . 17 1 1 A 95 95 ARG CA C 155 54.200 55.788 -1.588 1
1 1209 . 17 1 1 A 95 95 ARG CB C 155 32.400 30.898 1.502 1
1 1212 . 17 1 1 A 95 95 ARG N N 155 128.200 127.399 0.801 1
1 1213 . 17 1 1 A 96 96 ILE H H 156 8.700 8.466 0.234 1
1 1214 . 17 1 1 A 96 96 ILE HA H 156 4.440 4.565 -0.125 1
1 1224 . 17 1 1 A 96 96 ILE CA C 156 56.500 57.644 -1.144 1
1 1225 . 17 1 1 A 96 96 ILE CB C 156 36.700 38.142 -1.442 1
1 1229 . 17 1 1 A 96 96 ILE N N 156 124.100 128.038 -3.938 1
1 1230 . 17 1 1 A 97 97 PRO HA H 157 4.370 4.698 -0.328 1
1 1237 . 17 1 1 A 97 97 PRO C C 157 176.000 177.142 -1.142 1
1 1238 . 17 1 1 A 97 97 PRO CA C 157 63.200 62.793 0.407 1
1 1239 . 17 1 1 A 97 97 PRO CB C 157 32.400 31.995 0.405 1
1 1242 . 17 1 1 A 98 98 LYS H H 158 8.380 8.793 -0.413 1
1 1243 . 17 1 1 A 98 98 LYS HA H 158 4.190 4.302 -0.112 1
1 1252 . 17 1 1 A 98 98 LYS C C 158 176.800 176.271 0.529 1
1 1253 . 17 1 1 A 98 98 LYS CA C 158 57.100 56.676 0.424 1
1 1254 . 17 1 1 A 98 98 LYS CB C 158 32.800 32.876 -0.076 1
1 1258 . 17 1 1 A 98 98 LYS N N 158 120.800 119.869 0.931 1
1 1259 . 17 1 1 A 99 99 ILE H H 159 7.930 7.510 0.420 1
1 1260 . 17 1 1 A 99 99 ILE HA H 159 4.200 4.260 -0.060 1
1 1270 . 17 1 1 A 99 99 ILE C C 159 175.400 175.798 -0.398 1
1 1271 . 17 1 1 A 99 99 ILE CA C 159 60.600 60.994 -0.394 1
1 1272 . 17 1 1 A 99 99 ILE CB C 159 39.100 36.373 2.727 1
1 1276 . 17 1 1 A 99 99 ILE N N 159 120.200 121.537 -1.337 1
1 1277 . 17 1 1 A 100 100 ALA H H 160 8.370 7.884 0.486 1
1 1278 . 17 1 1 A 100 100 ALA HA H 160 4.370 4.659 -0.289 1
1 1282 . 17 1 1 A 100 100 ALA C C 160 177.200 177.005 0.195 1
1 1283 . 17 1 1 A 100 100 ALA CA C 160 52.200 51.031 1.169 1
1 1284 . 17 1 1 A 100 100 ALA CB C 160 19.400 19.833 -0.433 1
1 1285 . 17 1 1 A 100 100 ALA N N 160 128.300 128.118 0.182 1
1 1286 . 17 1 1 A 101 101 LEU H H 161 8.250 7.264 0.986 1
1 1287 . 17 1 1 A 101 101 LEU HA H 161 4.280 4.071 0.209 1
1 1297 . 17 1 1 A 101 101 LEU C C 161 177.200 177.249 -0.049 1
1 1298 . 17 1 1 A 101 101 LEU CA C 161 55.200 55.788 -0.588 1
1 1299 . 17 1 1 A 101 101 LEU CB C 161 42.400 41.903 0.497 1
1 1303 . 17 1 1 A 101 101 LEU N N 161 121.900 120.108 1.792 1
1 1304 . 17 1 1 A 102 102 GLU H H 162 8.390 8.949 -0.559 1
1 1305 . 17 1 1 A 102 102 GLU HA H 162 4.230 4.092 0.138 1
1 1310 . 17 1 1 A 102 102 GLU C C 162 176.100 176.152 -0.052 1
1 1311 . 17 1 1 A 102 102 GLU CA C 162 56.400 58.990 -2.590 1
1 1312 . 17 1 1 A 102 102 GLU CB C 162 30.500 30.262 0.238 1
1 1314 . 17 1 1 A 102 102 GLU N N 162 121.300 126.471 -5.171 1
1 1315 . 17 1 1 A 103 103 HIS H H 163 8.330 8.043 0.287 1
1 1316 . 17 1 1 A 103 103 HIS HA H 163 4.590 5.043 -0.453 1
1 1319 . 17 1 1 A 103 103 HIS C C 163 176.100 174.885 1.215 1
1 1320 . 17 1 1 A 103 103 HIS CA C 163 56.000 54.809 1.191 1
1 1321 . 17 1 1 A 103 103 HIS CB C 163 30.500 31.813 -1.313 1
1 1322 . 17 1 1 A 103 103 HIS N N 163 120.000 116.057 3.943 1
1 1323 . 17 1 1 A 107 107 HIS HA H 167 4.620 4.786 -0.166 1
1 1326 . 17 1 1 A 107 107 HIS C C 167 173.900 173.776 0.124 1
1 1327 . 17 1 1 A 107 107 HIS CA C 167 56.000 53.619 2.381 1
1 1328 . 17 1 1 A 107 107 HIS CB C 167 30.300 31.387 -1.087 1
1 15 . 18 1 1 A 2 2 ASP H H 62 8.760 8.844 -0.084 1
1 16 . 18 1 1 A 2 2 ASP HA H 62 4.810 4.237 0.573 1
1 19 . 18 1 1 A 2 2 ASP C C 62 175.800 175.774 0.026 1
1 20 . 18 1 1 A 2 2 ASP CA C 62 54.800 55.293 -0.493 1
1 21 . 18 1 1 A 2 2 ASP CB C 62 41.600 39.480 2.120 1
1 22 . 18 1 1 A 2 2 ASP N N 62 120.900 118.020 2.880 1
1 23 . 18 1 1 A 3 3 SER H H 63 8.710 7.978 0.732 1
1 24 . 18 1 1 A 3 3 SER HA H 63 4.970 4.431 0.539 1
1 27 . 18 1 1 A 3 3 SER C C 63 175.600 175.436 0.164 1
1 28 . 18 1 1 A 3 3 SER CA C 63 57.500 59.180 -1.680 1
1 29 . 18 1 1 A 3 3 SER CB C 63 65.900 64.338 1.562 1
1 30 . 18 1 1 A 3 3 SER N N 63 116.300 114.194 2.106 1
1 31 . 18 1 1 A 4 4 PHE H H 64 9.370 9.631 -0.261 1
1 32 . 18 1 1 A 4 4 PHE HA H 64 4.010 4.079 -0.069 1
1 39 . 18 1 1 A 4 4 PHE C C 64 176.700 177.647 -0.947 1
1 40 . 18 1 1 A 4 4 PHE CA C 64 62.200 61.592 0.608 1
1 41 . 18 1 1 A 4 4 PHE CB C 64 38.500 39.166 -0.666 1
1 46 . 18 1 1 A 4 4 PHE N N 64 121.400 124.338 -2.938 1
1 47 . 18 1 1 A 5 5 GLY H H 65 8.930 8.248 0.682 1
1 48 . 18 1 1 A 5 5 GLY HA2 H 65 2.020 2.608 -0.588 1
1 49 . 18 1 1 A 5 5 GLY HA3 H 65 3.250 2.958 0.292 1
1 50 . 18 1 1 A 5 5 GLY C C 65 175.200 175.181 0.019 1
1 51 . 18 1 1 A 5 5 GLY CA C 65 46.300 46.446 -0.146 1
1 52 . 18 1 1 A 5 5 GLY N N 65 106.500 105.064 1.436 1
1 53 . 18 1 1 A 6 6 ASP H H 66 7.630 8.027 -0.397 1
1 54 . 18 1 1 A 6 6 ASP HA H 66 4.100 4.213 -0.113 1
1 57 . 18 1 1 A 6 6 ASP C C 66 179.500 178.640 0.860 1
1 58 . 18 1 1 A 6 6 ASP CA C 66 57.400 56.812 0.588 1
1 59 . 18 1 1 A 6 6 ASP CB C 66 40.500 41.208 -0.708 1
1 60 . 18 1 1 A 6 6 ASP N N 66 120.500 121.156 -0.656 1
1 61 . 18 1 1 A 7 7 TRP H H 67 7.190 7.934 -0.744 1
1 62 . 18 1 1 A 7 7 TRP HA H 67 3.860 4.262 -0.402 1
1 71 . 18 1 1 A 7 7 TRP C C 67 177.200 178.232 -1.032 1
1 72 . 18 1 1 A 7 7 TRP CA C 67 61.100 59.730 1.370 1
1 73 . 18 1 1 A 7 7 TRP CB C 67 28.300 29.143 -0.843 1
1 79 . 18 1 1 A 7 7 TRP N N 67 120.700 120.051 0.649 1
1 81 . 18 1 1 A 8 8 ALA H H 68 9.040 8.521 0.519 1
1 82 . 18 1 1 A 8 8 ALA HA H 68 3.730 3.873 -0.143 1
1 86 . 18 1 1 A 8 8 ALA C C 68 179.500 180.157 -0.657 1
1 87 . 18 1 1 A 8 8 ALA CA C 68 55.200 55.213 -0.013 1
1 88 . 18 1 1 A 8 8 ALA CB C 68 18.600 17.828 0.772 1
1 89 . 18 1 1 A 8 8 ALA N N 68 125.700 122.419 3.281 1
1 90 . 18 1 1 A 9 9 GLU H H 69 8.060 8.098 -0.038 1
1 91 . 18 1 1 A 9 9 GLU HA H 69 4.020 4.007 0.013 1
1 96 . 18 1 1 A 9 9 GLU C C 69 180.400 179.257 1.143 1
1 97 . 18 1 1 A 9 9 GLU CA C 69 58.800 59.559 -0.759 1
1 98 . 18 1 1 A 9 9 GLU CB C 69 28.500 29.239 -0.739 1
1 99 . 18 1 1 A 9 9 GLU N N 69 115.400 117.887 -2.487 1
1 100 . 18 1 1 A 10 10 LYS H H 70 7.740 7.647 0.093 1
1 101 . 18 1 1 A 10 10 LYS HA H 70 3.910 3.971 -0.061 1
1 110 . 18 1 1 A 10 10 LYS C C 70 179.500 178.473 1.027 1
1 111 . 18 1 1 A 10 10 LYS CA C 70 60.000 58.842 1.158 1
1 112 . 18 1 1 A 10 10 LYS CB C 70 32.400 31.954 0.446 1
1 116 . 18 1 1 A 10 10 LYS N N 70 122.700 120.384 2.316 1
1 117 . 18 1 1 A 11 11 PHE H H 71 8.750 8.457 0.293 1
1 118 . 18 1 1 A 11 11 PHE HA H 71 4.080 4.375 -0.295 1
1 126 . 18 1 1 A 11 11 PHE C C 71 177.100 176.995 0.105 1
1 127 . 18 1 1 A 11 11 PHE CA C 71 61.200 61.188 0.012 1
1 128 . 18 1 1 A 11 11 PHE CB C 71 38.900 39.050 -0.150 1
1 134 . 18 1 1 A 11 11 PHE N N 71 123.500 120.716 2.784 1
1 135 . 18 1 1 A 12 12 LEU H H 72 8.400 8.964 -0.564 1
1 136 . 18 1 1 A 12 12 LEU HA H 72 3.520 3.527 -0.007 1
1 146 . 18 1 1 A 12 12 LEU C C 72 180.000 179.397 0.603 1
1 147 . 18 1 1 A 12 12 LEU CA C 72 58.200 57.696 0.504 1
1 148 . 18 1 1 A 12 12 LEU CB C 72 41.700 41.261 0.439 1
1 152 . 18 1 1 A 12 12 LEU N N 72 121.100 118.954 2.146 1
1 153 . 18 1 1 A 13 13 LYS H H 73 7.810 8.146 -0.336 1
1 154 . 18 1 1 A 13 13 LYS HA H 73 4.080 3.990 0.090 1
1 156 . 18 1 1 A 13 13 LYS C C 73 179.300 179.657 -0.357 1
1 157 . 18 1 1 A 13 13 LYS CA C 73 59.000 59.217 -0.217 1
1 158 . 18 1 1 A 13 13 LYS CB C 73 31.900 32.233 -0.333 1
1 159 . 18 1 1 A 13 13 LYS N N 73 119.400 118.742 0.658 1
1 160 . 18 1 1 A 14 14 SER H H 74 8.210 8.423 -0.213 1
1 161 . 18 1 1 A 14 14 SER HA H 74 4.210 4.158 0.052 1
1 164 . 18 1 1 A 14 14 SER C C 74 176.300 176.962 -0.662 1
1 165 . 18 1 1 A 14 14 SER CA C 74 61.400 61.186 0.214 1
1 166 . 18 1 1 A 14 14 SER CB C 74 62.600 62.394 0.206 1
1 167 . 18 1 1 A 14 14 SER N N 74 117.600 114.608 2.992 1
1 168 . 18 1 1 A 15 15 LYS H H 75 7.760 7.817 -0.057 1
1 169 . 18 1 1 A 15 15 LYS HA H 75 4.040 3.843 0.197 1
1 178 . 18 1 1 A 15 15 LYS C C 75 178.500 178.129 0.371 1
1 179 . 18 1 1 A 15 15 LYS CA C 75 56.500 59.447 -2.947 1
1 180 . 18 1 1 A 15 15 LYS CB C 75 30.600 31.189 -0.589 1
1 184 . 18 1 1 A 15 15 LYS N N 75 120.100 121.192 -1.092 1
1 185 . 18 1 1 A 16 16 GLU H H 76 7.680 8.234 -0.554 1
1 186 . 18 1 1 A 16 16 GLU HA H 76 4.030 4.029 0.001 1
1 191 . 18 1 1 A 16 16 GLU C C 76 179.900 178.315 1.585 1
1 192 . 18 1 1 A 16 16 GLU CA C 76 59.200 59.373 -0.173 1
1 193 . 18 1 1 A 16 16 GLU CB C 76 29.600 29.116 0.484 1
1 195 . 18 1 1 A 16 16 GLU N N 76 119.700 119.410 0.290 1
1 196 . 18 1 1 A 17 17 ALA H H 77 8.030 7.988 0.042 1
1 197 . 18 1 1 A 17 17 ALA HA H 77 4.200 4.176 0.024 1
1 201 . 18 1 1 A 17 17 ALA C C 77 178.900 180.130 -1.230 1
1 202 . 18 1 1 A 17 17 ALA CA C 77 54.400 53.499 0.901 1
1 203 . 18 1 1 A 17 17 ALA CB C 77 18.100 18.795 -0.695 1
1 204 . 18 1 1 A 17 17 ALA N N 77 123.000 120.544 2.456 1
1 205 . 18 1 1 A 18 18 ASP H H 78 7.860 7.620 0.240 1
1 206 . 18 1 1 A 18 18 ASP HA H 78 4.600 4.612 -0.012 1
1 209 . 18 1 1 A 18 18 ASP C C 78 177.500 176.357 1.143 1
1 210 . 18 1 1 A 18 18 ASP CA C 78 55.100 54.423 0.677 1
1 211 . 18 1 1 A 18 18 ASP CB C 78 41.400 41.229 0.171 1
1 212 . 18 1 1 A 18 18 ASP N N 78 117.700 116.293 1.407 1
1 213 . 18 1 1 A 19 19 GLY H H 79 7.910 8.085 -0.175 1
1 214 . 18 1 1 A 19 19 GLY HA2 H 79 3.860 3.952 -0.092 1
1 215 . 18 1 1 A 19 19 GLY HA3 H 79 4.080 3.956 0.124 1
1 216 . 18 1 1 A 19 19 GLY C C 79 175.300 173.923 1.377 1
1 217 . 18 1 1 A 19 19 GLY CA C 79 46.200 46.547 -0.347 1
1 218 . 18 1 1 A 19 19 GLY N N 79 107.100 107.437 -0.337 1
1 219 . 18 1 1 A 20 20 VAL H H 80 7.150 7.815 -0.665 1
1 220 . 18 1 1 A 20 20 VAL HA H 80 4.250 4.945 -0.695 1
1 228 . 18 1 1 A 20 20 VAL C C 80 175.100 174.764 0.336 1
1 229 . 18 1 1 A 20 20 VAL CA C 80 61.800 59.205 2.595 1
1 230 . 18 1 1 A 20 20 VAL CB C 80 32.200 35.195 -2.995 1
1 233 . 18 1 1 A 20 20 VAL N N 80 114.600 115.065 -0.465 1
1 234 . 18 1 1 A 21 21 SER H H 81 8.560 8.766 -0.206 1
1 235 . 18 1 1 A 21 21 SER HA H 81 4.390 4.491 -0.101 1
1 238 . 18 1 1 A 21 21 SER C C 81 174.600 175.818 -1.218 1
1 239 . 18 1 1 A 21 21 SER CA C 81 57.900 58.467 -0.567 1
1 240 . 18 1 1 A 21 21 SER CB C 81 64.700 64.180 0.520 1
1 241 . 18 1 1 A 21 21 SER N N 81 118.700 120.170 -1.470 1
1 242 . 18 1 1 A 22 22 VAL H H 82 8.690 8.751 -0.061 1
1 243 . 18 1 1 A 22 22 VAL HA H 82 3.700 3.657 0.043 1
1 251 . 18 1 1 A 22 22 VAL C C 82 178.000 177.778 0.222 1
1 252 . 18 1 1 A 22 22 VAL CA C 82 66.500 66.699 -0.199 1
1 253 . 18 1 1 A 22 22 VAL CB C 82 31.700 31.668 0.032 1
1 256 . 18 1 1 A 22 22 VAL N N 82 122.100 124.188 -2.088 1
1 257 . 18 1 1 A 23 23 SER H H 83 8.300 8.108 0.192 1
1 258 . 18 1 1 A 23 23 SER HA H 83 4.210 4.099 0.111 1
1 261 . 18 1 1 A 23 23 SER C C 83 177.600 176.987 0.613 1
1 262 . 18 1 1 A 23 23 SER CA C 83 61.400 61.167 0.233 1
1 263 . 18 1 1 A 23 23 SER CB C 83 62.400 63.177 -0.777 1
1 264 . 18 1 1 A 23 23 SER N N 83 113.600 115.417 -1.817 1
1 265 . 18 1 1 A 24 24 GLN H H 84 7.820 7.997 -0.177 1
1 266 . 18 1 1 A 24 24 GLN HA H 84 3.970 3.862 0.108 1
1 273 . 18 1 1 A 24 24 GLN C C 84 178.400 177.907 0.493 1
1 274 . 18 1 1 A 24 24 GLN CA C 84 58.400 58.646 -0.246 1
1 275 . 18 1 1 A 24 24 GLN CB C 84 28.900 28.216 0.684 1
1 278 . 18 1 1 A 24 24 GLN N N 84 122.900 121.102 1.798 1
1 280 . 18 1 1 A 25 25 LEU H H 85 8.920 7.848 1.072 1
1 281 . 18 1 1 A 25 25 LEU HA H 85 4.130 4.299 -0.169 1
1 291 . 18 1 1 A 25 25 LEU C C 85 178.800 178.493 0.307 1
1 292 . 18 1 1 A 25 25 LEU CA C 85 58.300 57.393 0.907 1
1 293 . 18 1 1 A 25 25 LEU CB C 85 41.200 41.544 -0.344 1
1 297 . 18 1 1 A 25 25 LEU N N 85 122.200 120.949 1.251 1
1 298 . 18 1 1 A 26 26 ASN H H 86 8.860 8.508 0.352 1
1 299 . 18 1 1 A 26 26 ASN HA H 86 4.420 4.391 0.029 1
1 304 . 18 1 1 A 26 26 ASN C C 86 179.000 177.532 1.468 1
1 305 . 18 1 1 A 26 26 ASN CA C 86 55.900 56.791 -0.891 1
1 306 . 18 1 1 A 26 26 ASN CB C 86 37.200 38.623 -1.423 1
1 308 . 18 1 1 A 26 26 ASN N N 86 117.600 118.246 -0.646 1
1 310 . 18 1 1 A 27 27 SER H H 87 7.840 8.118 -0.278 1
1 311 . 18 1 1 A 27 27 SER HA H 87 4.100 3.987 0.113 1
1 314 . 18 1 1 A 27 27 SER C C 87 179.000 176.659 2.341 1
1 315 . 18 1 1 A 27 27 SER CA C 87 62.100 61.217 0.883 1
1 316 . 18 1 1 A 27 27 SER CB C 87 62.100 62.147 -0.047 1
1 317 . 18 1 1 A 27 27 SER N N 87 118.500 115.566 2.934 1
1 318 . 18 1 1 A 28 28 TYR H H 88 8.180 7.485 0.695 1
1 319 . 18 1 1 A 28 28 TYR HA H 88 4.600 4.563 0.037 1
1 326 . 18 1 1 A 28 28 TYR C C 88 174.800 178.622 -3.822 1
1 327 . 18 1 1 A 28 28 TYR CA C 88 61.200 62.305 -1.105 1
1 328 . 18 1 1 A 28 28 TYR CB C 88 37.800 37.950 -0.150 1
1 333 . 18 1 1 A 28 28 TYR N N 88 119.300 119.801 -0.501 1
1 334 . 18 1 1 A 29 29 LYS H H 89 9.040 8.086 0.954 1
1 335 . 18 1 1 A 29 29 LYS HA H 89 3.890 4.111 -0.221 1
1 344 . 18 1 1 A 29 29 LYS C C 89 179.000 180.000 -1.000 1
1 345 . 18 1 1 A 29 29 LYS CA C 89 61.300 59.264 2.036 1
1 346 . 18 1 1 A 29 29 LYS CB C 89 32.800 31.886 0.914 1
1 350 . 18 1 1 A 29 29 LYS N N 89 119.300 119.049 0.251 1
1 351 . 18 1 1 A 30 30 ASN H H 90 7.770 8.148 -0.378 1
1 352 . 18 1 1 A 30 30 ASN HA H 90 4.560 4.404 0.156 1
1 357 . 18 1 1 A 30 30 ASN C C 90 178.300 177.617 0.683 1
1 358 . 18 1 1 A 30 30 ASN CA C 90 56.200 56.437 -0.237 1
1 359 . 18 1 1 A 30 30 ASN CB C 90 38.900 38.148 0.752 1
1 361 . 18 1 1 A 30 30 ASN N N 90 117.800 117.672 0.128 1
1 363 . 18 1 1 A 31 31 TYR H H 91 8.860 7.946 0.914 1
1 364 . 18 1 1 A 31 31 TYR HA H 91 4.910 4.513 0.397 1
1 371 . 18 1 1 A 31 31 TYR C C 91 178.300 178.820 -0.520 1
1 372 . 18 1 1 A 31 31 TYR CA C 91 59.700 60.690 -0.990 1
1 373 . 18 1 1 A 31 31 TYR CB C 91 37.500 38.019 -0.519 1
1 378 . 18 1 1 A 31 31 TYR N N 91 119.400 119.136 0.264 1
1 379 . 18 1 1 A 32 32 CYS H H 92 8.640 8.185 0.455 1
1 380 . 18 1 1 A 32 32 CYS HA H 92 4.410 4.351 0.059 1
1 383 . 18 1 1 A 32 32 CYS C C 92 173.700 176.754 -3.054 1
1 384 . 18 1 1 A 32 32 CYS CA C 92 65.500 63.828 1.672 1
1 385 . 18 1 1 A 32 32 CYS CB C 92 28.300 28.078 0.222 1
1 386 . 18 1 1 A 32 32 CYS N N 92 113.500 118.347 -4.847 1
1 387 . 18 1 1 A 33 33 ARG H H 93 8.440 8.704 -0.264 1
1 388 . 18 1 1 A 33 33 ARG HA H 93 3.740 4.101 -0.361 1
1 391 . 18 1 1 A 33 33 ARG C C 93 177.200 176.942 0.258 1
1 392 . 18 1 1 A 33 33 ARG CA C 93 58.300 57.678 0.622 1
1 393 . 18 1 1 A 33 33 ARG CB C 93 30.200 29.882 0.318 1
1 394 . 18 1 1 A 33 33 ARG N N 93 111.400 119.632 -8.232 1
1 395 . 18 1 1 A 34 34 ASN H H 94 8.020 8.128 -0.108 1
1 396 . 18 1 1 A 34 34 ASN HA H 94 4.980 5.013 -0.033 1
1 401 . 18 1 1 A 34 34 ASN C C 94 176.700 177.110 -0.410 1
1 402 . 18 1 1 A 34 34 ASN CA C 94 53.400 54.899 -1.499 1
1 403 . 18 1 1 A 34 34 ASN CB C 94 38.000 40.324 -2.324 1
1 405 . 18 1 1 A 34 34 ASN N N 94 113.600 118.752 -5.152 1
1 407 . 18 1 1 A 35 35 HIS H H 95 7.200 8.157 -0.957 1
1 408 . 18 1 1 A 35 35 HIS HA H 95 4.470 4.488 -0.018 1
1 411 . 18 1 1 A 35 35 HIS C C 95 176.600 176.286 0.314 1
1 412 . 18 1 1 A 35 35 HIS CA C 95 60.000 58.951 1.049 1
1 413 . 18 1 1 A 35 35 HIS CB C 95 30.500 31.116 -0.616 1
1 414 . 18 1 1 A 35 35 HIS N N 95 115.600 116.526 -0.926 1
1 415 . 18 1 1 A 36 36 LEU H H 96 8.170 7.697 0.473 1
1 416 . 18 1 1 A 36 36 LEU HA H 96 4.730 4.451 0.279 1
1 426 . 18 1 1 A 36 36 LEU C C 96 176.800 177.531 -0.731 1
1 427 . 18 1 1 A 36 36 LEU CA C 96 54.400 54.706 -0.306 1
1 428 . 18 1 1 A 36 36 LEU CB C 96 40.600 41.825 -1.225 1
1 432 . 18 1 1 A 36 36 LEU N N 96 114.000 120.034 -6.034 1
1 433 . 18 1 1 A 37 37 SER H H 97 7.140 7.929 -0.789 1
1 434 . 18 1 1 A 37 37 SER HA H 97 4.730 4.271 0.459 1
1 437 . 18 1 1 A 37 37 SER CA C 97 62.700 63.548 -0.848 1
1 438 . 18 1 1 A 37 37 SER CB C 97 62.600 61.697 0.903 1
1 439 . 18 1 1 A 37 37 SER N N 97 117.200 116.635 0.565 1
1 440 . 18 1 1 A 38 38 PRO HA H 98 4.560 4.364 0.196 1
1 447 . 18 1 1 A 38 38 PRO C C 98 177.900 178.981 -1.081 1
1 448 . 18 1 1 A 38 38 PRO CA C 98 65.700 66.028 -0.328 1
1 449 . 18 1 1 A 38 38 PRO CB C 98 31.800 30.932 0.868 1
1 452 . 18 1 1 A 39 39 LEU H H 99 8.090 7.618 0.472 1
1 453 . 18 1 1 A 39 39 LEU HA H 99 4.260 4.039 0.221 1
1 463 . 18 1 1 A 39 39 LEU C C 99 178.700 178.441 0.259 1
1 464 . 18 1 1 A 39 39 LEU CA C 99 54.300 57.324 -3.024 1
1 465 . 18 1 1 A 39 39 LEU CB C 99 42.400 41.585 0.815 1
1 469 . 18 1 1 A 39 39 LEU N N 99 112.400 117.243 -4.843 1
1 470 . 18 1 1 A 40 40 TYR H H 100 8.350 8.885 -0.535 1
1 471 . 18 1 1 A 40 40 TYR HA H 100 4.170 4.404 -0.234 1
1 478 . 18 1 1 A 40 40 TYR C C 100 178.300 176.906 1.394 1
1 479 . 18 1 1 A 40 40 TYR CA C 100 63.400 62.178 1.222 1
1 480 . 18 1 1 A 40 40 TYR CB C 100 38.600 39.155 -0.555 1
1 485 . 18 1 1 A 40 40 TYR N N 100 119.400 120.919 -1.519 1
1 486 . 18 1 1 A 41 41 MET H H 101 8.640 8.108 0.532 1
1 487 . 18 1 1 A 41 41 MET HA H 101 4.260 4.701 -0.441 1
1 488 . 18 1 1 A 41 41 MET C C 101 177.000 176.383 0.617 1
1 489 . 18 1 1 A 41 41 MET CA C 101 54.600 54.707 -0.107 1
1 490 . 18 1 1 A 41 41 MET N N 101 111.800 116.265 -4.465 1
1 491 . 18 1 1 A 42 42 LYS H H 102 7.880 7.873 0.007 1
1 492 . 18 1 1 A 42 42 LYS HA H 102 4.430 4.637 -0.207 1
1 501 . 18 1 1 A 42 42 LYS C C 102 176.300 176.026 0.274 1
1 502 . 18 1 1 A 42 42 LYS CA C 102 56.000 54.840 1.160 1
1 503 . 18 1 1 A 42 42 LYS CB C 102 33.400 33.373 0.027 1
1 507 . 18 1 1 A 42 42 LYS N N 102 121.700 119.895 1.805 1
1 508 . 18 1 1 A 43 43 SER H H 103 9.160 8.587 0.573 1
1 509 . 18 1 1 A 43 43 SER HA H 103 4.620 4.691 -0.071 1
1 513 . 18 1 1 A 43 43 SER C C 103 176.300 175.162 1.138 1
1 514 . 18 1 1 A 43 43 SER CA C 103 58.700 57.722 0.978 1
1 515 . 18 1 1 A 43 43 SER CB C 103 63.700 64.075 -0.375 1
1 516 . 18 1 1 A 43 43 SER N N 103 118.800 116.419 2.381 1
1 517 . 18 1 1 A 44 44 LEU H H 104 8.860 9.176 -0.316 1
1 518 . 18 1 1 A 44 44 LEU HA H 104 4.130 4.287 -0.157 1
1 528 . 18 1 1 A 44 44 LEU C C 104 178.700 178.222 0.478 1
1 529 . 18 1 1 A 44 44 LEU CA C 104 58.800 58.095 0.705 1
1 530 . 18 1 1 A 44 44 LEU CB C 104 42.600 41.764 0.836 1
1 534 . 18 1 1 A 44 44 LEU N N 104 124.200 130.192 -5.992 1
1 535 . 18 1 1 A 45 45 SER H H 105 8.330 7.760 0.570 1
1 536 . 18 1 1 A 45 45 SER HA H 105 4.310 4.324 -0.014 1
1 539 . 18 1 1 A 45 45 SER C C 105 175.000 175.651 -0.651 1
1 540 . 18 1 1 A 45 45 SER CA C 105 60.100 60.286 -0.186 1
1 541 . 18 1 1 A 45 45 SER CB C 105 63.400 63.120 0.280 1
1 542 . 18 1 1 A 45 45 SER N N 105 107.700 113.967 -6.267 1
1 543 . 18 1 1 A 46 46 GLU H H 106 7.800 7.903 -0.103 1
1 544 . 18 1 1 A 46 46 GLU HA H 106 4.570 4.402 0.168 1
1 549 . 18 1 1 A 46 46 GLU C C 106 174.100 175.549 -1.449 1
1 550 . 18 1 1 A 46 46 GLU CA C 106 55.600 56.073 -0.473 1
1 551 . 18 1 1 A 46 46 GLU CB C 106 31.200 30.308 0.892 1
1 553 . 18 1 1 A 46 46 GLU N N 106 119.600 118.004 1.596 1
