################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 19884 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $ccp_assignment _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC/HMQC' 1 $CcP_NMR_sample isotropic 19884 1 2 '3D HNCACB' 1 $CcP_NMR_sample isotropic 19884 1 3 '3D HNCA' 1 $CcP_NMR_sample isotropic 19884 1 4 'BESTTR_HN(Ca)CO_950 (H[N[ca[CO]]])' 1 $CcP_NMR_sample isotropic 19884 1 5 'BESTTR_HNCO_950 (H[N[trho(N)][CO]])' 1 $CcP_NMR_sample isotropic 19884 1 6 '3D HN(CO)CA' 1 $CcP_NMR_sample isotropic 19884 1 7 'BESTTR_HN(COCa)Cb_600 (H[N[co[{CA|ca[C]}]]])' 1 $CcP_NMR_sample isotropic 19884 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $CcpNmr_Analysis . . 19884 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET C C 13 177.296 . . 1 . 974 . . 1 MET C . 19884 1 2 . 1 1 2 2 SER H H 1 8.243 0.002 . 1 . 902 . . 2 SER H . 19884 1 3 . 1 1 2 2 SER C C 13 174.975 0.017 . 1 . 983 . . 2 SER C . 19884 1 4 . 1 1 2 2 SER CA C 13 58.129 0.045 . 1 . 600 . . 2 SER CA . 19884 1 5 . 1 1 2 2 SER CB C 13 63.081 0.069 . 1 . 682 . . 2 SER CB . 19884 1 6 . 1 1 2 2 SER N N 15 121.940 0.013 . 1 . 903 . . 2 SER N . 19884 1 7 . 1 1 3 3 LYS H H 1 8.389 0.013 . 1 . 981 . . 3 LYS H . 19884 1 8 . 1 1 3 3 LYS C C 13 176.208 0.051 . 1 . 1001 . . 3 LYS C . 19884 1 9 . 1 1 3 3 LYS CA C 13 55.844 0.103 . 1 . 612 . . 3 LYS CA . 19884 1 10 . 1 1 3 3 LYS CB C 13 32.108 0.069 . 1 . 919 . . 3 LYS CB . 19884 1 11 . 1 1 3 3 LYS N N 15 123.847 0.13 . 1 . 982 . . 3 LYS N . 19884 1 12 . 1 1 4 4 THR H H 1 8.177 0.013 . 1 . 258 . . 4 THR H . 19884 1 13 . 1 1 4 4 THR C C 13 173.912 0.013 . 1 . 850 . . 4 THR C . 19884 1 14 . 1 1 4 4 THR CA C 13 61.600 0.01 . 1 . 379 . . 4 THR CA . 19884 1 15 . 1 1 4 4 THR CB C 13 69.262 0.019 . 1 . 479 . . 4 THR CB . 19884 1 16 . 1 1 4 4 THR N N 15 118.283 0.123 . 1 . 259 . . 4 THR N . 19884 1 17 . 1 1 5 5 LEU H H 1 8.193 0.013 . 1 . 97 . . 5 LEU H . 19884 1 18 . 1 1 5 5 LEU C C 13 175.913 0.001 . 1 . 781 . . 5 LEU C . 19884 1 19 . 1 1 5 5 LEU CA C 13 54.536 0.004 . 1 . 465 . . 5 LEU CA . 19884 1 20 . 1 1 5 5 LEU CB C 13 41.405 0.033 . 1 . 984 . . 5 LEU CB . 19884 1 21 . 1 1 5 5 LEU N N 15 127.078 0.112 . 1 . 98 . . 5 LEU N . 19884 1 22 . 1 1 6 6 VAL H H 1 8.144 0.012 . 1 . 67 . . 6 VAL H . 19884 1 23 . 1 1 6 6 VAL C C 13 174.501 0.013 . 1 . 772 . . 6 VAL C . 19884 1 24 . 1 1 6 6 VAL CA C 13 60.717 0.047 . 1 . 409 . . 6 VAL CA . 19884 1 25 . 1 1 6 6 VAL CB C 13 33.138 0.013 . 1 . 497 . . 6 VAL CB . 19884 1 26 . 1 1 6 6 VAL N N 15 124.368 0.115 . 1 . 68 . . 6 VAL N . 19884 1 27 . 1 1 7 7 HIS H H 1 8.684 0.013 . 1 . 318 . . 7 HIS H . 19884 1 28 . 1 1 7 7 HIS C C 13 172.368 0.012 . 1 . 807 . . 7 HIS C . 19884 1 29 . 1 1 7 7 HIS CA C 13 51.638 0.006 . 1 . 1069 . . 7 HIS CA . 19884 1 30 . 1 1 7 7 HIS CB C 13 26.959 0.038 . 1 . 885 . . 7 HIS CB . 19884 1 31 . 1 1 7 7 HIS N N 15 124.865 0.118 . 1 . 319 . . 7 HIS N . 19884 1 32 . 1 1 8 8 VAL H H 1 8.843 0.014 . 1 . 280 . . 8 VAL H . 19884 1 33 . 1 1 8 8 VAL C C 13 177.815 0.006 . 1 . 797 . . 8 VAL C . 19884 1 34 . 1 1 8 8 VAL CA C 13 61.441 0.013 . 1 . 865 . . 8 VAL CA . 19884 1 35 . 1 1 8 8 VAL CB C 13 31.272 0.021 . 1 . 542 . . 8 VAL CB . 19884 1 36 . 1 1 8 8 VAL N N 15 124.946 0.111 . 1 . 281 . . 8 VAL N . 19884 1 37 . 1 1 9 9 ALA H H 1 8.459 0.014 . 1 . 9 . . 9 ALA H . 19884 1 38 . 1 1 9 9 ALA C C 13 177.167 0.01 . 1 . 755 . . 9 ALA C . 19884 1 39 . 1 1 9 9 ALA CA C 13 52.278 0.011 . 1 . 583 . . 9 ALA CA . 19884 1 40 . 1 1 9 9 ALA CB C 13 19.514 0.024 . 1 . 664 . . 9 ALA CB . 19884 1 41 . 1 1 9 9 ALA N N 15 135.147 0.108 . 1 . 10 . . 9 ALA N . 19884 1 42 . 1 1 10 10 SER H H 1 9.429 0.015 . 1 . 244 . . 10 SER H . 19884 1 43 . 1 1 10 10 SER C C 13 172.815 . . 1 . 722 . . 10 SER C . 19884 1 44 . 1 1 10 10 SER CA C 13 56.166 0.02 . 1 . 572 . . 10 SER CA . 19884 1 45 . 1 1 10 10 SER CB C 13 63.105 0.061 . 1 . 652 . . 10 SER CB . 19884 1 46 . 1 1 10 10 SER N N 15 121.287 0.138 . 1 . 245 . . 10 SER N . 19884 1 47 . 1 1 11 11 VAL H H 1 8.540 0.014 . 1 . 188 . . 11 VAL H . 19884 1 48 . 1 1 11 11 VAL CA C 13 64.199 . . 1 . 429 . . 11 VAL CA . 19884 1 49 . 1 1 11 11 VAL N N 15 128.516 0.134 . 1 . 189 . . 11 VAL N . 19884 1 50 . 1 1 12 12 GLU C C 13 176.551 0.023 . 1 . 1235 . . 12 GLU C . 19884 1 51 . 1 1 12 12 GLU CA C 13 58.870 0.024 . 1 . 1234 . . 12 GLU CA . 19884 1 52 . 1 1 12 12 GLU CB C 13 27.616 . . 1 . 1233 . . 12 GLU CB . 19884 1 53 . 1 1 13 13 LYS H H 1 8.263 0.015 . 1 . 314 . . 13 LYS H . 19884 1 54 . 1 1 13 13 LYS C C 13 178.596 0.02 . 1 . 971 . . 13 LYS C . 19884 1 55 . 1 1 13 13 LYS CA C 13 58.029 0.007 . 1 . 451 . . 13 LYS CA . 19884 1 56 . 1 1 13 13 LYS CB C 13 31.460 0.019 . 1 . 1015 . . 13 LYS CB . 19884 1 57 . 1 1 13 13 LYS N N 15 124.341 0.109 . 1 . 315 . . 13 LYS N . 19884 1 58 . 1 1 14 14 GLY H H 1 8.831 0.012 . 1 . 288 . . 14 GLY H . 19884 1 59 . 1 1 14 14 GLY C C 13 174.162 0.001 . 1 . 800 . . 14 GLY C . 19884 1 60 . 1 1 14 14 GLY CA C 13 45.054 0.02 . 1 . 420 . . 14 GLY CA . 19884 1 61 . 1 1 14 14 GLY N N 15 113.195 0.128 . 1 . 289 . . 14 GLY N . 19884 1 62 . 1 1 15 15 ARG H H 1 7.576 0.011 . 1 . 148 . . 15 ARG H . 19884 1 63 . 1 1 15 15 ARG C C 13 175.565 0.013 . 1 . 826 . . 15 ARG C . 19884 1 64 . 1 1 15 15 ARG CA C 13 52.628 0.01 . 1 . 388 . . 15 ARG CA . 19884 1 65 . 1 1 15 15 ARG CB C 13 28.796 0.023 . 1 . 486 . . 15 ARG CB . 19884 1 66 . 1 1 15 15 ARG N N 15 118.753 0.094 . 1 . 149 . . 15 ARG N . 19884 1 67 . 1 1 16 16 SER H H 1 9.447 0.014 . 1 . 162 . . 16 SER H . 19884 1 68 . 1 1 16 16 SER C C 13 174.244 0.013 . 1 . 732 . . 16 SER C . 19884 1 69 . 1 1 16 16 SER CA C 13 56.474 0.016 . 1 . 582 . . 16 SER CA . 19884 1 70 . 1 1 16 16 SER CB C 13 65.796 0.031 . 1 . 860 . . 16 SER CB . 19884 1 71 . 1 1 16 16 SER N N 15 119.642 0.112 . 1 . 163 . . 16 SER N . 19884 1 72 . 1 1 17 17 TYR H H 1 8.957 0.013 . 1 . 238 . . 17 TYR H . 19884 1 73 . 1 1 17 17 TYR C C 13 176.105 0.005 . 1 . 726 . . 17 TYR C . 19884 1 74 . 1 1 17 17 TYR CA C 13 61.486 0.012 . 1 . 386 . . 17 TYR CA . 19884 1 75 . 1 1 17 17 TYR CB C 13 37.876 0.018 . 1 . 658 . . 17 TYR CB . 19884 1 76 . 1 1 17 17 TYR N N 15 122.070 0.111 . 1 . 239 . . 17 TYR N . 19884 1 77 . 1 1 18 18 GLU H H 1 8.860 0.014 . 1 . 210 . . 18 GLU H . 19884 1 78 . 1 1 18 18 GLU C C 13 179.081 0.004 . 1 . 697 . . 18 GLU C . 19884 1 79 . 1 1 18 18 GLU CA C 13 59.477 0.015 . 1 . 455 . . 18 GLU CA . 19884 1 80 . 1 1 18 18 GLU CB C 13 28.183 0.018 . 1 . 634 . . 18 GLU CB . 19884 1 81 . 1 1 18 18 GLU N N 15 116.898 0.104 . 1 . 211 . . 18 GLU N . 19884 1 82 . 1 1 19 19 ASP H H 1 7.520 0.014 . 1 . 85 . . 19 ASP H . 19884 1 83 . 1 1 19 19 ASP C C 13 177.956 0.029 . 1 . 752 . . 19 ASP C . 19884 1 84 . 1 1 19 19 ASP CA C 13 57.377 0.022 . 1 . 378 . . 19 ASP CA . 19884 1 85 . 1 1 19 19 ASP CB C 13 41.277 0.037 . 1 . 884 . . 19 ASP CB . 19884 1 86 . 1 1 19 19 ASP N N 15 117.755 0.107 . 