1 554 . 18 1 1 A 47 47 ILE H H 107 7.100 7.642 -0.542 1
1 555 . 18 1 1 A 47 47 ILE HA H 107 4.040 4.303 -0.263 1
1 565 . 18 1 1 A 47 47 ILE C C 107 174.100 174.798 -0.698 1
1 566 . 18 1 1 A 47 47 ILE CA C 107 62.300 60.313 1.987 1
1 567 . 18 1 1 A 47 47 ILE CB C 107 38.500 38.687 -0.187 1
1 571 . 18 1 1 A 47 47 ILE N N 107 120.600 121.155 -0.555 1
1 572 . 18 1 1 A 48 48 LEU H H 108 9.180 8.867 0.313 1
1 573 . 18 1 1 A 48 48 LEU HA H 108 4.940 4.657 0.283 1
1 583 . 18 1 1 A 48 48 LEU CA C 108 51.900 51.911 -0.011 1
1 584 . 18 1 1 A 48 48 LEU CB C 108 42.000 41.932 0.068 1
1 588 . 18 1 1 A 48 48 LEU N N 108 129.400 128.643 0.757 1
1 589 . 18 1 1 A 49 49 PRO HA H 109 3.910 4.195 -0.285 1
1 596 . 18 1 1 A 49 49 PRO C C 109 178.500 177.939 0.561 1
1 597 . 18 1 1 A 49 49 PRO CA C 109 66.600 64.925 1.675 1
1 598 . 18 1 1 A 49 49 PRO CB C 109 31.300 31.633 -0.333 1
1 601 . 18 1 1 A 50 50 ALA H H 110 8.280 8.130 0.150 1
1 602 . 18 1 1 A 50 50 ALA HA H 110 4.110 4.059 0.051 1
1 606 . 18 1 1 A 50 50 ALA C C 110 179.700 179.828 -0.128 1
1 607 . 18 1 1 A 50 50 ALA CA C 110 55.100 54.838 0.262 1
1 608 . 18 1 1 A 50 50 ALA CB C 110 19.200 18.315 0.885 1
1 609 . 18 1 1 A 50 50 ALA N N 110 116.100 119.272 -3.172 1
1 610 . 18 1 1 A 51 51 ASP H H 111 7.790 7.780 0.010 1
1 611 . 18 1 1 A 51 51 ASP HA H 111 4.440 4.340 0.100 1
1 614 . 18 1 1 A 51 51 ASP C C 111 178.200 178.802 -0.602 1
1 615 . 18 1 1 A 51 51 ASP CA C 111 57.600 57.362 0.238 1
1 616 . 18 1 1 A 51 51 ASP CB C 111 41.800 40.936 0.864 1
1 617 . 18 1 1 A 51 51 ASP N N 111 116.500 117.753 -1.253 1
1 618 . 18 1 1 A 52 52 ILE H H 112 7.020 7.609 -0.589 1
1 619 . 18 1 1 A 52 52 ILE HA H 112 3.750 3.630 0.120 1
1 629 . 18 1 1 A 52 52 ILE C C 112 177.300 177.956 -0.656 1
1 630 . 18 1 1 A 52 52 ILE CA C 112 63.500 65.056 -1.556 1
1 631 . 18 1 1 A 52 52 ILE CB C 112 37.500 37.453 0.047 1
1 635 . 18 1 1 A 52 52 ILE N N 112 116.700 119.490 -2.790 1
1 636 . 18 1 1 A 53 53 GLN H H 113 9.150 8.334 0.816 1
1 637 . 18 1 1 A 53 53 GLN HA H 113 3.720 3.906 -0.186 1
1 644 . 18 1 1 A 53 53 GLN C C 113 177.500 178.736 -1.236 1
1 645 . 18 1 1 A 53 53 GLN CA C 113 58.200 59.096 -0.896 1
1 646 . 18 1 1 A 53 53 GLN CB C 113 30.200 28.347 1.853 1
1 649 . 18 1 1 A 53 53 GLN N N 113 121.200 118.943 2.257 1
1 651 . 18 1 1 A 54 54 SER H H 114 8.150 7.832 0.318 1
1 652 . 18 1 1 A 54 54 SER HA H 114 4.180 4.203 -0.023 1
1 655 . 18 1 1 A 54 54 SER C C 114 175.900 177.402 -1.502 1
1 656 . 18 1 1 A 54 54 SER CA C 114 62.100 61.713 0.387 1
1 657 . 18 1 1 A 54 54 SER CB C 114 62.800 63.093 -0.293 1
1 658 . 18 1 1 A 54 54 SER N N 114 112.200 115.227 -3.027 1
1 659 . 18 1 1 A 55 55 ILE H H 115 6.760 7.545 -0.785 1
1 660 . 18 1 1 A 55 55 ILE HA H 115 3.860 3.713 0.147 1
1 670 . 18 1 1 A 55 55 ILE C C 115 179.200 178.376 0.824 1
1 671 . 18 1 1 A 55 55 ILE CA C 115 64.700 65.127 -0.427 1
1 672 . 18 1 1 A 55 55 ILE CB C 115 38.900 38.041 0.859 1
1 676 . 18 1 1 A 55 55 ILE N N 115 119.500 120.831 -1.331 1
1 677 . 18 1 1 A 56 56 ILE H H 116 7.750 8.120 -0.370 1
1 678 . 18 1 1 A 56 56 ILE HA H 116 3.690 3.590 0.100 1
1 688 . 18 1 1 A 56 56 ILE C C 116 176.900 178.502 -1.602 1
1 689 . 18 1 1 A 56 56 ILE CA C 116 62.800 65.137 -2.337 1
1 690 . 18 1 1 A 56 56 ILE CB C 116 36.200 37.440 -1.240 1
1 694 . 18 1 1 A 56 56 ILE N N 116 120.200 120.165 0.035 1
1 695 . 18 1 1 A 57 57 ASN H H 117 8.690 8.251 0.439 1
1 696 . 18 1 1 A 57 57 ASN HA H 117 4.440 4.327 0.113 1
1 701 . 18 1 1 A 57 57 ASN C C 117 177.200 177.540 -0.340 1
1 702 . 18 1 1 A 57 57 ASN CA C 117 54.800 56.740 -1.940 1
1 703 . 18 1 1 A 57 57 ASN CB C 117 38.100 38.599 -0.499 1
1 705 . 18 1 1 A 57 57 ASN N N 117 117.000 120.078 -3.078 1
1 707 . 18 1 1 A 58 58 GLU H H 118 7.630 8.112 -0.482 1
1 708 . 18 1 1 A 58 58 GLU HA H 118 4.450 4.389 0.061 1
1 713 . 18 1 1 A 58 58 GLU C C 118 176.500 176.501 -0.001 1
1 714 . 18 1 1 A 58 58 GLU CA C 118 56.200 57.091 -0.891 1
1 715 . 18 1 1 A 58 58 GLU CB C 118 30.200 30.088 0.112 1
1 717 . 18 1 1 A 58 58 GLU N N 118 116.300 116.871 -0.571 1
1 718 . 18 1 1 A 59 59 THR H H 119 7.540 7.410 0.130 1
1 719 . 18 1 1 A 59 59 THR HA H 119 4.230 4.439 -0.209 1
1 724 . 18 1 1 A 59 59 THR C C 119 174.200 173.942 0.258 1
1 725 . 18 1 1 A 59 59 THR CA C 119 63.800 62.778 1.022 1
1 726 . 18 1 1 A 59 59 THR CB C 119 68.900 69.666 -0.766 1
1 728 . 18 1 1 A 59 59 THR N N 119 117.600 115.986 1.614 1
1 729 . 18 1 1 A 60 60 LYS H H 120 8.860 8.938 -0.078 1
1 730 . 18 1 1 A 60 60 LYS HA H 120 4.490 4.638 -0.148 1
1 739 . 18 1 1 A 60 60 LYS C C 120 175.800 175.332 0.468 1
1 740 . 18 1 1 A 60 60 LYS CA C 120 54.900 55.416 -0.516 1
1 741 . 18 1 1 A 60 60 LYS CB C 120 29.800 31.523 -1.723 1
1 745 . 18 1 1 A 60 60 LYS N N 120 128.500 127.246 1.254 1
1 746 . 18 1 1 A 61 61 LEU H H 121 7.150 8.353 -1.203 1
1 747 . 18 1 1 A 61 61 LEU HA H 121 4.710 4.944 -0.234 1
1 757 . 18 1 1 A 61 61 LEU C C 121 175.000 175.752 -0.752 1
1 758 . 18 1 1 A 61 61 LEU CA C 121 52.800 53.195 -0.395 1
1 759 . 18 1 1 A 61 61 LEU CB C 121 46.400 45.465 0.935 1
1 763 . 18 1 1 A 61 61 LEU N N 121 120.700 126.119 -5.419 1
1 764 . 18 1 1 A 62 62 ALA H H 122 8.000 8.601 -0.601 1
1 765 . 18 1 1 A 62 62 ALA HA H 122 4.250 4.435 -0.185 1
1 769 . 18 1 1 A 62 62 ALA CA C 122 52.100 52.197 -0.097 1
1 770 . 18 1 1 A 62 62 ALA CB C 122 19.500 19.111 0.389 1
1 771 . 18 1 1 A 62 62 ALA N N 122 119.900 123.436 -3.536 1
1 772 . 18 1 1 A 63 63 LYS H H 123 8.770 8.713 0.057 1
1 773 . 18 1 1 A 63 63 LYS HA H 123 3.800 4.034 -0.234 1
1 782 . 18 1 1 A 63 63 LYS C C 123 178.300 178.396 -0.096 1
1 783 . 18 1 1 A 63 63 LYS CA C 123 60.700 58.892 1.808 1
1 784 . 18 1 1 A 63 63 LYS CB C 123 32.300 31.992 0.308 1
1 788 . 18 1 1 A 63 63 LYS N N 123 121.400 121.807 -0.407 1
1 789 . 18 1 1 A 64 64 ASN H H 124 9.020 7.987 1.033 1
1 790 . 18 1 1 A 64 64 ASN HA H 124 4.430 4.525 -0.095 1
1 795 . 18 1 1 A 64 64 ASN C C 124 178.300 177.956 0.344 1
1 796 . 18 1 1 A 64 64 ASN CA C 124 56.200 56.131 0.069 1
1 797 . 18 1 1 A 64 64 ASN CB C 124 37.300 38.058 -0.758 1
1 799 . 18 1 1 A 64 64 ASN N N 124 115.000 118.173 -3.173 1
1 801 . 18 1 1 A 65 65 THR H H 125 7.620 8.087 -0.467 1
1 802 . 18 1 1 A 65 65 THR HA H 125 4.030 4.043 -0.013 1
1 807 . 18 1 1 A 65 65 THR C C 125 175.500 177.209 -1.709 1
1 808 . 18 1 1 A 65 65 THR CA C 125 66.000 66.898 -0.898 1
1 809 . 18 1 1 A 65 65 THR CB C 125 67.600 67.766 -0.166 1
1 811 . 18 1 1 A 65 65 THR N N 125 119.800 117.794 2.006 1
1 812 . 18 1 1 A 66 66 LEU H H 126 8.020 8.088 -0.068 1
1 813 . 18 1 1 A 66 66 LEU HA H 126 3.790 3.895 -0.105 1
1 823 . 18 1 1 A 66 66 LEU C C 126 179.200 179.233 -0.033 1
1 824 . 18 1 1 A 66 66 LEU CA C 126 58.700 57.927 0.773 1
1 825 . 18 1 1 A 66 66 LEU CB C 126 41.300 41.262 0.038 1
1 829 . 18 1 1 A 66 66 LEU N N 126 121.200 121.921 -0.721 1
1 830 . 18 1 1 A 67 67 LYS H H 127 8.380 7.873 0.507 1
1 831 . 18 1 1 A 67 67 LYS HA H 127 3.740 4.098 -0.358 1
1 840 . 18 1 1 A 67 67 LYS C C 127 178.300 179.408 -1.108 1
1 841 . 18 1 1 A 67 67 LYS CA C 127 60.100 59.238 0.862 1
1 842 . 18 1 1 A 67 67 LYS CB C 127 32.400 31.942 0.458 1
1 846 . 18 1 1 A 67 67 LYS N N 127 117.000 118.041 -1.041 1
1 847 . 18 1 1 A 68 68 ALA H H 128 7.480 7.776 -0.296 1
1 848 . 18 1 1 A 68 68 ALA HA H 128 4.210 3.978 0.232 1
1 852 . 18 1 1 A 68 68 ALA C C 128 181.200 179.592 1.608 1
1 853 . 18 1 1 A 68 68 ALA CA C 128 55.200 54.745 0.455 1
1 854 . 18 1 1 A 68 68 ALA CB C 128 18.600 18.281 0.319 1
1 855 . 18 1 1 A 68 68 ALA N N 128 122.900 121.927 0.973 1
1 856 . 18 1 1 A 69 69 ILE H H 129 8.250 7.528 0.722 1
1 857 . 18 1 1 A 69 69 ILE HA H 129 3.130 3.309 -0.179 1
1 867 . 18 1 1 A 69 69 ILE C C 129 177.400 177.706 -0.306 1
1 868 . 18 1 1 A 69 69 ILE CA C 129 66.700 65.275 1.425 1
1 869 . 18 1 1 A 69 69 ILE CB C 129 37.900 37.316 0.584 1
1 873 . 18 1 1 A 69 69 ILE N N 129 122.800 118.231 4.569 1
1 874 . 18 1 1 A 70 70 ARG H H 130 8.040 8.295 -0.255 1
1 875 . 18 1 1 A 70 70 ARG HA H 130 3.620 3.897 -0.277 1
1 882 . 18 1 1 A 70 70 ARG C C 130 177.800 178.596 -0.796 1
1 883 . 18 1 1 A 70 70 ARG CA C 130 60.700 59.882 0.818 1
1 884 . 18 1 1 A 70 70 ARG CB C 130 29.600 29.826 -0.226 1
1 887 . 18 1 1 A 70 70 ARG N N 130 119.700 120.431 -0.731 1
1 888 . 18 1 1 A 71 71 ASN H H 131 8.920 8.360 0.560 1
1 889 . 18 1 1 A 71 71 ASN HA H 131 4.430 4.460 -0.030 1
1 894 . 18 1 1 A 71 71 ASN C C 131 177.500 177.213 0.287 1
1 895 . 18 1 1 A 71 71 ASN CA C 131 56.100 56.605 -0.505 1
1 896 . 18 1 1 A 71 71 ASN CB C 131 38.600 39.184 -0.584 1
1 898 . 18 1 1 A 71 71 ASN N N 131 117.200 118.131 -0.931 1
1 900 . 18 1 1 A 72 72 THR H H 132 8.300 7.951 0.349 1
1 901 . 18 1 1 A 72 72 THR HA H 132 4.430 3.799 0.631 1
1 906 . 18 1 1 A 72 72 THR C C 132 175.100 176.981 -1.881 1
1 907 . 18 1 1 A 72 72 THR CA C 132 68.200 65.359 2.841 1
1 908 . 18 1 1 A 72 72 THR CB C 132 68.500 68.779 -0.279 1
1 910 . 18 1 1 A 72 72 THR N N 132 119.200 113.268 5.932 1
1 911 . 18 1 1 A 73 73 ALA H H 133 7.950 8.209 -0.259 1
1 912 . 18 1 1 A 73 73 ALA HA H 133 4.040 4.146 -0.106 1
1 916 . 18 1 1 A 73 73 ALA C C 133 178.200 179.504 -1.304 1
1 917 . 18 1 1 A 73 73 ALA CA C 133 55.900 55.528 0.372 1
1 918 . 18 1 1 A 73 73 ALA CB C 133 16.700 18.556 -1.856 1
1 919 . 18 1 1 A 73 73 ALA N N 133 120.900 123.675 -2.775 1
1 920 . 18 1 1 A 74 74 SER H H 134 8.440 8.370 0.070 1
1 921 . 18 1 1 A 74 74 SER HA H 134 4.430 4.222 0.208 1
1 924 . 18 1 1 A 74 74 SER C C 134 178.800 177.270 1.530 1
1 925 . 18 1 1 A 74 74 SER CA C 134 61.300 61.053 0.247 1
1 926 . 18 1 1 A 74 74 SER CB C 134 62.600 63.125 -0.525 1
1 927 . 18 1 1 A 74 74 SER N N 134 110.100 113.241 -3.141 1
1 928 . 18 1 1 A 75 75 GLN H H 135 8.340 7.769 0.571 1
1 929 . 18 1 1 A 75 75 GLN HA H 135 3.880 3.947 -0.067 1
1 936 . 18 1 1 A 75 75 GLN C C 135 178.800 178.466 0.334 1
1 937 . 18 1 1 A 75 75 GLN CA C 135 59.600 58.954 0.646 1
1 938 . 18 1 1 A 75 75 GLN CB C 135 29.900 27.704 2.196 1
1 941 . 18 1 1 A 75 75 GLN N N 135 118.100 121.229 -3.129 1
1 943 . 18 1 1 A 76 76 ILE H H 136 7.670 7.202 0.468 1
1 944 . 18 1 1 A 76 76 ILE HA H 136 3.200 3.251 -0.051 1
1 954 . 18 1 1 A 76 76 ILE C C 136 177.500 178.048 -0.548 1
1 955 . 18 1 1 A 76 76 ILE CA C 136 66.100 65.028 1.072 1
1 956 . 18 1 1 A 76 76 ILE CB C 136 37.400 37.307 0.093 1
1 960 . 18 1 1 A 76 76 ILE N N 136 122.500 119.717 2.783 1
1 961 . 18 1 1 A 77 77 PHE H H 137 7.930 8.216 -0.286 1
1 962 . 18 1 1 A 77 77 PHE HA H 137 3.890 4.183 -0.293 1
1 969 . 18 1 1 A 77 77 PHE C C 137 178.200 179.041 -0.841 1
1 970 . 18 1 1 A 77 77 PHE CA C 137 63.600 60.742 2.858 1
1 971 . 18 1 1 A 77 77 PHE CB C 137 39.300 38.290 1.010 1
1 976 . 18 1 1 A 77 77 PHE N N 137 116.100 119.203 -3.103 1
1 977 . 18 1 1 A 78 78 ARG H H 138 8.900 8.630 0.270 1
1 978 . 18 1 1 A 78 78 ARG HA H 138 3.910 4.154 -0.244 1
1 986 . 18 1 1 A 78 78 ARG C C 138 178.300 178.704 -0.404 1
1 987 . 18 1 1 A 78 78 ARG CA C 138 60.100 58.380 1.720 1
1 988 . 18 1 1 A 78 78 ARG CB C 138 29.600 29.470 0.130 1
1 991 . 18 1 1 A 78 78 ARG N N 138 118.600 117.917 0.683 1
1 993 . 18 1 1 A 79 79 LEU H H 139 7.730 7.826 -0.096 1
1 994 . 18 1 1 A 79 79 LEU HA H 139 4.280 4.111 0.169 1
1 1004 . 18 1 1 A 79 79 LEU C C 139 179.000 178.278 0.722 1
1 1005 . 18 1 1 A 79 79 LEU CA C 139 57.800 57.724 0.076 1
1 1006 . 18 1 1 A 79 79 LEU CB C 139 41.900 41.362 0.538 1
1 1010 . 18 1 1 A 79 79 LEU N N 139 121.900 122.881 -0.981 1
1 1011 . 18 1 1 A 80 80 ALA H H 140 7.590 7.544 0.046 1
1 1012 . 18 1 1 A 80 80 ALA HA H 140 2.710 3.371 -0.661 1
1 1016 . 18 1 1 A 80 80 ALA C C 140 179.900 180.337 -0.437 1
1 1017 . 18 1 1 A 80 80 ALA CA C 140 55.100 54.597 0.503 1
1 1018 . 18 1 1 A 80 80 ALA CB C 140 17.600 17.740 -0.140 1
1 1019 . 18 1 1 A 80 80 ALA N N 140 123.400 119.960 3.440 1
1 1020 . 18 1 1 A 81 81 ILE H H 141 8.910 7.538 1.372 1
1 1021 . 18 1 1 A 81 81 ILE HA H 141 4.110 3.694 0.416 1
1 1031 . 18 1 1 A 81 81 ILE C C 141 181.700 177.677 4.023 1
1 1032 . 18 1 1 A 81 81 ILE CA C 141 64.800 65.306 -0.506 1
1 1033 . 18 1 1 A 81 81 ILE CB C 141 38.600 37.582 1.018 1
1 1037 . 18 1 1 A 81 81 ILE N N 141 122.400 118.774 3.626 1
1 1038 . 18 1 1 A 82 82 GLU H H 142 8.560 8.328 0.232 1
1 1039 . 18 1 1 A 82 82 GLU HA H 142 4.100 4.108 -0.008 1
1 1044 . 18 1 1 A 82 82 GLU C C 142 177.700 178.121 -0.421 1
1 1045 . 18 1 1 A 82 82 GLU CA C 142 59.100 59.791 -0.691 1
1 1046 . 18 1 1 A 82 82 GLU CB C 142 29.200 29.131 0.069 1
1 1048 . 18 1 1 A 82 82 GLU N N 142 123.200 119.987 3.213 1
1 1049 . 18 1 1 A 83 83 ASN H H 143 7.310 7.782 -0.472 1
1 1050 . 18 1 1 A 83 83 ASN HA H 143 4.750 4.903 -0.153 1
1 1055 . 18 1 1 A 83 83 ASN C C 143 173.200 174.438 -1.238 1
1 1056 . 18 1 1 A 83 83 ASN CA C 143 54.200 52.884 1.316 1
1 1057 . 18 1 1 A 83 83 ASN CB C 143 41.300 38.920 2.380 1
1 1059 . 18 1 1 A 83 83 ASN N N 143 114.900 115.414 -0.514 1
1 1061 . 18 1 1 A 84 84 ARG H H 144 8.320 7.872 0.448 1
1 1062 . 18 1 1 A 84 84 ARG HA H 144 4.120 4.038 0.082 1
1 1069 . 18 1 1 A 84 84 ARG C C 144 175.300 175.972 -0.672 1
1 1070 . 18 1 1 A 84 84 ARG CA C 144 57.100 56.962 0.138 1
1 1071 . 18 1 1 A 84 84 ARG CB C 144 26.000 26.972 -0.972 1
1 1074 . 18 1 1 A 84 84 ARG N N 144 114.400 115.323 -0.923 1
1 1075 . 18 1 1 A 85 85 ALA H H 145 8.350 8.462 -0.112 1
1 1076 . 18 1 1 A 85 85 ALA HA H 145 4.320 4.272 0.048 1
1 1080 . 18 1 1 A 85 85 ALA C C 145 176.500 177.432 -0.932 1
1 1081 . 18 1 1 A 85 85 ALA CA C 145 53.400 53.852 -0.452 1
1 1082 . 18 1 1 A 85 85 ALA CB C 145 19.900 19.323 0.577 1
1 1083 . 18 1 1 A 85 85 ALA N N 145 120.600 118.762 1.838 1
1 1084 . 18 1 1 A 86 86 ILE H H 146 7.290 7.509 -0.219 1
1 1085 . 18 1 1 A 86 86 ILE HA H 146 4.400 4.532 -0.132 1
1 1095 . 18 1 1 A 86 86 ILE C C 146 173.600 172.687 0.913 1
1 1096 . 18 1 1 A 86 86 ILE CA C 146 59.200 60.263 -1.063 1
1 1097 . 18 1 1 A 86 86 ILE CB C 146 41.600 41.180 0.420 1
1 1101 . 18 1 1 A 86 86 ILE N N 146 111.500 115.666 -4.166 1
1 1102 . 18 1 1 A 87 87 ASP H H 147 8.270 8.975 -0.705 1
1 1103 . 18 1 1 A 87 87 ASP HA H 147 4.940 4.931 0.009 1
1 1106 . 18 1 1 A 87 87 ASP C C 147 174.700 174.952 -0.252 1
1 1107 . 18 1 1 A 87 87 ASP CA C 147 53.700 53.052 0.648 1
1 1108 . 18 1 1 A 87 87 ASP CB C 147 41.800 39.483 2.317 1
1 1109 . 18 1 1 A 87 87 ASP N N 147 119.400 130.398 -10.998 1
1 1110 . 18 1 1 A 88 88 PHE H H 148 7.230 7.944 -0.714 1
1 1111 . 18 1 1 A 88 88 PHE HA H 148 4.690 4.773 -0.083 1
1 1119 . 18 1 1 A 88 88 PHE C C 148 171.500 172.834 -1.334 1
1 1120 . 18 1 1 A 88 88 PHE CA C 148 56.400 58.357 -1.957 1
1 1121 . 18 1 1 A 88 88 PHE CB C 148 42.000 42.196 -0.196 1
1 1127 . 18 1 1 A 88 88 PHE N N 148 119.700 124.363 -4.663 1
1 1128 . 18 1 1 A 89 89 ASN H H 149 8.060 8.423 -0.363 1
1 1129 . 18 1 1 A 89 89 ASN HA H 149 4.490 5.036 -0.546 1
1 1134 . 18 1 1 A 89 89 ASN CA C 149 48.100 48.844 -0.744 1
1 1135 . 18 1 1 A 89 89 ASN CB C 149 39.200 39.521 -0.321 1
1 1137 . 18 1 1 A 89 89 ASN N N 149 119.700 125.714 -6.014 1
1 1139 . 18 1 1 A 90 90 PRO HA H 150 3.970 4.205 -0.235 1
1 1146 . 18 1 1 A 90 90 PRO C C 150 177.700 177.431 0.269 1
1 1147 . 18 1 1 A 90 90 PRO CA C 150 63.900 64.432 -0.532 1
1 1148 . 18 1 1 A 90 90 PRO CB C 150 31.700 31.607 0.093 1
1 1151 . 18 1 1 A 91 91 ALA H H 151 7.240 7.355 -0.115 1
1 1152 . 18 1 1 A 91 91 ALA HA H 151 3.900 4.013 -0.113 1
1 1156 . 18 1 1 A 91 91 ALA C C 151 178.000 179.507 -1.507 1
1 1157 . 18 1 1 A 91 91 ALA CA C 151 53.900 53.988 -0.088 1
1 1158 . 18 1 1 A 91 91 ALA CB C 151 17.700 18.280 -0.580 1
1 1159 . 18 1 1 A 91 91 ALA N N 151 115.700 118.922 -3.222 1
1 1160 . 18 1 1 A 92 92 ASP H H 152 7.080 7.876 -0.796 1
1 1161 . 18 1 1 A 92 92 ASP HA H 152 4.220 4.286 -0.066 1
1 1164 . 18 1 1 A 92 92 ASP C C 152 176.200 177.090 -0.890 1
1 1165 . 18 1 1 A 92 92 ASP CA C 152 55.800 56.850 -1.050 1
1 1166 . 18 1 1 A 92 92 ASP CB C 152 39.500 40.485 -0.985 1
1 1167 . 18 1 1 A 92 92 ASP N N 152 117.100 119.621 -2.521 1
1 1168 . 18 1 1 A 93 93 TYR H H 153 7.060 7.414 -0.354 1
1 1169 . 18 1 1 A 93 93 TYR HA H 153 4.490 4.490 0.000 1
1 1176 . 18 1 1 A 93 93 TYR C C 153 174.700 175.537 -0.837 1
1 1177 . 18 1 1 A 93 93 TYR CA C 153 57.600 58.883 -1.283 1
1 1178 . 18 1 1 A 93 93 TYR CB C 153 38.500 38.496 0.004 1
1 1183 . 18 1 1 A 93 93 TYR N N 153 116.800 116.644 0.156 1
1 1184 . 18 1 1 A 94 94 VAL H H 154 7.000 7.234 -0.234 1
1 1185 . 18 1 1 A 94 94 VAL HA H 154 4.040 4.184 -0.144 1
1 1193 . 18 1 1 A 94 94 VAL C C 154 174.700 175.027 -0.327 1
1 1194 . 18 1 1 A 94 94 VAL CA C 154 62.100 62.203 -0.103 1
1 1195 . 18 1 1 A 94 94 VAL CB C 154 32.700 32.084 0.616 1
1 1198 . 18 1 1 A 94 94 VAL N N 154 120.600 120.715 -0.115 1
1 1199 . 18 1 1 A 95 95 ARG H H 155 9.430 8.983 0.447 1
1 1200 . 18 1 1 A 95 95 ARG HA H 155 4.640 4.617 0.023 1
1 1207 . 18 1 1 A 95 95 ARG C C 155 175.400 175.872 -0.472 1
1 1208 . 18 1 1 A 95 95 ARG CA C 155 54.200 56.096 -1.896 1
1 1209 . 18 1 1 A 95 95 ARG CB C 155 32.400 30.986 1.414 1
1 1212 . 18 1 1 A 95 95 ARG N N 155 128.200 127.105 1.095 1
1 1213 . 18 1 1 A 96 96 ILE H H 156 8.700 8.619 0.081 1
1 1214 . 18 1 1 A 96 96 ILE HA H 156 4.440 4.559 -0.119 1
1 1224 . 18 1 1 A 96 96 ILE CA C 156 56.500 57.877 -1.377 1
1 1225 . 18 1 1 A 96 96 ILE CB C 156 36.700 38.446 -1.746 1
1 1229 . 18 1 1 A 96 96 ILE N N 156 124.100 123.158 0.942 1
1 1230 . 18 1 1 A 97 97 PRO HA H 157 4.370 4.491 -0.121 1
1 1237 . 18 1 1 A 97 97 PRO C C 157 176.000 176.732 -0.732 1
1 1238 . 18 1 1 A 97 97 PRO CA C 157 63.200 63.178 0.022 1
1 1239 . 18 1 1 A 97 97 PRO CB C 157 32.400 31.967 0.433 1
1 1242 . 18 1 1 A 98 98 LYS H H 158 8.380 8.573 -0.193 1
1 1243 . 18 1 1 A 98 98 LYS HA H 158 4.190 4.551 -0.361 1
1 1252 . 18 1 1 A 98 98 LYS C C 158 176.800 176.271 0.529 1
1 1253 . 18 1 1 A 98 98 LYS CA C 158 57.100 55.402 1.698 1
1 1254 . 18 1 1 A 98 98 LYS CB C 158 32.800 32.209 0.591 1
1 1258 . 18 1 1 A 98 98 LYS N N 158 120.800 121.625 -0.825 1
1 1259 . 18 1 1 A 99 99 ILE H H 159 7.930 7.490 0.440 1
1 1260 . 18 1 1 A 99 99 ILE HA H 159 4.200 4.443 -0.243 1
1 1270 . 18 1 1 A 99 99 ILE C C 159 175.400 175.807 -0.407 1
1 1271 . 18 1 1 A 99 99 ILE CA C 159 60.600 61.104 -0.504 1
1 1272 . 18 1 1 A 99 99 ILE CB C 159 39.100 35.771 3.329 1
1 1276 . 18 1 1 A 99 99 ILE N N 159 120.200 120.703 -0.503 1
1 1277 . 18 1 1 A 100 100 ALA H H 160 8.370 8.376 -0.006 1
1 1278 . 18 1 1 A 100 100 ALA HA H 160 4.370 4.708 -0.338 1
1 1282 . 18 1 1 A 100 100 ALA C C 160 177.200 177.869 -0.669 1
1 1283 . 18 1 1 A 100 100 ALA CA C 160 52.200 51.335 0.865 1
1 1284 . 18 1 1 A 100 100 ALA CB C 160 19.400 20.071 -0.671 1
1 1285 . 18 1 1 A 100 100 ALA N N 160 128.300 127.938 0.362 1
1 1286 . 18 1 1 A 101 101 LEU H H 161 8.250 7.850 0.400 1
1 1287 . 18 1 1 A 101 101 LEU HA H 161 4.280 4.631 -0.351 1
1 1297 . 18 1 1 A 101 101 LEU C C 161 177.200 176.460 0.740 1
1 1298 . 18 1 1 A 101 101 LEU CA C 161 55.200 53.465 1.735 1
1 1299 . 18 1 1 A 101 101 LEU CB C 161 42.400 41.519 0.881 1
1 1303 . 18 1 1 A 101 101 LEU N N 161 121.900 115.049 6.851 1
1 1304 . 18 1 1 A 102 102 GLU H H 162 8.390 8.193 0.197 1
1 1305 . 18 1 1 A 102 102 GLU HA H 162 4.230 4.550 -0.320 1
1 1310 . 18 1 1 A 102 102 GLU C C 162 176.100 175.080 1.020 1
1 1311 . 18 1 1 A 102 102 GLU CA C 162 56.400 56.766 -0.366 1
1 1312 . 18 1 1 A 102 102 GLU CB C 162 30.500 29.225 1.275 1
1 1314 . 18 1 1 A 102 102 GLU N N 162 121.300 118.899 2.401 1
1 1315 . 18 1 1 A 103 103 HIS H H 163 8.330 8.742 -0.412 1
1 1316 . 18 1 1 A 103 103 HIS HA H 163 4.590 5.500 -0.910 1
1 1319 . 18 1 1 A 103 103 HIS C C 163 176.100 174.943 1.157 1
1 1320 . 18 1 1 A 103 103 HIS CA C 163 56.000 53.949 2.051 1
1 1321 . 18 1 1 A 103 103 HIS CB C 163 30.500 31.487 -0.987 1
1 1322 . 18 1 1 A 103 103 HIS N N 163 120.000 118.898 1.102 1
1 1323 . 18 1 1 A 107 107 HIS HA H 167 4.620 4.683 -0.063 1
1 1326 . 18 1 1 A 107 107 HIS C C 167 173.900 174.196 -0.296 1
1 1327 . 18 1 1 A 107 107 HIS CA C 167 56.000 55.711 0.289 1
1 1328 . 18 1 1 A 107 107 HIS CB C 167 30.300 30.852 -0.552 1
1 15 . 19 1 1 A 2 2 ASP H H 62 8.760 8.907 -0.147 1
1 16 . 19 1 1 A 2 2 ASP HA H 62 4.810 4.584 0.226 1
1 19 . 19 1 1 A 2 2 ASP C C 62 175.800 176.476 -0.676 1
1 20 . 19 1 1 A 2 2 ASP CA C 62 54.800 56.877 -2.077 1
1 21 . 19 1 1 A 2 2 ASP CB C 62 41.600 39.731 1.869 1
1 22 . 19 1 1 A 2 2 ASP N N 62 120.900 118.873 2.027 1
1 23 . 19 1 1 A 3 3 SER H H 63 8.710 8.872 -0.162 1
1 24 . 19 1 1 A 3 3 SER HA H 63 4.970 5.100 -0.130 1
1 27 . 19 1 1 A 3 3 SER C C 63 175.600 175.205 0.395 1
1 28 . 19 1 1 A 3 3 SER CA C 63 57.500 56.532 0.968 1
1 29 . 19 1 1 A 3 3 SER CB C 63 65.900 66.456 -0.556 1
1 30 . 19 1 1 A 3 3 SER N N 63 116.300 115.106 1.194 1
1 31 . 19 1 1 A 4 4 PHE H H 64 9.370 9.327 0.043 1
1 32 . 19 1 1 A 4 4 PHE HA H 64 4.010 4.172 -0.162 1
1 39 . 19 1 1 A 4 4 PHE C C 64 176.700 177.379 -0.679 1
1 40 . 19 1 1 A 4 4 PHE CA C 64 62.200 61.685 0.515 1
1 41 . 19 1 1 A 4 4 PHE CB C 64 38.500 39.264 -0.764 1
1 46 . 19 1 1 A 4 4 PHE N N 64 121.400 121.768 -0.368 1
1 47 . 19 1 1 A 5 5 GLY H H 65 8.930 8.416 0.514 1
1 48 . 19 1 1 A 5 5 GLY HA2 H 65 2.020 2.884 -0.864 1
1 49 . 19 1 1 A 5 5 GLY HA3 H 65 3.250 3.386 -0.136 1
1 50 . 19 1 1 A 5 5 GLY C C 65 175.200 175.527 -0.327 1
1 51 . 19 1 1 A 5 5 GLY CA C 65 46.300 46.736 -0.436 1
1 52 . 19 1 1 A 5 5 GLY N N 65 106.500 104.656 1.844 1
1 53 . 19 1 1 A 6 6 ASP H H 66 7.630 7.780 -0.150 1
1 54 . 19 1 1 A 6 6 ASP HA H 66 4.100 4.162 -0.062 1
1 57 . 19 1 1 A 6 6 ASP C C 66 179.500 178.832 0.668 1
1 58 . 19 1 1 A 6 6 ASP CA C 66 57.400 56.674 0.726 1
1 59 . 19 1 1 A 6 6 ASP CB C 66 40.500 40.067 0.433 1
1 60 . 19 1 1 A 6 6 ASP N N 66 120.500 121.485 -0.985 1
1 61 . 19 1 1 A 7 7 TRP H H 67 7.190 7.470 -0.280 1
1 62 . 19 1 1 A 7 7 TRP HA H 67 3.860 4.194 -0.334 1
1 71 . 19 1 1 A 7 7 TRP C C 67 177.200 178.329 -1.129 1
1 72 . 19 1 1 A 7 7 TRP CA C 67 61.100 59.760 1.340 1
1 73 . 19 1 1 A 7 7 TRP CB C 67 28.300 29.521 -1.221 1
1 79 . 19 1 1 A 7 7 TRP N N 67 120.700 120.739 -0.039 1
1 81 . 19 1 1 A 8 8 ALA H H 68 9.040 8.418 0.622 1
1 82 . 19 1 1 A 8 8 ALA HA H 68 3.730 3.740 -0.010 1
1 86 . 19 1 1 A 8 8 ALA C C 68 179.500 179.260 0.240 1
1 87 . 19 1 1 A 8 8 ALA CA C 68 55.200 55.115 0.085 1
1 88 . 19 1 1 A 8 8 ALA CB C 68 18.600 17.802 0.798 1
1 89 . 19 1 1 A 8 8 ALA N N 68 125.700 122.111 3.589 1
1 90 . 19 1 1 A 9 9 GLU H H 69 8.060 8.012 0.048 1
1 91 . 19 1 1 A 9 9 GLU HA H 69 4.020 4.037 -0.017 1
1 96 . 19 1 1 A 9 9 GLU C C 69 180.400 178.857 1.543 1
1 97 . 19 1 1 A 9 9 GLU CA C 69 58.800 60.026 -1.226 1
1 98 . 19 1 1 A 9 9 GLU CB C 69 28.500 29.038 -0.538 1
1 99 . 19 1 1 A 9 9 GLU N N 69 115.400 118.365 -2.965 1
1 100 . 19 1 1 A 10 10 LYS H H 70 7.740 7.637 0.103 1
1 101 . 19 1 1 A 10 10 LYS HA H 70 3.910 3.978 -0.068 1
1 110 . 19 1 1 A 10 10 LYS C C 70 179.500 178.679 0.821 1
1 111 . 19 1 1 A 10 10 LYS CA C 70 60.000 58.971 1.029 1
1 112 . 19 1 1 A 10 10 LYS CB C 70 32.400 32.044 0.356 1
1 116 . 19 1 1 A 10 10 LYS N N 70 122.700 119.647 3.053 1
1 117 . 19 1 1 A 11 11 PHE H H 71 8.750 8.123 0.627 1
1 118 . 19 1 1 A 11 11 PHE HA H 71 4.080 4.192 -0.112 1
1 126 . 19 1 1 A 11 11 PHE C C 71 177.100 177.023 0.077 1
1 127 . 19 1 1 A 11 11 PHE CA C 71 61.200 61.125 0.075 1
1 128 . 19 1 1 A 11 11 PHE CB C 71 38.900 38.884 0.016 1
1 134 . 19 1 1 A 11 11 PHE N N 71 123.500 120.449 3.051 1
1 135 . 19 1 1 A 12 12 LEU H H 72 8.400 8.817 -0.417 1
1 136 . 19 1 1 A 12 12 LEU HA H 72 3.520 3.555 -0.035 1
1 146 . 19 1 1 A 12 12 LEU C C 72 180.000 179.081 0.919 1
1 147 . 19 1 1 A 12 12 LEU CA C 72 58.200 57.977 0.223 1
1 148 . 19 1 1 A 12 12 LEU CB C 72 41.700 41.456 0.244 1
1 152 . 19 1 1 A 12 12 LEU N N 72 121.100 119.004 2.096 1
1 153 . 19 1 1 A 13 13 LYS H H 73 7.810 7.975 -0.165 1
1 154 . 19 1 1 A 13 13 LYS HA H 73 4.080 3.957 0.123 1
1 156 . 19 1 1 A 13 13 LYS C C 73 179.300 178.845 0.455 1
1 157 . 19 1 1 A 13 13 LYS CA C 73 59.000 58.492 0.508 1
1 158 . 19 1 1 A 13 13 LYS CB C 73 31.900 31.627 0.273 1
1 159 . 19 1 1 A 13 13 LYS N N 73 119.400 120.430 -1.030 1
1 160 . 19 1 1 A 14 14 SER H H 74 8.210 8.068 0.142 1
1 161 . 19 1 1 A 14 14 SER HA H 74 4.210 4.093 0.117 1
1 164 . 19 1 1 A 14 14 SER C C 74 176.300 177.163 -0.863 1
1 165 . 19 1 1 A 14 14 SER CA C 74 61.400 61.132 0.268 1
1 166 . 19 1 1 A 14 14 SER CB C 74 62.600 62.331 0.269 1
1 167 . 19 1 1 A 14 14 SER N N 74 117.600 115.231 2.369 1
1 168 . 19 1 1 A 15 15 LYS H H 75 7.760 7.141 0.619 1
1 169 . 19 1 1 A 15 15 LYS HA H 75 4.040 4.021 0.019 1
1 178 . 19 1 1 A 15 15 LYS C C 75 178.500 179.013 -0.513 1
1 179 . 19 1 1 A 15 15 LYS CA C 75 56.500 58.900 -2.400 1
1 180 . 19 1 1 A 15 15 LYS CB C 75 30.600 32.243 -1.643 1
1 184 . 19 1 1 A 15 15 LYS N N 75 120.100 122.559 -2.459 1
1 185 . 19 1 1 A 16 16 GLU H H 76 7.680 8.241 -0.561 1
1 186 . 19 1 1 A 16 16 GLU HA H 76 4.030 4.028 0.002 1
1 191 . 19 1 1 A 16 16 GLU C C 76 179.900 178.696 1.204 1
1 192 . 19 1 1 A 16 16 GLU CA C 76 59.200 59.591 -0.391 1
1 193 . 19 1 1 A 16 16 GLU CB C 76 29.600 29.320 0.280 1
1 195 . 19 1 1 A 16 16 GLU N N 76 119.700 119.662 0.038 1
1 196 . 19 1 1 A 17 17 ALA H H 77 8.030 8.508 -0.478 1
1 197 . 19 1 1 A 17 17 ALA HA H 77 4.200 4.078 0.122 1
1 201 . 19 1 1 A 17 17 ALA C C 77 178.900 179.482 -0.582 1
1 202 . 19 1 1 A 17 17 ALA CA C 77 54.400 54.734 -0.334 1
1 203 . 19 1 1 A 17 17 ALA CB C 77 18.100 18.211 -0.111 1
1 204 . 19 1 1 A 17 17 ALA N N 77 123.000 121.060 1.940 1
1 205 . 19 1 1 A 18 18 ASP H H 78 7.860 7.715 0.145 1
1 206 . 19 1 1 A 18 18 ASP HA H 78 4.600 4.501 0.099 1
1 209 . 19 1 1 A 18 18 ASP C C 78 177.500 176.155 1.345 1
1 210 . 19 1 1 A 18 18 ASP CA C 78 55.100 54.745 0.355 1
1 211 . 19 1 1 A 18 18 ASP CB C 78 41.400 41.063 0.337 1
1 212 . 19 1 1 A 18 18 ASP N N 78 117.700 116.788 0.912 1
1 213 . 19 1 1 A 19 19 GLY H H 79 7.910 7.797 0.113 1
1 214 . 19 1 1 A 19 19 GLY HA2 H 79 3.860 4.055 -0.195 1
1 215 . 19 1 1 A 19 19 GLY HA3 H 79 4.080 4.057 0.023 1
1 216 . 19 1 1 A 19 19 GLY C C 79 175.300 174.787 0.513 1
1 217 . 19 1 1 A 19 19 GLY CA C 79 46.200 45.061 1.139 1
1 218 . 19 1 1 A 19 19 GLY N N 79 107.100 107.009 0.091 1
1 219 . 19 1 1 A 20 20 VAL H H 80 7.150 7.549 -0.399 1
1 220 . 19 1 1 A 20 20 VAL HA H 80 4.250 4.236 0.014 1
1 228 . 19 1 1 A 20 20 VAL C C 80 175.100 175.348 -0.248 1
1 229 . 19 1 1 A 20 20 VAL CA C 80 61.800 61.463 0.337 1
1 230 . 19 1 1 A 20 20 VAL CB C 80 32.200 32.918 -0.718 1
1 233 . 19 1 1 A 20 20 VAL N N 80 114.600 119.567 -4.967 1
1 234 . 19 1 1 A 21 21 SER H H 81 8.560 8.691 -0.131 1
1 235 . 19 1 1 A 21 21 SER HA H 81 4.390 4.560 -0.170 1
1 238 . 19 1 1 A 21 21 SER C C 81 174.600 175.302 -0.702 1
1 239 . 19 1 1 A 21 21 SER CA C 81 57.900 58.611 -0.711 1
1 240 . 19 1 1 A 21 21 SER CB C 81 64.700 63.441 1.259 1
1 241 . 19 1 1 A 21 21 SER N N 81 118.700 119.512 -0.812 1
1 242 . 19 1 1 A 22 22 VAL H H 82 8.690 8.569 0.121 1
1 243 . 19 1 1 A 22 22 VAL HA H 82 3.700 3.877 -0.177 1
1 251 . 19 1 1 A 22 22 VAL C C 82 178.000 177.777 0.223 1
1 252 . 19 1 1 A 22 22 VAL CA C 82 66.500 65.212 1.288 1
1 253 . 19 1 1 A 22 22 VAL CB C 82 31.700 31.790 -0.090 1
1 256 . 19 1 1 A 22 22 VAL N N 82 122.100 126.709 -4.609 1
1 257 . 19 1 1 A 23 23 SER H H 83 8.300 8.083 0.217 1
1 258 . 19 1 1 A 23 23 SER HA H 83 4.210 4.027 0.183 1
1 261 . 19 1 1 A 23 23 SER C C 83 177.600 175.897 1.703 1
1 262 . 19 1 1 A 23 23 SER CA C 83 61.400 62.080 -0.680 1
1 263 . 19 1 1 A 23 23 SER CB C 83 62.400 62.962 -0.562 1
1 264 . 19 1 1 A 23 23 SER N N 83 113.600 118.792 -5.192 1
1 265 . 19 1 1 A 24 24 GLN H H 84 7.820 7.638 0.182 1
1 266 . 19 1 1 A 24 24 GLN HA H 84 3.970 4.068 -0.098 1
1 273 . 19 1 1 A 24 24 GLN C C 84 178.400 178.016 0.384 1
1 274 . 19 1 1 A 24 24 GLN CA C 84 58.400 58.675 -0.275 1
1 275 . 19 1 1 A 24 24 GLN CB C 84 28.900 28.441 0.459 1
1 278 . 19 1 1 A 24 24 GLN N N 84 122.900 120.953 1.947 1
1 280 . 19 1 1 A 25 25 LEU H H 85 8.920 8.116 0.804 1
1 281 . 19 1 1 A 25 25 LEU HA H 85 4.130 4.349 -0.219 1
1 291 . 19 1 1 A 25 25 LEU C C 85 178.800 178.949 -0.149 1
1 292 . 19 1 1 A 25 25 LEU CA C 85 58.300 57.922 0.378 1
1 293 . 19 1 1 A 25 25 LEU CB C 85 41.200 41.912 -0.712 1
1 297 . 19 1 1 A 25 25 LEU N N 85 122.200 121.393 0.807 1
1 298 . 19 1 1 A 26 26 ASN H H 86 8.860 8.901 -0.041 1
1 299 . 19 1 1 A 26 26 ASN HA H 86 4.420 4.434 -0.014 1
1 304 . 19 1 1 A 26 26 ASN C C 86 179.000 177.968 1.032 1
1 305 . 19 1 1 A 26 26 ASN CA C 86 55.900 56.170 -0.270 1
1 306 . 19 1 1 A 26 26 ASN CB C 86 37.200 37.553 -0.353 1
1 308 . 19 1 1 A 26 26 ASN N N 86 117.600 117.471 0.129 1
1 310 . 19 1 1 A 27 27 SER H H 87 7.840 7.665 0.175 1
1 311 . 19 1 1 A 27 27 SER HA H 87 4.100 4.174 -0.074 1
1 314 . 19 1 1 A 27 27 SER C C 87 179.000 176.994 2.006 1
1 315 . 19 1 1 A 27 27 SER CA C 87 62.100 61.075 1.025 1
1 316 . 19 1 1 A 27 27 SER CB C 87 62.100 62.800 -0.700 1
1 317 . 19 1 1 A 27 27 SER N N 87 118.500 115.244 3.256 1
1 318 . 19 1 1 A 28 28 TYR H H 88 8.180 7.740 0.440 1
1 319 . 19 1 1 A 28 28 TYR HA H 88 4.600 4.603 -0.003 1
1 326 . 19 1 1 A 28 28 TYR C C 88 174.800 178.507 -3.707 1
1 327 . 19 1 1 A 28 28 TYR CA C 88 61.200 61.924 -0.724 1
1 328 . 19 1 1 A 28 28 TYR CB C 88 37.800 38.055 -0.255 1
1 333 . 19 1 1 A 28 28 TYR N N 88 119.300 119.349 -0.049 1
1 334 . 19 1 1 A 29 29 LYS H H 89 9.040 8.008 1.032 1
1 335 . 19 1 1 A 29 29 LYS HA H 89 3.890 4.104 -0.214 1
1 344 . 19 1 1 A 29 29 LYS C C 89 179.000 179.926 -0.926 1
1 345 . 19 1 1 A 29 29 LYS CA C 89 61.300 59.222 2.078 1
1 346 . 19 1 1 A 29 29 LYS CB C 89 32.800 31.883 0.917 1
1 350 . 19 1 1 A 29 29 LYS N N 89 119.300 120.248 -0.948 1
1 351 . 19 1 1 A 30 30 ASN H H 90 7.770 7.987 -0.217 1
1 352 . 19 1 1 A 30 30 ASN HA H 90 4.560 4.366 0.194 1
1 357 . 19 1 1 A 30 30 ASN C C 90 178.300 178.137 0.163 1
1 358 . 19 1 1 A 30 30 ASN CA C 90 56.200 56.384 -0.184 1
1 359 . 19 1 1 A 30 30 ASN CB C 90 38.900 37.498 1.402 1
1 361 . 19 1 1 A 30 30 ASN N N 90 117.800 117.759 0.041 1
1 363 . 19 1 1 A 31 31 TYR H H 91 8.860 7.374 1.486 1
1 364 . 19 1 1 A 31 31 TYR HA H 91 4.910 4.563 0.347 1
1 371 . 19 1 1 A 31 31 TYR C C 91 178.300 179.027 -0.727 1
1 372 . 19 1 1 A 31 31 TYR CA C 91 59.700 60.740 -1.040 1
1 373 . 19 1 1 A 31 31 TYR CB C 91 37.500 38.828 -1.328 1
1 378 . 19 1 1 A 31 31 TYR N N 91 119.400 118.585 0.815 1
1 379 . 19 1 1 A 32 32 CYS H H 92 8.640 9.124 -0.484 1
1 380 . 19 1 1 A 32 32 CYS HA H 92 4.410 4.351 0.059 1
1 383 . 19 1 1 A 32 32 CYS C C 92 173.700 176.774 -3.074 1
1 384 . 19 1 1 A 32 32 CYS CA C 92 65.500 63.938 1.562 1
1 385 . 19 1 1 A 32 32 CYS CB C 92 28.300 27.922 0.378 1
1 386 . 19 1 1 A 32 32 CYS N N 92 113.500 118.258 -4.758 1
1 387 . 19 1 1 A 33 33 ARG H H 93 8.440 7.808 0.632 1
1 388 . 19 1 1 A 33 33 ARG HA H 93 3.740 3.678 0.062 1
1 391 . 19 1 1 A 33 33 ARG C C 93 177.200 178.252 -1.052 1
1 392 . 19 1 1 A 33 33 ARG CA C 93 58.300 58.531 -0.231 1
1 393 . 19 1 1 A 33 33 ARG CB C 93 30.200 29.877 0.323 1
1 394 . 19 1 1 A 33 33 ARG N N 93 111.400 120.589 -9.189 1
1 395 . 19 1 1 A 34 34 ASN H H 94 8.020 7.706 0.314 1
1 396 . 19 1 1 A 34 34 ASN HA H 94 4.980 4.582 0.398 1
1 401 . 19 1 1 A 34 34 ASN C C 94 176.700 177.261 -0.561 1
1 402 . 19 1 1 A 34 34 ASN CA C 94 53.400 55.449 -2.049 1
1 403 . 19 1 1 A 34 34 ASN CB C 94 38.000 38.985 -0.985 1
1 405 . 19 1 1 A 34 34 ASN N N 94 113.600 117.838 -4.238 1
1 407 . 19 1 1 A 35 35 HIS H H 95 7.200 7.595 -0.395 1
1 408 . 19 1 1 A 35 35 HIS HA H 95 4.470 4.480 -0.010 1
1 411 . 19 1 1 A 35 35 HIS C C 95 176.600 176.385 0.215 1
1 412 . 19 1 1 A 35 35 HIS CA C 95 60.000 59.119 0.881 1
1 413 . 19 1 1 A 35 35 HIS CB C 95 30.500 31.199 -0.699 1
1 414 . 19 1 1 A 35 35 HIS N N 95 115.600 116.843 -1.243 1
1 415 . 19 1 1 A 36 36 LEU H H 96 8.170 8.334 -0.164 1
1 416 . 19 1 1 A 36 36 LEU HA H 96 4.730 4.540 0.190 1
1 426 . 19 1 1 A 36 36 LEU C C 96 176.800 177.371 -0.571 1
1 427 . 19 1 1 A 36 36 LEU CA C 96 54.400 54.597 -0.197 1
1 428 . 19 1 1 A 36 36 LEU CB C 96 40.600 41.864 -1.264 1
1 432 . 19 1 1 A 36 36 LEU N N 96 114.000 118.782 -4.782 1
1 433 . 19 1 1 A 37 37 SER H H 97 7.140 7.965 -0.825 1
1 434 . 19 1 1 A 37 37 SER HA H 97 4.730 4.226 0.504 1
1 437 . 19 1 1 A 37 37 SER CA C 97 62.700 63.521 -0.821 1
1 438 . 19 1 1 A 37 37 SER CB C 97 62.600 61.460 1.140 1
1 439 . 19 1 1 A 37 37 SER N N 97 117.200 116.526 0.674 1
1 440 . 19 1 1 A 38 38 PRO HA H 98 4.560 4.384 0.176 1
1 447 . 19 1 1 A 38 38 PRO C C 98 177.900 179.043 -1.143 1
1 448 . 19 1 1 A 38 38 PRO CA C 98 65.700 65.957 -0.257 1
1 449 . 19 1 1 A 38 38 PRO CB C 98 31.800 30.796 1.004 1
1 452 . 19 1 1 A 39 39 LEU H H 99 8.090 7.613 0.477 1
1 453 . 19 1 1 A 39 39 LEU HA H 99 4.260 4.015 0.245 1
1 463 . 19 1 1 A 39 39 LEU C C 99 178.700 178.809 -0.109 1
1 464 . 19 1 1 A 39 39 LEU CA C 99 54.300 57.297 -2.997 1
1 465 . 19 1 1 A 39 39 LEU CB C 99 42.400 40.805 1.595 1
1 469 . 19 1 1 A 39 39 LEU N N 99 112.400 116.817 -4.417 1
1 470 . 19 1 1 A 40 40 TYR H H 100 8.350 8.115 0.235 1
1 471 . 19 1 1 A 40 40 TYR HA H 100 4.170 4.538 -0.368 1
1 478 . 19 1 1 A 40 40 TYR C C 100 178.300 177.334 0.966 1
1 479 . 19 1 1 A 40 40 TYR CA C 100 63.400 60.478 2.922 1
1 480 . 19 1 1 A 40 40 TYR CB C 100 38.600 38.365 0.235 1
1 485 . 19 1 1 A 40 40 TYR N N 100 119.400 119.545 -0.145 1
1 486 . 19 1 1 A 41 41 MET H H 101 8.640 7.557 1.083 1
1 487 . 19 1 1 A 41 41 MET HA H 101 4.260 4.646 -0.386 1
1 488 . 19 1 1 A 41 41 MET C C 101 177.000 176.097 0.903 1
1 489 . 19 1 1 A 41 41 MET CA C 101 54.600 54.910 -0.310 1
1 490 . 19 1 1 A 41 41 MET N N 101 111.800 116.879 -5.079 1
1 491 . 19 1 1 A 42 42 LYS H H 102 7.880 7.873 0.007 1
1 492 . 19 1 1 A 42 42 LYS HA H 102 4.430 4.825 -0.395 1
1 501 . 19 1 1 A 42 42 LYS C C 102 176.300 176.017 0.283 1
1 502 . 19 1 1 A 42 42 LYS CA C 102 56.000 54.452 1.548 1
1 503 . 19 1 1 A 42 42 LYS CB C 102 33.400 33.967 -0.567 1
1 507 . 19 1 1 A 42 42 LYS N N 102 121.700 120.516 1.184 1
1 508 . 19 1 1 A 43 43 SER H H 103 9.160 9.340 -0.180 1
1 509 . 19 1 1 A 43 43 SER HA H 103 4.620 4.999 -0.379 1
1 513 . 19 1 1 A 43 43 SER C C 103 176.300 175.457 0.843 1
1 514 . 19 1 1 A 43 43 SER CA C 103 58.700 58.029 0.671 1
1 515 . 19 1 1 A 43 43 SER CB C 103 63.700 64.907 -1.207 1
1 516 . 19 1 1 A 43 43 SER N N 103 118.800 118.528 0.272 1
1 517 . 19 1 1 A 44 44 LEU H H 104 8.860 8.847 0.013 1
1 518 . 19 1 1 A 44 44 LEU HA H 104 4.130 4.290 -0.160 1
1 528 . 19 1 1 A 44 44 LEU C C 104 178.700 178.441 0.259 1
1 529 . 19 1 1 A 44 44 LEU CA C 104 58.800 57.230 1.570 1
1 530 . 19 1 1 A 44 44 LEU CB C 104 42.600 41.917 0.683 1
1 534 . 19 1 1 A 44 44 LEU N N 104 124.200 125.849 -1.649 1
1 535 . 19 1 1 A 45 45 SER H H 105 8.330 7.802 0.528 1
1 536 . 19 1 1 A 45 45 SER HA H 105 4.310 4.347 -0.037 1
1 539 . 19 1 1 A 45 45 SER C C 105 175.000 174.947 0.053 1
1 540 . 19 1 1 A 45 45 SER CA C 105 60.100 59.997 0.103 1
1 541 . 19 1 1 A 45 45 SER CB C 105 63.400 63.400 0.000 1
1 542 . 19 1 1 A 45 45 SER N N 105 107.700 115.294 -7.594 1
1 543 . 19 1 1 A 46 46 GLU H H 106 7.800 8.726 -0.926 1
1 544 . 19 1 1 A 46 46 GLU HA H 106 4.570 4.444 0.126 1
1 549 . 19 1 1 A 46 46 GLU C C 106 174.100 175.702 -1.602 1
1 550 . 19 1 1 A 46 46 GLU CA C 106 55.600 55.895 -0.295 1
1 551 . 19 1 1 A 46 46 GLU CB C 106 31.200 30.594 0.606 1
1 553 . 19 1 1 A 46 46 GLU N N 106 119.600 114.509 5.091 1
1 554 . 19 1 1 A 47 47 ILE H H 107 7.100 7.066 0.034 1
1 555 . 19 1 1 A 47 47 ILE HA H 107 4.040 4.210 -0.170 1
1 565 . 19 1 1 A 47 47 ILE C C 107 174.100 175.238 -1.138 1
1 566 . 19 1 1 A 47 47 ILE CA C 107 62.300 60.631 1.669 1
1 567 . 19 1 1 A 47 47 ILE CB C 107 38.500 38.111 0.389 1
1 571 . 19 1 1 A 47 47 ILE N N 107 120.600 122.326 -1.726 1
1 572 . 19 1 1 A 48 48 LEU H H 108 9.180 8.810 0.370 1
1 573 . 19 1 1 A 48 48 LEU HA H 108 4.940 4.559 0.381 1
1 583 . 19 1 1 A 48 48 LEU CA C 108 51.900 53.007 -1.107 1
1 584 . 19 1 1 A 48 48 LEU CB C 108 42.000 41.374 0.626 1
1 588 . 19 1 1 A 48 48 LEU N N 108 129.400 128.795 0.605 1
1 589 . 19 1 1 A 49 49 PRO HA H 109 3.910 4.254 -0.344 1
1 596 . 19 1 1 A 49 49 PRO C C 109 178.500 177.796 0.704 1
1 597 . 19 1 1 A 49 49 PRO CA C 109 66.600 64.957 1.643 1
1 598 . 19 1 1 A 49 49 PRO CB C 109 31.300 31.709 -0.409 1
1 601 . 19 1 1 A 50 50 ALA H H 110 8.280 8.109 0.171 1
1 602 . 19 1 1 A 50 50 ALA HA H 110 4.110 4.151 -0.041 1
1 606 . 19 1 1 A 50 50 ALA C C 110 179.700 179.404 0.296 1
1 607 . 19 1 1 A 50 50 ALA CA C 110 55.100 54.167 0.933 1
1 608 . 19 1 1 A 50 50 ALA CB C 110 19.200 18.447 0.753 1
1 609 . 19 1 1 A 50 50 ALA N N 110 116.100 119.414 -3.314 1
1 610 . 19 1 1 A 51 51 ASP H H 111 7.790 7.866 -0.076 1
1 611 . 19 1 1 A 51 51 ASP HA H 111 4.440 4.339 0.101 1
1 614 . 19 1 1 A 51 51 ASP C C 111 178.200 178.522 -0.322 1
1 615 . 19 1 1 A 51 51 ASP CA C 111 57.600 57.439 0.161 1
1 616 . 19 1 1 A 51 51 ASP CB C 111 41.800 41.143 0.657 1
1 617 . 19 1 1 A 51 51 ASP N N 111 116.500 118.527 -2.027 1