1 . 86 . . 19 ASP N . 19884 1 87 . 1 1 20 20 PHE H H 1 7.435 0.016 . 1 . 348 . . 20 PHE H . 19884 1 88 . 1 1 20 20 PHE C C 13 177.391 0.007 . 1 . 692 . . 20 PHE C . 19884 1 89 . 1 1 20 20 PHE CA C 13 62.326 0.017 . 1 . 557 . . 20 PHE CA . 19884 1 90 . 1 1 20 20 PHE CB C 13 38.795 0.016 . 1 . 1092 . . 20 PHE CB . 19884 1 91 . 1 1 20 20 PHE N N 15 116.066 0.117 . 1 . 349 . . 20 PHE N . 19884 1 92 . 1 1 21 21 GLN H H 1 8.846 0.014 . 1 . 57 . . 21 GLN H . 19884 1 93 . 1 1 21 21 GLN C C 13 177.779 0.004 . 1 . 770 . . 21 GLN C . 19884 1 94 . 1 1 21 21 GLN CA C 13 57.333 0.02 . 1 . 552 . . 21 GLN CA . 19884 1 95 . 1 1 21 21 GLN CB C 13 27.123 0.019 . 1 . 622 . . 21 GLN CB . 19884 1 96 . 1 1 21 21 GLN N N 15 121.601 0.11 . 1 . 58 . . 21 GLN N . 19884 1 97 . 1 1 22 22 LYS H H 1 7.389 0.015 . 1 . 23 . . 22 LYS H . 19884 1 98 . 1 1 22 22 LYS C C 13 178.933 . . 1 . 760 . . 22 LYS C . 19884 1 99 . 1 1 22 22 LYS CA C 13 59.767 . . 1 . 460 . . 22 LYS CA . 19884 1 100 . 1 1 22 22 LYS CB C 13 31.244 . . 1 . 540 . . 22 LYS CB . 19884 1 101 . 1 1 22 22 LYS N N 15 119.498 0.111 . 1 . 24 . . 22 LYS N . 19884 1 102 . 1 1 24 24 TYR CA C 13 60.424 . . 1 . 1173 . . 24 TYR CA . 19884 1 103 . 1 1 24 24 TYR CB C 13 36.473 0.028 . 1 . 1174 . . 24 TYR CB . 19884 1 104 . 1 1 25 25 ASN H H 1 8.756 0.025 . 1 . 939 . . 25 ASN H . 19884 1 105 . 1 1 25 25 ASN C C 13 176.836 . . 1 . 1171 . . 25 ASN C . 19884 1 106 . 1 1 25 25 ASN CA C 13 54.902 0.027 . 1 . 1172 . . 25 ASN CA . 19884 1 107 . 1 1 25 25 ASN CB C 13 36.196 . . 1 . 1232 . . 25 ASN CB . 19884 1 108 . 1 1 25 25 ASN N N 15 117.717 0.152 . 1 . 940 . . 25 ASN N . 19884 1 109 . 1 1 26 26 ALA H H 1 7.842 0.017 . 1 . 922 . . 26 ALA H . 19884 1 110 . 1 1 26 26 ALA CB C 13 18.481 . . 1 . 924 . . 26 ALA CB . 19884 1 111 . 1 1 26 26 ALA N N 15 123.090 0.174 . 1 . 923 . . 26 ALA N . 19884 1 112 . 1 1 27 27 ILE C C 13 177.010 . . 1 . 1187 . . 27 ILE C . 19884 1 113 . 1 1 27 27 ILE CA C 13 65.163 . . 1 . 1188 . . 27 ILE CA . 19884 1 114 . 1 1 27 27 ILE CB C 13 37.086 . . 1 . 1189 . . 27 ILE CB . 19884 1 115 . 1 1 28 28 ALA H H 1 9.125 0.018 . 1 . 1185 . . 28 ALA H . 19884 1 116 . 1 1 28 28 ALA C C 13 180.688 . . 1 . 1194 . . 28 ALA C . 19884 1 117 . 1 1 28 28 ALA CA C 13 54.949 0.068 . 1 . 1190 . . 28 ALA CA . 19884 1 118 . 1 1 28 28 ALA CB C 13 18.558 0.045 . 1 . 1191 . . 28 ALA CB . 19884 1 119 . 1 1 28 28 ALA N N 15 122.232 0.159 . 1 . 1186 . . 28 ALA N . 19884 1 120 . 1 1 29 29 LEU H H 1 9.322 0.019 . 1 . 1192 . . 29 LEU H . 19884 1 121 . 1 1 29 29 LEU C C 13 179.609 . . 1 . 1178 . . 29 LEU C . 19884 1 122 . 1 1 29 29 LEU CA C 13 57.324 . . 1 . 1169 . . 29 LEU CA . 19884 1 123 . 1 1 29 29 LEU CB C 13 40.674 0.051 . 1 . 1195 . . 29 LEU CB . 19884 1 124 . 1 1 29 29 LEU N N 15 121.657 0.168 . 1 . 1193 . . 29 LEU N . 19884 1 125 . 1 1 30 30 LYS H H 1 7.578 0.021 . 1 . 925 . . 30 LYS H . 19884 1 126 . 1 1 30 30 LYS C C 13 178.610 0.038 . 1 . 1177 . . 30 LYS C . 19884 1 127 . 1 1 30 30 LYS CA C 13 59.259 0.007 . 1 . 1175 . . 30 LYS CA . 19884 1 128 . 1 1 30 30 LYS CB C 13 35.504 . . 1 . 1176 . . 30 LYS CB . 19884 1 129 . 1 1 30 30 LYS N N 15 123.293 0.126 . 1 . 926 . . 30 LYS N . 19884 1 130 . 1 1 31 31 LEU H H 1 8.730 0.016 . 1 . 1196 . . 31 LEU H . 19884 1 131 . 1 1 31 31 LEU C C 13 180.091 0.023 . 1 . 712 . . 31 LEU C . 19884 1 132 . 1 1 31 31 LEU CA C 13 56.989 0.066 . 1 . 467 . . 31 LEU CA . 19884 1 133 . 1 1 31 31 LEU CB C 13 41.490 0.031 . 1 . 1198 . . 31 LEU CB . 19884 1 134 . 1 1 31 31 LEU N N 15 120.584 0.149 . 1 . 1197 . . 31 LEU N . 19884 1 135 . 1 1 32 32 ARG H H 1 7.476 0.016 . 1 . 160 . . 32 ARG H . 19884 1 136 . 1 1 32 32 ARG C C 13 177.808 0.015 . 1 . 775 . . 32 ARG C . 19884 1 137 . 1 1 32 32 ARG CA C 13 58.168 0.032 . 1 . 1102 . . 32 ARG CA . 19884 1 138 . 1 1 32 32 ARG CB C 13 30.809 0.038 . 1 . 679 . . 32 ARG CB . 19884 1 139 . 1 1 32 32 ARG N N 15 117.585 0.128 . 1 . 161 . . 32 ARG N . 19884 1 140 . 1 1 33 33 GLU H H 1 7.921 0.014 . 1 . 312 . . 33 GLU H . 19884 1 141 . 1 1 33 33 GLU C C 13 177.907 0.015 . 1 . 976 . . 33 GLU C . 19884 1 142 . 1 1 33 33 GLU CA C 13 58.132 0.003 . 1 . 1115 . . 33 GLU CA . 19884 1 143 . 1 1 33 33 GLU CB C 13 29.954 0.024 . 1 . 1114 . . 33 GLU CB . 19884 1 144 . 1 1 33 33 GLU N N 15 118.246 0.129 . 1 . 313 . . 33 GLU N . 19884 1 145 . 1 1 34 34 ASP H H 1 8.680 0.013 . 1 . 220 . . 34 ASP H . 19884 1 146 . 1 1 34 34 ASP C C 13 177.559 0.001 . 1 . 977 . . 34 ASP C . 19884 1 147 . 1 1 34 34 ASP CA C 13 52.732 0.005 . 1 . 954 . . 34 ASP CA . 19884 1 148 . 1 1 34 34 ASP CB C 13 37.899 0.029 . 1 . 889 . . 34 ASP CB . 19884 1 149 . 1 1 34 34 ASP N N 15 123.019 0.122 . 1 . 221 . . 34 ASP N . 19884 1 150 . 1 1 35 35 ASP H H 1 8.327 0.02 . 1 . 184 . . 35 ASP H . 19884 1 151 . 1 1 35 35 ASP C C 13 176.478 0.016 . 1 . 848 . . 35 ASP C . 19884 1 152 . 1 1 35 35 ASP CA C 13 54.572 0.037 . 1 . 415 . . 35 ASP CA . 19884 1 153 . 1 1 35 35 ASP CB C 13 39.295 0.053 . 1 . 504 . . 35 ASP CB . 19884 1 154 . 1 1 35 35 ASP N N 15 119.591 0.104 . 1 . 185 . . 35 ASP N . 19884 1 155 . 1 1 36 36 GLU H H 1 8.365 0.013 . 1 . 895 . . 36 GLU H . 19884 1 156 . 1 1 36 36 GLU C C 13 177.277 0.04 . 1 . 751 . . 36 GLU C . 19884 1 157 . 1 1 36 36 GLU CA C 13 56.696 0.01 . 1 . 556 . . 36 GLU CA . 19884 1 158 . 1 1 36 36 GLU CB C 13 28.830 0.016 . 1 . 626 . . 36 GLU CB . 19884 1 159 . 1 1 36 36 GLU N N 15 117.859 0.122 . 1 . 896 . . 36 GLU N . 19884 1 160 . 1 1 37 37 TYR H H 1 6.896 0.014 . 1 . 51 . . 37 TYR H . 19884 1 161 . 1 1 37 37 TYR C C 13 174.229 0.004 . 1 . 768 . . 37 TYR C . 19884 1 162 . 1 1 37 37 TYR CA C 13 58.658 0.012 . 1 . 447 . . 37 TYR CA . 19884 1 163 . 1 1 37 37 TYR CB C 13 40.354 0.024 . 1 . 530 . . 37 TYR CB . 19884 1 164 . 1 1 37 37 TYR N N 15 121.377 0.114 . 1 . 52 . . 37 TYR N . 19884 1 165 . 1 1 38 38 ASP H H 1 8.181 0.012 . 1 . 212 . . 38 ASP H . 19884 1 166 . 1 1 38 38 ASP C C 13 175.642 0.007 . 1 . 836 . . 38 ASP C . 19884 1 167 . 1 1 38 38 ASP CA C 13 53.281 0.007 . 1 . 470 . . 38 ASP CA . 19884 1 168 . 1 1 38 38 ASP CB C 13 38.606 0.03 . 1 . 547 . . 38 ASP CB . 19884 1 169 . 1 1 38 38 ASP N N 15 128.139 0.116 . 1 . 213 . . 38 ASP N . 19884 1 170 . 1 1 39 39 ASN H H 1 8.534 0.013 . 1 . 1144 . . 39 ASN H . 19884 1 171 . 1 1 39 39 ASN C C 13 175.052 0.003 . 1 . 1143 . . 39 ASN C . 19884 1 172 . 1 1 39 39 ASN CA C 13 54.560 0.013 . 1 . 855 . . 39 ASN CA . 19884 1 173 . 1 1 39 39 ASN CB C 13 36.742 0.045 . 1 . 1118 . . 39 ASN CB . 19884 1 174 . 1 1 39 39 ASN N N 15 114.984 0.117 . 1 . 1145 . . 39 ASN N . 19884 1 175 . 1 1 40 40 TYR H H 1 7.516 0.013 . 1 . 49 . . 40 TYR H . 19884 1 176 . 1 1 40 40 TYR C C 13 176.986 0.008 . 1 . 767 . . 40 TYR C . 19884 1 177 . 1 1 40 40 TYR CA C 13 60.139 0.05 . 1 . 1046 . . 40 TYR CA . 19884 1 178 . 1 1 40 40 TYR CB C 13 33.037 0.009 . 1 . 1047 . . 40 TYR CB . 19884 1 179 . 1 1 40 40 TYR N N 15 109.089 0.129 . 