1 618 . 19 1 1 A 52 52 ILE H H 112 7.020 7.708 -0.688 1
1 619 . 19 1 1 A 52 52 ILE HA H 112 3.750 3.706 0.044 1
1 629 . 19 1 1 A 52 52 ILE C C 112 177.300 177.899 -0.599 1
1 630 . 19 1 1 A 52 52 ILE CA C 112 63.500 65.113 -1.613 1
1 631 . 19 1 1 A 52 52 ILE CB C 112 37.500 37.256 0.244 1
1 635 . 19 1 1 A 52 52 ILE N N 112 116.700 119.361 -2.661 1
1 636 . 19 1 1 A 53 53 GLN H H 113 9.150 8.280 0.870 1
1 637 . 19 1 1 A 53 53 GLN HA H 113 3.720 3.976 -0.256 1
1 644 . 19 1 1 A 53 53 GLN C C 113 177.500 178.177 -0.677 1
1 645 . 19 1 1 A 53 53 GLN CA C 113 58.200 59.007 -0.807 1
1 646 . 19 1 1 A 53 53 GLN CB C 113 30.200 28.389 1.811 1
1 649 . 19 1 1 A 53 53 GLN N N 113 121.200 120.990 0.210 1
1 651 . 19 1 1 A 54 54 SER H H 114 8.150 8.014 0.136 1
1 652 . 19 1 1 A 54 54 SER HA H 114 4.180 4.160 0.020 1
1 655 . 19 1 1 A 54 54 SER C C 114 175.900 175.853 0.047 1
1 656 . 19 1 1 A 54 54 SER CA C 114 62.100 62.417 -0.317 1
1 657 . 19 1 1 A 54 54 SER CB C 114 62.800 63.151 -0.351 1
1 658 . 19 1 1 A 54 54 SER N N 114 112.200 116.760 -4.560 1
1 659 . 19 1 1 A 55 55 ILE H H 115 6.760 7.552 -0.792 1
1 660 . 19 1 1 A 55 55 ILE HA H 115 3.860 3.725 0.135 1
1 670 . 19 1 1 A 55 55 ILE C C 115 179.200 178.317 0.883 1
1 671 . 19 1 1 A 55 55 ILE CA C 115 64.700 65.107 -0.407 1
1 672 . 19 1 1 A 55 55 ILE CB C 115 38.900 37.937 0.963 1
1 676 . 19 1 1 A 55 55 ILE N N 115 119.500 120.942 -1.442 1
1 677 . 19 1 1 A 56 56 ILE H H 116 7.750 8.346 -0.596 1
1 678 . 19 1 1 A 56 56 ILE HA H 116 3.690 3.562 0.128 1
1 688 . 19 1 1 A 56 56 ILE C C 116 176.900 178.313 -1.413 1
1 689 . 19 1 1 A 56 56 ILE CA C 116 62.800 65.291 -2.491 1
1 690 . 19 1 1 A 56 56 ILE CB C 116 36.200 37.910 -1.710 1
1 694 . 19 1 1 A 56 56 ILE N N 116 120.200 120.508 -0.308 1
1 695 . 19 1 1 A 57 57 ASN H H 117 8.690 8.158 0.532 1
1 696 . 19 1 1 A 57 57 ASN HA H 117 4.440 4.460 -0.020 1
1 701 . 19 1 1 A 57 57 ASN C C 117 177.200 177.230 -0.030 1
1 702 . 19 1 1 A 57 57 ASN CA C 117 54.800 56.269 -1.469 1
1 703 . 19 1 1 A 57 57 ASN CB C 117 38.100 37.947 0.153 1
1 705 . 19 1 1 A 57 57 ASN N N 117 117.000 117.809 -0.809 1
1 707 . 19 1 1 A 58 58 GLU H H 118 7.630 7.671 -0.041 1
1 708 . 19 1 1 A 58 58 GLU HA H 118 4.450 4.402 0.048 1
1 713 . 19 1 1 A 58 58 GLU C C 118 176.500 176.502 -0.002 1
1 714 . 19 1 1 A 58 58 GLU CA C 118 56.200 56.556 -0.356 1
1 715 . 19 1 1 A 58 58 GLU CB C 118 30.200 30.065 0.135 1
1 717 . 19 1 1 A 58 58 GLU N N 118 116.300 116.595 -0.295 1
1 718 . 19 1 1 A 59 59 THR H H 119 7.540 7.260 0.280 1
1 719 . 19 1 1 A 59 59 THR HA H 119 4.230 4.354 -0.124 1
1 724 . 19 1 1 A 59 59 THR C C 119 174.200 173.942 0.258 1
1 725 . 19 1 1 A 59 59 THR CA C 119 63.800 63.355 0.445 1
1 726 . 19 1 1 A 59 59 THR CB C 119 68.900 68.921 -0.021 1
1 728 . 19 1 1 A 59 59 THR N N 119 117.600 116.467 1.133 1
1 729 . 19 1 1 A 60 60 LYS H H 120 8.860 8.918 -0.058 1
1 730 . 19 1 1 A 60 60 LYS HA H 120 4.490 4.667 -0.177 1
1 739 . 19 1 1 A 60 60 LYS C C 120 175.800 175.006 0.794 1
1 740 . 19 1 1 A 60 60 LYS CA C 120 54.900 55.596 -0.696 1
1 741 . 19 1 1 A 60 60 LYS CB C 120 29.800 31.336 -1.536 1
1 745 . 19 1 1 A 60 60 LYS N N 120 128.500 128.309 0.191 1
1 746 . 19 1 1 A 61 61 LEU H H 121 7.150 7.867 -0.717 1
1 747 . 19 1 1 A 61 61 LEU HA H 121 4.710 4.887 -0.177 1
1 757 . 19 1 1 A 61 61 LEU C C 121 175.000 175.861 -0.861 1
1 758 . 19 1 1 A 61 61 LEU CA C 121 52.800 53.275 -0.475 1
1 759 . 19 1 1 A 61 61 LEU CB C 121 46.400 45.809 0.591 1
1 763 . 19 1 1 A 61 61 LEU N N 121 120.700 125.241 -4.541 1
1 764 . 19 1 1 A 62 62 ALA H H 122 8.000 8.465 -0.465 1
1 765 . 19 1 1 A 62 62 ALA HA H 122 4.250 4.415 -0.165 1
1 769 . 19 1 1 A 62 62 ALA CA C 122 52.100 52.383 -0.283 1
1 770 . 19 1 1 A 62 62 ALA CB C 122 19.500 19.273 0.227 1
1 771 . 19 1 1 A 62 62 ALA N N 122 119.900 123.425 -3.525 1
1 772 . 19 1 1 A 63 63 LYS H H 123 8.770 8.711 0.059 1
1 773 . 19 1 1 A 63 63 LYS HA H 123 3.800 4.036 -0.236 1
1 782 . 19 1 1 A 63 63 LYS C C 123 178.300 178.915 -0.615 1
1 783 . 19 1 1 A 63 63 LYS CA C 123 60.700 59.059 1.641 1
1 784 . 19 1 1 A 63 63 LYS CB C 123 32.300 32.005 0.295 1
1 788 . 19 1 1 A 63 63 LYS N N 123 121.400 121.237 0.163 1
1 789 . 19 1 1 A 64 64 ASN H H 124 9.020 8.043 0.977 1
1 790 . 19 1 1 A 64 64 ASN HA H 124 4.430 4.545 -0.115 1
1 795 . 19 1 1 A 64 64 ASN C C 124 178.300 178.039 0.261 1
1 796 . 19 1 1 A 64 64 ASN CA C 124 56.200 56.349 -0.149 1
1 797 . 19 1 1 A 64 64 ASN CB C 124 37.300 38.829 -1.529 1
1 799 . 19 1 1 A 64 64 ASN N N 124 115.000 118.558 -3.558 1
1 801 . 19 1 1 A 65 65 THR H H 125 7.620 8.080 -0.460 1
1 802 . 19 1 1 A 65 65 THR HA H 125 4.030 4.078 -0.048 1
1 807 . 19 1 1 A 65 65 THR C C 125 175.500 176.642 -1.142 1
1 808 . 19 1 1 A 65 65 THR CA C 125 66.000 67.254 -1.254 1
1 809 . 19 1 1 A 65 65 THR CB C 125 67.600 67.758 -0.158 1
1 811 . 19 1 1 A 65 65 THR N N 125 119.800 116.655 3.145 1
1 812 . 19 1 1 A 66 66 LEU H H 126 8.020 8.203 -0.183 1
1 813 . 19 1 1 A 66 66 LEU HA H 126 3.790 3.865 -0.075 1
1 823 . 19 1 1 A 66 66 LEU C C 126 179.200 179.180 0.020 1
1 824 . 19 1 1 A 66 66 LEU CA C 126 58.700 58.333 0.367 1
1 825 . 19 1 1 A 66 66 LEU CB C 126 41.300 41.777 -0.477 1
1 829 . 19 1 1 A 66 66 LEU N N 126 121.200 121.336 -0.136 1
1 830 . 19 1 1 A 67 67 LYS H H 127 8.380 7.938 0.442 1
1 831 . 19 1 1 A 67 67 LYS HA H 127 3.740 4.042 -0.302 1
1 840 . 19 1 1 A 67 67 LYS C C 127 178.300 179.635 -1.335 1
1 841 . 19 1 1 A 67 67 LYS CA C 127 60.100 59.541 0.559 1
1 842 . 19 1 1 A 67 67 LYS CB C 127 32.400 32.153 0.247 1
1 846 . 19 1 1 A 67 67 LYS N N 127 117.000 117.503 -0.503 1
1 847 . 19 1 1 A 68 68 ALA H H 128 7.480 8.104 -0.624 1
1 848 . 19 1 1 A 68 68 ALA HA H 128 4.210 3.961 0.249 1
1 852 . 19 1 1 A 68 68 ALA C C 128 181.200 180.050 1.150 1
1 853 . 19 1 1 A 68 68 ALA CA C 128 55.200 54.925 0.275 1
1 854 . 19 1 1 A 68 68 ALA CB C 128 18.600 18.360 0.240 1
1 855 . 19 1 1 A 68 68 ALA N N 128 122.900 121.965 0.935 1
1 856 . 19 1 1 A 69 69 ILE H H 129 8.250 7.931 0.319 1
1 857 . 19 1 1 A 69 69 ILE HA H 129 3.130 3.246 -0.116 1
1 867 . 19 1 1 A 69 69 ILE C C 129 177.400 177.818 -0.418 1
1 868 . 19 1 1 A 69 69 ILE CA C 129 66.700 65.268 1.432 1
1 869 . 19 1 1 A 69 69 ILE CB C 129 37.900 37.546 0.354 1
1 873 . 19 1 1 A 69 69 ILE N N 129 122.800 118.826 3.974 1
1 874 . 19 1 1 A 70 70 ARG H H 130 8.040 7.776 0.264 1
1 875 . 19 1 1 A 70 70 ARG HA H 130 3.620 3.869 -0.249 1
1 882 . 19 1 1 A 70 70 ARG C C 130 177.800 178.585 -0.785 1
1 883 . 19 1 1 A 70 70 ARG CA C 130 60.700 59.876 0.824 1
1 884 . 19 1 1 A 70 70 ARG CB C 130 29.600 29.849 -0.249 1
1 887 . 19 1 1 A 70 70 ARG N N 130 119.700 120.508 -0.808 1
1 888 . 19 1 1 A 71 71 ASN H H 131 8.920 8.649 0.271 1
1 889 . 19 1 1 A 71 71 ASN HA H 131 4.430 4.516 -0.086 1
1 894 . 19 1 1 A 71 71 ASN C C 131 177.500 177.632 -0.132 1
1 895 . 19 1 1 A 71 71 ASN CA C 131 56.100 56.562 -0.462 1
1 896 . 19 1 1 A 71 71 ASN CB C 131 38.600 39.344 -0.744 1
1 898 . 19 1 1 A 71 71 ASN N N 131 117.200 117.841 -0.641 1
1 900 . 19 1 1 A 72 72 THR H H 132 8.300 8.547 -0.247 1
1 901 . 19 1 1 A 72 72 THR HA H 132 4.430 3.841 0.589 1
1 906 . 19 1 1 A 72 72 THR C C 132 175.100 176.349 -1.249 1
1 907 . 19 1 1 A 72 72 THR CA C 132 68.200 66.505 1.695 1
1 908 . 19 1 1 A 72 72 THR CB C 132 68.500 68.668 -0.168 1
1 910 . 19 1 1 A 72 72 THR N N 132 119.200 115.480 3.720 1
1 911 . 19 1 1 A 73 73 ALA H H 133 7.950 8.343 -0.393 1
1 912 . 19 1 1 A 73 73 ALA HA H 133 4.040 3.975 0.065 1
1 916 . 19 1 1 A 73 73 ALA C C 133 178.200 179.670 -1.470 1
1 917 . 19 1 1 A 73 73 ALA CA C 133 55.900 55.395 0.505 1
1 918 . 19 1 1 A 73 73 ALA CB C 133 16.700 17.868 -1.168 1
1 919 . 19 1 1 A 73 73 ALA N N 133 120.900 123.484 -2.584 1
1 920 . 19 1 1 A 74 74 SER H H 134 8.440 8.662 -0.222 1
1 921 . 19 1 1 A 74 74 SER HA H 134 4.430 4.364 0.066 1
1 924 . 19 1 1 A 74 74 SER C C 134 178.800 177.307 1.493 1
1 925 . 19 1 1 A 74 74 SER CA C 134 61.300 61.452 -0.152 1
1 926 . 19 1 1 A 74 74 SER CB C 134 62.600 62.497 0.103 1
1 927 . 19 1 1 A 74 74 SER N N 134 110.100 113.164 -3.064 1
1 928 . 19 1 1 A 75 75 GLN H H 135 8.340 7.015 1.325 1
1 929 . 19 1 1 A 75 75 GLN HA H 135 3.880 4.077 -0.197 1
1 936 . 19 1 1 A 75 75 GLN C C 135 178.800 178.844 -0.044 1
1 937 . 19 1 1 A 75 75 GLN CA C 135 59.600 58.551 1.049 1
1 938 . 19 1 1 A 75 75 GLN CB C 135 29.900 28.242 1.658 1
1 941 . 19 1 1 A 75 75 GLN N N 135 118.100 121.505 -3.405 1
1 943 . 19 1 1 A 76 76 ILE H H 136 7.670 7.310 0.360 1
1 944 . 19 1 1 A 76 76 ILE HA H 136 3.200 3.409 -0.209 1
1 954 . 19 1 1 A 76 76 ILE C C 136 177.500 177.737 -0.237 1
1 955 . 19 1 1 A 76 76 ILE CA C 136 66.100 65.141 0.959 1
1 956 . 19 1 1 A 76 76 ILE CB C 136 37.400 37.291 0.109 1
1 960 . 19 1 1 A 76 76 ILE N N 136 122.500 120.510 1.990 1
1 961 . 19 1 1 A 77 77 PHE H H 137 7.930 7.736 0.194 1
1 962 . 19 1 1 A 77 77 PHE HA H 137 3.890 4.017 -0.127 1
1 969 . 19 1 1 A 77 77 PHE C C 137 178.200 178.242 -0.042 1
1 970 . 19 1 1 A 77 77 PHE CA C 137 63.600 60.209 3.391 1
1 971 . 19 1 1 A 77 77 PHE CB C 137 39.300 38.669 0.631 1
1 976 . 19 1 1 A 77 77 PHE N N 137 116.100 118.348 -2.248 1
1 977 . 19 1 1 A 78 78 ARG H H 138 8.900 8.049 0.851 1
1 978 . 19 1 1 A 78 78 ARG HA H 138 3.910 3.930 -0.020 1
1 986 . 19 1 1 A 78 78 ARG C C 138 178.300 178.732 -0.432 1
1 987 . 19 1 1 A 78 78 ARG CA C 138 60.100 59.306 0.794 1
1 988 . 19 1 1 A 78 78 ARG CB C 138 29.600 29.784 -0.184 1
1 991 . 19 1 1 A 78 78 ARG N N 138 118.600 119.572 -0.972 1
1 993 . 19 1 1 A 79 79 LEU H H 139 7.730 8.265 -0.535 1
1 994 . 19 1 1 A 79 79 LEU HA H 139 4.280 4.079 0.201 1
1 1004 . 19 1 1 A 79 79 LEU C C 139 179.000 178.468 0.532 1
1 1005 . 19 1 1 A 79 79 LEU CA C 139 57.800 57.799 0.001 1
1 1006 . 19 1 1 A 79 79 LEU CB C 139 41.900 41.327 0.573 1
1 1010 . 19 1 1 A 79 79 LEU N N 139 121.900 121.599 0.301 1
1 1011 . 19 1 1 A 80 80 ALA H H 140 7.590 7.402 0.188 1
1 1012 . 19 1 1 A 80 80 ALA HA H 140 2.710 2.844 -0.134 1
1 1016 . 19 1 1 A 80 80 ALA C C 140 179.900 179.207 0.693 1
1 1017 . 19 1 1 A 80 80 ALA CA C 140 55.100 54.594 0.506 1
1 1018 . 19 1 1 A 80 80 ALA CB C 140 17.600 17.483 0.117 1
1 1019 . 19 1 1 A 80 80 ALA N N 140 123.400 120.435 2.965 1
1 1020 . 19 1 1 A 81 81 ILE H H 141 8.910 8.066 0.844 1
1 1021 . 19 1 1 A 81 81 ILE HA H 141 4.110 4.080 0.030 1
1 1031 . 19 1 1 A 81 81 ILE C C 141 181.700 177.754 3.946 1
1 1032 . 19 1 1 A 81 81 ILE CA C 141 64.800 65.236 -0.436 1
1 1033 . 19 1 1 A 81 81 ILE CB C 141 38.600 37.716 0.884 1
1 1037 . 19 1 1 A 81 81 ILE N N 141 122.400 118.089 4.311 1
1 1038 . 19 1 1 A 82 82 GLU H H 142 8.560 8.532 0.028 1
1 1039 . 19 1 1 A 82 82 GLU HA H 142 4.100 4.070 0.030 1
1 1044 . 19 1 1 A 82 82 GLU C C 142 177.700 178.059 -0.359 1
1 1045 . 19 1 1 A 82 82 GLU CA C 142 59.100 59.647 -0.547 1
1 1046 . 19 1 1 A 82 82 GLU CB C 142 29.200 29.193 0.007 1
1 1048 . 19 1 1 A 82 82 GLU N N 142 123.200 119.469 3.731 1
1 1049 . 19 1 1 A 83 83 ASN H H 143 7.310 7.369 -0.059 1
1 1050 . 19 1 1 A 83 83 ASN HA H 143 4.750 4.919 -0.169 1
1 1055 . 19 1 1 A 83 83 ASN C C 143 173.200 174.146 -0.946 1
1 1056 . 19 1 1 A 83 83 ASN CA C 143 54.200 52.798 1.402 1
1 1057 . 19 1 1 A 83 83 ASN CB C 143 41.300 38.702 2.598 1
1 1059 . 19 1 1 A 83 83 ASN N N 143 114.900 115.384 -0.484 1
1 1061 . 19 1 1 A 84 84 ARG H H 144 8.320 7.935 0.385 1
1 1062 . 19 1 1 A 84 84 ARG HA H 144 4.120 4.041 0.079 1
1 1069 . 19 1 1 A 84 84 ARG C C 144 175.300 175.688 -0.388 1
1 1070 . 19 1 1 A 84 84 ARG CA C 144 57.100 56.911 0.189 1
1 1071 . 19 1 1 A 84 84 ARG CB C 144 26.000 26.784 -0.784 1
1 1074 . 19 1 1 A 84 84 ARG N N 144 114.400 114.952 -0.552 1
1 1075 . 19 1 1 A 85 85 ALA H H 145 8.350 8.351 -0.001 1
1 1076 . 19 1 1 A 85 85 ALA HA H 145 4.320 4.241 0.079 1
1 1080 . 19 1 1 A 85 85 ALA C C 145 176.500 177.177 -0.677 1
1 1081 . 19 1 1 A 85 85 ALA CA C 145 53.400 53.754 -0.354 1
1 1082 . 19 1 1 A 85 85 ALA CB C 145 19.900 19.724 0.176 1
1 1083 . 19 1 1 A 85 85 ALA N N 145 120.600 118.925 1.675 1
1 1084 . 19 1 1 A 86 86 ILE H H 146 7.290 7.549 -0.259 1
1 1085 . 19 1 1 A 86 86 ILE HA H 146 4.400 4.481 -0.081 1
1 1095 . 19 1 1 A 86 86 ILE C C 146 173.600 173.564 0.036 1
1 1096 . 19 1 1 A 86 86 ILE CA C 146 59.200 59.313 -0.113 1
1 1097 . 19 1 1 A 86 86 ILE CB C 146 41.600 41.327 0.273 1
1 1101 . 19 1 1 A 86 86 ILE N N 146 111.500 115.931 -4.431 1
1 1102 . 19 1 1 A 87 87 ASP H H 147 8.270 8.658 -0.388 1
1 1103 . 19 1 1 A 87 87 ASP HA H 147 4.940 4.945 -0.005 1
1 1106 . 19 1 1 A 87 87 ASP C C 147 174.700 175.640 -0.940 1
1 1107 . 19 1 1 A 87 87 ASP CA C 147 53.700 54.605 -0.905 1
1 1108 . 19 1 1 A 87 87 ASP CB C 147 41.800 42.165 -0.365 1
1 1109 . 19 1 1 A 87 87 ASP N N 147 119.400 124.025 -4.625 1
1 1110 . 19 1 1 A 88 88 PHE H H 148 7.230 7.244 -0.014 1
1 1111 . 19 1 1 A 88 88 PHE HA H 148 4.690 5.330 -0.640 1
1 1119 . 19 1 1 A 88 88 PHE C C 148 171.500 172.332 -0.832 1
1 1120 . 19 1 1 A 88 88 PHE CA C 148 56.400 55.426 0.974 1
1 1121 . 19 1 1 A 88 88 PHE CB C 148 42.000 42.736 -0.736 1
1 1127 . 19 1 1 A 88 88 PHE N N 148 119.700 116.238 3.462 1
1 1128 . 19 1 1 A 89 89 ASN H H 149 8.060 8.941 -0.881 1
1 1129 . 19 1 1 A 89 89 ASN HA H 149 4.490 5.082 -0.592 1
1 1134 . 19 1 1 A 89 89 ASN CA C 149 48.100 49.119 -1.019 1
1 1135 . 19 1 1 A 89 89 ASN CB C 149 39.200 39.765 -0.565 1
1 1137 . 19 1 1 A 89 89 ASN N N 149 119.700 119.839 -0.139 1
1 1139 . 19 1 1 A 90 90 PRO HA H 150 3.970 4.506 -0.536 1
1 1146 . 19 1 1 A 90 90 PRO C C 150 177.700 177.999 -0.299 1
1 1147 . 19 1 1 A 90 90 PRO CA C 150 63.900 64.885 -0.985 1
1 1148 . 19 1 1 A 90 90 PRO CB C 150 31.700 31.439 0.261 1
1 1151 . 19 1 1 A 91 91 ALA H H 151 7.240 7.410 -0.170 1
1 1152 . 19 1 1 A 91 91 ALA HA H 151 3.900 4.147 -0.247 1
1 1156 . 19 1 1 A 91 91 ALA C C 151 178.000 179.609 -1.609 1
1 1157 . 19 1 1 A 91 91 ALA CA C 151 53.900 54.015 -0.115 1
1 1158 . 19 1 1 A 91 91 ALA CB C 151 17.700 18.571 -0.871 1
1 1159 . 19 1 1 A 91 91 ALA N N 151 115.700 119.008 -3.308 1
1 1160 . 19 1 1 A 92 92 ASP H H 152 7.080 7.917 -0.837 1
1 1161 . 19 1 1 A 92 92 ASP HA H 152 4.220 4.299 -0.079 1
1 1164 . 19 1 1 A 92 92 ASP C C 152 176.200 176.930 -0.730 1
1 1165 . 19 1 1 A 92 92 ASP CA C 152 55.800 56.360 -0.560 1
1 1166 . 19 1 1 A 92 92 ASP CB C 152 39.500 40.382 -0.882 1
1 1167 . 19 1 1 A 92 92 ASP N N 152 117.100 119.641 -2.541 1
1 1168 . 19 1 1 A 93 93 TYR H H 153 7.060 7.432 -0.372 1
1 1169 . 19 1 1 A 93 93 TYR HA H 153 4.490 4.631 -0.141 1
1 1176 . 19 1 1 A 93 93 TYR C C 153 174.700 175.878 -1.178 1
1 1177 . 19 1 1 A 93 93 TYR CA C 153 57.600 58.164 -0.564 1
1 1178 . 19 1 1 A 93 93 TYR CB C 153 38.500 38.338 0.162 1
1 1183 . 19 1 1 A 93 93 TYR N N 153 116.800 116.569 0.231 1
1 1184 . 19 1 1 A 94 94 VAL H H 154 7.000 7.047 -0.047 1
1 1185 . 19 1 1 A 94 94 VAL HA H 154 4.040 3.953 0.087 1
1 1193 . 19 1 1 A 94 94 VAL C C 154 174.700 175.079 -0.379 1
1 1194 . 19 1 1 A 94 94 VAL CA C 154 62.100 62.801 -0.701 1
1 1195 . 19 1 1 A 94 94 VAL CB C 154 32.700 32.273 0.427 1
1 1198 . 19 1 1 A 94 94 VAL N N 154 120.600 121.216 -0.616 1
1 1199 . 19 1 1 A 95 95 ARG H H 155 9.430 8.812 0.618 1
1 1200 . 19 1 1 A 95 95 ARG HA H 155 4.640 4.645 -0.005 1
1 1207 . 19 1 1 A 95 95 ARG C C 155 175.400 175.397 0.003 1
1 1208 . 19 1 1 A 95 95 ARG CA C 155 54.200 55.737 -1.537 1
1 1209 . 19 1 1 A 95 95 ARG CB C 155 32.400 30.815 1.585 1
1 1212 . 19 1 1 A 95 95 ARG N N 155 128.200 127.387 0.813 1
1 1213 . 19 1 1 A 96 96 ILE H H 156 8.700 8.546 0.154 1
1 1214 . 19 1 1 A 96 96 ILE HA H 156 4.440 4.265 0.175 1
1 1224 . 19 1 1 A 96 96 ILE CA C 156 56.500 59.876 -3.376 1
1 1225 . 19 1 1 A 96 96 ILE CB C 156 36.700 38.643 -1.943 1
1 1229 . 19 1 1 A 96 96 ILE N N 156 124.100 126.968 -2.868 1
1 1230 . 19 1 1 A 97 97 PRO HA H 157 4.370 4.789 -0.419 1
1 1237 . 19 1 1 A 97 97 PRO C C 157 176.000 176.905 -0.905 1
1 1238 . 19 1 1 A 97 97 PRO CA C 157 63.200 62.403 0.797 1
1 1239 . 19 1 1 A 97 97 PRO CB C 157 32.400 32.550 -0.150 1
1 1242 . 19 1 1 A 98 98 LYS H H 158 8.380 8.985 -0.605 1
1 1243 . 19 1 1 A 98 98 LYS HA H 158 4.190 4.345 -0.155 1
1 1252 . 19 1 1 A 98 98 LYS C C 158 176.800 176.304 0.496 1
1 1253 . 19 1 1 A 98 98 LYS CA C 158 57.100 56.742 0.358 1
1 1254 . 19 1 1 A 98 98 LYS CB C 158 32.800 34.023 -1.223 1
1 1258 . 19 1 1 A 98 98 LYS N N 158 120.800 119.600 1.200 1
1 1259 . 19 1 1 A 99 99 ILE H H 159 7.930 7.952 -0.022 1
1 1260 . 19 1 1 A 99 99 ILE HA H 159 4.200 3.766 0.434 1
1 1270 . 19 1 1 A 99 99 ILE C C 159 175.400 175.027 0.373 1
1 1271 . 19 1 1 A 99 99 ILE CA C 159 60.600 61.815 -1.215 1
1 1272 . 19 1 1 A 99 99 ILE CB C 159 39.100 36.550 2.550 1
1 1276 . 19 1 1 A 99 99 ILE N N 159 120.200 117.094 3.106 1
1 1277 . 19 1 1 A 100 100 ALA H H 160 8.370 7.993 0.377 1
1 1278 . 19 1 1 A 100 100 ALA HA H 160 4.370 4.586 -0.216 1
1 1282 . 19 1 1 A 100 100 ALA C C 160 177.200 176.905 0.295 1
1 1283 . 19 1 1 A 100 100 ALA CA C 160 52.200 51.233 0.967 1
1 1284 . 19 1 1 A 100 100 ALA CB C 160 19.400 19.693 -0.293 1
1 1285 . 19 1 1 A 100 100 ALA N N 160 128.300 126.301 1.999 1
1 1286 . 19 1 1 A 101 101 LEU H H 161 8.250 8.736 -0.486 1
1 1287 . 19 1 1 A 101 101 LEU HA H 161 4.280 4.189 0.091 1
1 1297 . 19 1 1 A 101 101 LEU C C 161 177.200 176.468 0.732 1
1 1298 . 19 1 1 A 101 101 LEU CA C 161 55.200 55.325 -0.125 1
1 1299 . 19 1 1 A 101 101 LEU CB C 161 42.400 41.233 1.167 1
1 1303 . 19 1 1 A 101 101 LEU N N 161 121.900 126.605 -4.705 1
1 1304 . 19 1 1 A 102 102 GLU H H 162 8.390 8.465 -0.075 1
1 1305 . 19 1 1 A 102 102 GLU HA H 162 4.230 4.372 -0.142 1
1 1310 . 19 1 1 A 102 102 GLU C C 162 176.100 175.889 0.211 1
1 1311 . 19 1 1 A 102 102 GLU CA C 162 56.400 57.805 -1.405 1
1 1312 . 19 1 1 A 102 102 GLU CB C 162 30.500 32.317 -1.817 1
1 1314 . 19 1 1 A 102 102 GLU N N 162 121.300 124.944 -3.644 1
1 1315 . 19 1 1 A 103 103 HIS H H 163 8.330 7.325 1.005 1
1 1316 . 19 1 1 A 103 103 HIS HA H 163 4.590 4.303 0.287 1
1 1319 . 19 1 1 A 103 103 HIS C C 163 176.100 174.745 1.355 1
1 1320 . 19 1 1 A 103 103 HIS CA C 163 56.000 57.732 -1.732 1
1 1321 . 19 1 1 A 103 103 HIS CB C 163 30.500 30.177 0.323 1
1 1322 . 19 1 1 A 103 103 HIS N N 163 120.000 118.614 1.386 1
1 1323 . 19 1 1 A 107 107 HIS HA H 167 4.620 4.972 -0.352 1
1 1326 . 19 1 1 A 107 107 HIS C C 167 173.900 172.509 1.391 1
1 1327 . 19 1 1 A 107 107 HIS CA C 167 56.000 53.584 2.416 1
1 1328 . 19 1 1 A 107 107 HIS CB C 167 30.300 33.657 -3.357 1
1 15 . 20 1 1 A 2 2 ASP H H 62 8.760 9.131 -0.371 1
1 16 . 20 1 1 A 2 2 ASP HA H 62 4.810 5.263 -0.453 1
1 19 . 20 1 1 A 2 2 ASP C C 62 175.800 174.898 0.902 1
1 20 . 20 1 1 A 2 2 ASP CA C 62 54.800 52.917 1.883 1
1 21 . 20 1 1 A 2 2 ASP CB C 62 41.600 43.762 -2.162 1
1 22 . 20 1 1 A 2 2 ASP N N 62 120.900 125.521 -4.621 1
1 23 . 20 1 1 A 3 3 SER H H 63 8.710 8.704 0.006 1
1 24 . 20 1 1 A 3 3 SER HA H 63 4.970 4.817 0.153 1
1 27 . 20 1 1 A 3 3 SER C C 63 175.600 175.352 0.248 1
1 28 . 20 1 1 A 3 3 SER CA C 63 57.500 57.063 0.437 1
1 29 . 20 1 1 A 3 3 SER CB C 63 65.900 64.597 1.303 1
1 30 . 20 1 1 A 3 3 SER N N 63 116.300 117.139 -0.839 1
1 31 . 20 1 1 A 4 4 PHE H H 64 9.370 9.366 0.004 1
1 32 . 20 1 1 A 4 4 PHE HA H 64 4.010 4.174 -0.164 1
1 39 . 20 1 1 A 4 4 PHE C C 64 176.700 177.361 -0.661 1
1 40 . 20 1 1 A 4 4 PHE CA C 64 62.200 61.618 0.582 1
1 41 . 20 1 1 A 4 4 PHE CB C 64 38.500 39.388 -0.888 1
1 46 . 20 1 1 A 4 4 PHE N N 64 121.400 128.242 -6.842 1
1 47 . 20 1 1 A 5 5 GLY H H 65 8.930 8.009 0.921 1
1 48 . 20 1 1 A 5 5 GLY HA2 H 65 2.020 2.682 -0.662 1
1 49 . 20 1 1 A 5 5 GLY HA3 H 65 3.250 2.935 0.315 1
1 50 . 20 1 1 A 5 5 GLY C C 65 175.200 174.810 0.390 1
1 51 . 20 1 1 A 5 5 GLY CA C 65 46.300 46.413 -0.113 1
1 52 . 20 1 1 A 5 5 GLY N N 65 106.500 105.243 1.257 1
1 53 . 20 1 1 A 6 6 ASP H H 66 7.630 7.688 -0.058 1
1 54 . 20 1 1 A 6 6 ASP HA H 66 4.100 4.292 -0.192 1
1 57 . 20 1 1 A 6 6 ASP C C 66 179.500 178.622 0.878 1
1 58 . 20 1 1 A 6 6 ASP CA C 66 57.400 56.532 0.868 1
1 59 . 20 1 1 A 6 6 ASP CB C 66 40.500 41.147 -0.647 1
1 60 . 20 1 1 A 6 6 ASP N N 66 120.500 120.742 -0.242 1
1 61 . 20 1 1 A 7 7 TRP H H 67 7.190 7.794 -0.604 1
1 62 . 20 1 1 A 7 7 TRP HA H 67 3.860 4.392 -0.532 1
1 71 . 20 1 1 A 7 7 TRP C C 67 177.200 178.409 -1.209 1
1 72 . 20 1 1 A 7 7 TRP CA C 67 61.100 60.122 0.978 1
1 73 . 20 1 1 A 7 7 TRP CB C 67 28.300 28.978 -0.678 1
1 79 . 20 1 1 A 7 7 TRP N N 67 120.700 120.338 0.362 1
1 81 . 20 1 1 A 8 8 ALA H H 68 9.040 8.357 0.683 1
1 82 . 20 1 1 A 8 8 ALA HA H 68 3.730 3.789 -0.059 1
1 86 . 20 1 1 A 8 8 ALA C C 68 179.500 179.317 0.183 1
1 87 . 20 1 1 A 8 8 ALA CA C 68 55.200 55.165 0.035 1
1 88 . 20 1 1 A 8 8 ALA CB C 68 18.600 17.839 0.761 1
1 89 . 20 1 1 A 8 8 ALA N N 68 125.700 121.956 3.744 1
1 90 . 20 1 1 A 9 9 GLU H H 69 8.060 7.863 0.197 1
1 91 . 20 1 1 A 9 9 GLU HA H 69 4.020 4.097 -0.077 1
1 96 . 20 1 1 A 9 9 GLU C C 69 180.400 178.399 2.001 1
1 97 . 20 1 1 A 9 9 GLU CA C 69 58.800 59.141 -0.341 1
1 98 . 20 1 1 A 9 9 GLU CB C 69 28.500 29.226 -0.726 1
1 99 . 20 1 1 A 9 9 GLU N N 69 115.400 118.663 -3.263 1
1 100 . 20 1 1 A 10 10 LYS H H 70 7.740 8.195 -0.455 1
1 101 . 20 1 1 A 10 10 LYS HA H 70 3.910 4.014 -0.104 1
1 110 . 20 1 1 A 10 10 LYS C C 70 179.500 178.967 0.533 1
1 111 . 20 1 1 A 10 10 LYS CA C 70 60.000 58.936 1.064 1
1 112 . 20 1 1 A 10 10 LYS CB C 70 32.400 32.094 0.306 1
1 116 . 20 1 1 A 10 10 LYS N N 70 122.700 119.216 3.484 1
1 117 . 20 1 1 A 11 11 PHE H H 71 8.750 8.092 0.658 1
1 118 . 20 1 1 A 11 11 PHE HA H 71 4.080 4.361 -0.281 1
1 126 . 20 1 1 A 11 11 PHE C C 71 177.100 176.796 0.304 1
1 127 . 20 1 1 A 11 11 PHE CA C 71 61.200 61.470 -0.270 1
1 128 . 20 1 1 A 11 11 PHE CB C 71 38.900 39.327 -0.427 1
1 134 . 20 1 1 A 11 11 PHE N N 71 123.500 120.789 2.711 1
1 135 . 20 1 1 A 12 12 LEU H H 72 8.400 8.615 -0.215 1
1 136 . 20 1 1 A 12 12 LEU HA H 72 3.520 3.864 -0.344 1
1 146 . 20 1 1 A 12 12 LEU C C 72 180.000 178.894 1.106 1
1 147 . 20 1 1 A 12 12 LEU CA C 72 58.200 57.738 0.462 1
1 148 . 20 1 1 A 12 12 LEU CB C 72 41.700 41.288 0.412 1
1 152 . 20 1 1 A 12 12 LEU N N 72 121.100 118.877 2.223 1
1 153 . 20 1 1 A 13 13 LYS H H 73 7.810 8.133 -0.323 1
1 154 . 20 1 1 A 13 13 LYS HA H 73 4.080 4.065 0.015 1
1 156 . 20 1 1 A 13 13 LYS C C 73 179.300 178.736 0.564 1
1 157 . 20 1 1 A 13 13 LYS CA C 73 59.000 58.675 0.325 1
1 158 . 20 1 1 A 13 13 LYS CB C 73 31.900 32.024 -0.124 1
1 159 . 20 1 1 A 13 13 LYS N N 73 119.400 121.452 -2.052 1
1 160 . 20 1 1 A 14 14 SER H H 74 8.210 8.256 -0.046 1
1 161 . 20 1 1 A 14 14 SER HA H 74 4.210 4.125 0.085 1
1 164 . 20 1 1 A 14 14 SER C C 74 176.300 176.831 -0.531 1
1 165 . 20 1 1 A 14 14 SER CA C 74 61.400 61.162 0.238 1
1 166 . 20 1 1 A 14 14 SER CB C 74 62.600 62.254 0.346 1
1 167 . 20 1 1 A 14 14 SER N N 74 117.600 115.509 2.091 1
1 168 . 20 1 1 A 15 15 LYS H H 75 7.760 7.538 0.222 1
1 169 . 20 1 1 A 15 15 LYS HA H 75 4.040 3.828 0.212 1
1 178 . 20 1 1 A 15 15 LYS C C 75 178.500 178.211 0.289 1
1 179 . 20 1 1 A 15 15 LYS CA C 75 56.500 59.265 -2.765 1
1 180 . 20 1 1 A 15 15 LYS CB C 75 30.600 31.377 -0.777 1
1 184 . 20 1 1 A 15 15 LYS N N 75 120.100 121.366 -1.266 1
1 185 . 20 1 1 A 16 16 GLU H H 76 7.680 8.138 -0.458 1
1 186 . 20 1 1 A 16 16 GLU HA H 76 4.030 4.019 0.011 1
1 191 . 20 1 1 A 16 16 GLU C C 76 179.900 178.527 1.373 1
1 192 . 20 1 1 A 16 16 GLU CA C 76 59.200 59.592 -0.392 1
1 193 . 20 1 1 A 16 16 GLU CB C 76 29.600 29.207 0.393 1
1 195 . 20 1 1 A 16 16 GLU N N 76 119.700 119.206 0.494 1
1 196 . 20 1 1 A 17 17 ALA H H 77 8.030 8.038 -0.008 1
1 197 . 20 1 1 A 17 17 ALA HA H 77 4.200 4.105 0.095 1
1 201 . 20 1 1 A 17 17 ALA C C 77 178.900 179.340 -0.440 1
1 202 . 20 1 1 A 17 17 ALA CA C 77 54.400 53.776 0.624 1
1 203 . 20 1 1 A 17 17 ALA CB C 77 18.100 18.586 -0.486 1
1 204 . 20 1 1 A 17 17 ALA N N 77 123.000 120.892 2.108 1
1 205 . 20 1 1 A 18 18 ASP H H 78 7.860 7.671 0.189 1
1 206 . 20 1 1 A 18 18 ASP HA H 78 4.600 4.401 0.199 1
1 209 . 20 1 1 A 18 18 ASP C C 78 177.500 176.310 1.190 1
1 210 . 20 1 1 A 18 18 ASP CA C 78 55.100 55.602 -0.502 1
1 211 . 20 1 1 A 18 18 ASP CB C 78 41.400 41.408 -0.008 1
1 212 . 20 1 1 A 18 18 ASP N N 78 117.700 118.000 -0.300 1
1 213 . 20 1 1 A 19 19 GLY H H 79 7.910 7.422 0.488 1
1 214 . 20 1 1 A 19 19 GLY HA2 H 79 3.860 4.068 -0.208 1
1 215 . 20 1 1 A 19 19 GLY HA3 H 79 4.080 4.068 0.012 1
1 216 . 20 1 1 A 19 19 GLY C C 79 175.300 173.966 1.334 1
1 217 . 20 1 1 A 19 19 GLY CA C 79 46.200 45.536 0.664 1
1 218 . 20 1 1 A 19 19 GLY N N 79 107.100 106.251 0.849 1
1 219 . 20 1 1 A 20 20 VAL H H 80 7.150 7.998 -0.848 1
1 220 . 20 1 1 A 20 20 VAL HA H 80 4.250 4.939 -0.689 1
1 228 . 20 1 1 A 20 20 VAL C C 80 175.100 174.783 0.317 1
1 229 . 20 1 1 A 20 20 VAL CA C 80 61.800 59.363 2.437 1
1 230 . 20 1 1 A 20 20 VAL CB C 80 32.200 34.807 -2.607 1
1 233 . 20 1 1 A 20 20 VAL N N 80 114.600 115.010 -0.410 1
1 234 . 20 1 1 A 21 21 SER H H 81 8.560 8.599 -0.039 1
1 235 . 20 1 1 A 21 21 SER HA H 81 4.390 4.619 -0.229 1
1 238 . 20 1 1 A 21 21 SER C C 81 174.600 175.312 -0.712 1
1 239 . 20 1 1 A 21 21 SER CA C 81 57.900 58.187 -0.287 1
1 240 . 20 1 1 A 21 21 SER CB C 81 64.700 63.837 0.863 1
1 241 . 20 1 1 A 21 21 SER N N 81 118.700 118.725 -0.025 1
1 242 . 20 1 1 A 22 22 VAL H H 82 8.690 8.588 0.102 1
1 243 . 20 1 1 A 22 22 VAL HA H 82 3.700 3.872 -0.172 1
1 251 . 20 1 1 A 22 22 VAL C C 82 178.000 177.760 0.240 1
1 252 . 20 1 1 A 22 22 VAL CA C 82 66.500 65.077 1.423 1
1 253 . 20 1 1 A 22 22 VAL CB C 82 31.700 31.864 -0.164 1
1 256 . 20 1 1 A 22 22 VAL N N 82 122.100 126.888 -4.788 1
1 257 . 20 1 1 A 23 23 SER H H 83 8.300 7.658 0.642 1
1 258 . 20 1 1 A 23 23 SER HA H 83 4.210 3.987 0.223 1
1 261 . 20 1 1 A 23 23 SER C C 83 177.600 175.780 1.820 1
1 262 . 20 1 1 A 23 23 SER CA C 83 61.400 61.848 -0.448 1
1 263 . 20 1 1 A 23 23 SER CB C 83 62.400 62.869 -0.469 1
1 264 . 20 1 1 A 23 23 SER N N 83 113.600 118.808 -5.208 1
1 265 . 20 1 1 A 24 24 GLN H H 84 7.820 7.944 -0.124 1
1 266 . 20 1 1 A 24 24 GLN HA H 84 3.970 4.107 -0.137 1
1 273 . 20 1 1 A 24 24 GLN C C 84 178.400 177.843 0.557 1
1 274 . 20 1 1 A 24 24 GLN CA C 84 58.400 58.568 -0.168 1
1 275 . 20 1 1 A 24 24 GLN CB C 84 28.900 28.374 0.526 1
1 278 . 20 1 1 A 24 24 GLN N N 84 122.900 121.145 1.755 1
1 280 . 20 1 1 A 25 25 LEU H H 85 8.920 8.285 0.635 1
1 281 . 20 1 1 A 25 25 LEU HA H 85 4.130 4.229 -0.099 1
1 291 . 20 1 1 A 25 25 LEU C C 85 178.800 178.578 0.222 1
1 292 . 20 1 1 A 25 25 LEU CA C 85 58.300 57.696 0.604 1
1 293 . 20 1 1 A 25 25 LEU CB C 85 41.200 41.611 -0.411 1
1 297 . 20 1 1 A 25 25 LEU N N 85 122.200 121.152 1.048 1
1 298 . 20 1 1 A 26 26 ASN H H 86 8.860 8.886 -0.026 1
1 299 . 20 1 1 A 26 26 ASN HA H 86 4.420 4.390 0.030 1
1 304 . 20 1 1 A 26 26 ASN C C 86 179.000 177.967 1.033 1
1 305 . 20 1 1 A 26 26 ASN CA C 86 55.900 56.556 -0.656 1
1 306 . 20 1 1 A 26 26 ASN CB C 86 37.200 38.550 -1.350 1
1 308 . 20 1 1 A 26 26 ASN N N 86 117.600 117.296 0.304 1
1 310 . 20 1 1 A 27 27 SER H H 87 7.840 7.993 -0.153 1
1 311 . 20 1 1 A 27 27 SER HA H 87 4.100 4.252 -0.152 1
1 314 . 20 1 1 A 27 27 SER C C 87 179.000 177.048 1.952 1
1 315 . 20 1 1 A 27 27 SER CA C 87 62.100 61.446 0.654 1
1 316 . 20 1 1 A 27 27 SER CB C 87 62.100 62.328 -0.228 1
1 317 . 20 1 1 A 27 27 SER N N 87 118.500 114.521 3.979 1
1 318 . 20 1 1 A 28 28 TYR H H 88 8.180 7.707 0.473 1
1 319 . 20 1 1 A 28 28 TYR HA H 88 4.600 4.357 0.243 1
1 326 . 20 1 1 A 28 28 TYR C C 88 174.800 178.694 -3.894 1
1 327 . 20 1 1 A 28 28 TYR CA C 88 61.200 62.106 -0.906 1
1 328 . 20 1 1 A 28 28 TYR CB C 88 37.800 38.070 -0.270 1
1 333 . 20 1 1 A 28 28 TYR N N 88 119.300 119.781 -0.481 1
1 334 . 20 1 1 A 29 29 LYS H H 89 9.040 8.347 0.693 1
1 335 . 20 1 1 A 29 29 LYS HA H 89 3.890 4.127 -0.237 1
1 344 . 20 1 1 A 29 29 LYS C C 89 179.000 180.054 -1.054 1
1 345 . 20 1 1 A 29 29 LYS CA C 89 61.300 59.380 1.920 1
1 346 . 20 1 1 A 29 29 LYS CB C 89 32.800 31.948 0.852 1
1 350 . 20 1 1 A 29 29 LYS N N 89 119.300 118.931 0.369 1
1 351 . 20 1 1 A 30 30 ASN H H 90 7.770 8.599 -0.829 1
1 352 . 20 1 1 A 30 30 ASN HA H 90 4.560 4.419 0.141 1
1 357 . 20 1 1 A 30 30 ASN C C 90 178.300 177.580 0.720 1
1 358 . 20 1 1 A 30 30 ASN CA C 90 56.200 56.603 -0.403 1
1 359 . 20 1 1 A 30 30 ASN CB C 90 38.900 38.789 0.111 1
1 361 . 20 1 1 A 30 30 ASN N N 90 117.800 117.720 0.080 1
1 363 . 20 1 1 A 31 31 TYR H H 91 8.860 8.517 0.343 1
1 364 . 20 1 1 A 31 31 TYR HA H 91 4.910 4.854 0.056 1
1 371 . 20 1 1 A 31 31 TYR C C 91 178.300 178.359 -0.059 1
1 372 . 20 1 1 A 31 31 TYR CA C 91 59.700 60.715 -1.015 1
1 373 . 20 1 1 A 31 31 TYR CB C 91 37.500 38.212 -0.712 1
1 378 . 20 1 1 A 31 31 TYR N N 91 119.400 118.721 0.679 1
1 379 . 20 1 1 A 32 32 CYS H H 92 8.640 8.219 0.421 1
1 380 . 20 1 1 A 32 32 CYS HA H 92 4.410 4.271 0.139 1
1 383 . 20 1 1 A 32 32 CYS C C 92 173.700 177.294 -3.594 1
1 384 . 20 1 1 A 32 32 CYS CA C 92 65.500 62.674 2.826 1
1 385 . 20 1 1 A 32 32 CYS CB C 92 28.300 26.938 1.362 1
1 386 . 20 1 1 A 32 32 CYS N N 92 113.500 119.051 -5.551 1
1 387 . 20 1 1 A 33 33 ARG H H 93 8.440 8.178 0.262 1
1 388 . 20 1 1 A 33 33 ARG HA H 93 3.740 3.745 -0.005 1
1 391 . 20 1 1 A 33 33 ARG C C 93 177.200 178.033 -0.833 1
1 392 . 20 1 1 A 33 33 ARG CA C 93 58.300 58.628 -0.328 1
1 393 . 20 1 1 A 33 33 ARG CB C 93 30.200 29.451 0.749 1
1 394 . 20 1 1 A 33 33 ARG N N 93 111.400 121.429 -10.029 1
1 395 . 20 1 1 A 34 34 ASN H H 94 8.020 7.878 0.142 1
1 396 . 20 1 1 A 34 34 ASN HA H 94 4.980 4.379 0.601 1
1 401 . 20 1 1 A 34 34 ASN C C 94 176.700 177.136 -0.436 1
1 402 . 20 1 1 A 34 34 ASN CA C 94 53.400 55.896 -2.496 1
1 403 . 20 1 1 A 34 34 ASN CB C 94 38.000 38.526 -0.526 1
1 405 . 20 1 1 A 34 34 ASN N N 94 113.600 117.869 -4.269 1
1 407 . 20 1 1 A 35 35 HIS H H 95 7.200 7.551 -0.351 1
1 408 . 20 1 1 A 35 35 HIS HA H 95 4.470 4.464 0.006 1
1 411 . 20 1 1 A 35 35 HIS C C 95 176.600 176.032 0.568 1
1 412 . 20 1 1 A 35 35 HIS CA C 95 60.000 59.451 0.549 1
1 413 . 20 1 1 A 35 35 HIS CB C 95 30.500 31.215 -0.715 1
1 414 . 20 1 1 A 35 35 HIS N N 95 115.600 116.451 -0.851 1
1 415 . 20 1 1 A 36 36 LEU H H 96 8.170 7.814 0.356 1
1 416 . 20 1 1 A 36 36 LEU HA H 96 4.730 4.600 0.130 1
1 426 . 20 1 1 A 36 36 LEU C C 96 176.800 177.471 -0.671 1
1 427 . 20 1 1 A 36 36 LEU CA C 96 54.400 54.533 -0.133 1
1 428 . 20 1 1 A 36 36 LEU CB C 96 40.600 41.934 -1.334 1
1 432 . 20 1 1 A 36 36 LEU N N 96 114.000 119.161 -5.161 1
1 433 . 20 1 1 A 37 37 SER H H 97 7.140 8.307 -1.167 1
1 434 . 20 1 1 A 37 37 SER HA H 97 4.730 4.303 0.427 1
1 437 . 20 1 1 A 37 37 SER CA C 97 62.700 62.821 -0.121 1
1 438 . 20 1 1 A 37 37 SER CB C 97 62.600 61.215 1.385 1
1 439 . 20 1 1 A 37 37 SER N N 97 117.200 116.023 1.177 1
1 440 . 20 1 1 A 38 38 PRO HA H 98 4.560 4.378 0.182 1
1 447 . 20 1 1 A 38 38 PRO C C 98 177.900 179.147 -1.247 1
1 448 . 20 1 1 A 38 38 PRO CA C 98 65.700 65.874 -0.174 1
1 449 . 20 1 1 A 38 38 PRO CB C 98 31.800 30.840 0.960 1
1 452 . 20 1 1 A 39 39 LEU H H 99 8.090 7.302 0.788 1
1 453 . 20 1 1 A 39 39 LEU HA H 99 4.260 3.987 0.273 1
1 463 . 20 1 1 A 39 39 LEU C C 99 178.700 178.449 0.251 1
1 464 . 20 1 1 A 39 39 LEU CA C 99 54.300 57.391 -3.091 1
1 465 . 20 1 1 A 39 39 LEU CB C 99 42.400 41.179 1.221 1
1 469 . 20 1 1 A 39 39 LEU N N 99 112.400 117.500 -5.100 1
1 470 . 20 1 1 A 40 40 TYR H H 100 8.350 8.727 -0.377 1
1 471 . 20 1 1 A 40 40 TYR HA H 100 4.170 4.447 -0.277 1
1 478 . 20 1 1 A 40 40 TYR C C 100 178.300 176.866 1.434 1
1 479 . 20 1 1 A 40 40 TYR CA C 100 63.400 61.769 1.631 1
1 480 . 20 1 1 A 40 40 TYR CB C 100 38.600 39.037 -0.437 1
1 485 . 20 1 1 A 40 40 TYR N N 100 119.400 120.730 -1.330 1
1 486 . 20 1 1 A 41 41 MET H H 101 8.640 7.616 1.024 1
1 487 . 20 1 1 A 41 41 MET HA H 101 4.260 4.715 -0.455 1
1 488 . 20 1 1 A 41 41 MET C C 101 177.000 176.155 0.845 1
1 489 . 20 1 1 A 41 41 MET CA C 101 54.600 54.642 -0.042 1
1 490 . 20 1 1 A 41 41 MET N N 101 111.800 116.927 -5.127 1
1 491 . 20 1 1 A 42 42 LYS H H 102 7.880 7.812 0.068 1
1 492 . 20 1 1 A 42 42 LYS HA H 102 4.430 4.797 -0.367 1
1 501 . 20 1 1 A 42 42 LYS C C 102 176.300 175.964 0.336 1
1 502 . 20 1 1 A 42 42 LYS CA C 102 56.000 54.367 1.633 1
1 503 . 20 1 1 A 42 42 LYS CB C 102 33.400 33.886 -0.486 1
1 507 . 20 1 1 A 42 42 LYS N N 102 121.700 119.704 1.996 1
1 508 . 20 1 1 A 43 43 SER H H 103 9.160 8.964 0.196 1
1 509 . 20 1 1 A 43 43 SER HA H 103 4.620 4.604 0.016 1
1 513 . 20 1 1 A 43 43 SER C C 103 176.300 175.669 0.631 1
1 514 . 20 1 1 A 43 43 SER CA C 103 58.700 58.442 0.258 1
1 515 . 20 1 1 A 43 43 SER CB C 103 63.700 64.117 -0.417 1
1 516 . 20 1 1 A 43 43 SER N N 103 118.800 117.392 1.408 1
1 517 . 20 1 1 A 44 44 LEU H H 104 8.860 9.214 -0.354 1
1 518 . 20 1 1 A 44 44 LEU HA H 104 4.130 4.211 -0.081 1
1 528 . 20 1 1 A 44 44 LEU C C 104 178.700 178.963 -0.263 1
1 529 . 20 1 1 A 44 44 LEU CA C 104 58.800 58.528 0.272 1
1 530 . 20 1 1 A 44 44 LEU CB C 104 42.600 41.426 1.174 1
1 534 . 20 1 1 A 44 44 LEU N N 104 124.200 128.290 -4.090 1
1 535 . 20 1 1 A 45 45 SER H H 105 8.330 8.115 0.215 1
1 536 . 20 1 1 A 45 45 SER HA H 105 4.310 4.582 -0.272 1
1 539 . 20 1 1 A 45 45 SER C C 105 175.000 174.932 0.068 1
1 540 . 20 1 1 A 45 45 SER CA C 105 60.100 59.067 1.033 1
1 541 . 20 1 1 A 45 45 SER CB C 105 63.400 63.766 -0.366 1
1 542 . 20 1 1 A 45 45 SER N N 105 107.700 114.695 -6.995 1
1 543 . 20 1 1 A 46 46 GLU H H 106 7.800 7.914 -0.114 1
1 544 . 20 1 1 A 46 46 GLU HA H 106 4.570 4.353 0.217 1
1 549 . 20 1 1 A 46 46 GLU C C 106 174.100 176.449 -2.349 1
1 550 . 20 1 1 A 46 46 GLU CA C 106 55.600 55.907 -0.307 1
1 551 . 20 1 1 A 46 46 GLU CB C 106 31.200 30.622 0.578 1
1 553 . 20 1 1 A 46 46 GLU N N 106 119.600 118.638 0.962 1
1 554 . 20 1 1 A 47 47 ILE H H 107 7.100 7.414 -0.314 1
1 555 . 20 1 1 A 47 47 ILE HA H 107 4.040 4.055 -0.015 1
1 565 . 20 1 1 A 47 47 ILE C C 107 174.100 175.249 -1.149 1
1 566 . 20 1 1 A 47 47 ILE CA C 107 62.300 61.504 0.796 1
1 567 . 20 1 1 A 47 47 ILE CB C 107 38.500 38.080 0.420 1
1 571 . 20 1 1 A 47 47 ILE N N 107 120.600 121.648 -1.048 1
1 572 . 20 1 1 A 48 48 LEU H H 108 9.180 8.633 0.547 1
1 573 . 20 1 1 A 48 48 LEU HA H 108 4.940 4.632 0.308 1
1 583 . 20 1 1 A 48 48 LEU CA C 108 51.900 52.465 -0.565 1
1 584 . 20 1 1 A 48 48 LEU CB C 108 42.000 42.024 -0.024 1
1 588 . 20 1 1 A 48 48 LEU N N 108 129.400 128.632 0.768 1
1 589 . 20 1 1 A 49 49 PRO HA H 109 3.910 4.275 -0.365 1
1 596 . 20 1 1 A 49 49 PRO C C 109 178.500 177.662 0.838 1
1 597 . 20 1 1 A 49 49 PRO CA C 109 66.600 64.985 1.615 1
1 598 . 20 1 1 A 49 49 PRO CB C 109 31.300 31.774 -0.474 1
1 601 . 20 1 1 A 50 50 ALA H H 110 8.280 8.324 -0.044 1
1 602 . 20 1 1 A 50 50 ALA HA H 110 4.110 4.035 0.075 1
1 606 . 20 1 1 A 50 50 ALA C C 110 179.700 180.040 -0.340 1
1 607 . 20 1 1 A 50 50 ALA CA C 110 55.100 55.031 0.069 1
1 608 . 20 1 1 A 50 50 ALA CB C 110 19.200 18.357 0.843 1
1 609 . 20 1 1 A 50 50 ALA N N 110 116.100 119.039 -2.939 1
1 610 . 20 1 1 A 51 51 ASP H H 111 7.790 7.906 -0.116 1
1 611 . 20 1 1 A 51 51 ASP HA H 111 4.440 4.330 0.110 1
1 614 . 20 1 1 A 51 51 ASP C C 111 178.200 178.835 -0.635 1
1 615 . 20 1 1 A 51 51 ASP CA C 111 57.600 57.270 0.330 1
1 616 . 20 1 1 A 51 51 ASP CB C 111 41.800 40.950 0.850 1
1 617 . 20 1 1 A 51 51 ASP N N 111 116.500 118.385 -1.885 1
1 618 . 20 1 1 A 52 52 ILE H H 112 7.020 7.509 -0.489 1
1 619 . 20 1 1 A 52 52 ILE HA H 112 3.750 3.690 0.060 1
1 629 . 20 1 1 A 52 52 ILE C C 112 177.300 177.739 -0.439 1
1 630 . 20 1 1 A 52 52 ILE CA C 112 63.500 65.144 -1.644 1
1 631 . 20 1 1 A 52 52 ILE CB C 112 37.500 37.204 0.296 1
1 635 . 20 1 1 A 52 52 ILE N N 112 116.700 120.380 -3.680 1
1 636 . 20 1 1 A 53 53 GLN H H 113 9.150 8.480 0.670 1
1 637 . 20 1 1 A 53 53 GLN HA H 113 3.720 3.970 -0.250 1
1 644 . 20 1 1 A 53 53 GLN C C 113 177.500 177.856 -0.356 1
1 645 . 20 1 1 A 53 53 GLN CA C 113 58.200 58.692 -0.492 1
1 646 . 20 1 1 A 53 53 GLN CB C 113 30.200 28.562 1.638 1
1 649 . 20 1 1 A 53 53 GLN N N 113 121.200 121.234 -0.034 1
1 651 . 20 1 1 A 54 54 SER H H 114 8.150 8.037 0.113 1
1 652 . 20 1 1 A 54 54 SER HA H 114 4.180 4.237 -0.057 1
1 655 . 20 1 1 A 54 54 SER C C 114 175.900 177.478 -1.578 1
1 656 . 20 1 1 A 54 54 SER CA C 114 62.100 61.717 0.383 1
1 657 . 20 1 1 A 54 54 SER CB C 114 62.800 63.036 -0.236 1
1 658 . 20 1 1 A 54 54 SER N N 114 112.200 114.325 -2.125 1
1 659 . 20 1 1 A 55 55 ILE H H 115 6.760 7.852 -1.092 1
1 660 . 20 1 1 A 55 55 ILE HA H 115 3.860 3.729 0.131 1
1 670 . 20 1 1 A 55 55 ILE C C 115 179.200 178.399 0.801 1
1 671 . 20 1 1 A 55 55 ILE CA C 115 64.700 64.963 -0.263 1
1 672 . 20 1 1 A 55 55 ILE CB C 115 38.900 37.988 0.912 1
1 676 . 20 1 1 A 55 55 ILE N N 115 119.500 121.092 -1.592 1
1 677 . 20 1 1 A 56 56 ILE H H 116 7.750 8.279 -0.529 1
1 678 . 20 1 1 A 56 56 ILE HA H 116 3.690 3.590 0.100 1
1 688 . 20 1 1 A 56 56 ILE C C 116 176.900 178.587 -1.687 1