1 . 50 . . 40 TYR N . 19884 1 180 . 1 1 41 41 ILE H H 1 8.000 0.013 . 1 . 95 . . 41 ILE H . 19884 1 181 . 1 1 41 41 ILE C C 13 179.193 0.003 . 1 . 779 . . 41 ILE C . 19884 1 182 . 1 1 41 41 ILE CA C 13 65.886 0.019 . 1 . 452 . . 41 ILE CA . 19884 1 183 . 1 1 41 41 ILE CB C 13 38.442 0.019 . 1 . 534 . . 41 ILE CB . 19884 1 184 . 1 1 41 41 ILE N N 15 124.278 0.114 . 1 . 96 . . 41 ILE N . 19884 1 185 . 1 1 42 42 GLY H H 1 8.786 0.015 . 1 . 208 . . 42 GLY H . 19884 1 186 . 1 1 42 42 GLY C C 13 173.706 0.012 . 1 . 881 . . 42 GLY C . 19884 1 187 . 1 1 42 42 GLY CA C 13 44.455 0.028 . 1 . 1040 . . 42 GLY CA . 19884 1 188 . 1 1 42 42 GLY N N 15 107.557 0.126 . 1 . 209 . . 42 GLY N . 19884 1 189 . 1 1 43 43 TYR H H 1 9.686 0.011 . 1 . 282 . . 43 TYR H . 19884 1 190 . 1 1 43 43 TYR C C 13 175.524 0.012 . 1 . 798 . . 43 TYR C . 19884 1 191 . 1 1 43 43 TYR CA C 13 60.265 0.019 . 1 . 597 . . 43 TYR CA . 19884 1 192 . 1 1 43 43 TYR CB C 13 38.925 0.017 . 1 . 883 . . 43 TYR CB . 19884 1 193 . 1 1 43 43 TYR N N 15 116.071 0.092 . 1 . 283 . . 43 TYR N . 19884 1 194 . 1 1 44 44 GLY H H 1 9.814 0.014 . 1 . 352 . . 44 GLY H . 19884 1 195 . 1 1 44 44 GLY C C 13 174.904 . . 1 . 814 . . 44 GLY C . 19884 1 196 . 1 1 44 44 GLY CA C 13 48.825 . . 1 . 446 . . 44 GLY CA . 19884 1 197 . 1 1 44 44 GLY N N 15 109.621 0.133 . 1 . 353 . . 44 GLY N . 19884 1 198 . 1 1 48 48 VAL C C 13 176.081 0.015 . 1 . 1159 . . 48 VAL C . 19884 1 199 . 1 1 48 48 VAL CA C 13 61.901 . . 1 . 613 . . 48 VAL CA . 19884 1 200 . 1 1 48 48 VAL CB C 13 30.092 . . 1 . 1160 . . 48 VAL CB . 19884 1 201 . 1 1 49 49 ARG H H 1 9.191 0.012 . 1 . 1157 . . 49 ARG H . 19884 1 202 . 1 1 49 49 ARG C C 13 173.049 0.027 . 1 . 990 . . 49 ARG C . 19884 1 203 . 1 1 49 49 ARG CA C 13 56.766 0.042 . 1 . 992 . . 49 ARG CA . 19884 1 204 . 1 1 49 49 ARG CB C 13 31.906 0.085 . 1 . 1161 . . 49 ARG CB . 19884 1 205 . 1 1 49 49 ARG N N 15 124.868 0.144 . 1 . 1158 . . 49 ARG N . 19884 1 206 . 1 1 50 50 LEU H H 1 7.935 0.017 . 1 . 987 . . 50 LEU H . 19884 1 207 . 1 1 50 50 LEU C C 13 171.959 0.017 . 1 . 989 . . 50 LEU C . 19884 1 208 . 1 1 50 50 LEU CA C 13 52.900 0.019 . 1 . 991 . . 50 LEU CA . 19884 1 209 . 1 1 50 50 LEU CB C 13 33.511 0.037 . 1 . 483 . . 50 LEU CB . 19884 1 210 . 1 1 50 50 LEU N N 15 126.643 0.117 . 1 . 988 . . 50 LEU N . 19884 1 211 . 1 1 51 51 ALA H H 1 6.625 0.012 . 1 . 108 . . 51 ALA H . 19884 1 212 . 1 1 51 51 ALA C C 13 176.852 . . 1 . 785 . . 51 ALA C . 19884 1 213 . 1 1 51 51 ALA CA C 13 49.628 . . 1 . 442 . . 51 ALA CA . 19884 1 214 . 1 1 51 51 ALA CB C 13 22.243 . . 1 . 526 . . 51 ALA CB . 19884 1 215 . 1 1 51 51 ALA N N 15 121.389 0.108 . 1 . 109 . . 51 ALA N . 19884 1 216 . 1 1 53 53 HIS CA C 13 57.130 . . 1 . 590 . . 53 HIS CA . 19884 1 217 . 1 1 53 53 HIS CB C 13 27.993 . . 1 . 888 . . 53 HIS CB . 19884 1 218 . 1 1 54 54 THR H H 1 7.719 0.015 . 1 . 298 . . 54 THR H . 19884 1 219 . 1 1 54 54 THR CB C 13 69.067 . . 1 . 1108 . . 54 THR CB . 19884 1 220 . 1 1 54 54 THR N N 15 117.584 0.142 . 1 . 299 . . 54 THR N . 19884 1 221 . 1 1 57 57 THR C C 13 173.576 0.097 . 1 . 1135 . . 57 THR C . 19884 1 222 . 1 1 57 57 THR CA C 13 59.632 0.011 . 1 . 1109 . . 57 THR CA . 19884 1 223 . 1 1 57 57 THR CB C 13 69.198 . . 1 . 1134 . . 57 THR CB . 19884 1 224 . 1 1 58 58 TRP H H 1 6.721 0.015 . 1 . 350 . . 58 TRP H . 19884 1 225 . 1 1 58 58 TRP C C 13 173.693 0.005 . 1 . 1062 . . 58 TRP C . 19884 1 226 . 1 1 58 58 TRP CA C 13 58.685 0.012 . 1 . 445 . . 58 TRP CA . 19884 1 227 . 1 1 58 58 TRP CB C 13 27.641 0.031 . 1 . 529 . . 58 TRP CB . 19884 1 228 . 1 1 58 58 TRP N N 15 121.686 0.115 . 1 . 351 . . 58 TRP N . 19884 1 229 . 1 1 59 59 ASP H H 1 7.339 0.012 . 1 . 120 . . 59 ASP H . 19884 1 230 . 1 1 59 59 ASP C C 13 175.021 0.004 . 1 . 788 . . 59 ASP C . 19884 1 231 . 1 1 59 59 ASP CA C 13 52.059 0.019 . 1 . 402 . . 59 ASP CA . 19884 1 232 . 1 1 59 59 ASP CB C 13 42.039 0.015 . 1 . 494 . . 59 ASP CB . 19884 1 233 . 1 1 59 59 ASP N N 15 125.694 0.138 . 1 . 121 . . 59 ASP N . 19884 1 234 . 1 1 60 60 LYS H H 1 6.811 0.016 . 1 . 33 . . 60 LYS H . 19884 1 235 . 1 1 60 60 LYS C C 13 177.262 0.013 . 1 . 763 . . 60 LYS C . 19884 1 236 . 1 1 60 60 LYS CA C 13 56.491 0.021 . 1 . 868 . . 60 LYS CA . 19884 1 237 . 1 1 60 60 LYS CB C 13 31.406 0.015 . 1 . 478 . . 60 LYS CB . 19884 1 238 . 1 1 60 60 LYS N N 15 122.736 0.112 . 1 . 34 . . 60 LYS N . 19884 1 239 . 1 1 61 61 HIS H H 1 8.842 0.015 . 1 . 27 . . 61 HIS H . 19884 1 240 . 1 1 61 61 HIS C C 13 175.595 0.007 . 1 . 761 . . 61 HIS C . 19884 1 241 . 1 1 61 61 HIS CA C 13 58.419 0.021 . 1 . 387 . . 61 HIS CA . 19884 1 242 . 1 1 61 61 HIS CB C 13 27.197 0.026 . 1 . 485 . . 61 HIS CB . 19884 1 243 . 1 1 61 61 HIS N N 15 119.000 0.111 . 1 . 28 . . 61 HIS N . 19884 1 244 . 1 1 62 62 ASP H H 1 6.846 0.015 . 1 . 296 . . 62 ASP H . 19884 1 245 . 1 1 62 62 ASP C C 13 176.082 0.025 . 1 . 803 . . 62 ASP C . 19884 1 246 . 1 1 62 62 ASP CA C 13 51.909 0.017 . 1 . 422 . . 62 ASP CA . 19884 1 247 . 1 1 62 62 ASP CB C 13 40.880 0.038 . 1 . 509 . . 62 ASP CB . 19884 1 248 . 1 1 62 62 ASP N N 15 114.272 0.114 . 1 . 297 . . 62 ASP N . 19884 1 249 . 1 1 63 63 ASN H H 1 8.285 0.017 . 1 . 374 . . 63 ASN H . 19884 1 250 . 1 1 63 63 ASN C C 13 174.450 0.023 . 1 . 812 . . 63 ASN C . 19884 1 251 . 1 1 63 63 ASN CA C 13 53.144 0.026 . 1 . 874 . . 63 ASN CA . 19884 1 252 . 1 1 63 63 ASN CB C 13 38.017 0.042 . 1 . 535 . . 63 ASN CB . 19884 1 253 . 1 1 63 63 ASN N N 15 117.501 0.108 . 1 . 375 . . 63 ASN N . 19884 1 254 . 1 1 64 64 THR H H 1 7.557 0.014 . 1 . 342 . . 64 THR H . 19884 1 255 . 1 1 64 64 THR C C 13 175.582 0.027 . 1 . 811 . . 64 THR C . 19884 1 256 . 1 1 64 64 THR CA C 13 60.530 0.011 . 1 . 432 . . 64 THR CA . 19884 1 257 . 1 1 64 64 THR CB C 13 71.469 0.042 . 1 . 627 . . 64 THR CB . 19884 1 258 . 1 1 64 64 THR N N 15 108.356 0.128 . 1 . 343 . . 64 THR N . 19884 1 259 . 1 1 65 65 GLY H H 1 8.348 0.015 . 1 . 53 . . 65 GLY H . 19884 1 260 . 1 1 65 65 GLY C C 13 175.879 0.011 . 1 . 769 . . 65 GLY C . 19884 1 261 . 1 1 65 65 GLY CA C 13 44.259 0.048 . 1 . 471 . . 65 GLY CA . 19884 1 262 . 1 1 65 65 GLY N N 15 105.385 0.13 . 1 . 54 . . 65 GLY N . 19884 1 263 . 1 1 66 66 GLY H H 1 7.816 0.015 . 1 . 152 . . 66 GLY H . 19884 1 264 . 1 1 66 66 GLY C C 13 172.947 0.03 . 1 . 835 . . 66 GLY C . 19884 1 265 . 1 1 66 66 GLY CA C 13 43.572 0.026 . 1 . 1048 . . 66 GLY CA . 19884 1 266 . 1 1 66 66 GLY N N 15 107.555 0.1 . 1 . 153 . . 66 GLY N . 19884 1 267 . 1 1 67 67 SER H H 1 8.473 0.014 . 1 . 206 . . 67 SER H . 19884 1 268 . 1 1 67 67 SER C C 13 177.479 0.029 . 1 . 1018 . . 67 SER C . 19884 1 269 . 1 1 67 67 SER CA C 13 59.524 0.015 . 1 . 1049 . . 67 SER CA . 19884 1 270 . 1 1 67 67 SER CB C 13 63.516 0.058 . 1 . 637 . . 67 SER CB . 19884 1 271 . 1 1 67 67 SER N N 15 111.724 0.104 . 1 . 207 . . 67 SER N . 19884 1 272 . 1 1 68 68 TYR H H 1 8.350 0.013 . 1 . 224 . . 68 TYR H . 19884 1 273 . 1 1 68 68 TYR C C 13 175.409 0.003 . 1 . 1021 . . 68 TYR C . 19884 1 274 . 1 1 68 68 TYR CA C 13 62.471 0.011 . 1 . 1020 . . 68 TYR CA . 19884 1 275 . 1 1 68 68 TYR CB C 13 37.328 0.023 . 1 . 1019 . . 68 TYR CB . 19884 1 276 . 1 1 68 68 TYR N N 15 122.348 0.113 . 1 . 225 . . 68 TYR N . 19884 1 277 . 1 1 69 69 GLY H H 1 8.315 0.013 . 1 . 615 . . 69 GLY H . 19884 1 278 . 1 1 69 69 GLY C C 13 175.932 0.014 . 1 . 1013 . . 69 GLY C . 19884 1 279 . 1 1 69 69 GLY CA C 13 45.921 0.016 . 1 . 404 . . 69 GLY CA . 19884 1 280 . 1 1 69 69 GLY N N 15 98.827 . . 1 . 1236 . . 69 GLY N . 19884 1 281 . 1 1 70 70 GLY H H 1 7.608 0.011 . 1 . 254 . . 70 GLY H . 19884 1 282 . 1 1 70 70 GLY C C 13 177.638 . . 1 . 1050 . . 70 GLY C . 19884 1 283 . 1 1 70 70 GLY CA C 13 46.846 0.045 . 1 . 1025 . . 70 GLY CA . 19884 1 284 . 1 1 70 70 GLY N N 15 109.689 0.015 . 1 . 255 . . 70 GLY N . 19884 1 285 . 1 1 71 71 THR H H 1 7.433 0.014 . 1 . 186 . . 71 THR H . 19884 1 286 . 1 1 71 71 THR C C 13 174.076 0.035 . 1 . 694 . . 71 THR C . 19884 1 287 . 1 1 71 71 THR CA C 13 64.025 0.041 . 1 . 1044 . . 71 THR CA . 19884 1 288 . 1 1 71 71 THR CB C 13 66.952 0.082 . 1 . 1043 . . 71 THR CB . 19884 1 289 . 1 1 71 71 THR N N 15 111.991 0.107 . 1 . 187 . . 71 THR N . 19884 1 290 . 1 1 72 72 TYR H H 1 8.061 0.015 . 1 . 932 . . 72 TYR H . 19884 1 291 . 1 1 72 72 TYR C C 13 170.818 0.006 . 1 . 880 . . 72 TYR C . 19884 1 292 . 1 1 72 72 TYR CA C 13 59.163 0.097 . 1 . 466 . . 72 TYR CA . 19884 1 293 . 1 1 72 72 TYR CB C 13 38.278 0.033 . 1 . 646 . . 72 TYR CB . 19884 1 294 . 1 1 72 72 TYR N N 15 124.191 0.119 . 1 . 933 . . 72 TYR N . 19884 1 295 . 1 1 73 73 ARG H H 1 6.509 0.016 . 1 . 164 . . 73 ARG H . 19884 1 296 . 1 1 73 73 ARG C C 13 175.991 0.01 . 1 . 738 . . 73 ARG C . 19884 1 297 . 1 1 73 73 ARG CA C 13 55.450 0.015 . 1 . 588 . . 73 ARG CA . 19884 1 298 . 1 1 73 73 ARG CB C 13 28.358 0.038 . 1 . 669 . . 73 ARG CB . 19884 1 299 . 1 1 73 73 ARG N N 15 107.928 0.118 . 1 . 165 . . 73 ARG N . 19884 1 300 . 1 1 74 74 PHE H H 1 7.964 0.016 . 1 . 276 . . 74 PHE H . 19884 1 301 . 1 1 74 74 PHE C C 13 176.267 0.007 . 1 . 796 . . 74 PHE C . 19884 1 302 . 1 1 74 74 PHE CA C 13 57.094 0.024 . 1 . 392 . . 74 PHE CA . 19884 1 303 . 1 1 74 74 PHE CB C 13 37.732 0.044 . 1 . 490 . . 74 PHE CB . 19884 1 304 . 1 1 74 74 PHE N N 15 123.354 0.127 . 1 . 277 . . 74 PHE N . 19884 1 305 . 1 1 75 75 LYS H H 1 8.605 0.014 . 1 . 1005 . . 75 LYS H . 19884 1 306 . 1 1 75 75 LYS C C 13 176.804 0.003 . 1 . 711 . . 75 LYS C . 19884 1 307 . 1 1 75 75 LYS CA C 13 58.628 0.053 . 1 . 390 . . 75 LYS CA . 19884 1 308 . 1 1 75 75 LYS CB C 13 31.487 0.025 . 1 . 648 . . 75 LYS CB . 19884 1 309 . 1 1 75 75 LYS N N 15 121.961 0.114 . 1 . 1006 . . 75 LYS N . 19884 1 310 . 1 1 76 76 LYS H H 1 8.349 0.015 . 1 . 158 . . 76 LYS H . 19884 1 311 . 1 1 76 76 LYS C C 13 177.243 0.001 . 1 . 759 . . 76 LYS C . 19884 1 312 . 1 1 76 76 LYS CA C 13 59.408 . . 1 . 389 . . 76 LYS CA . 19884 1 313 . 1 1 76 76 LYS CB C 13 31.447 . . 1 . 487 . . 76 LYS CB . 19884 1 314 . 1 1 76 76 LYS N N 15 117.336 0.121 . 1 . 159 . . 76 LYS N . 19884 1 315 . 1 1 77 77 GLU H H 1 6.289 0.004 . 1 . 21 . . 77 GLU H . 19884 1 316 . 1 1 77 77 GLU C C 13 178.752 0.017 . 1 . 1022 . . 77 GLU C . 19884 1 317 . 1 1 77 77 GLU CA C 13 57.071 0.033 . 1 . 399 . . 77 GLU CA . 19884 1 318 . 1 1 77 77 GLU CB C 13 29.372 0.039 . 1 . 1023 . . 77 GLU CB . 19884 1 319 . 1 1 77 77 GLU N N 15 118.446 0.013 . 1 . 22 . . 77 GLU N . 19884 1 320 . 1 1 78 78 PHE H H 1 8.027 0.013 . 1 . 69 . . 78 PHE H . 19884 1 321 . 1 1 78 78 PHE C C 13 177.459 0.121 . 1 . 1007 . . 78 PHE C . 19884 1 322 . 1 1 78 78 PHE CA C 13 59.974 0.01 . 1 . 1024 . . 78 PHE CA . 19884 1 323 . 1 1 78 78 PHE CB C 13 37.126 0.024 . 1 . 651 . . 78 PHE CB . 19884 1 324 . 1 1 78 78 PHE N N 15 124.214 0.132 . 1 . 70 . . 78 PHE N . 19884 1 325 . 1 1 79 79 ASN H H 1 7.436 0.016 . 1 . 372 . . 79 ASN H . 19884 1 326 . 1 1 79 79 ASN C C 13 174.046 0.003 . 1 . 1045 . . 79 ASN C . 19884 1 327 . 1 1 79 79 ASN CA C 13 52.007 0.004 . 1 . 418 . . 79 ASN CA . 19884 1 328 . 1 1 79 79 ASN CB C 13 37.531 0.043 . 1 . 877 . . 79 ASN CB . 19884 1 329 . 1 1 79 79 ASN N N 15 112.004 0.122 . 1 . 373 . . 79 ASN N . 19884 1 330 . 1 1 80 80 ASP H H 1 6.702 0.02 . 1 . 73 . . 80 ASP H . 19884 1 331 . 1 1 80 80 ASP C C 13 177.233 . . 1 . 774 . . 80 ASP C . 19884 1 332 . 1 1 80 80 ASP CB C 13 40.925 . . 1 . 511 . . 80 ASP CB . 19884 1 333 . 1 1 80 80 ASP N N 15 123.926 0.116 . 1 . 74 . . 80 ASP N . 19884 1 334 . 1 1 82 82 SER C C 13 170.372 0.03 . 1 . 749 . . 82 SER C . 19884 1 335 . 1 1 82 82 SER CA C 13 57.193 0.005 . 1 . 596 . . 82 SER CA . 19884 1 336 . 1 1 82 82 SER CB C 13 62.578 0.049 . 1 . 678 . . 82 SER CB . 19884 1 337 . 1 1 83 83 ASN H H 1 8.288 0.012 . 1 . 340 . . 83 ASN H . 19884 1 338 . 1 1 83 83 ASN C C 13 181.281 . . 1 . 762 . . 83 ASN C . 19884 1 339 . 1 1 83 83 ASN CA C 13 57.861 . . 1 . 951 . . 83 ASN CA . 19884 1 340 . 1 1 83 83 ASN CB C 13 32.523 . . 1 . 474 . . 83 ASN CB . 19884 1 341 . 1 1 83 83 ASN N N 15 127.402 0.104 . 1 . 341 . . 83 ASN N . 19884 1 342 . 1 1 84 84 ALA C C 13 177.548 0.0 . 1 . 695 . . 84 ALA C . 19884 1 343 . 1 1 84 84 ALA CA C 13 54.364 0.011 . 1 . 457 . . 84 ALA CA . 19884 1 344 . 1 1 84 84 ALA CB C 13 17.306 0.001 . 1 . 632 . . 84 ALA CB . 19884 1 345 . 1 1 85 85 GLY H H 1 8.260 0.017 . 1 . 77 . . 85 GLY H . 19884 1 346 . 1 1 85 85 GLY CA C 13 44.546 . . 1 . 458 . . 85 GLY CA . 19884 1 347 . 1 1 85 85 GLY N N 15 114.422 0.125 . 1 . 78 . . 85 GLY N . 19884 1 348 . 1 1 86 86 LEU C C 13 177.877 0.011 . 1 . 717 . . 86 LEU C . 19884 1 349 . 1 1 86 86 LEU CA C 13 55.552 0.016 . 1 . 575 . . 86 LEU CA . 19884 1 350 . 1 1 86 86 LEU CB C 13 38.518 0.04 . 1 . 655 . . 86 LEU CB . 19884 1 351 . 1 1 87 87 GLN H H 1 9.236 0.015 . 1 . 200 . . 87 GLN H . 19884 1 352 . 1 1 87 87 GLN C C 13 178.261 0.042 . 1 . 828 . . 87 GLN C . 19884 1 353 . 1 1 87 87 GLN CA C 13 58.559 0.021 . 1 . 433 . . 87 GLN CA . 19884 1 354 . 1 1 87 87 GLN CB C 13 25.675 0.013 . 1 . 518 . . 87 GLN CB . 19884 1 355 . 1 1 87 87 GLN N N 15 121.848 0.119 . 1 . 201 . . 87 GLN N . 19884 1 356 . 1 1 88 88 ASN H H 1 7.311 0.014 . 1 . 61 . . 88 ASN H . 19884 1 357 . 1 1 88 88 ASN C C 13 178.356 . . 1 . 741 . . 88 ASN C . 19884 1 358 . 1 1 88 88 ASN CA C 13 56.018 0.023 . 1 . 469 . . 88 ASN CA . 19884 1 359 . 1 1 88 88 ASN CB C 13 38.068 0.041 . 1 . 546 . . 88 ASN CB . 19884 1 360 . 1 1 88 88 ASN N N 15 116.394 0.112 . 1 . 62 . . 88 ASN N . 19884 1 361 . 1 1 89 89 GLY H H 1 7.428 0.017 . 1 . 292 . . 89 GLY H . 19884 1 362 . 1 1 89 89 GLY C C 13 173.513 0.004 . 1 . 727 . . 89 GLY C . 19884 1 363 . 1 1 89 89 GLY CA C 13 46.418 0.038 . 1 . 1051 . . 89 GLY CA . 19884 1 364 . 1 1 89 89 GLY N N 15 107.234 0.134 . 1 . 293 . . 89 GLY N . 19884 1 365 . 1 1 90 90 PHE H H 1 7.812 0.012 . 