1 689 . 20 1 1 A 56 56 ILE CA C 116 62.800 65.291 -2.491 1
1 690 . 20 1 1 A 56 56 ILE CB C 116 36.200 37.702 -1.502 1
1 694 . 20 1 1 A 56 56 ILE N N 116 120.200 120.553 -0.353 1
1 695 . 20 1 1 A 57 57 ASN H H 117 8.690 8.423 0.267 1
1 696 . 20 1 1 A 57 57 ASN HA H 117 4.440 4.415 0.025 1
1 701 . 20 1 1 A 57 57 ASN C C 117 177.200 177.616 -0.416 1
1 702 . 20 1 1 A 57 57 ASN CA C 117 54.800 56.838 -2.038 1
1 703 . 20 1 1 A 57 57 ASN CB C 117 38.100 38.919 -0.819 1
1 705 . 20 1 1 A 57 57 ASN N N 117 117.000 119.882 -2.882 1
1 707 . 20 1 1 A 58 58 GLU H H 118 7.630 8.238 -0.608 1
1 708 . 20 1 1 A 58 58 GLU HA H 118 4.450 4.366 0.084 1
1 713 . 20 1 1 A 58 58 GLU C C 118 176.500 177.010 -0.510 1
1 714 . 20 1 1 A 58 58 GLU CA C 118 56.200 57.444 -1.244 1
1 715 . 20 1 1 A 58 58 GLU CB C 118 30.200 30.183 0.017 1
1 717 . 20 1 1 A 58 58 GLU N N 118 116.300 117.056 -0.756 1
1 718 . 20 1 1 A 59 59 THR H H 119 7.540 7.395 0.145 1
1 719 . 20 1 1 A 59 59 THR HA H 119 4.230 4.335 -0.105 1
1 724 . 20 1 1 A 59 59 THR C C 119 174.200 174.192 0.008 1
1 725 . 20 1 1 A 59 59 THR CA C 119 63.800 63.180 0.620 1
1 726 . 20 1 1 A 59 59 THR CB C 119 68.900 68.978 -0.078 1
1 728 . 20 1 1 A 59 59 THR N N 119 117.600 115.913 1.687 1
1 729 . 20 1 1 A 60 60 LYS H H 120 8.860 8.926 -0.066 1
1 730 . 20 1 1 A 60 60 LYS HA H 120 4.490 4.516 -0.026 1
1 739 . 20 1 1 A 60 60 LYS C C 120 175.800 174.960 0.840 1
1 740 . 20 1 1 A 60 60 LYS CA C 120 54.900 55.584 -0.684 1
1 741 . 20 1 1 A 60 60 LYS CB C 120 29.800 30.874 -1.074 1
1 745 . 20 1 1 A 60 60 LYS N N 120 128.500 127.838 0.662 1
1 746 . 20 1 1 A 61 61 LEU H H 121 7.150 7.510 -0.360 1
1 747 . 20 1 1 A 61 61 LEU HA H 121 4.710 4.884 -0.174 1
1 757 . 20 1 1 A 61 61 LEU C C 121 175.000 175.983 -0.983 1
1 758 . 20 1 1 A 61 61 LEU CA C 121 52.800 53.150 -0.350 1
1 759 . 20 1 1 A 61 61 LEU CB C 121 46.400 44.718 1.682 1
1 763 . 20 1 1 A 61 61 LEU N N 121 120.700 124.044 -3.344 1
1 764 . 20 1 1 A 62 62 ALA H H 122 8.000 8.509 -0.509 1
1 765 . 20 1 1 A 62 62 ALA HA H 122 4.250 4.438 -0.188 1
1 769 . 20 1 1 A 62 62 ALA CA C 122 52.100 52.140 -0.040 1
1 770 . 20 1 1 A 62 62 ALA CB C 122 19.500 19.523 -0.023 1
1 771 . 20 1 1 A 62 62 ALA N N 122 119.900 123.252 -3.352 1
1 772 . 20 1 1 A 63 63 LYS H H 123 8.770 9.047 -0.277 1
1 773 . 20 1 1 A 63 63 LYS HA H 123 3.800 3.913 -0.113 1
1 782 . 20 1 1 A 63 63 LYS C C 123 178.300 178.385 -0.085 1
1 783 . 20 1 1 A 63 63 LYS CA C 123 60.700 59.913 0.787 1
1 784 . 20 1 1 A 63 63 LYS CB C 123 32.300 32.209 0.091 1
1 788 . 20 1 1 A 63 63 LYS N N 123 121.400 121.539 -0.139 1
1 789 . 20 1 1 A 64 64 ASN H H 124 9.020 8.659 0.361 1
1 790 . 20 1 1 A 64 64 ASN HA H 124 4.430 4.469 -0.039 1
1 795 . 20 1 1 A 64 64 ASN C C 124 178.300 177.320 0.980 1
1 796 . 20 1 1 A 64 64 ASN CA C 124 56.200 55.827 0.373 1
1 797 . 20 1 1 A 64 64 ASN CB C 124 37.300 37.277 0.023 1
1 799 . 20 1 1 A 64 64 ASN N N 124 115.000 117.049 -2.049 1
1 801 . 20 1 1 A 65 65 THR H H 125 7.620 7.763 -0.143 1
1 802 . 20 1 1 A 65 65 THR HA H 125 4.030 4.130 -0.100 1
1 807 . 20 1 1 A 65 65 THR C C 125 175.500 176.790 -1.290 1
1 808 . 20 1 1 A 65 65 THR CA C 125 66.000 67.025 -1.025 1
1 809 . 20 1 1 A 65 65 THR CB C 125 67.600 68.227 -0.627 1
1 811 . 20 1 1 A 65 65 THR N N 125 119.800 116.806 2.994 1
1 812 . 20 1 1 A 66 66 LEU H H 126 8.020 8.217 -0.197 1
1 813 . 20 1 1 A 66 66 LEU HA H 126 3.790 3.905 -0.115 1
1 823 . 20 1 1 A 66 66 LEU C C 126 179.200 179.312 -0.112 1
1 824 . 20 1 1 A 66 66 LEU CA C 126 58.700 58.118 0.582 1
1 825 . 20 1 1 A 66 66 LEU CB C 126 41.300 41.383 -0.083 1
1 829 . 20 1 1 A 66 66 LEU N N 126 121.200 121.552 -0.352 1
1 830 . 20 1 1 A 67 67 LYS H H 127 8.380 8.475 -0.095 1
1 831 . 20 1 1 A 67 67 LYS HA H 127 3.740 3.915 -0.175 1
1 840 . 20 1 1 A 67 67 LYS C C 127 178.300 179.622 -1.322 1
1 841 . 20 1 1 A 67 67 LYS CA C 127 60.100 60.149 -0.049 1
1 842 . 20 1 1 A 67 67 LYS CB C 127 32.400 32.260 0.140 1
1 846 . 20 1 1 A 67 67 LYS N N 127 117.000 117.900 -0.900 1
1 847 . 20 1 1 A 68 68 ALA H H 128 7.480 7.819 -0.339 1
1 848 . 20 1 1 A 68 68 ALA HA H 128 4.210 3.967 0.243 1
1 852 . 20 1 1 A 68 68 ALA C C 128 181.200 180.130 1.070 1
1 853 . 20 1 1 A 68 68 ALA CA C 128 55.200 55.056 0.144 1
1 854 . 20 1 1 A 68 68 ALA CB C 128 18.600 17.991 0.609 1
1 855 . 20 1 1 A 68 68 ALA N N 128 122.900 122.160 0.740 1
1 856 . 20 1 1 A 69 69 ILE H H 129 8.250 7.898 0.352 1
1 857 . 20 1 1 A 69 69 ILE HA H 129 3.130 3.681 -0.551 1
1 867 . 20 1 1 A 69 69 ILE C C 129 177.400 178.178 -0.778 1
1 868 . 20 1 1 A 69 69 ILE CA C 129 66.700 65.768 0.932 1
1 869 . 20 1 1 A 69 69 ILE CB C 129 37.900 37.791 0.109 1
1 873 . 20 1 1 A 69 69 ILE N N 129 122.800 118.994 3.806 1
1 874 . 20 1 1 A 70 70 ARG H H 130 8.040 7.863 0.177 1
1 875 . 20 1 1 A 70 70 ARG HA H 130 3.620 3.971 -0.351 1
1 882 . 20 1 1 A 70 70 ARG C C 130 177.800 178.276 -0.476 1
1 883 . 20 1 1 A 70 70 ARG CA C 130 60.700 59.925 0.775 1
1 884 . 20 1 1 A 70 70 ARG CB C 130 29.600 29.915 -0.315 1
1 887 . 20 1 1 A 70 70 ARG N N 130 119.700 120.682 -0.982 1
1 888 . 20 1 1 A 71 71 ASN H H 131 8.920 8.656 0.264 1
1 889 . 20 1 1 A 71 71 ASN HA H 131 4.430 4.444 -0.014 1
1 894 . 20 1 1 A 71 71 ASN C C 131 177.500 177.931 -0.431 1
1 895 . 20 1 1 A 71 71 ASN CA C 131 56.100 56.230 -0.130 1
1 896 . 20 1 1 A 71 71 ASN CB C 131 38.600 38.565 0.035 1
1 898 . 20 1 1 A 71 71 ASN N N 131 117.200 118.035 -0.835 1
1 900 . 20 1 1 A 72 72 THR H H 132 8.300 8.464 -0.164 1
1 901 . 20 1 1 A 72 72 THR HA H 132 4.430 3.843 0.587 1
1 906 . 20 1 1 A 72 72 THR C C 132 175.100 176.626 -1.526 1
1 907 . 20 1 1 A 72 72 THR CA C 132 68.200 66.353 1.847 1
1 908 . 20 1 1 A 72 72 THR CB C 132 68.500 68.708 -0.208 1
1 910 . 20 1 1 A 72 72 THR N N 132 119.200 115.294 3.906 1
1 911 . 20 1 1 A 73 73 ALA H H 133 7.950 8.160 -0.210 1
1 912 . 20 1 1 A 73 73 ALA HA H 133 4.040 4.161 -0.121 1
1 916 . 20 1 1 A 73 73 ALA C C 133 178.200 179.759 -1.559 1
1 917 . 20 1 1 A 73 73 ALA CA C 133 55.900 55.519 0.381 1
1 918 . 20 1 1 A 73 73 ALA CB C 133 16.700 18.090 -1.390 1
1 919 . 20 1 1 A 73 73 ALA N N 133 120.900 123.715 -2.815 1
1 920 . 20 1 1 A 74 74 SER H H 134 8.440 8.676 -0.236 1
1 921 . 20 1 1 A 74 74 SER HA H 134 4.430 4.395 0.035 1
1 924 . 20 1 1 A 74 74 SER C C 134 178.800 177.340 1.460 1
1 925 . 20 1 1 A 74 74 SER CA C 134 61.300 61.556 -0.256 1
1 926 . 20 1 1 A 74 74 SER CB C 134 62.600 62.500 0.100 1
1 927 . 20 1 1 A 74 74 SER N N 134 110.100 113.178 -3.078 1
1 928 . 20 1 1 A 75 75 GLN H H 135 8.340 7.544 0.796 1
1 929 . 20 1 1 A 75 75 GLN HA H 135 3.880 3.905 -0.025 1
1 936 . 20 1 1 A 75 75 GLN C C 135 178.800 178.716 0.084 1
1 937 . 20 1 1 A 75 75 GLN CA C 135 59.600 58.718 0.882 1
1 938 . 20 1 1 A 75 75 GLN CB C 135 29.900 27.848 2.052 1
1 941 . 20 1 1 A 75 75 GLN N N 135 118.100 121.990 -3.890 1
1 943 . 20 1 1 A 76 76 ILE H H 136 7.670 7.346 0.324 1
1 944 . 20 1 1 A 76 76 ILE HA H 136 3.200 3.273 -0.073 1
1 954 . 20 1 1 A 76 76 ILE C C 136 177.500 177.964 -0.464 1
1 955 . 20 1 1 A 76 76 ILE CA C 136 66.100 65.125 0.975 1
1 956 . 20 1 1 A 76 76 ILE CB C 136 37.400 37.396 0.004 1
1 960 . 20 1 1 A 76 76 ILE N N 136 122.500 120.083 2.417 1
1 961 . 20 1 1 A 77 77 PHE H H 137 7.930 7.961 -0.031 1
1 962 . 20 1 1 A 77 77 PHE HA H 137 3.890 4.191 -0.301 1
1 969 . 20 1 1 A 77 77 PHE C C 137 178.200 178.306 -0.106 1
1 970 . 20 1 1 A 77 77 PHE CA C 137 63.600 60.483 3.117 1
1 971 . 20 1 1 A 77 77 PHE CB C 137 39.300 38.490 0.810 1
1 976 . 20 1 1 A 77 77 PHE N N 137 116.100 118.587 -2.487 1
1 977 . 20 1 1 A 78 78 ARG H H 138 8.900 8.137 0.763 1
1 978 . 20 1 1 A 78 78 ARG HA H 138 3.910 4.024 -0.114 1
1 986 . 20 1 1 A 78 78 ARG C C 138 178.300 178.829 -0.529 1
1 987 . 20 1 1 A 78 78 ARG CA C 138 60.100 58.934 1.166 1
1 988 . 20 1 1 A 78 78 ARG CB C 138 29.600 29.750 -0.150 1
1 991 . 20 1 1 A 78 78 ARG N N 138 118.600 119.722 -1.122 1
1 993 . 20 1 1 A 79 79 LEU H H 139 7.730 7.871 -0.141 1
1 994 . 20 1 1 A 79 79 LEU HA H 139 4.280 4.119 0.161 1
1 1004 . 20 1 1 A 79 79 LEU C C 139 179.000 178.416 0.584 1
1 1005 . 20 1 1 A 79 79 LEU CA C 139 57.800 57.944 -0.144 1
1 1006 . 20 1 1 A 79 79 LEU CB C 139 41.900 41.361 0.539 1
1 1010 . 20 1 1 A 79 79 LEU N N 139 121.900 121.395 0.505 1
1 1011 . 20 1 1 A 80 80 ALA H H 140 7.590 7.654 -0.064 1
1 1012 . 20 1 1 A 80 80 ALA HA H 140 2.710 3.080 -0.370 1
1 1016 . 20 1 1 A 80 80 ALA C C 140 179.900 180.155 -0.255 1
1 1017 . 20 1 1 A 80 80 ALA CA C 140 55.100 54.561 0.539 1
1 1018 . 20 1 1 A 80 80 ALA CB C 140 17.600 17.547 0.053 1
1 1019 . 20 1 1 A 80 80 ALA N N 140 123.400 119.934 3.466 1
1 1020 . 20 1 1 A 81 81 ILE H H 141 8.910 7.854 1.056 1
1 1021 . 20 1 1 A 81 81 ILE HA H 141 4.110 3.997 0.113 1
1 1031 . 20 1 1 A 81 81 ILE C C 141 181.700 177.653 4.047 1
1 1032 . 20 1 1 A 81 81 ILE CA C 141 64.800 65.291 -0.491 1
1 1033 . 20 1 1 A 81 81 ILE CB C 141 38.600 37.586 1.014 1
1 1037 . 20 1 1 A 81 81 ILE N N 141 122.400 118.769 3.631 1
1 1038 . 20 1 1 A 82 82 GLU H H 142 8.560 8.648 -0.088 1
1 1039 . 20 1 1 A 82 82 GLU HA H 142 4.100 4.082 0.018 1
1 1044 . 20 1 1 A 82 82 GLU C C 142 177.700 178.195 -0.495 1
1 1045 . 20 1 1 A 82 82 GLU CA C 142 59.100 59.793 -0.693 1
1 1046 . 20 1 1 A 82 82 GLU CB C 142 29.200 29.216 -0.016 1
1 1048 . 20 1 1 A 82 82 GLU N N 142 123.200 119.996 3.204 1
1 1049 . 20 1 1 A 83 83 ASN H H 143 7.310 7.712 -0.402 1
1 1050 . 20 1 1 A 83 83 ASN HA H 143 4.750 4.892 -0.142 1
1 1055 . 20 1 1 A 83 83 ASN C C 143 173.200 174.329 -1.129 1
1 1056 . 20 1 1 A 83 83 ASN CA C 143 54.200 52.909 1.291 1
1 1057 . 20 1 1 A 83 83 ASN CB C 143 41.300 38.829 2.471 1
1 1059 . 20 1 1 A 83 83 ASN N N 143 114.900 115.418 -0.518 1
1 1061 . 20 1 1 A 84 84 ARG H H 144 8.320 7.906 0.414 1
1 1062 . 20 1 1 A 84 84 ARG HA H 144 4.120 4.025 0.095 1
1 1069 . 20 1 1 A 84 84 ARG C C 144 175.300 175.796 -0.496 1
1 1070 . 20 1 1 A 84 84 ARG CA C 144 57.100 56.865 0.235 1
1 1071 . 20 1 1 A 84 84 ARG CB C 144 26.000 27.158 -1.158 1
1 1074 . 20 1 1 A 84 84 ARG N N 144 114.400 115.318 -0.918 1
1 1075 . 20 1 1 A 85 85 ALA H H 145 8.350 8.549 -0.199 1
1 1076 . 20 1 1 A 85 85 ALA HA H 145 4.320 4.307 0.013 1
1 1080 . 20 1 1 A 85 85 ALA C C 145 176.500 177.180 -0.680 1
1 1081 . 20 1 1 A 85 85 ALA CA C 145 53.400 53.025 0.375 1
1 1082 . 20 1 1 A 85 85 ALA CB C 145 19.900 19.723 0.177 1
1 1083 . 20 1 1 A 85 85 ALA N N 145 120.600 118.366 2.234 1
1 1084 . 20 1 1 A 86 86 ILE H H 146 7.290 7.502 -0.212 1
1 1085 . 20 1 1 A 86 86 ILE HA H 146 4.400 4.636 -0.236 1
1 1095 . 20 1 1 A 86 86 ILE C C 146 173.600 173.715 -0.115 1
1 1096 . 20 1 1 A 86 86 ILE CA C 146 59.200 60.066 -0.866 1
1 1097 . 20 1 1 A 86 86 ILE CB C 146 41.600 41.300 0.300 1
1 1101 . 20 1 1 A 86 86 ILE N N 146 111.500 115.842 -4.342 1
1 1102 . 20 1 1 A 87 87 ASP H H 147 8.270 8.918 -0.648 1
1 1103 . 20 1 1 A 87 87 ASP HA H 147 4.940 4.917 0.023 1
1 1106 . 20 1 1 A 87 87 ASP C C 147 174.700 174.127 0.573 1
1 1107 . 20 1 1 A 87 87 ASP CA C 147 53.700 54.183 -0.483 1
1 1108 . 20 1 1 A 87 87 ASP CB C 147 41.800 41.730 0.070 1
1 1109 . 20 1 1 A 87 87 ASP N N 147 119.400 124.876 -5.476 1
1 1110 . 20 1 1 A 88 88 PHE H H 148 7.230 7.677 -0.447 1
1 1111 . 20 1 1 A 88 88 PHE HA H 148 4.690 5.084 -0.394 1
1 1119 . 20 1 1 A 88 88 PHE C C 148 171.500 174.265 -2.765 1
1 1120 . 20 1 1 A 88 88 PHE CA C 148 56.400 56.618 -0.218 1
1 1121 . 20 1 1 A 88 88 PHE CB C 148 42.000 43.609 -1.609 1
1 1127 . 20 1 1 A 88 88 PHE N N 148 119.700 118.429 1.271 1
1 1128 . 20 1 1 A 89 89 ASN H H 149 8.060 8.789 -0.729 1
1 1129 . 20 1 1 A 89 89 ASN HA H 149 4.490 5.106 -0.616 1
1 1134 . 20 1 1 A 89 89 ASN CA C 149 48.100 49.736 -1.636 1
1 1135 . 20 1 1 A 89 89 ASN CB C 149 39.200 39.730 -0.530 1
1 1137 . 20 1 1 A 89 89 ASN N N 149 119.700 121.559 -1.859 1
1 1139 . 20 1 1 A 90 90 PRO HA H 150 3.970 4.499 -0.529 1
1 1146 . 20 1 1 A 90 90 PRO C C 150 177.700 177.734 -0.034 1
1 1147 . 20 1 1 A 90 90 PRO CA C 150 63.900 64.680 -0.780 1
1 1148 . 20 1 1 A 90 90 PRO CB C 150 31.700 31.590 0.110 1
1 1151 . 20 1 1 A 91 91 ALA H H 151 7.240 7.355 -0.115 1
1 1152 . 20 1 1 A 91 91 ALA HA H 151 3.900 4.061 -0.161 1
1 1156 . 20 1 1 A 91 91 ALA C C 151 178.000 179.782 -1.782 1
1 1157 . 20 1 1 A 91 91 ALA CA C 151 53.900 54.558 -0.658 1
1 1158 . 20 1 1 A 91 91 ALA CB C 151 17.700 18.333 -0.633 1
1 1159 . 20 1 1 A 91 91 ALA N N 151 115.700 118.889 -3.189 1
1 1160 . 20 1 1 A 92 92 ASP H H 152 7.080 7.780 -0.700 1
1 1161 . 20 1 1 A 92 92 ASP HA H 152 4.220 4.327 -0.107 1
1 1164 . 20 1 1 A 92 92 ASP C C 152 176.200 177.093 -0.893 1
1 1165 . 20 1 1 A 92 92 ASP CA C 152 55.800 56.503 -0.703 1
1 1166 . 20 1 1 A 92 92 ASP CB C 152 39.500 40.555 -1.055 1
1 1167 . 20 1 1 A 92 92 ASP N N 152 117.100 119.312 -2.212 1
1 1168 . 20 1 1 A 93 93 TYR H H 153 7.060 7.212 -0.152 1
1 1169 . 20 1 1 A 93 93 TYR HA H 153 4.490 4.462 0.028 1
1 1176 . 20 1 1 A 93 93 TYR C C 153 174.700 176.109 -1.409 1
1 1177 . 20 1 1 A 93 93 TYR CA C 153 57.600 59.340 -1.740 1
1 1178 . 20 1 1 A 93 93 TYR CB C 153 38.500 38.298 0.202 1
1 1183 . 20 1 1 A 93 93 TYR N N 153 116.800 116.769 0.031 1
1 1184 . 20 1 1 A 94 94 VAL H H 154 7.000 7.161 -0.161 1
1 1185 . 20 1 1 A 94 94 VAL HA H 154 4.040 3.970 0.070 1
1 1193 . 20 1 1 A 94 94 VAL C C 154 174.700 175.194 -0.494 1
1 1194 . 20 1 1 A 94 94 VAL CA C 154 62.100 62.760 -0.660 1
1 1195 . 20 1 1 A 94 94 VAL CB C 154 32.700 32.191 0.509 1
1 1198 . 20 1 1 A 94 94 VAL N N 154 120.600 120.702 -0.102 1
1 1199 . 20 1 1 A 95 95 ARG H H 155 9.430 8.576 0.854 1
1 1200 . 20 1 1 A 95 95 ARG HA H 155 4.640 4.638 0.002 1
1 1207 . 20 1 1 A 95 95 ARG C C 155 175.400 175.560 -0.160 1
1 1208 . 20 1 1 A 95 95 ARG CA C 155 54.200 55.847 -1.647 1
1 1209 . 20 1 1 A 95 95 ARG CB C 155 32.400 31.418 0.982 1
1 1212 . 20 1 1 A 95 95 ARG N N 155 128.200 127.143 1.057 1
1 1213 . 20 1 1 A 96 96 ILE H H 156 8.700 8.647 0.053 1
1 1214 . 20 1 1 A 96 96 ILE HA H 156 4.440 4.608 -0.168 1
1 1224 . 20 1 1 A 96 96 ILE CA C 156 56.500 57.891 -1.391 1
1 1225 . 20 1 1 A 96 96 ILE CB C 156 36.700 38.419 -1.719 1
1 1229 . 20 1 1 A 96 96 ILE N N 156 124.100 124.366 -0.266 1
1 1230 . 20 1 1 A 97 97 PRO HA H 157 4.370 4.509 -0.139 1
1 1237 . 20 1 1 A 97 97 PRO C C 157 176.000 177.194 -1.194 1
1 1238 . 20 1 1 A 97 97 PRO CA C 157 63.200 63.538 -0.338 1
1 1239 . 20 1 1 A 97 97 PRO CB C 157 32.400 32.252 0.148 1
1 1242 . 20 1 1 A 98 98 LYS H H 158 8.380 8.648 -0.268 1
1 1243 . 20 1 1 A 98 98 LYS HA H 158 4.190 4.484 -0.294 1
1 1252 . 20 1 1 A 98 98 LYS C C 158 176.800 176.438 0.362 1
1 1253 . 20 1 1 A 98 98 LYS CA C 158 57.100 55.890 1.210 1
1 1254 . 20 1 1 A 98 98 LYS CB C 158 32.800 32.360 0.440 1
1 1258 . 20 1 1 A 98 98 LYS N N 158 120.800 121.383 -0.583 1
1 1259 . 20 1 1 A 99 99 ILE H H 159 7.930 7.412 0.518 1
1 1260 . 20 1 1 A 99 99 ILE HA H 159 4.200 4.351 -0.151 1
1 1270 . 20 1 1 A 99 99 ILE C C 159 175.400 174.484 0.916 1
1 1271 . 20 1 1 A 99 99 ILE CA C 159 60.600 60.977 -0.377 1
1 1272 . 20 1 1 A 99 99 ILE CB C 159 39.100 35.735 3.365 1
1 1276 . 20 1 1 A 99 99 ILE N N 159 120.200 121.246 -1.046 1
1 1277 . 20 1 1 A 100 100 ALA H H 160 8.370 7.775 0.595 1
1 1278 . 20 1 1 A 100 100 ALA HA H 160 4.370 4.781 -0.411 1
1 1282 . 20 1 1 A 100 100 ALA C C 160 177.200 177.427 -0.227 1
1 1283 . 20 1 1 A 100 100 ALA CA C 160 52.200 50.525 1.675 1
1 1284 . 20 1 1 A 100 100 ALA CB C 160 19.400 20.204 -0.804 1
1 1285 . 20 1 1 A 100 100 ALA N N 160 128.300 126.617 1.683 1
1 1286 . 20 1 1 A 101 101 LEU H H 161 8.250 8.273 -0.023 1
1 1287 . 20 1 1 A 101 101 LEU HA H 161 4.280 4.506 -0.226 1
1 1297 . 20 1 1 A 101 101 LEU C C 161 177.200 176.779 0.421 1
1 1298 . 20 1 1 A 101 101 LEU CA C 161 55.200 54.206 0.994 1
1 1299 . 20 1 1 A 101 101 LEU CB C 161 42.400 41.391 1.009 1
1 1303 . 20 1 1 A 101 101 LEU N N 161 121.900 125.345 -3.445 1
1 1304 . 20 1 1 A 102 102 GLU H H 162 8.390 7.770 0.620 1
1 1305 . 20 1 1 A 102 102 GLU HA H 162 4.230 4.297 -0.067 1
1 1310 . 20 1 1 A 102 102 GLU C C 162 176.100 176.455 -0.355 1
1 1311 . 20 1 1 A 102 102 GLU CA C 162 56.400 56.541 -0.141 1
1 1312 . 20 1 1 A 102 102 GLU CB C 162 30.500 29.883 0.617 1
1 1314 . 20 1 1 A 102 102 GLU N N 162 121.300 119.381 1.919 1
1 1315 . 20 1 1 A 103 103 HIS H H 163 8.330 8.784 -0.454 1
1 1316 . 20 1 1 A 103 103 HIS HA H 163 4.590 4.745 -0.155 1
1 1319 . 20 1 1 A 103 103 HIS C C 163 176.100 175.958 0.142 1
1 1320 . 20 1 1 A 103 103 HIS CA C 163 56.000 54.557 1.443 1
1 1321 . 20 1 1 A 103 103 HIS CB C 163 30.500 27.418 3.082 1
1 1322 . 20 1 1 A 103 103 HIS N N 163 120.000 123.579 -3.579 1
1 1323 . 20 1 1 A 107 107 HIS HA H 167 4.620 5.079 -0.459 1
1 1326 . 20 1 1 A 107 107 HIS C C 167 173.900 171.752 2.148 1
1 1327 . 20 1 1 A 107 107 HIS CA C 167 56.000 54.163 1.837 1
1 1328 . 20 1 1 A 107 107 HIS CB C 167 30.300 32.330 -2.030 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 98 1.100 1
2 1 1 1 "RMS(OBS, PRED)" CA 103 1.148 1
3 1 1 1 "RMS(OBS, PRED)" CB 100 0.942 1
4 1 1 1 "RMS(OBS, PRED)" H 98 0.484 1
5 1 1 1 "RMS(OBS, PRED)" HA 105 0.230 1
6 1 1 1 "RMS(OBS, PRED)" N 98 2.796 1
7 1 2 1 "RMS(OBS, PRED)" C 98 1.064 1
8 1 2 1 "RMS(OBS, PRED)" CA 103 1.066 1
9 1 2 1 "RMS(OBS, PRED)" CB 100 1.081 1
10 1 2 1 "RMS(OBS, PRED)" H 98 0.490 1
11 1 2 1 "RMS(OBS, PRED)" HA 105 0.257 1
12 1 2 1 "RMS(OBS, PRED)" N 98 2.971 1
13 1 3 1 "RMS(OBS, PRED)" C 98 1.134 1
14 1 3 1 "RMS(OBS, PRED)" CA 103 1.145 1
15 1 3 1 "RMS(OBS, PRED)" CB 100 1.008 1
16 1 3 1 "RMS(OBS, PRED)" H 98 0.542 1
17 1 3 1 "RMS(OBS, PRED)" HA 105 0.214 1
18 1 3 1 "RMS(OBS, PRED)" N 98 3.022 1
19 1 4 1 "RMS(OBS, PRED)" C 98 1.081 1
20 1 4 1 "RMS(OBS, PRED)" CA 103 1.101 1
21 1 4 1 "RMS(OBS, PRED)" CB 100 1.067 1
22 1 4 1 "RMS(OBS, PRED)" H 98 0.487 1
23 1 4 1 "RMS(OBS, PRED)" HA 105 0.231 1
24 1 4 1 "RMS(OBS, PRED)" N 98 3.115 1
25 1 5 1 "RMS(OBS, PRED)" C 98 1.102 1
26 1 5 1 "RMS(OBS, PRED)" CA 103 1.131 1
27 1 5 1 "RMS(OBS, PRED)" CB 100 0.990 1
28 1 5 1 "RMS(OBS, PRED)" H 98 0.445 1
29 1 5 1 "RMS(OBS, PRED)" HA 105 0.219 1
30 1 5 1 "RMS(OBS, PRED)" N 98 2.885 1
31 1 6 1 "RMS(OBS, PRED)" C 98 1.050 1
32 1 6 1 "RMS(OBS, PRED)" CA 103 1.086 1
33 1 6 1 "RMS(OBS, PRED)" CB 100 1.006 1
34 1 6 1 "RMS(OBS, PRED)" H 98 0.479 1
35 1 6 1 "RMS(OBS, PRED)" HA 105 0.229 1
36 1 6 1 "RMS(OBS, PRED)" N 98 2.797 1
37 1 7 1 "RMS(OBS, PRED)" C 98 1.119 1
38 1 7 1 "RMS(OBS, PRED)" CA 103 1.031 1
39 1 7 1 "RMS(OBS, PRED)" CB 100 0.976 1