1 . 214 . . 90 PHE H . 19884 1 366 . 1 1 90 90 PHE C C 13 177.472 0.005 . 1 . 1133 . . 90 PHE C . 19884 1 367 . 1 1 90 90 PHE CA C 13 61.738 0.019 . 1 . 1132 . . 90 PHE CA . 19884 1 368 . 1 1 90 90 PHE CB C 13 39.042 0.033 . 1 . 1131 . . 90 PHE CB . 19884 1 369 . 1 1 90 90 PHE N N 15 122.809 0.1 . 1 . 215 . . 90 PHE N . 19884 1 370 . 1 1 91 91 LYS H H 1 8.450 0.015 . 1 . 306 . . 91 LYS H . 19884 1 371 . 1 1 91 91 LYS C C 13 178.976 0.016 . 1 . 1065 . . 91 LYS C . 19884 1 372 . 1 1 91 91 LYS CA C 13 58.321 0.015 . 1 . 1064 . . 91 LYS CA . 19884 1 373 . 1 1 91 91 LYS CB C 13 31.174 0.028 . 1 . 1063 . . 91 LYS CB . 19884 1 374 . 1 1 91 91 LYS N N 15 117.732 0.115 . 1 . 307 . . 91 LYS N . 19884 1 375 . 1 1 92 92 PHE H H 1 7.129 0.015 . 1 . 110 . . 92 PHE H . 19884 1 376 . 1 1 92 92 PHE C C 13 175.713 0.004 . 1 . 1039 . . 92 PHE C . 19884 1 377 . 1 1 92 92 PHE CA C 13 60.471 0.018 . 1 . 1038 . . 92 PHE CA . 19884 1 378 . 1 1 92 92 PHE CB C 13 37.851 0.034 . 1 . 1037 . . 92 PHE CB . 19884 1 379 . 1 1 92 92 PHE N N 15 121.115 0.115 . 1 . 111 . . 92 PHE N . 19884 1 380 . 1 1 93 93 LEU H H 1 7.152 0.014 . 1 . 47 . . 93 LEU H . 19884 1 381 . 1 1 93 93 LEU C C 13 178.488 0.036 . 1 . 821 . . 93 LEU C . 19884 1 382 . 1 1 93 93 LEU CA C 13 55.009 0.017 . 1 . 438 . . 93 LEU CA . 19884 1 383 . 1 1 93 93 LEU CB C 13 41.812 0.018 . 1 . 523 . . 93 LEU CB . 19884 1 384 . 1 1 93 93 LEU N N 15 114.081 0.119 . 1 . 48 . . 93 LEU N . 19884 1 385 . 1 1 94 94 GLU H H 1 7.633 0.014 . 1 . 190 . . 94 GLU H . 19884 1 386 . 1 1 94 94 GLU C C 13 175.909 . . 1 . 813 . . 94 GLU C . 19884 1 387 . 1 1 94 94 GLU CA C 13 61.266 . . 1 . 423 . . 94 GLU CA . 19884 1 388 . 1 1 94 94 GLU CB C 13 26.634 . . 1 . 510 . . 94 GLU CB . 19884 1 389 . 1 1 94 94 GLU N N 15 122.907 0.118 . 1 . 191 . . 94 GLU N . 19884 1 390 . 1 1 95 95 PRO C C 13 179.871 0.011 . 1 . 745 . . 95 PRO C . 19884 1 391 . 1 1 95 95 PRO CA C 13 64.866 0.023 . 1 . 593 . . 95 PRO CA . 19884 1 392 . 1 1 95 95 PRO CB C 13 29.915 0.039 . 1 . 674 . . 95 PRO CB . 19884 1 393 . 1 1 96 96 ILE H H 1 6.620 0.015 . 1 . 328 . . 96 ILE H . 19884 1 394 . 1 1 96 96 ILE C C 13 177.542 0.021 . 1 . 809 . . 96 ILE C . 19884 1 395 . 1 1 96 96 ILE CA C 13 62.961 0.024 . 1 . 427 . . 96 ILE CA . 19884 1 396 . 1 1 96 96 ILE CB C 13 35.525 0.044 . 1 . 515 . . 96 ILE CB . 19884 1 397 . 1 1 96 96 ILE N N 15 119.115 0.113 . 1 . 329 . . 96 ILE N . 19884 1 398 . 1 1 97 97 HIS H H 1 8.170 0.012 . 1 . 83 . . 97 HIS H . 19884 1 399 . 1 1 97 97 HIS C C 13 177.560 0.001 . 1 . 720 . . 97 HIS C . 19884 1 400 . 1 1 97 97 HIS CA C 13 55.289 0.015 . 1 . 435 . . 97 HIS CA . 19884 1 401 . 1 1 97 97 HIS CB C 13 28.464 0.031 . 1 . 898 . . 97 HIS CB . 19884 1 402 . 1 1 97 97 HIS N N 15 120.955 0.116 . 1 . 84 . . 97 HIS N . 19884 1 403 . 1 1 98 98 LYS H H 1 7.582 0.013 . 1 . 194 . . 98 LYS H . 19884 1 404 . 1 1 98 98 LYS C C 13 177.811 0.012 . 1 . 724 . . 98 LYS C . 19884 1 405 . 1 1 98 98 LYS CA C 13 57.988 0.047 . 1 . 576 . . 98 LYS CA . 19884 1 406 . 1 1 98 98 LYS CB C 13 31.151 0.024 . 1 . 656 . . 98 LYS CB . 19884 1 407 . 1 1 98 98 LYS N N 15 115.270 0.127 . 1 . 195 . . 98 LYS N . 19884 1 408 . 1 1 99 99 GLU H H 1 7.064 0.014 . 1 . 202 . . 99 GLU H . 19884 1 409 . 1 1 99 99 GLU C C 13 175.751 0.058 . 1 . 1031 . . 99 GLU C . 19884 1 410 . 1 1 99 99 GLU CA C 13 57.178 0.039 . 1 . 1030 . . 99 GLU CA . 19884 1 411 . 1 1 99 99 GLU CB C 13 28.517 0.014 . 1 . 944 . . 99 GLU CB . 19884 1 412 . 1 1 99 99 GLU N N 15 119.319 0.116 . 1 . 203 . . 99 GLU N . 19884 1 413 . 1 1 100 100 PHE H H 1 7.349 0.018 . 1 . 941 . . 100 PHE H . 19884 1 414 . 1 1 100 100 PHE CA C 13 53.458 . . 1 . 1035 . . 100 PHE CA . 19884 1 415 . 1 1 100 100 PHE CB C 13 38.089 . . 1 . 943 . . 100 PHE CB . 19884 1 416 . 1 1 100 100 PHE N N 15 116.778 0.123 . 1 . 942 . . 100 PHE N . 19884 1 417 . 1 1 101 101 PRO C C 13 175.814 0.006 . 1 . 733 . . 101 PRO C . 19884 1 418 . 1 1 101 101 PRO CA C 13 64.486 0.047 . 1 . 398 . . 101 PRO CA . 19884 1 419 . 1 1 101 101 PRO CB C 13 30.536 0.011 . 1 . 858 . . 101 PRO CB . 19884 1 420 . 1 1 102 102 TRP H H 1 6.639 0.014 . 1 . 240 . . 102 TRP H . 19884 1 421 . 1 1 102 102 TRP C C 13 177.092 0.027 . 1 . 840 . . 102 TRP C . 19884 1 422 . 1 1 102 102 TRP CA C 13 53.665 0.02 . 1 . 397 . . 102 TRP CA . 19884 1 423 . 1 1 102 102 TRP CB C 13 28.948 0.025 . 1 . 852 . . 102 TRP CB . 19884 1 424 . 1 1 102 102 TRP N N 15 114.335 0.11 . 1 . 241 . . 102 TRP N . 19884 1 425 . 1 1 103 103 ILE H H 1 6.861 0.015 . 1 . 5 . . 103 ILE H . 19884 1 426 . 1 1 103 103 ILE C C 13 173.890 . . 1 . 754 . . 103 ILE C . 19884 1 427 . 1 1 103 103 ILE CA C 13 61.684 . . 1 . 1111 . . 103 ILE CA . 19884 1 428 . 1 1 103 103 ILE CB C 13 37.998 . . 1 . 1110 . . 103 ILE CB . 19884 1 429 . 1 1 103 103 ILE N N 15 125.423 0.111 . 1 . 6 . . 103 ILE N . 19884 1 430 . 1 1 104 104 SER C C 13 174.929 0.001 . 1 . 701 . . 104 SER C . 19884 1 431 . 1 1 104 104 SER CA C 13 57.251 0.023 . 1 . 561 . . 104 SER CA . 19884 1 432 . 1 1 104 104 SER CB C 13 64.322 0.063 . 1 . 639 . . 104 SER CB . 19884 1 433 . 1 1 105 105 SER H H 1 10.096 0.014 . 1 . 114 . . 105 SER H . 19884 1 434 . 1 1 105 105 SER C C 13 174.195 0.006 . 1 . 1002 . . 105 SER C . 19884 1 435 . 1 1 105 105 SER CA C 13 63.290 0.036 . 1 . 421 . . 105 SER CA . 19884 1 436 . 1 1 105 105 SER CB C 13 61.355 0.007 . 1 . 508 . . 105 SER CB . 19884 1 437 . 1 1 105 105 SER N N 15 120.281 0.115 . 1 . 115 . . 105 SER N . 19884 1 438 . 1 1 106 106 GLY H H 1 9.368 0.014 . 1 . 370 . . 106 GLY H . 19884 1 439 . 1 1 106 106 GLY C C 13 178.740 0.022 . 1 . 1085 . . 106 GLY C . 19884 1 440 . 1 1 106 106 GLY CA C 13 45.675 0.002 . 1 . 1084 . . 106 GLY CA . 19884 1 441 . 1 1 106 106 GLY N N 15 108.932 0.14 . 1 . 371 . . 106 GLY N . 19884 1 442 . 1 1 107 107 ASP H H 1 7.549 0.015 . 1 . 605 . . 107 ASP H . 19884 1 443 . 1 1 107 107 ASP C C 13 176.087 . . 1 . 1199 . . 107 ASP C . 19884 1 444 . 1 1 107 107 ASP CB C 13 38.069 . . 1 . 1083 . . 107 ASP CB . 19884 1 445 . 1 1 107 107 ASP N N 15 124.499 0.114 . 1 . 606 . . 107 ASP N . 19884 1 446 . 1 1 108 108 LEU H H 1 7.785 0.011 . 1 . 1010 . . 108 LEU H . 19884 1 447 . 1 1 108 108 LEU C C 13 178.224 . . 1 . 1121 . . 108 LEU C . 19884 1 448 . 1 1 108 108 LEU CA C 13 57.763 0.065 . 1 . 1086 . . 108 LEU CA . 19884 1 449 . 1 1 108 108 LEU N N 15 122.050 0.136 . 1 . 1011 . . 108 LEU N . 19884 1 450 . 1 1 109 109 PHE H H 1 8.565 0.02 . 1 . 1200 . . 109 PHE H . 19884 1 451 . 1 1 109 109 PHE CA C 13 57.284 . . 1 . 1202 . . 109 PHE CA . 19884 1 452 . 1 1 109 109 PHE N N 15 116.071 0.104 . 1 . 1201 . . 109 PHE N . 19884 1 453 . 1 1 110 110 SER H H 1 7.775 0.003 . 1 . 1203 . . 110 SER H . 19884 1 454 . 1 1 110 110 SER C C 13 176.038 . . 1 . 1180 . . 110 SER C . 19884 1 455 . 1 1 110 110 SER CA C 13 61.313 0.091 . 1 . 1179 . . 110 SER CA . 19884 1 456 . 1 1 110 110 SER N N 15 112.572 0.057 . 1 . 1204 . . 110 SER N . 19884 1 457 . 1 1 111 111 LEU H H 1 8.688 0.015 . 1 . 958 . . 111 LEU H . 19884 1 458 . 1 1 111 111 LEU C C 13 180.830 . . 1 . 1207 . . 111 LEU C . 19884 1 459 . 1 1 111 111 LEU CA C 13 57.031 0.053 . 1 . 960 . . 111 LEU CA . 19884 1 460 . 1 1 111 111 LEU CB C 13 40.541 0.031 . 1 . 961 . . 111 LEU CB . 19884 1 461 . 1 1 111 111 LEU N N 15 127.411 0.126 . 1 . 959 . . 111 LEU N . 19884 1 462 . 1 1 112 112 GLY H H 1 8.783 0.015 . 1 . 1205 . . 112 GLY H . 19884 1 463 . 1 1 112 112 GLY CA C 13 47.657 0.068 . 1 . 1208 . . 112 GLY CA . 19884 1 464 . 1 1 112 112 GLY N N 15 109.236 0.229 . 1 . 1206 . . 112 GLY N . 19884 1 465 . 1 1 113 113 GLY H H 1 7.258 0.011 . 1 . 1209 . . 113 GLY H . 19884 1 466 . 1 1 113 113 GLY C C 13 174.703 0.087 . 1 . 1212 . . 113 GLY C . 19884 1 467 . 1 1 113 113 GLY CA C 13 47.397 . . 1 . 1211 . . 113 GLY CA . 19884 1 468 . 1 1 113 113 GLY N N 15 105.446 0.122 . 1 . 1210 . . 113 GLY N . 19884 1 469 . 1 1 115 115 THR C C 13 176.026 . . 1 . 998 . . 115 THR C . 19884 1 470 . 1 1 115 115 THR CA C 13 65.999 . . 1 . 1026 . . 115 THR CA . 19884 1 471 . 1 1 115 115 THR CB C 13 67.945 . . 1 . 930 . . 115 THR CB . 19884 1 472 . 1 1 116 116 ALA H H 1 8.021 0.015 . 1 . 928 . . 116 ALA H . 19884 1 473 . 1 1 116 116 ALA C C 13 178.660 . . 1 . 997 . . 116 ALA C . 19884 1 474 . 1 1 116 116 ALA CA C 13 55.954 . . 1 . 1027 . . 116 ALA CA . 19884 1 475 . 1 1 116 116 ALA CB C 13 19.561 . . 1 . 931 . . 116 ALA CB . 19884 1 476 . 1 1 116 116 ALA N N 15 121.310 0.144 . 1 . 929 . . 116 ALA N . 19884 1 477 . 1 1 117 117 VAL C C 13 178.906 . . 1 . 1219 . . 117 VAL C . 19884 1 478 . 1 1 117 117 VAL CB C 13 31.334 0.052 . 1 . 659 . . 117 VAL CB . 19884 1 479 . 1 1 118 118 GLN H H 1 8.275 0.015 . 1 . 915 . . 118 GLN H . 19884 1 480 . 1 1 118 118 GLN C C 13 181.440 0.022 . 1 . 1215 . . 118 GLN C . 19884 1 481 . 1 1 118 118 GLN CA C 13 59.420 0.038 . 1 . 1216 . . 118 GLN CA . 19884 1 482 . 1 1 118 118 GLN CB C 13 27.708 . . 1 . 1016 . . 118 GLN CB . 19884 1 483 . 1 1 118 118 GLN N N 15 115.040 0.107 . 1 . 916 . . 118 GLN N . 19884 1 484 . 1 1 119 119 GLU H H 1 9.352 0.015 . 1 . 1213 . . 119 GLU H . 19884 1 485 . 1 1 119 119 GLU CA C 13 57.989 0.01 . 1 . 1217 . . 119 GLU CA . 19884 1 486 . 1 1 119 119 GLU CB C 13 28.543 0.023 . 1 . 1218 . . 119 GLU CB . 19884 1 487 . 1 1 119 119 GLU N N 15 119.836 0.115 . 1 . 1214 . . 119 GLU N . 19884 1 488 . 1 1 120 120 MET H H 1 7.849 0.016 . 1 . 1162 . . 120 MET H . 19884 1 489 . 1 1 120 120 MET C C 13 173.677 0.004 . 1 . 1170 . . 120 MET C . 19884 1 490 . 1 1 120 120 MET CA C 13 56.462 0.063 . 1 . 1165 . . 120 MET CA . 19884 1 491 . 1 1 120 120 MET CB C 13 31.182 0.025 . 1 . 1164 . . 120 MET CB . 19884 1 492 . 1 1 120 120 MET N N 15 120.304 0.23 . 1 . 1163 . . 120 MET N . 19884 1 493 . 1 1 121 121 GLN H H 1 7.683 0.014 . 1 . 1146 . . 121 GLN H . 19884 1 494 . 1 1 121 121 GLN C C 13 176.180 0.037 . 1 . 1008 . . 121 GLN C . 19884 1 495 . 1 1 121 121 GLN CA C 13 57.204 0.052 . 1 . 1104 . . 121 GLN CA . 19884 1 496 . 1 1 121 121 GLN CB C 13 24.258 0.028 . 1 . 936 . . 121 GLN CB . 19884 1 497 . 1 1 121 121 GLN N N 15 109.002 0.119 . 1 . 105 . . 121 GLN N . 19884 1 498 . 1 1 122 122 GLY H H 1 8.297 0.017 . 1 . 934 . . 122 GLY H . 19884 1 499 . 1 1 122 122 GLY CA C 13 44.542 . . 1 . 1105 . . 122 GLY CA . 19884 1 500 . 1 1 122 122 GLY N N 15 106.061 0.142 . 1 . 935 . . 122 GLY N . 19884 1 501 . 1 1 123 123 PRO C C 13 174.283 0.0 . 1 . 1221 . . 123 PRO C . 19884 1 502 . 1 1 123 123 PRO CA C 13 61.299 0.013 . 1 . 1222 . . 123 PRO CA . 19884 1 503 . 1 1 123 123 PRO CB C 13 31.236 0.045 . 1 . 1220 . . 123 PRO CB . 19884 1 504 . 1 1 124 124 LYS H H 1 7.900 0.013 . 1 . 216 . . 124 LYS H . 19884 1 505 . 1 1 124 124 LYS C C 13 178.845 0.041 . 1 . 1226 . . 124 LYS C . 19884 1 506 . 1 1 124 124 LYS CA C 13 54.344 0.043 . 1 . 1225 . . 124 LYS CA . 19884 1 507 . 1 1 124 124 LYS N N 15 112.581 0.121 . 1 . 217 . . 124 LYS N . 19884 1 508 . 1 1 125 125 ILE H H 1 8.835 0.014 . 1 . 270 . . 125 ILE H . 19884 1 509 . 1 1 125 125 ILE C C 13 172.337 . . 1 . 1009 . . 125 ILE C . 19884 1 510 . 1 1 125 125 ILE CA C 13 56.220 . . 1 . 1103 . . 125 ILE CA . 19884 1 511 . 1 1 125 125 ILE CB C 13 38.182 . . 1 . 851 . . 125 ILE CB . 19884 1 512 . 1 1 125 125 ILE N N 15 125.702 0.117 . 1 . 271 . . 125 ILE N . 19884 1 513 . 1 1 127 127 TRP C C 13 178.306 . . 1 . 1089 . . 127 TRP C . 19884 1 514 . 1 1 127 127 TRP CA C 13 61.566 . . 1 . 1117 . . 127 TRP CA . 19884 1 515 . 1 1 127 127 TRP CB C 13 30.123 . . 1 . 1090 . . 127 TRP CB . 19884 1 516 . 1 1 128 128 ARG H H 1 8.148 0.005 . 1 . 1003 . . 128 ARG H . 19884 1 517 . 1 1 128 128 ARG C C 13 175.970 . . 1 . 1119 . . 128 ARG C . 19884 1 518 . 1 1 128 128 ARG CA C 13 56.327 . . 1 . 1100 . . 128 ARG CA . 19884 1 519 . 1 1 128 128 ARG CB C 13 32.826 . . 1 . 1091 . . 128 ARG CB . 19884 1 520 . 1 1 128 128 ARG N N 15 126.997 0.015 . 1 . 1004 . . 128 ARG N . 19884 1 521 . 1 1 129 129 ALA H H 1 7.928 0.014 . 1 . 603 . . 129 ALA H . 19884 1 522 . 1 1 129 129 ALA CB C 13 19.561 . . 1 . 1099 . . 129 ALA CB . 19884 1 523 . 1 1 129 129 ALA N N 15 129.919 0.174 . 1 . 604 . . 129 ALA N . 19884 1 524 . 1 1 131 131 ARG C C 13 175.330 . . 1 . 704 . . 131 ARG C . 19884 1 525 . 1 1 131 131 ARG CA C 13 58.934 . . 1 . 563 . . 131 ARG CA . 19884 1 526 . 1 1 131 131 ARG CB C 13 28.056 . . 1 . 861 . . 131 ARG CB . 19884 1 527 . 1 1 132 132 VAL H H 1 7.022 0.02 . 1 . 124 . . 132 VAL H . 19884 1 528 . 1 1 132 132 VAL C C 13 172.095 0.0 . 1 . 683 . . 132 VAL C . 19884 1 529 . 1 1 132 132 VAL CA C 13 60.495 0.035 . 1 . 1034 . . 132 VAL CA . 19884 1 530 . 1 1 132 132 VAL CB C 13 33.780 0.025 . 1 . 477 . . 132 VAL CB . 19884 1 531 . 1 1 132 132 VAL N N 15 117.126 0.133 . 1 . 125 . . 132 VAL N . 19884 1 532 . 1 1 133 133 ASP H H 1 8.066 0.012 . 1 . 3 . . 133 ASP H . 19884 1 533 . 1 1 133 133 ASP C C 13 177.664 0.005 . 1 . 728 . . 133 ASP C . 19884 1 534 . 1 1 133 133 ASP CA C 13 54.479 0.01 . 1 . 411 . . 133 ASP CA . 19884 1 535 . 1 1 133 133 ASP CB C 13 38.044 0.022 . 1 . 660 . . 133 ASP CB . 19884 1 536 . 1 1 133 133 ASP N N 15 123.966 0.128 . 1 . 4 . . 133 ASP N . 19884 1 537 . 1 1 134 134 THR H H 1 8.534 0.015 . 1 . 218 . . 134 THR H . 19884 1 538 . 1 1 134 134 THR C C 13 173.971 . . 1 . 841 . . 134 THR C . 19884 1 539 . 1 1 134 134 THR CA C 13 59.150 . . 1 . 410 . . 134 THR CA . 19884 1 540 . 1 1 134 134 THR CB C 13 67.658 . . 1 . 499 . . 134 THR CB . 19884 1 541 . 1 1 134 134 THR N N 15 116.895 0.112 . 1 . 219 . . 134 THR N . 19884 1 542 . 1 1 135 135 PRO C C 13 177.561 0.0 . 1 . 707 . . 135 PRO C . 19884 1 543 . 1 1 135 135 PRO CA C 13 62.646 0.005 . 1 . 565 . . 135 PRO CA . 19884 1 544 . 1 1 135 135 PRO CB C 13 32.114 0.017 . 1 . 645 . . 135 PRO CB . 19884 1 545 . 1 1 136 136 GLU H H 1 8.584 0.013 . 1 . 140 . . 136 GLU H . 19884 1 546 . 1 1 136 136 GLU C C 13 178.728 0.007 . 