40 1 7 1 "RMS(OBS, PRED)" H 98 0.477 1
41 1 7 1 "RMS(OBS, PRED)" HA 105 0.208 1
42 1 7 1 "RMS(OBS, PRED)" N 98 2.805 1
43 1 8 1 "RMS(OBS, PRED)" C 98 1.159 1
44 1 8 1 "RMS(OBS, PRED)" CA 103 1.218 1
45 1 8 1 "RMS(OBS, PRED)" CB 100 1.038 1
46 1 8 1 "RMS(OBS, PRED)" H 98 0.497 1
47 1 8 1 "RMS(OBS, PRED)" HA 105 0.232 1
48 1 8 1 "RMS(OBS, PRED)" N 98 2.929 1
49 1 9 1 "RMS(OBS, PRED)" C 98 1.063 1
50 1 9 1 "RMS(OBS, PRED)" CA 103 1.217 1
51 1 9 1 "RMS(OBS, PRED)" CB 100 1.002 1
52 1 9 1 "RMS(OBS, PRED)" H 98 0.501 1
53 1 9 1 "RMS(OBS, PRED)" HA 105 0.218 1
54 1 9 1 "RMS(OBS, PRED)" N 98 3.069 1
55 1 10 1 "RMS(OBS, PRED)" C 98 1.064 1
56 1 10 1 "RMS(OBS, PRED)" CA 103 1.109 1
57 1 10 1 "RMS(OBS, PRED)" CB 100 1.001 1
58 1 10 1 "RMS(OBS, PRED)" H 98 0.474 1
59 1 10 1 "RMS(OBS, PRED)" HA 105 0.265 1
60 1 10 1 "RMS(OBS, PRED)" N 98 2.927 1
61 1 11 1 "RMS(OBS, PRED)" C 98 1.117 1
62 1 11 1 "RMS(OBS, PRED)" CA 103 1.151 1
63 1 11 1 "RMS(OBS, PRED)" CB 100 1.019 1
64 1 11 1 "RMS(OBS, PRED)" H 98 0.442 1
65 1 11 1 "RMS(OBS, PRED)" HA 105 0.274 1
66 1 11 1 "RMS(OBS, PRED)" N 98 3.039 1
67 1 12 1 "RMS(OBS, PRED)" C 98 1.098 1
68 1 12 1 "RMS(OBS, PRED)" CA 103 1.111 1
69 1 12 1 "RMS(OBS, PRED)" CB 100 0.877 1
70 1 12 1 "RMS(OBS, PRED)" H 98 0.471 1
71 1 12 1 "RMS(OBS, PRED)" HA 105 0.246 1
72 1 12 1 "RMS(OBS, PRED)" N 98 2.914 1
73 1 13 1 "RMS(OBS, PRED)" C 98 1.043 1
74 1 13 1 "RMS(OBS, PRED)" CA 103 1.082 1
75 1 13 1 "RMS(OBS, PRED)" CB 100 1.006 1
76 1 13 1 "RMS(OBS, PRED)" H 98 0.456 1
77 1 13 1 "RMS(OBS, PRED)" HA 105 0.226 1
78 1 13 1 "RMS(OBS, PRED)" N 98 2.848 1
79 1 14 1 "RMS(OBS, PRED)" C 98 1.161 1
80 1 14 1 "RMS(OBS, PRED)" CA 103 1.073 1
81 1 14 1 "RMS(OBS, PRED)" CB 100 1.002 1
82 1 14 1 "RMS(OBS, PRED)" H 98 0.495 1
83 1 14 1 "RMS(OBS, PRED)" HA 105 0.245 1
84 1 14 1 "RMS(OBS, PRED)" N 98 2.910 1
85 1 15 1 "RMS(OBS, PRED)" C 98 1.091 1
86 1 15 1 "RMS(OBS, PRED)" CA 103 1.173 1
87 1 15 1 "RMS(OBS, PRED)" CB 100 1.051 1
88 1 15 1 "RMS(OBS, PRED)" H 98 0.495 1
89 1 15 1 "RMS(OBS, PRED)" HA 105 0.234 1
90 1 15 1 "RMS(OBS, PRED)" N 98 3.123 1
91 1 16 1 "RMS(OBS, PRED)" C 98 1.098 1
92 1 16 1 "RMS(OBS, PRED)" CA 103 1.200 1
93 1 16 1 "RMS(OBS, PRED)" CB 100 0.877 1
94 1 16 1 "RMS(OBS, PRED)" H 98 0.513 1
95 1 16 1 "RMS(OBS, PRED)" HA 105 0.248 1
96 1 16 1 "RMS(OBS, PRED)" N 98 2.981 1
97 1 17 1 "RMS(OBS, PRED)" C 98 1.107 1
98 1 17 1 "RMS(OBS, PRED)" CA 103 1.154 1
99 1 17 1 "RMS(OBS, PRED)" CB 100 0.957 1
100 1 17 1 "RMS(OBS, PRED)" H 98 0.474 1
101 1 17 1 "RMS(OBS, PRED)" HA 105 0.211 1
102 1 17 1 "RMS(OBS, PRED)" N 98 2.975 1
103 1 18 1 "RMS(OBS, PRED)" C 98 1.091 1
104 1 18 1 "RMS(OBS, PRED)" CA 103 1.152 1
105 1 18 1 "RMS(OBS, PRED)" CB 100 0.992 1
106 1 18 1 "RMS(OBS, PRED)" H 98 0.498 1
107 1 18 1 "RMS(OBS, PRED)" HA 105 0.260 1
108 1 18 1 "RMS(OBS, PRED)" N 98 3.067 1
109 1 19 1 "RMS(OBS, PRED)" C 98 1.027 1
110 1 19 1 "RMS(OBS, PRED)" CA 103 1.176 1
111 1 19 1 "RMS(OBS, PRED)" CB 100 0.960 1
112 1 19 1 "RMS(OBS, PRED)" H 98 0.505 1
113 1 19 1 "RMS(OBS, PRED)" HA 105 0.237 1
114 1 19 1 "RMS(OBS, PRED)" N 98 2.868 1
115 1 20 1 "RMS(OBS, PRED)" C 98 1.166 1
116 1 20 1 "RMS(OBS, PRED)" CA 103 1.127 1
117 1 20 1 "RMS(OBS, PRED)" CB 100 0.999 1
118 1 20 1 "RMS(OBS, PRED)" H 98 0.465 1
119 1 20 1 "RMS(OBS, PRED)" HA 105 0.254 1
120 1 20 1 "RMS(OBS, PRED)" N 98 2.903 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 15 . 1 1 A 2 2 ASP H H 62 8.760 8.500 0.260 2
1 16 . 1 1 A 2 2 ASP HA H 62 4.810 4.863 -0.053 2
1 19 . 1 1 A 2 2 ASP C C 62 175.800 175.440 0.360 2
1 20 . 1 1 A 2 2 ASP CA C 62 54.800 53.908 0.892 2
1 21 . 1 1 A 2 2 ASP CB C 62 41.600 41.965 -0.365 2
1 22 . 1 1 A 2 2 ASP N N 62 120.900 120.237 0.663 2
1 23 . 1 1 A 3 3 SER H H 63 8.710 8.558 0.152 2
1 24 . 1 1 A 3 3 SER HA H 63 4.970 4.895 0.075 2
1 27 . 1 1 A 3 3 SER C C 63 175.600 175.265 0.335 2
1 28 . 1 1 A 3 3 SER CA C 63 57.500 57.055 0.445 2
1 29 . 1 1 A 3 3 SER CB C 63 65.900 65.317 0.583 2
1 30 . 1 1 A 3 3 SER N N 63 116.300 116.137 0.163 2
1 31 . 1 1 A 4 4 PHE H H 64 9.370 9.377 -0.007 2
1 32 . 1 1 A 4 4 PHE HA H 64 4.010 4.153 -0.143 2
1 39 . 1 1 A 4 4 PHE C C 64 176.700 177.441 -0.741 2
1 40 . 1 1 A 4 4 PHE CA C 64 62.200 61.616 0.584 2
1 41 . 1 1 A 4 4 PHE CB C 64 38.500 39.359 -0.859 2
1 46 . 1 1 A 4 4 PHE N N 64 121.400 124.246 -2.846 2
1 47 . 1 1 A 5 5 GLY H H 65 8.930 8.095 0.835 2
1 48 . 1 1 A 5 5 GLY HA2 H 65 2.020 2.618 -0.598 2
1 49 . 1 1 A 5 5 GLY HA3 H 65 3.250 2.987 0.263 2
1 50 . 1 1 A 5 5 GLY C C 65 175.200 175.204 -0.004 2
1 51 . 1 1 A 5 5 GLY CA C 65 46.300 46.504 -0.204 2
1 52 . 1 1 A 5 5 GLY N N 65 106.500 105.104 1.396 2
1 53 . 1 1 A 6 6 ASP H H 66 7.630 7.798 -0.168 2
1 54 . 1 1 A 6 6 ASP HA H 66 4.100 4.195 -0.095 2
1 57 . 1 1 A 6 6 ASP C C 66 179.500 178.618 0.882 2
1 58 . 1 1 A 6 6 ASP CA C 66 57.400 56.762 0.638 2
1 59 . 1 1 A 6 6 ASP CB C 66 40.500 40.806 -0.306 2
1 60 . 1 1 A 6 6 ASP N N 66 120.500 121.116 -0.616 2
1 61 . 1 1 A 7 7 TRP H H 67 7.190 7.732 -0.542 2
1 62 . 1 1 A 7 7 TRP HA H 67 3.860 4.273 -0.413 2
1 71 . 1 1 A 7 7 TRP C C 67 177.200 178.359 -1.159 2
1 72 . 1 1 A 7 7 TRP CA C 67 61.100 59.796 1.304 2
1 73 . 1 1 A 7 7 TRP CB C 67 28.300 28.983 -0.682 2
1 79 . 1 1 A 7 7 TRP N N 67 120.700 120.156 0.543 2
1 81 . 1 1 A 8 8 ALA H H 68 9.040 8.370 0.670 2
1 82 . 1 1 A 8 8 ALA HA H 68 3.730 3.825 -0.095 2
1 86 . 1 1 A 8 8 ALA C C 68 179.500 179.510 -0.010 2
1 87 . 1 1 A 8 8 ALA CA C 68 55.200 55.185 0.015 2
1 88 . 1 1 A 8 8 ALA CB C 68 18.600 17.943 0.657 2
1 89 . 1 1 A 8 8 ALA N N 68 125.700 122.413 3.287 2
1 90 . 1 1 A 9 9 GLU H H 69 8.060 7.993 0.067 2
1 91 . 1 1 A 9 9 GLU HA H 69 4.020 4.070 -0.050 2
1 96 . 1 1 A 9 9 GLU C C 69 180.400 178.926 1.474 2
1 97 . 1 1 A 9 9 GLU CA C 69 58.800 59.475 -0.675 2
1 98 . 1 1 A 9 9 GLU CB C 69 28.500 29.253 -0.753 2
1 99 . 1 1 A 9 9 GLU N N 69 115.400 118.367 -2.967 2
1 100 . 1 1 A 10 10 LYS H H 70 7.740 7.810 -0.070 2
1 101 . 1 1 A 10 10 LYS HA H 70 3.910 4.022 -0.112 2
1 110 . 1 1 A 10 10 LYS C C 70 179.500 178.866 0.634 2
1 111 . 1 1 A 10 10 LYS CA C 70 60.000 58.871 1.129 2
1 112 . 1 1 A 10 10 LYS CB C 70 32.400 32.086 0.314 2
1 116 . 1 1 A 10 10 LYS N N 70 122.700 119.519 3.181 2
1 117 . 1 1 A 11 11 PHE H H 71 8.750 8.324 0.426 2
1 118 . 1 1 A 11 11 PHE HA H 71 4.080 4.224 -0.144 2
1 126 . 1 1 A 11 11 PHE C C 71 177.100 177.157 -0.057 2
1 127 . 1 1 A 11 11 PHE CA C 71 61.200 61.296 -0.096 2
1 128 . 1 1 A 11 11 PHE CB C 71 38.900 39.172 -0.272 2
1 134 . 1 1 A 11 11 PHE N N 71 123.500 121.029 2.471 2
1 135 . 1 1 A 12 12 LEU H H 72 8.400 8.734 -0.334 2
1 136 . 1 1 A 12 12 LEU HA H 72 3.520 3.702 -0.182 2
1 146 . 1 1 A 12 12 LEU C C 72 180.000 179.208 0.792 2
1 147 . 1 1 A 12 12 LEU CA C 72 58.200 57.948 0.252 2
1 148 . 1 1 A 12 12 LEU CB C 72 41.700 41.451 0.249 2
1 152 . 1 1 A 12 12 LEU N N 72 121.100 119.256 1.844 2
1 153 . 1 1 A 13 13 LYS H H 73 7.810 8.158 -0.347 2
1 154 . 1 1 A 13 13 LYS HA H 73 4.080 3.993 0.087 2
1 156 . 1 1 A 13 13 LYS C C 73 179.300 178.879 0.421 2
1 157 . 1 1 A 13 13 LYS CA C 73 59.000 58.964 0.036 2
1 158 . 1 1 A 13 13 LYS CB C 73 31.900 31.986 -0.086 2
1 159 . 1 1 A 13 13 LYS N N 73 119.400 120.135 -0.735 2
1 160 . 1 1 A 14 14 SER H H 74 8.210 8.131 0.079 2
1 161 . 1 1 A 14 14 SER HA H 74 4.210 4.115 0.095 2
1 164 . 1 1 A 14 14 SER C C 74 176.300 177.028 -0.728 2
1 165 . 1 1 A 14 14 SER CA C 74 61.400 61.338 0.062 2
1 166 . 1 1 A 14 14 SER CB C 74 62.600 62.511 0.089 2
1 167 . 1 1 A 14 14 SER N N 74 117.600 115.426 2.174 2
1 168 . 1 1 A 15 15 LYS H H 75 7.760 7.500 0.260 2
1 169 . 1 1 A 15 15 LYS HA H 75 4.040 3.912 0.128 2
1 178 . 1 1 A 15 15 LYS C C 75 178.500 178.765 -0.265 2
1 179 . 1 1 A 15 15 LYS CA C 75 56.500 59.219 -2.719 2
1 180 . 1 1 A 15 15 LYS CB C 75 30.600 31.780 -1.180 2
1 184 . 1 1 A 15 15 LYS N N 75 120.100 121.921 -1.821 2
1 185 . 1 1 A 16 16 GLU H H 76 7.680 8.341 -0.661 2
1 186 . 1 1 A 16 16 GLU HA H 76 4.030 4.019 0.011 2
1 191 . 1 1 A 16 16 GLU C C 76 179.900 178.551 1.349 2
1 192 . 1 1 A 16 16 GLU CA C 76 59.200 59.512 -0.312 2
1 193 . 1 1 A 16 16 GLU CB C 76 29.600 29.245 0.355 2
1 195 . 1 1 A 16 16 GLU N N 76 119.700 119.366 0.334 2
1 196 . 1 1 A 17 17 ALA H H 77 8.030 7.950 0.080 2
1 197 . 1 1 A 17 17 ALA HA H 77 4.200 4.104 0.096 2
1 201 . 1 1 A 17 17 ALA C C 77 178.900 179.435 -0.535 2
1 202 . 1 1 A 17 17 ALA CA C 77 54.400 54.119 0.281 2
1 203 . 1 1 A 17 17 ALA CB C 77 18.100 18.472 -0.372 2
1 204 . 1 1 A 17 17 ALA N N 77 123.000 121.004 1.995 2
1 205 . 1 1 A 18 18 ASP H H 78 7.860 7.852 0.008 2
1 206 . 1 1 A 18 18 ASP HA H 78 4.600 4.504 0.096 2
1 209 . 1 1 A 18 18 ASP C C 78 177.500 176.273 1.228 2
1 210 . 1 1 A 18 18 ASP CA C 78 55.100 54.942 0.158 2
1 211 . 1 1 A 18 18 ASP CB C 78 41.400 41.170 0.230 2
1 212 . 1 1 A 18 18 ASP N N 78 117.700 117.118 0.582 2
1 213 . 1 1 A 19 19 GLY H H 79 7.910 7.696 0.214 2
1 214 . 1 1 A 19 19 GLY HA2 H 79 3.860 4.027 -0.167 2
1 215 . 1 1 A 19 19 GLY HA3 H 79 4.080 4.029 0.051 2
1 216 . 1 1 A 19 19 GLY C C 79 175.300 174.437 0.863 2
1 217 . 1 1 A 19 19 GLY CA C 79 46.200 45.552 0.648 2
1 218 . 1 1 A 19 19 GLY N N 79 107.100 106.901 0.199 2
1 219 . 1 1 A 20 20 VAL H H 80 7.150 7.593 -0.443 2
1 220 . 1 1 A 20 20 VAL HA H 80 4.250 4.590 -0.340 2
1 228 . 1 1 A 20 20 VAL C C 80 175.100 175.316 -0.216 2
1 229 . 1 1 A 20 20 VAL CA C 80 61.800 60.379 1.421 2
1 230 . 1 1 A 20 20 VAL CB C 80 32.200 33.824 -1.624 2
1 233 . 1 1 A 20 20 VAL N N 80 114.600 116.955 -2.355 2
1 234 . 1 1 A 21 21 SER H H 81 8.560 8.663 -0.103 2
1 235 . 1 1 A 21 21 SER HA H 81 4.390 4.583 -0.193 2
1 238 . 1 1 A 21 21 SER C C 81 174.600 175.544 -0.944 2
1 239 . 1 1 A 21 21 SER CA C 81 57.900 58.399 -0.499 2
1 240 . 1 1 A 21 21 SER CB C 81 64.700 64.214 0.486 2
1 241 . 1 1 A 21 21 SER N N 81 118.700 118.895 -0.195 2
1 242 . 1 1 A 22 22 VAL H H 82 8.690 8.677 0.013 2
1 243 . 1 1 A 22 22 VAL HA H 82 3.700 3.764 -0.064 2
1 251 . 1 1 A 22 22 VAL C C 82 178.000 177.556 0.444 2
1 252 . 1 1 A 22 22 VAL CA C 82 66.500 65.954 0.546 2
1 253 . 1 1 A 22 22 VAL CB C 82 31.700 31.668 0.032 2
1 256 . 1 1 A 22 22 VAL N N 82 122.100 125.151 -3.052 2
1 257 . 1 1 A 23 23 SER H H 83 8.300 8.054 0.246 2
1 258 . 1 1 A 23 23 SER HA H 83 4.210 4.092 0.118 2
1 261 . 1 1 A 23 23 SER C C 83 177.600 176.465 1.135 2
1 262 . 1 1 A 23 23 SER CA C 83 61.400 61.741 -0.341 2
1 263 . 1 1 A 23 23 SER CB C 83 62.400 62.820 -0.420 2
1 264 . 1 1 A 23 23 SER N N 83 113.600 116.447 -2.847 2
1 265 . 1 1 A 24 24 GLN H H 84 7.820 7.859 -0.039 2
1 266 . 1 1 A 24 24 GLN HA H 84 3.970 3.968 0.002 2
1 273 . 1 1 A 24 24 GLN C C 84 178.400 177.999 0.401 2
1 274 . 1 1 A 24 24 GLN CA C 84 58.400 58.722 -0.322 2
1 275 . 1 1 A 24 24 GLN CB C 84 28.900 28.290 0.610 2
1 278 . 1 1 A 24 24 GLN N N 84 122.900 121.062 1.838 2
1 280 . 1 1 A 25 25 LEU H H 85 8.920 8.233 0.687 2
1 281 . 1 1 A 25 25 LEU HA H 85 4.130 4.301 -0.171 2
1 291 . 1 1 A 25 25 LEU C C 85 178.800 178.691 0.109 2
1 292 . 1 1 A 25 25 LEU CA C 85 58.300 57.780 0.520 2
1 293 . 1 1 A 25 25 LEU CB C 85 41.200 41.664 -0.464 2
1 297 . 1 1 A 25 25 LEU N N 85 122.200 121.204 0.996 2
1 298 . 1 1 A 26 26 ASN H H 86 8.860 8.723 0.137 2
1 299 . 1 1 A 26 26 ASN HA H 86 4.420 4.431 -0.011 2
1 304 . 1 1 A 26 26 ASN C C 86 179.000 177.907 1.093 2
1 305 . 1 1 A 26 26 ASN CA C 86 55.900 56.296 -0.396 2
1 306 . 1 1 A 26 26 ASN CB C 86 37.200 38.297 -1.097 2
1 308 . 1 1 A 26 26 ASN N N 86 117.600 117.697 -0.096 2
1 310 . 1 1 A 27 27 SER H H 87 7.840 7.951 -0.111 2
1 311 . 1 1 A 27 27 SER HA H 87 4.100 4.021 0.079 2
1 314 . 1 1 A 27 27 SER C C 87 179.000 176.604 2.396 2
1 315 . 1 1 A 27 27 SER CA C 87 62.100 61.423 0.677 2
1 316 . 1 1 A 27 27 SER CB C 87 62.100 62.632 -0.532 2
1 317 . 1 1 A 27 27 SER N N 87 118.500 115.392 3.108 2
1 318 . 1 1 A 28 28 TYR H H 88 8.180 7.718 0.462 2
1 319 . 1 1 A 28 28 TYR HA H 88 4.600 4.460 0.140 2
1 326 . 1 1 A 28 28 TYR C C 88 174.800 178.446 -3.646 2
1 327 . 1 1 A 28 28 TYR CA C 88 61.200 62.020 -0.820 2
1 328 . 1 1 A 28 28 TYR CB C 88 37.800 38.122 -0.322 2
1 333 . 1 1 A 28 28 TYR N N 88 119.300 119.665 -0.365 2
1 334 . 1 1 A 29 29 LYS H H 89 9.040 8.278 0.762 2
1 335 . 1 1 A 29 29 LYS HA H 89 3.890 4.129 -0.239 2
1 344 . 1 1 A 29 29 LYS C C 89 179.000 179.134 -0.134 2
1 345 . 1 1 A 29 29 LYS CA C 89 61.300 59.522 1.778 2
1 346 . 1 1 A 29 29 LYS CB C 89 32.800 32.041 0.759 2
1 350 . 1 1 A 29 29 LYS N N 89 119.300 120.067 -0.767 2
1 351 . 1 1 A 30 30 ASN H H 90 7.770 8.171 -0.401 2
1 352 . 1 1 A 30 30 ASN HA H 90 4.560 4.423 0.137 2
1 357 . 1 1 A 30 30 ASN C C 90 178.300 177.728 0.572 2
1 358 . 1 1 A 30 30 ASN CA C 90 56.200 56.370 -0.170 2
1 359 . 1 1 A 30 30 ASN CB C 90 38.900 38.595 0.305 2
1 361 . 1 1 A 30 30 ASN N N 90 117.800 117.798 0.002 2
1 363 . 1 1 A 31 31 TYR H H 91 8.860 7.878 0.982 2
1 364 . 1 1 A 31 31 TYR HA H 91 4.910 4.545 0.365 2
1 371 . 1 1 A 31 31 TYR C C 91 178.300 178.783 -0.483 2
1 372 . 1 1 A 31 31 TYR CA C 91 59.700 60.764 -1.064 2
1 373 . 1 1 A 31 31 TYR CB C 91 37.500 37.932 -0.432 2
1 378 . 1 1 A 31 31 TYR N N 91 119.400 118.509 0.891 2
1 379 . 1 1 A 32 32 CYS H H 92 8.640 8.417 0.223 2
1 380 . 1 1 A 32 32 CYS HA H 92 4.410 4.370 0.040 2
1 383 . 1 1 A 32 32 CYS C C 92 173.700 177.063 -3.363 2
1 384 . 1 1 A 32 32 CYS CA C 92 65.500 62.984 2.516 2
1 385 . 1 1 A 32 32 CYS CB C 92 28.300 27.364 0.936 2
1 386 . 1 1 A 32 32 CYS N N 92 113.500 119.095 -5.595 2
1 387 . 1 1 A 33 33 ARG H H 93 8.440 8.221 0.219 2
1 388 . 1 1 A 33 33 ARG HA H 93 3.740 3.908 -0.168 2
1 391 . 1 1 A 33 33 ARG C C 93 177.200 177.980 -0.780 2
1 392 . 1 1 A 33 33 ARG CA C 93 58.300 58.567 -0.267 2
1 393 . 1 1 A 33 33 ARG CB C 93 30.200 30.032 0.168 2
1 394 . 1 1 A 33 33 ARG N N 93 111.400 120.619 -9.219 2
1 395 . 1 1 A 34 34 ASN H H 94 8.020 8.024 -0.005 2
1 396 . 1 1 A 34 34 ASN HA H 94 4.980 4.665 0.315 2
1 401 . 1 1 A 34 34 ASN C C 94 176.700 177.138 -0.438 2
1 402 . 1 1 A 34 34 ASN CA C 94 53.400 55.181 -1.781 2
1 403 . 1 1 A 34 34 ASN CB C 94 38.000 39.275 -1.275 2
1 405 . 1 1 A 34 34 ASN N N 94 113.600 116.884 -3.284 2
1 407 . 1 1 A 35 35 HIS H H 95 7.200 7.783 -0.583 2
1 408 . 1 1 A 35 35 HIS HA H 95 4.470 4.466 0.004 2
1 411 . 1 1 A 35 35 HIS C C 95 176.600 176.266 0.334 2
1 412 . 1 1 A 35 35 HIS CA C 95 60.000 59.238 0.762 2
1 413 . 1 1 A 35 35 HIS CB C 95 30.500 31.000 -0.500 2
1 414 . 1 1 A 35 35 HIS N N 95 115.600 117.423 -1.823 2
1 415 . 1 1 A 36 36 LEU H H 96 8.170 8.031 0.139 2
1 416 . 1 1 A 36 36 LEU HA H 96 4.730 4.533 0.197 2
1 426 . 1 1 A 36 36 LEU C C 96 176.800 177.420 -0.620 2
1 427 . 1 1 A 36 36 LEU CA C 96 54.400 54.631 -0.231 2
1 428 . 1 1 A 36 36 LEU CB C 96 40.600 41.882 -1.282 2
1 432 . 1 1 A 36 36 LEU N N 96 114.000 119.097 -5.097 2
1 433 . 1 1 A 37 37 SER H H 97 7.140 8.217 -1.077 2
1 434 . 1 1 A 37 37 SER HA H 97 4.730 4.308 0.422 2
1 437 . 1 1 A 37 37 SER CA C 97 62.700 62.930 -0.230 2
1 438 . 1 1 A 37 37 SER CB C 97 62.600 61.680 0.920 2
1 439 . 1 1 A 37 37 SER N N 97 117.200 116.237 0.963 2
1 440 . 1 1 A 38 38 PRO HA H 98 4.560 4.398 0.162 2
1 447 . 1 1 A 38 38 PRO C C 98 177.900 178.749 -0.849 2
1 448 . 1 1 A 38 38 PRO CA C 98 65.700 65.730 -0.030 2
1 449 . 1 1 A 38 38 PRO CB C 98 31.800 30.925 0.875 2
1 452 . 1 1 A 39 39 LEU H H 99 8.090 7.578 0.512 2
1 453 . 1 1 A 39 39 LEU HA H 99 4.260 4.055 0.205 2
1 463 . 1 1 A 39 39 LEU C C 99 178.700 178.516 0.184 2
1 464 . 1 1 A 39 39 LEU CA C 99 54.300 57.272 -2.972 2
1 465 . 1 1 A 39 39 LEU CB C 99 42.400 41.542 0.858 2
1 469 . 1 1 A 39 39 LEU N N 99 112.400 117.310 -4.910 2
1 470 . 1 1 A 40 40 TYR H H 100 8.350 8.650 -0.300 2
1 471 . 1 1 A 40 40 TYR HA H 100 4.170 4.425 -0.255 2
1 478 . 1 1 A 40 40 TYR C C 100 178.300 177.351 0.949 2
1 479 . 1 1 A 40 40 TYR CA C 100 63.400 61.915 1.485 2
1 480 . 1 1 A 40 40 TYR CB C 100 38.600 39.102 -0.502 2
1 485 . 1 1 A 40 40 TYR N N 100 119.400 120.794 -1.394 2
1 486 . 1 1 A 41 41 MET H H 101 8.640 7.998 0.642 2
1 487 . 1 1 A 41 41 MET HA H 101 4.260 4.645 -0.385 2
1 488 . 1 1 A 41 41 MET C C 101 177.000 175.916 1.084 2
1 489 . 1 1 A 41 41 MET CA C 101 54.600 55.111 -0.511 2
1 490 . 1 1 A 41 41 MET N N 101 111.800 116.222 -4.422 2
1 491 . 1 1 A 42 42 LYS H H 102 7.880 7.843 0.037 2
1 492 . 1 1 A 42 42 LYS HA H 102 4.430 4.739 -0.309 2
1 501 . 1 1 A 42 42 LYS C C 102 176.300 176.000 0.300 2
1 502 . 1 1 A 42 42 LYS CA C 102 56.000 54.673 1.327 2
1 503 . 1 1 A 42 42 LYS CB C 102 33.400 33.955 -0.555 2
1 507 . 1 1 A 42 42 LYS N N 102 121.700 119.923 1.777 2
1 508 . 1 1 A 43 43 SER H H 103 9.160 8.955 0.205 2
1 509 . 1 1 A 43 43 SER HA H 103 4.620 4.720 -0.100 2
1 513 . 1 1 A 43 43 SER C C 103 176.300 175.574 0.726 2
1 514 . 1 1 A 43 43 SER CA C 103 58.700 58.041 0.659 2
1 515 . 1 1 A 43 43 SER CB C 103 63.700 64.298 -0.598 2
1 516 . 1 1 A 43 43 SER N N 103 118.800 117.393 1.407 2
1 517 . 1 1 A 44 44 LEU H H 104 8.860 8.975 -0.115 2
1 518 . 1 1 A 44 44 LEU HA H 104 4.130 4.241 -0.111 2
1 528 . 1 1 A 44 44 LEU C C 104 178.700 178.341 0.359 2
1 529 . 1 1 A 44 44 LEU CA C 104 58.800 58.154 0.647 2
1 530 . 1 1 A 44 44 LEU CB C 104 42.600 41.593 1.007 2
1 534 . 1 1 A 44 44 LEU N N 104 124.200 128.064 -3.864 2
1 535 . 1 1 A 45 45 SER H H 105 8.330 8.141 0.189 2
1 536 . 1 1 A 45 45 SER HA H 105 4.310 4.415 -0.105 2
1 539 . 1 1 A 45 45 SER C C 105 175.000 175.306 -0.306 2
1 540 . 1 1 A 45 45 SER CA C 105 60.100 60.059 0.041 2
1 541 . 1 1 A 45 45 SER CB C 105 63.400 63.366 0.034 2
1 542 . 1 1 A 45 45 SER N N 105 107.700 114.291 -6.591 2
1 543 . 1 1 A 46 46 GLU H H 106 7.800 8.070 -0.270 2
1 544 . 1 1 A 46 46 GLU HA H 106 4.570 4.385 0.185 2
1 549 . 1 1 A 46 46 GLU C C 106 174.100 176.257 -2.157 2
1 550 . 1 1 A 46 46 GLU CA C 106 55.600 56.517 -0.917 2
1 551 . 1 1 A 46 46 GLU CB C 106 31.200 30.067 1.133 2
1 553 . 1 1 A 46 46 GLU N N 106 119.600 118.175 1.425 2
1 554 . 1 1 A 47 47 ILE H H 107 7.100 7.331 -0.231 2
1 555 . 1 1 A 47 47 ILE HA H 107 4.040 4.138 -0.098 2
1 565 . 1 1 A 47 47 ILE C C 107 174.100 175.150 -1.050 2
1 566 . 1 1 A 47 47 ILE CA C 107 62.300 61.147 1.153 2
1 567 . 1 1 A 47 47 ILE CB C 107 38.500 38.196 0.304 2
1 571 . 1 1 A 47 47 ILE N N 107 120.600 122.082 -1.482 2
1 572 . 1 1 A 48 48 LEU H H 108 9.180 8.774 0.406 2
1 573 . 1 1 A 48 48 LEU HA H 108 4.940 4.711 0.229 2
1 583 . 1 1 A 48 48 LEU CA C 108 51.900 52.171 -0.271 2
1 584 . 1 1 A 48 48 LEU CB C 108 42.000 42.256 -0.256 2