1 . 823 . . 136 GLU C . 19884 1 547 . 1 1 136 136 GLU CA C 13 59.603 0.025 . 1 . 413 . . 136 GLU CA . 19884 1 548 . 1 1 136 136 GLU CB C 13 28.124 0.03 . 1 . 502 . . 136 GLU CB . 19884 1 549 . 1 1 136 136 GLU N N 15 124.180 0.119 . 1 . 141 . . 136 GLU N . 19884 1 550 . 1 1 137 137 ASP H H 1 8.383 0.013 . 1 . 332 . . 137 ASP H . 19884 1 551 . 1 1 137 137 ASP C C 13 176.447 0.011 . 1 . 713 . . 137 ASP C . 19884 1 552 . 1 1 137 137 ASP CA C 13 55.006 0.07 . 1 . 956 . . 137 ASP CA . 19884 1 553 . 1 1 137 137 ASP CB C 13 38.487 0.053 . 1 . 541 . . 137 ASP CB . 19884 1 554 . 1 1 137 137 ASP N N 15 117.766 0.119 . 1 . 333 . . 137 ASP N . 19884 1 555 . 1 1 138 138 THR H H 1 7.862 0.013 . 1 . 326 . . 138 THR H . 19884 1 556 . 1 1 138 138 THR C C 13 174.374 0.001 . 1 . 700 . . 138 THR C . 19884 1 557 . 1 1 138 138 THR CA C 13 61.619 0.029 . 1 . 1130 . . 138 THR CA . 19884 1 558 . 1 1 138 138 THR CB C 13 69.512 0.056 . 1 . 638 . . 138 THR CB . 19884 1 559 . 1 1 138 138 THR N N 15 110.419 0.116 . 1 . 327 . . 138 THR N . 19884 1 560 . 1 1 139 139 THR H H 1 7.370 0.015 . 1 . 106 . . 139 THR H . 19884 1 561 . 1 1 139 139 THR C C 13 172.629 . . 1 . 784 . . 139 THR C . 19884 1 562 . 1 1 139 139 THR N N 15 123.714 0.149 . 1 . 107 . . 139 THR N . 19884 1 563 . 1 1 140 140 PRO C C 13 175.721 0.032 . 1 . 685 . . 140 PRO C . 19884 1 564 . 1 1 140 140 PRO CA C 13 61.727 0.001 . 1 . 431 . . 140 PRO CA . 19884 1 565 . 1 1 140 140 PRO CB C 13 30.121 0.023 . 1 . 620 . . 140 PRO CB . 19884 1 566 . 1 1 141 141 ASP H H 1 8.082 0.013 . 1 . 11 . . 141 ASP H . 19884 1 567 . 1 1 141 141 ASP C C 13 175.667 0.0 . 1 . 689 . . 141 ASP C . 19884 1 568 . 1 1 141 141 ASP CA C 13 53.909 0.014 . 1 . 430 . . 141 ASP CA . 19884 1 569 . 1 1 141 141 ASP CB C 13 39.759 0.025 . 1 . 517 . . 141 ASP CB . 19884 1 570 . 1 1 141 141 ASP N N 15 119.715 0.124 . 1 . 12 . . 141 ASP N . 19884 1 571 . 1 1 142 142 ASN H H 1 8.394 0.014 . 1 . 41 . . 142 ASN H . 19884 1 572 . 1 1 142 142 ASN C C 13 174.578 0.017 . 1 . 764 . . 142 ASN C . 19884 1 573 . 1 1 142 142 ASN CA C 13 52.927 0.006 . 1 . 406 . . 142 ASN CA . 19884 1 574 . 1 1 142 142 ASN CB C 13 38.359 0.012 . 1 . 496 . . 142 ASN CB . 19884 1 575 . 1 1 142 142 ASN N N 15 117.068 0.117 . 1 . 42 . . 142 ASN N . 19884 1 576 . 1 1 143 143 GLY H H 1 7.692 0.018 . 1 . 320 . . 143 GLY H . 19884 1 577 . 1 1 143 143 GLY C C 13 175.847 0.007 . 1 . 1148 . . 143 GLY C . 19884 1 578 . 1 1 143 143 GLY CA C 13 44.622 0.038 . 1 . 1080 . . 143 GLY CA . 19884 1 579 . 1 1 143 143 GLY N N 15 110.438 0.116 . 1 . 321 . . 143 GLY N . 19884 1 580 . 1 1 144 144 ARG H H 1 8.556 0.014 . 1 . 617 . . 144 ARG H . 19884 1 581 . 1 1 144 144 ARG C C 13 175.791 0.005 . 1 . 1081 . . 144 ARG C . 19884 1 582 . 1 1 144 144 ARG CA C 13 55.784 0.002 . 1 . 1073 . . 144 ARG CA . 19884 1 583 . 1 1 144 144 ARG CB C 13 29.521 0.056 . 1 . 1074 . . 144 ARG CB . 19884 1 584 . 1 1 144 144 ARG N N 15 119.809 0.102 . 1 . 618 . . 144 ARG N . 19884 1 585 . 1 1 145 145 LEU H H 1 7.089 0.025 . 1 . 300 . . 145 LEU H . 19884 1 586 . 1 1 145 145 LEU C C 13 174.962 . . 1 . 973 . . 145 LEU C . 19884 1 587 . 1 1 145 145 LEU CA C 13 50.962 . . 1 . 952 . . 145 LEU CA . 19884 1 588 . 1 1 145 145 LEU N N 15 120.704 0.162 . 1 . 301 . . 145 LEU N . 19884 1 589 . 1 1 148 148 ALA C C 13 179.205 . . 1 . 994 . . 148 ALA C . 19884 1 590 . 1 1 148 148 ALA CA C 13 55.121 . . 1 . 1155 . . 148 ALA CA . 19884 1 591 . 1 1 149 149 ASP H H 1 9.708 0.008 . 1 . 995 . . 149 ASP H . 19884 1 592 . 1 1 149 149 ASP C C 13 177.079 0.004 . 1 . 986 . . 149 ASP C . 19884 1 593 . 1 1 149 149 ASP CA C 13 53.427 0.022 . 1 . 1154 . . 149 ASP CA . 19884 1 594 . 1 1 149 149 ASP CB C 13 39.749 0.08 . 1 . 1156 . . 149 ASP CB . 19884 1 595 . 1 1 149 149 ASP N N 15 117.491 0.114 . 1 . 996 . . 149 ASP N . 19884 1 596 . 1 1 150 150 LYS H H 1 7.248 0.012 . 1 . 937 . . 150 LYS H . 19884 1 597 . 1 1 150 150 LYS C C 13 173.358 0.011 . 1 . 985 . . 150 LYS C . 19884 1 598 . 1 1 150 150 LYS CA C 13 54.236 0.005 . 1 . 1052 . . 150 LYS CA . 19884 1 599 . 1 1 150 150 LYS CB C 13 36.084 0.04 . 1 . 1036 . . 150 LYS CB . 19884 1 600 . 1 1 150 150 LYS N N 15 119.318 0.124 . 1 . 938 . . 150 LYS N . 19884 1 601 . 1 1 151 151 ASP H H 1 7.596 0.013 . 1 . 364 . . 151 ASP H . 19884 1 602 . 1 1 151 151 ASP C C 13 176.939 0.006 . 1 . 818 . . 151 ASP C . 19884 1 603 . 1 1 151 151 ASP CA C 13 51.721 0.016 . 1 . 1054 . . 151 ASP CA . 19884 1 604 . 1 1 151 151 ASP CB C 13 42.668 0.025 . 1 . 1053 . . 151 ASP CB . 19884 1 605 . 1 1 151 151 ASP N N 15 116.469 0.118 . 1 . 365 . . 151 ASP N . 19884 1 606 . 1 1 152 152 ALA H H 1 8.808 0.013 . 1 . 172 . . 152 ALA H . 19884 1 607 . 1 1 152 152 ALA C C 13 179.637 . . 1 . 1055 . . 152 ALA C . 19884 1 608 . 1 1 152 152 ALA CA C 13 55.525 0.004 . 1 . 463 . . 152 ALA CA . 19884 1 609 . 1 1 152 152 ALA CB C 13 19.069 0.017 . 1 . 856 . . 152 ALA CB . 19884 1 610 . 1 1 152 152 ALA N N 15 120.137 0.108 . 1 . 173 . . 152 ALA N . 19884 1 611 . 1 1 153 153 ASP H H 1 8.094 0.014 . 1 . 29 . . 153 ASP H . 19884 1 612 . 1 1 153 153 ASP C C 13 179.551 0.054 . 1 . 833 . . 153 ASP C . 19884 1 613 . 1 1 153 153 ASP CA C 13 57.168 0.009 . 1 . 578 . . 153 ASP CA . 19884 1 614 . 1 1 153 153 ASP CB C 13 40.286 0.007 . 1 . 661 . . 153 ASP CB . 19884 1 615 . 1 1 153 153 ASP N N 15 115.742 0.122 . 1 . 30 . . 153 ASP N . 19884 1 616 . 1 1 154 154 TYR H H 1 8.361 0.014 . 1 . 368 . . 154 TYR H . 19884 1 617 . 1 1 154 154 TYR C C 13 177.978 0.026 . 1 . 820 . . 154 TYR C . 19884 1 618 . 1 1 154 154 TYR CA C 13 61.852 0.058 . 1 . 416 . . 154 TYR CA . 19884 1 619 . 1 1 154 154 TYR CB C 13 38.132 0.021 . 1 . 505 . . 154 TYR CB . 19884 1 620 . 1 1 154 154 TYR N N 15 122.286 0.12 . 1 . 369 . . 154 TYR N . 19884 1 621 . 1 1 155 155 VAL H H 1 9.016 0.014 . 1 . 236 . . 155 VAL H . 19884 1 622 . 1 1 155 155 VAL C C 13 178.178 0.051 . 1 . 703 . . 155 VAL C . 19884 1 623 . 1 1 155 155 VAL CA C 13 68.741 0.027 . 1 . 562 . . 155 VAL CA . 19884 1 624 . 1 1 155 155 VAL CB C 13 32.347 0.035 . 1 . 641 . . 155 VAL CB . 19884 1 625 . 1 1 155 155 VAL N N 15 123.800 0.126 . 1 . 237 . . 155 VAL N . 19884 1 626 . 1 1 156 156 ARG H H 1 9.401 0.013 . 1 . 118 . . 156 ARG H . 19884 1 627 . 1 1 156 156 ARG C C 13 181.030 0.006 . 1 . 693 . . 156 ARG C . 19884 1 628 . 1 1 156 156 ARG CA C 13 60.389 0.017 . 1 . 400 . . 156 ARG CA . 19884 1 629 . 1 1 156 156 ARG CB C 13 29.294 0.03 . 1 . 630 . . 156 ARG CB . 19884 1 630 . 1 1 156 156 ARG N N 15 122.263 0.117 . 1 . 119 . . 156 ARG N . 19884 1 631 . 1 1 157 157 THR H H 1 8.645 0.014 . 1 . 63 . . 157 THR H . 19884 1 632 . 1 1 157 157 THR C C 13 177.610 0.013 . 1 . 706 . . 157 THR C . 19884 1 633 . 1 1 157 157 THR CA C 13 66.538 0.024 . 1 . 584 . . 157 THR CA . 19884 1 634 . 1 1 157 157 THR CB C 13 68.645 0.083 . 1 . 643 . . 157 THR CB . 19884 1 635 . 1 1 157 157 THR N N 15 116.578 0.123 . 