1 588 . 1 1 A 48 48 LEU N N 108 129.400 128.300 1.100 2
1 589 . 1 1 A 49 49 PRO HA H 109 3.910 4.263 -0.353 2
1 596 . 1 1 A 49 49 PRO C C 109 178.500 177.960 0.540 2
1 597 . 1 1 A 49 49 PRO CA C 109 66.600 65.051 1.549 2
1 598 . 1 1 A 49 49 PRO CB C 109 31.300 31.744 -0.444 2
1 601 . 1 1 A 50 50 ALA H H 110 8.280 8.254 0.026 2
1 602 . 1 1 A 50 50 ALA HA H 110 4.110 4.071 0.039 2
1 606 . 1 1 A 50 50 ALA C C 110 179.700 179.837 -0.137 2
1 607 . 1 1 A 50 50 ALA CA C 110 55.100 54.949 0.151 2
1 608 . 1 1 A 50 50 ALA CB C 110 19.200 18.388 0.812 2
1 609 . 1 1 A 50 50 ALA N N 110 116.100 119.090 -2.990 2
1 610 . 1 1 A 51 51 ASP H H 111 7.790 7.985 -0.195 2
1 611 . 1 1 A 51 51 ASP HA H 111 4.440 4.337 0.103 2
1 614 . 1 1 A 51 51 ASP C C 111 178.200 178.749 -0.549 2
1 615 . 1 1 A 51 51 ASP CA C 111 57.600 57.410 0.190 2
1 616 . 1 1 A 51 51 ASP CB C 111 41.800 40.939 0.861 2
1 617 . 1 1 A 51 51 ASP N N 111 116.500 118.371 -1.872 2
1 618 . 1 1 A 52 52 ILE H H 112 7.020 7.620 -0.600 2
1 619 . 1 1 A 52 52 ILE HA H 112 3.750 3.660 0.090 2
1 629 . 1 1 A 52 52 ILE C C 112 177.300 177.824 -0.524 2
1 630 . 1 1 A 52 52 ILE CA C 112 63.500 65.088 -1.588 2
1 631 . 1 1 A 52 52 ILE CB C 112 37.500 37.243 0.257 2
1 635 . 1 1 A 52 52 ILE N N 112 116.700 119.836 -3.136 2
1 636 . 1 1 A 53 53 GLN H H 113 9.150 8.307 0.843 2
1 637 . 1 1 A 53 53 GLN HA H 113 3.720 3.972 -0.252 2
1 644 . 1 1 A 53 53 GLN C C 113 177.500 178.120 -0.620 2
1 645 . 1 1 A 53 53 GLN CA C 113 58.200 58.755 -0.555 2
1 646 . 1 1 A 53 53 GLN CB C 113 30.200 28.545 1.655 2
1 649 . 1 1 A 53 53 GLN N N 113 121.200 121.103 0.097 2
1 651 . 1 1 A 54 54 SER H H 114 8.150 8.109 0.041 2
1 652 . 1 1 A 54 54 SER HA H 114 4.180 4.176 0.004 2
1 655 . 1 1 A 54 54 SER C C 114 175.900 176.947 -1.047 2
1 656 . 1 1 A 54 54 SER CA C 114 62.100 62.017 0.083 2
1 657 . 1 1 A 54 54 SER CB C 114 62.800 62.953 -0.153 2
1 658 . 1 1 A 54 54 SER N N 114 112.200 115.664 -3.464 2
1 659 . 1 1 A 55 55 ILE H H 115 6.760 7.594 -0.834 2
1 660 . 1 1 A 55 55 ILE HA H 115 3.860 3.695 0.165 2
1 670 . 1 1 A 55 55 ILE C C 115 179.200 178.263 0.937 2
1 671 . 1 1 A 55 55 ILE CA C 115 64.700 64.905 -0.205 2
1 672 . 1 1 A 55 55 ILE CB C 115 38.900 37.902 0.998 2
1 676 . 1 1 A 55 55 ILE N N 115 119.500 121.219 -1.719 2
1 677 . 1 1 A 56 56 ILE H H 116 7.750 8.182 -0.432 2
1 678 . 1 1 A 56 56 ILE HA H 116 3.690 3.597 0.093 2
1 688 . 1 1 A 56 56 ILE C C 116 176.900 178.255 -1.355 2
1 689 . 1 1 A 56 56 ILE CA C 116 62.800 65.078 -2.278 2
1 690 . 1 1 A 56 56 ILE CB C 116 36.200 37.531 -1.331 2
1 694 . 1 1 A 56 56 ILE N N 116 120.200 120.663 -0.463 2
1 695 . 1 1 A 57 57 ASN H H 117 8.690 8.272 0.418 2
1 696 . 1 1 A 57 57 ASN HA H 117 4.440 4.442 -0.002 2
1 701 . 1 1 A 57 57 ASN C C 117 177.200 177.391 -0.191 2
1 702 . 1 1 A 57 57 ASN CA C 117 54.800 56.469 -1.669 2
1 703 . 1 1 A 57 57 ASN CB C 117 38.100 38.578 -0.478 2
1 705 . 1 1 A 57 57 ASN N N 117 117.000 119.573 -2.573 2
1 707 . 1 1 A 58 58 GLU H H 118 7.630 7.921 -0.291 2
1 708 . 1 1 A 58 58 GLU HA H 118 4.450 4.362 0.088 2
1 713 . 1 1 A 58 58 GLU C C 118 176.500 176.842 -0.342 2
1 714 . 1 1 A 58 58 GLU CA C 118 56.200 57.370 -1.170 2
1 715 . 1 1 A 58 58 GLU CB C 118 30.200 30.058 0.142 2
1 717 . 1 1 A 58 58 GLU N N 118 116.300 116.489 -0.189 2
1 718 . 1 1 A 59 59 THR H H 119 7.540 7.523 0.017 2
1 719 . 1 1 A 59 59 THR HA H 119 4.230 4.347 -0.117 2
1 724 . 1 1 A 59 59 THR C C 119 174.200 174.276 -0.076 2
1 725 . 1 1 A 59 59 THR CA C 119 63.800 63.291 0.509 2
1 726 . 1 1 A 59 59 THR CB C 119 68.900 69.030 -0.130 2
1 728 . 1 1 A 59 59 THR N N 119 117.600 116.324 1.276 2
1 729 . 1 1 A 60 60 LYS H H 120 8.860 8.856 0.004 2
1 730 . 1 1 A 60 60 LYS HA H 120 4.490 4.598 -0.108 2
1 739 . 1 1 A 60 60 LYS C C 120 175.800 175.449 0.351 2
1 740 . 1 1 A 60 60 LYS CA C 120 54.900 55.513 -0.613 2
1 741 . 1 1 A 60 60 LYS CB C 120 29.800 31.987 -2.187 2
1 745 . 1 1 A 60 60 LYS N N 120 128.500 126.407 2.093 2
1 746 . 1 1 A 61 61 LEU H H 121 7.150 7.901 -0.751 2
1 747 . 1 1 A 61 61 LEU HA H 121 4.710 4.805 -0.095 2
1 757 . 1 1 A 61 61 LEU C C 121 175.000 176.117 -1.117 2
1 758 . 1 1 A 61 61 LEU CA C 121 52.800 53.461 -0.661 2
1 759 . 1 1 A 61 61 LEU CB C 121 46.400 44.348 2.052 2
1 763 . 1 1 A 61 61 LEU N N 121 120.700 124.533 -3.833 2
1 764 . 1 1 A 62 62 ALA H H 122 8.000 8.545 -0.545 2
1 765 . 1 1 A 62 62 ALA HA H 122 4.250 4.405 -0.155 2
1 769 . 1 1 A 62 62 ALA CA C 122 52.100 52.183 -0.083 2
1 770 . 1 1 A 62 62 ALA CB C 122 19.500 19.470 0.030 2
1 771 . 1 1 A 62 62 ALA N N 122 119.900 123.258 -3.358 2
1 772 . 1 1 A 63 63 LYS H H 123 8.770 8.890 -0.120 2
1 773 . 1 1 A 63 63 LYS HA H 123 3.800 3.948 -0.148 2
1 782 . 1 1 A 63 63 LYS C C 123 178.300 178.622 -0.322 2
1 783 . 1 1 A 63 63 LYS CA C 123 60.700 59.666 1.034 2
1 784 . 1 1 A 63 63 LYS CB C 123 32.300 32.069 0.231 2
1 788 . 1 1 A 63 63 LYS N N 123 121.400 121.776 -0.376 2
1 789 . 1 1 A 64 64 ASN H H 124 9.020 8.223 0.797 2
1 790 . 1 1 A 64 64 ASN HA H 124 4.430 4.492 -0.062 2
1 795 . 1 1 A 64 64 ASN C C 124 178.300 177.786 0.514 2
1 796 . 1 1 A 64 64 ASN CA C 124 56.200 56.133 0.067 2
1 797 . 1 1 A 64 64 ASN CB C 124 37.300 38.368 -1.068 2
1 799 . 1 1 A 64 64 ASN N N 124 115.000 117.653 -2.653 2
1 801 . 1 1 A 65 65 THR H H 125 7.620 7.979 -0.359 2
1 802 . 1 1 A 65 65 THR HA H 125 4.030 4.048 -0.018 2
1 807 . 1 1 A 65 65 THR C C 125 175.500 176.746 -1.246 2
1 808 . 1 1 A 65 65 THR CA C 125 66.000 67.061 -1.061 2
1 809 . 1 1 A 65 65 THR CB C 125 67.600 68.022 -0.422 2
1 811 . 1 1 A 65 65 THR N N 125 119.800 116.688 3.112 2
1 812 . 1 1 A 66 66 LEU H H 126 8.020 8.289 -0.269 2
1 813 . 1 1 A 66 66 LEU HA H 126 3.790 3.836 -0.046 2
1 823 . 1 1 A 66 66 LEU C C 126 179.200 179.299 -0.099 2
1 824 . 1 1 A 66 66 LEU CA C 126 58.700 58.089 0.611 2
1 825 . 1 1 A 66 66 LEU CB C 126 41.300 41.378 -0.078 2
1 829 . 1 1 A 66 66 LEU N N 126 121.200 121.392 -0.192 2
1 830 . 1 1 A 67 67 LYS H H 127 8.380 8.162 0.218 2
1 831 . 1 1 A 67 67 LYS HA H 127 3.740 4.046 -0.306 2
1 840 . 1 1 A 67 67 LYS C C 127 178.300 179.312 -1.012 2
1 841 . 1 1 A 67 67 LYS CA C 127 60.100 59.428 0.672 2
1 842 . 1 1 A 67 67 LYS CB C 127 32.400 32.046 0.354 2
1 846 . 1 1 A 67 67 LYS N N 127 117.000 117.970 -0.970 2
1 847 . 1 1 A 68 68 ALA H H 128 7.480 7.901 -0.421 2
1 848 . 1 1 A 68 68 ALA HA H 128 4.210 3.994 0.215 2
1 852 . 1 1 A 68 68 ALA C C 128 181.200 179.873 1.327 2
1 853 . 1 1 A 68 68 ALA CA C 128 55.200 54.941 0.259 2
1 854 . 1 1 A 68 68 ALA CB C 128 18.600 18.119 0.481 2
1 855 . 1 1 A 68 68 ALA N N 128 122.900 121.934 0.966 2
1 856 . 1 1 A 69 69 ILE H H 129 8.250 7.695 0.555 2
1 857 . 1 1 A 69 69 ILE HA H 129 3.130 3.319 -0.189 2
1 867 . 1 1 A 69 69 ILE C C 129 177.400 177.876 -0.476 2
1 868 . 1 1 A 69 69 ILE CA C 129 66.700 65.288 1.412 2
1 869 . 1 1 A 69 69 ILE CB C 129 37.900 37.482 0.418 2
1 873 . 1 1 A 69 69 ILE N N 129 122.800 118.442 4.358 2
1 874 . 1 1 A 70 70 ARG H H 130 8.040 7.918 0.122 2
1 875 . 1 1 A 70 70 ARG HA H 130 3.620 3.903 -0.283 2
1 882 . 1 1 A 70 70 ARG C C 130 177.800 178.639 -0.839 2
1 883 . 1 1 A 70 70 ARG CA C 130 60.700 59.870 0.830 2
1 884 . 1 1 A 70 70 ARG CB C 130 29.600 29.891 -0.291 2
1 887 . 1 1 A 70 70 ARG N N 130 119.700 120.648 -0.948 2
1 888 . 1 1 A 71 71 ASN H H 131 8.920 8.577 0.343 2
1 889 . 1 1 A 71 71 ASN HA H 131 4.430 4.512 -0.082 2
1 894 . 1 1 A 71 71 ASN C C 131 177.500 177.804 -0.304 2
1 895 . 1 1 A 71 71 ASN CA C 131 56.100 56.415 -0.315 2
1 896 . 1 1 A 71 71 ASN CB C 131 38.600 38.941 -0.341 2
1 898 . 1 1 A 71 71 ASN N N 131 117.200 118.020 -0.820 2
1 900 . 1 1 A 72 72 THR H H 132 8.300 8.322 -0.022 2
1 901 . 1 1 A 72 72 THR HA H 132 4.430 3.844 0.586 2
1 906 . 1 1 A 72 72 THR C C 132 175.100 176.586 -1.486 2
1 907 . 1 1 A 72 72 THR CA C 132 68.200 66.372 1.828 2
1 908 . 1 1 A 72 72 THR CB C 132 68.500 68.786 -0.286 2
1 910 . 1 1 A 72 72 THR N N 132 119.200 115.638 3.562 2
1 911 . 1 1 A 73 73 ALA H H 133 7.950 8.233 -0.283 2
1 912 . 1 1 A 73 73 ALA HA H 133 4.040 4.054 -0.014 2
1 916 . 1 1 A 73 73 ALA C C 133 178.200 179.602 -1.402 2
1 917 . 1 1 A 73 73 ALA CA C 133 55.900 55.395 0.505 2
1 918 . 1 1 A 73 73 ALA CB C 133 16.700 18.118 -1.418 2
1 919 . 1 1 A 73 73 ALA N N 133 120.900 123.752 -2.852 2
1 920 . 1 1 A 74 74 SER H H 134 8.440 8.388 0.052 2
1 921 . 1 1 A 74 74 SER HA H 134 4.430 4.326 0.104 2
1 924 . 1 1 A 74 74 SER C C 134 178.800 177.253 1.547 2
1 925 . 1 1 A 74 74 SER CA C 134 61.300 61.364 -0.064 2
1 926 . 1 1 A 74 74 SER CB C 134 62.600 62.803 -0.203 2
1 927 . 1 1 A 74 74 SER N N 134 110.100 113.301 -3.201 2
1 928 . 1 1 A 75 75 GLN H H 135 8.340 7.609 0.731 2
1 929 . 1 1 A 75 75 GLN HA H 135 3.880 4.047 -0.167 2
1 936 . 1 1 A 75 75 GLN C C 135 178.800 178.799 0.001 2
1 937 . 1 1 A 75 75 GLN CA C 135 59.600 58.703 0.897 2
1 938 . 1 1 A 75 75 GLN CB C 135 29.900 28.219 1.681 2
1 941 . 1 1 A 75 75 GLN N N 135 118.100 121.227 -3.127 2
1 943 . 1 1 A 76 76 ILE H H 136 7.670 7.325 0.345 2
1 944 . 1 1 A 76 76 ILE HA H 136 3.200 3.353 -0.153 2
1 954 . 1 1 A 76 76 ILE C C 136 177.500 177.855 -0.355 2
1 955 . 1 1 A 76 76 ILE CA C 136 66.100 65.054 1.046 2
1 956 . 1 1 A 76 76 ILE CB C 136 37.400 37.318 0.082 2
1 960 . 1 1 A 76 76 ILE N N 136 122.500 120.229 2.271 2
1 961 . 1 1 A 77 77 PHE H H 137 7.930 7.851 0.079 2
1 962 . 1 1 A 77 77 PHE HA H 137 3.890 4.112 -0.222 2
1 969 . 1 1 A 77 77 PHE C C 137 178.200 178.383 -0.183 2
1 970 . 1 1 A 77 77 PHE CA C 137 63.600 60.535 3.065 2
1 971 . 1 1 A 77 77 PHE CB C 137 39.300 38.483 0.817 2
1 976 . 1 1 A 77 77 PHE N N 137 116.100 118.760 -2.660 2
1 977 . 1 1 A 78 78 ARG H H 138 8.900 8.243 0.657 2
1 978 . 1 1 A 78 78 ARG HA H 138 3.910 3.980 -0.070 2
1 986 . 1 1 A 78 78 ARG C C 138 178.300 178.740 -0.440 2
1 987 . 1 1 A 78 78 ARG CA C 138 60.100 59.059 1.041 2
1 988 . 1 1 A 78 78 ARG CB C 138 29.600 29.747 -0.147 2
1 991 . 1 1 A 78 78 ARG N N 138 118.600 119.278 -0.678 2
1 993 . 1 1 A 79 79 LEU H H 139 7.730 7.970 -0.240 2
1 994 . 1 1 A 79 79 LEU HA H 139 4.280 4.101 0.179 2
1 1004 . 1 1 A 79 79 LEU C C 139 179.000 178.306 0.694 2
1 1005 . 1 1 A 79 79 LEU CA C 139 57.800 57.705 0.095 2
1 1006 . 1 1 A 79 79 LEU CB C 139 41.900 41.317 0.583 2
1 1010 . 1 1 A 79 79 LEU N N 139 121.900 121.603 0.297 2
1 1011 . 1 1 A 80 80 ALA H H 140 7.590 7.431 0.159 2
1 1012 . 1 1 A 80 80 ALA HA H 140 2.710 2.917 -0.207 2
1 1016 . 1 1 A 80 80 ALA C C 140 179.900 179.940 -0.040 2
1 1017 . 1 1 A 80 80 ALA CA C 140 55.100 54.450 0.650 2
1 1018 . 1 1 A 80 80 ALA CB C 140 17.600 17.519 0.081 2
1 1019 . 1 1 A 80 80 ALA N N 140 123.400 120.038 3.362 2
1 1020 . 1 1 A 81 81 ILE H H 141 8.910 7.840 1.070 2
1 1021 . 1 1 A 81 81 ILE HA H 141 4.110 3.958 0.152 2
1 1031 . 1 1 A 81 81 ILE C C 141 181.700 177.873 3.827 2
1 1032 . 1 1 A 81 81 ILE CA C 141 64.800 65.272 -0.472 2
1 1033 . 1 1 A 81 81 ILE CB C 141 38.600 37.655 0.945 2
1 1037 . 1 1 A 81 81 ILE N N 141 122.400 118.690 3.710 2
1 1038 . 1 1 A 82 82 GLU H H 142 8.560 8.620 -0.060 2
1 1039 . 1 1 A 82 82 GLU HA H 142 4.100 4.068 0.032 2
1 1044 . 1 1 A 82 82 GLU C C 142 177.700 178.025 -0.325 2
1 1045 . 1 1 A 82 82 GLU CA C 142 59.100 59.398 -0.298 2
1 1046 . 1 1 A 82 82 GLU CB C 142 29.200 28.991 0.209 2
1 1048 . 1 1 A 82 82 GLU N N 142 123.200 120.105 3.095 2
1 1049 . 1 1 A 83 83 ASN H H 143 7.310 7.626 -0.316 2
1 1050 . 1 1 A 83 83 ASN HA H 143 4.750 4.894 -0.144 2
1 1055 . 1 1 A 83 83 ASN C C 143 173.200 174.300 -1.100 2
1 1056 . 1 1 A 83 83 ASN CA C 143 54.200 52.850 1.350 2
1 1057 . 1 1 A 83 83 ASN CB C 143 41.300 38.764 2.536 2
1 1059 . 1 1 A 83 83 ASN N N 143 114.900 115.695 -0.795 2
1 1061 . 1 1 A 84 84 ARG H H 144 8.320 7.970 0.350 2
1 1062 . 1 1 A 84 84 ARG HA H 144 4.120 4.018 0.102 2
1 1069 . 1 1 A 84 84 ARG C C 144 175.300 175.842 -0.542 2
1 1070 . 1 1 A 84 84 ARG CA C 144 57.100 56.965 0.135 2
1 1071 . 1 1 A 84 84 ARG CB C 144 26.000 26.965 -0.965 2
1 1074 . 1 1 A 84 84 ARG N N 144 114.400 115.238 -0.838 2
1 1075 . 1 1 A 85 85 ALA H H 145 8.350 8.346 0.004 2
1 1076 . 1 1 A 85 85 ALA HA H 145 4.320 4.312 0.008 2
1 1080 . 1 1 A 85 85 ALA C C 145 176.500 177.230 -0.730 2
1 1081 . 1 1 A 85 85 ALA CA C 145 53.400 53.560 -0.160 2
1 1082 . 1 1 A 85 85 ALA CB C 145 19.900 19.774 0.126 2
1 1083 . 1 1 A 85 85 ALA N N 145 120.600 119.082 1.518 2
1 1084 . 1 1 A 86 86 ILE H H 146 7.290 7.465 -0.175 2
1 1085 . 1 1 A 86 86 ILE HA H 146 4.400 4.607 -0.207 2
1 1095 . 1 1 A 86 86 ILE C C 146 173.600 173.822 -0.222 2
1 1096 . 1 1 A 86 86 ILE CA C 146 59.200 59.756 -0.556 2
1 1097 . 1 1 A 86 86 ILE CB C 146 41.600 41.388 0.212 2
1 1101 . 1 1 A 86 86 ILE N N 146 111.500 115.955 -4.455 2
1 1102 . 1 1 A 87 87 ASP H H 147 8.270 8.841 -0.571 2
1 1103 . 1 1 A 87 87 ASP HA H 147 4.940 4.898 0.042 2
1 1106 . 1 1 A 87 87 ASP C C 147 174.700 175.315 -0.615 2
1 1107 . 1 1 A 87 87 ASP CA C 147 53.700 53.514 0.186 2
1 1108 . 1 1 A 87 87 ASP CB C 147 41.800 41.475 0.325 2
1 1109 . 1 1 A 87 87 ASP N N 147 119.400 127.162 -7.762 2
1 1110 . 1 1 A 88 88 PHE H H 148 7.230 7.595 -0.365 2
1 1111 . 1 1 A 88 88 PHE HA H 148 4.690 4.940 -0.250 2
1 1119 . 1 1 A 88 88 PHE C C 148 171.500 172.878 -1.378 2
1 1120 . 1 1 A 88 88 PHE CA C 148 56.400 56.866 -0.466 2
1 1121 . 1 1 A 88 88 PHE CB C 148 42.000 42.394 -0.394 2
1 1127 . 1 1 A 88 88 PHE N N 148 119.700 119.587 0.113 2
1 1128 . 1 1 A 89 89 ASN H H 149 8.060 8.479 -0.419 2
1 1129 . 1 1 A 89 89 ASN HA H 149 4.490 4.996 -0.506 2
1 1134 . 1 1 A 89 89 ASN CA C 149 48.100 49.117 -1.017 2
1 1135 . 1 1 A 89 89 ASN CB C 149 39.200 39.703 -0.503 2
1 1137 . 1 1 A 89 89 ASN N N 149 119.700 123.444 -3.744 2
1 1139 . 1 1 A 90 90 PRO HA H 150 3.970 4.308 -0.338 2
1 1146 . 1 1 A 90 90 PRO C C 150 177.700 177.608 0.092 2
1 1147 . 1 1 A 90 90 PRO CA C 150 63.900 64.473 -0.573 2
1 1148 . 1 1 A 90 90 PRO CB C 150 31.700 31.596 0.104 2
1 1151 . 1 1 A 91 91 ALA H H 151 7.240 7.507 -0.267 2
1 1152 . 1 1 A 91 91 ALA HA H 151 3.900 4.075 -0.175 2
1 1156 . 1 1 A 91 91 ALA C C 151 178.000 179.523 -1.523 2
1 1157 . 1 1 A 91 91 ALA CA C 151 53.900 54.311 -0.411 2
1 1158 . 1 1 A 91 91 ALA CB C 151 17.700 18.418 -0.718 2
1 1159 . 1 1 A 91 91 ALA N N 151 115.700 119.097 -3.397 2
1 1160 . 1 1 A 92 92 ASP H H 152 7.080 7.853 -0.773 2
1 1161 . 1 1 A 92 92 ASP HA H 152 4.220 4.310 -0.090 2
1 1164 . 1 1 A 92 92 ASP C C 152 176.200 177.133 -0.933 2
1 1165 . 1 1 A 92 92 ASP CA C 152 55.800 56.449 -0.649 2
1 1166 . 1 1 A 92 92 ASP CB C 152 39.500 40.383 -0.883 2
1 1167 . 1 1 A 92 92 ASP N N 152 117.100 119.194 -2.094 2
1 1168 . 1 1 A 93 93 TYR H H 153 7.060 7.418 -0.358 2
1 1169 . 1 1 A 93 93 TYR HA H 153 4.490 4.469 0.021 2
1 1176 . 1 1 A 93 93 TYR C C 153 174.700 175.754 -1.054 2
1 1177 . 1 1 A 93 93 TYR CA C 153 57.600 58.878 -1.278 2
1 1178 . 1 1 A 93 93 TYR CB C 153 38.500 38.739 -0.239 2
1 1183 . 1 1 A 93 93 TYR N N 153 116.800 117.802 -1.002 2
1 1184 . 1 1 A 94 94 VAL H H 154 7.000 7.155 -0.155 2
1 1185 . 1 1 A 94 94 VAL HA H 154 4.040 4.047 -0.007 2
1 1193 . 1 1 A 94 94 VAL C C 154 174.700 175.166 -0.466 2
1 1194 . 1 1 A 94 94 VAL CA C 154 62.100 62.506 -0.406 2
1 1195 . 1 1 A 94 94 VAL CB C 154 32.700 32.160 0.540 2
1 1198 . 1 1 A 94 94 VAL N N 154 120.600 120.824 -0.224 2
1 1199 . 1 1 A 95 95 ARG H H 155 9.430 8.756 0.674 2
1 1200 . 1 1 A 95 95 ARG HA H 155 4.640 4.682 -0.042 2
1 1207 . 1 1 A 95 95 ARG C C 155 175.400 175.409 -0.009 2
1 1208 . 1 1 A 95 95 ARG CA C 155 54.200 55.511 -1.311 2
1 1209 . 1 1 A 95 95 ARG CB C 155 32.400 31.566 0.834 2
1 1212 . 1 1 A 95 95 ARG N N 155 128.200 127.143 1.057 2
1 1213 . 1 1 A 96 96 ILE H H 156 8.700 8.646 0.054 2
1 1214 . 1 1 A 96 96 ILE HA H 156 4.440 4.555 -0.115 2
1 1224 . 1 1 A 96 96 ILE CA C 156 56.500 58.032 -1.532 2
1 1225 . 1 1 A 96 96 ILE CB C 156 36.700 38.736 -2.036 2
1 1229 . 1 1 A 96 96 ILE N N 156 124.100 125.192 -1.092 2
1 1230 . 1 1 A 97 97 PRO HA H 157 4.370 4.642 -0.272 2
1 1237 . 1 1 A 97 97 PRO C C 157 176.000 176.854 -0.854 2
1 1238 . 1 1 A 97 97 PRO CA C 157 63.200 62.975 0.225 2
1 1239 . 1 1 A 97 97 PRO CB C 157 32.400 32.144 0.256 2
1 1242 . 1 1 A 98 98 LYS H H 158 8.380 8.773 -0.393 2
1 1243 . 1 1 A 98 98 LYS HA H 158 4.190 4.373 -0.183 2
1 1252 . 1 1 A 98 98 LYS C C 158 176.800 176.260 0.540 2
1 1253 . 1 1 A 98 98 LYS CA C 158 57.100 56.460 0.640 2
1 1254 . 1 1 A 98 98 LYS CB C 158 32.800 32.456 0.344 2
1 1258 . 1 1 A 98 98 LYS N N 158 120.800 119.796 1.005 2
1 1259 . 1 1 A 99 99 ILE H H 159 7.930 7.837 0.093 2
1 1260 . 1 1 A 99 99 ILE HA H 159 4.200 4.107 0.093 2
1 1270 . 1 1 A 99 99 ILE C C 159 175.400 175.413 -0.013 2
1 1271 . 1 1 A 99 99 ILE CA C 159 60.600 61.788 -1.188 2
1 1272 . 1 1 A 99 99 ILE CB C 159 39.100 37.038 2.062 2
1 1276 . 1 1 A 99 99 ILE N N 159 120.200 119.909 0.291 2
1 1277 . 1 1 A 100 100 ALA H H 160 8.370 8.289 0.081 2
1 1278 . 1 1 A 100 100 ALA HA H 160 4.370 4.623 -0.253 2
1 1282 . 1 1 A 100 100 ALA C C 160 177.200 177.202 -0.002 2
1 1283 . 1 1 A 100 100 ALA CA C 160 52.200 51.349 0.851 2
1 1284 . 1 1 A 100 100 ALA CB C 160 19.400 20.371 -0.971 2
1 1285 . 1 1 A 100 100 ALA N N 160 128.300 127.511 0.789 2
1 1286 . 1 1 A 101 101 LEU H H 161 8.250 8.354 -0.104 2
1 1287 . 1 1 A 101 101 LEU HA H 161 4.280 4.367 -0.087 2
1 1297 . 1 1 A 101 101 LEU C C 161 177.200 176.773 0.427 2
1 1298 . 1 1 A 101 101 LEU CA C 161 55.200 54.789 0.411 2
1 1299 . 1 1 A 101 101 LEU CB C 161 42.400 41.673 0.727 2
1 1303 . 1 1 A 101 101 LEU N N 161 121.900 120.666 1.234 2
1 1304 . 1 1 A 102 102 GLU H H 162 8.390 8.279 0.111 2
1 1305 . 1 1 A 102 102 GLU HA H 162 4.230 4.272 -0.042 2
1 1310 . 1 1 A 102 102 GLU C C 162 176.100 175.918 0.182 2
1 1311 . 1 1 A 102 102 GLU CA C 162 56.400 57.336 -0.936 2
1 1312 . 1 1 A 102 102 GLU CB C 162 30.500 29.828 0.672 2
1 1314 . 1 1 A 102 102 GLU N N 162 121.300 120.930 0.370 2
1 1315 . 1 1 A 103 103 HIS H H 163 8.330 8.275 0.055 2
1 1316 . 1 1 A 103 103 HIS HA H 163 4.590 4.886 -0.296 2
1 1319 . 1 1 A 103 103 HIS C C 163 176.100 174.712 1.388 2
1 1320 . 1 1 A 103 103 HIS CA C 163 56.000 54.977 1.023 2
1 1321 . 1 1 A 103 103 HIS CB C 163 30.500 30.643 -0.143 2
1 1322 . 1 1 A 103 103 HIS N N 163 120.000 119.785 0.215 2
1 1323 . 1 1 A 107 107 HIS HA H 167 4.620 4.787 -0.167 2
1 1326 . 1 1 A 107 107 HIS C C 167 173.900 173.878 0.022 2
1 1327 . 1 1 A 107 107 HIS CA C 167 56.000 55.058 0.942 2
1 1328 . 1 1 A 107 107 HIS CB C 167 30.300 31.338 -1.038 2
stop_
save_