1 . 64 . . 157 THR N . 19884 1 636 . 1 1 158 158 PHE H H 1 9.744 0.014 . 1 . 138 . . 158 PHE H . 19884 1 637 . 1 1 158 158 PHE C C 13 178.609 0.031 . 1 . 822 . . 158 PHE C . 19884 1 638 . 1 1 158 158 PHE CA C 13 62.077 0.022 . 1 . 591 . . 158 PHE CA . 19884 1 639 . 1 1 158 158 PHE CB C 13 38.719 0.033 . 1 . 629 . . 158 PHE CB . 19884 1 640 . 1 1 158 158 PHE N N 15 126.691 0.122 . 1 . 139 . . 158 PHE N . 19884 1 641 . 1 1 159 159 PHE H H 1 9.132 0.014 . 1 . 308 . . 159 PHE H . 19884 1 642 . 1 1 159 159 PHE C C 13 179.902 0.004 . 1 . 805 . . 159 PHE C . 19884 1 643 . 1 1 159 159 PHE CA C 13 62.709 0.012 . 1 . 558 . . 159 PHE CA . 19884 1 644 . 1 1 159 159 PHE CB C 13 39.939 0.019 . 1 . 631 . . 159 PHE CB . 19884 1 645 . 1 1 159 159 PHE N N 15 115.064 0.122 . 1 . 309 . . 159 PHE N . 19884 1 646 . 1 1 160 160 GLN H H 1 8.257 0.014 . 1 . 75 . . 160 GLN H . 19884 1 647 . 1 1 160 160 GLN C C 13 180.535 0.006 . 1 . 691 . . 160 GLN C . 19884 1 648 . 1 1 160 160 GLN CA C 13 59.278 0.025 . 1 . 1057 . . 160 GLN CA . 19884 1 649 . 1 1 160 160 GLN CB C 13 26.990 0.027 . 1 . 1056 . . 160 GLN CB . 19884 1 650 . 1 1 160 160 GLN N N 15 122.308 0.112 . 1 . 76 . . 160 GLN N . 19884 1 651 . 1 1 161 161 ARG H H 1 7.800 0.015 . 1 . 55 . . 161 ARG H . 19884 1 652 . 1 1 161 161 ARG C C 13 175.100 0.018 . 1 . 718 . . 161 ARG C . 19884 1 653 . 1 1 161 161 ARG CA C 13 58.127 0.022 . 1 . 425 . . 161 ARG CA . 19884 1 654 . 1 1 161 161 ARG CB C 13 29.810 0.028 . 1 . 897 . . 161 ARG CB . 19884 1 655 . 1 1 161 161 ARG N N 15 123.947 0.115 . 1 . 56 . . 161 ARG N . 19884 1 656 . 1 1 162 162 LEU H H 1 6.989 0.014 . 1 . 198 . . 162 LEU H . 19884 1 657 . 1 1 162 162 LEU C C 13 176.011 0.013 . 1 . 702 . . 162 LEU C . 19884 1 658 . 1 1 162 162 LEU CA C 13 53.680 0.042 . 1 . 955 . . 162 LEU CA . 19884 1 659 . 1 1 162 162 LEU CB C 13 43.012 0.019 . 1 . 640 . . 162 LEU CB . 19884 1 660 . 1 1 162 162 LEU N N 15 112.577 0.103 . 1 . 199 . . 162 LEU N . 19884 1 661 . 1 1 163 163 ASN H H 1 8.163 0.016 . 1 . 246 . . 163 ASN H . 19884 1 662 . 1 1 163 163 ASN C C 13 174.324 0.008 . 1 . 716 . . 163 ASN C . 19884 1 663 . 1 1 163 163 ASN CA C 13 53.661 0.041 . 1 . 894 . . 163 ASN CA . 19884 1 664 . 1 1 163 163 ASN CB C 13 37.551 0.018 . 1 . 1142 . . 163 ASN CB . 19884 1 665 . 1 1 163 163 ASN N N 15 113.695 0.114 . 1 . 247 . . 163 ASN N . 19884 1 666 . 1 1 164 164 MET H H 1 7.942 0.014 . 1 . 176 . . 164 MET H . 19884 1 667 . 1 1 164 164 MET C C 13 176.803 0.005 . 1 . 698 . . 164 MET C . 19884 1 668 . 1 1 164 164 MET CA C 13 52.935 0.023 . 1 . 598 . . 164 MET CA . 19884 1 669 . 1 1 164 164 MET CB C 13 33.498 0.067 . 1 . 636 . . 164 MET CB . 19884 1 670 . 1 1 164 164 MET N N 15 114.332 0.114 . 1 . 177 . . 164 MET N . 19884 1 671 . 1 1 165 165 ASN H H 1 10.298 0.012 . 1 . 360 . . 165 ASN H . 19884 1 672 . 1 1 165 165 ASN C C 13 174.735 0.01 . 1 . 734 . . 165 ASN C . 19884 1 673 . 1 1 165 165 ASN CA C 13 50.698 0.007 . 1 . 454 . . 165 ASN CA . 19884 1 674 . 1 1 165 165 ASN CB C 13 38.611 0.015 . 1 . 859 . . 165 ASN CB . 19884 1 675 . 1 1 165 165 ASN N N 15 126.783 0.127 . 1 . 361 . . 165 ASN N . 19884 1 676 . 1 1 166 166 ASP H H 1 8.293 0.012 . 1 . 242 . . 166 ASP H . 19884 1 677 . 1 1 166 166 ASP C C 13 177.127 0.019 . 1 . 688 . . 166 ASP C . 19884 1 678 . 1 1 166 166 ASP CA C 13 57.771 0.024 . 1 . 554 . . 166 ASP CA . 19884 1 679 . 1 1 166 166 ASP CB C 13 40.265 0.029 . 1 . 623 . . 166 ASP CB . 19884 1 680 . 1 1 166 166 ASP N N 15 114.883 0.11 . 1 . 243 . . 166 ASP N . 19884 1 681 . 1 1 167 167 ARG H H 1 7.823 0.014 . 1 . 37 . . 167 ARG H . 19884 1 682 . 1 1 167 167 ARG C C 13 177.463 0.011 . 1 . 705 . . 167 ARG C . 19884 1 683 . 1 1 167 167 ARG CA C 13 60.207 0.035 . 1 . 564 . . 167 ARG CA . 19884 1 684 . 1 1 167 167 ARG CB C 13 29.421 0.025 . 1 . 642 . . 167 ARG CB . 19884 1 685 . 1 1 167 167 ARG N N 15 118.115 0.125 . 1 . 38 . . 167 ARG N . 19884 1 686 . 1 1 168 168 GLU H H 1 8.107 0.013 . 1 . 126 . . 168 GLU H . 19884 1 687 . 1 1 168 168 GLU C C 13 178.611 0.034 . 1 . 687 . . 168 GLU C . 19884 1 688 . 1 1 168 168 GLU CA C 13 59.485 0.027 . 1 . 1098 . . 168 GLU CA . 19884 1 689 . 1 1 168 168 GLU CB C 13 30.136 0.031 . 1 . 1041 . . 168 GLU CB . 19884 1 690 . 1 1 168 168 GLU N N 15 117.655 0.129 . 1 . 127 . . 168 GLU N . 19884 1 691 . 1 1 169 169 VAL H H 1 8.761 0.013 . 1 . 25 . . 169 VAL H . 19884 1 692 . 1 1 169 169 VAL C C 13 177.681 0.013 . 1 . 1128 . . 169 VAL C . 19884 1 693 . 1 1 169 169 VAL CA C 13 67.756 0.072 . 1 . 873 . . 169 VAL CA . 19884 1 694 . 1 1 169 169 VAL CB C 13 31.295 . . 1 . 1129 . . 169 VAL CB . 19884 1 695 . 1 1 169 169 VAL N N 15 118.643 0.118 . 1 . 26 . . 169 VAL N . 19884 1 696 . 1 1 170 170 VAL H H 1 8.276 0.012 . 1 . 346 . . 170 VAL H . 19884 1 697 . 1 1 170 170 VAL C C 13 179.987 0.025 . 1 . 744 . . 170 VAL C . 19884 1 698 . 1 1 170 170 VAL CA C 13 66.733 0.067 . 1 . 1042 . . 170 VAL CA . 19884 1 699 . 1 1 170 170 VAL CB C 13 30.866 0.031 . 1 . 675 . . 170 VAL CB . 19884 1 700 . 1 1 170 170 VAL N N 15 117.491 0.115 . 1 . 347 . . 170 VAL N . 19884 1 701 . 1 1 171 171 ALA H H 1 9.102 0.017 . 1 . 324 . . 171 ALA H . 19884 1 702 . 1 1 171 171 ALA CA C 13 55.398 . . 1 . 616 . . 171 ALA CA . 19884 1 703 . 1 1 171 171 ALA CB C 13 16.064 . . 1 . 488 . . 171 ALA CB . 19884 1 704 . 1 1 171 171 ALA N N 15 123.264 0.119 . 1 . 325 . . 171 ALA N . 19884 1 705 . 1 1 174 174 GLY H H 1 7.174 0.002 . 1 . 1149 . . 174 GLY H . 19884 1 706 . 1 1 174 174 GLY CA C 13 44.224 . . 1 . 1107 . . 174 GLY CA . 19884 1 707 . 1 1 174 174 GLY N N 15 114.635 0.07 . 1 . 1150 . . 174 GLY N . 19884 1 708 . 1 1 176 176 HIS C C 13 181.208 . . 1 . 1000 . . 176 HIS C . 19884 1 709 . 1 1 176 176 HIS CB C 13 24.293 0.114 . 1 . 914 . . 176 HIS CB . 19884 1 710 . 1 1 177 177 ALA H H 1 7.053 0.017 . 1 . 911 . . 177 ALA H . 19884 1 711 . 1 1 177 177 ALA CB C 13 14.577 . . 1 . 913 . . 177 ALA CB . 19884 1 712 . 1 1 177 177 ALA N N 15 113.613 0.124 . 1 . 912 . . 177 ALA N . 19884 1 713 . 1 1 180 180 LYS C C 13 176.438 . . 1 . 1152 . . 180 LYS C . 19884 1 714 . 1 1 180 180 LYS CA C 13 55.624 . . 1 . 1153 . . 180 LYS CA . 19884 1 715 . 1 1 180 180 LYS CB C 13 31.935 0.067 . 1 . 1151 . . 180 LYS CB . 19884 1 716 . 1 1 181 181 THR H H 1 7.994 0.018 . 1 . 917 . . 181 THR H . 19884 1 717 . 1 1 181 181 THR C C 13 176.886 . . 1 . 1139 . . 181 THR C . 19884 1 718 . 1 1 181 181 THR CA C 13 61.492 . . 1 . 614 . . 181 THR CA . 19884 1 719 . 1 1 181 181 THR CB C 13 69.307 . . 1 . 927 . . 181 THR CB . 19884 1 720 . 1 1 181 181 THR N N 15 116.936 0.139 . 1 . 918 . . 181 THR N . 19884 1 721 . 1 1 182 182 HIS H H 1 7.970 0.001 . 1 . 968 . . 182 HIS H . 19884 1 722 . 1 1 182 182 HIS C C 13 178.007 0.006 . 1 . 1122 . . 182 HIS C . 19884 1 723 . 1 1 182 182 HIS CA C 13 55.314 0.034 . 1 . 1120 . . 182 HIS CA . 19884 1 724 . 1 1 182 182 HIS CB C 13 30.427 0.004 . 1 . 1123 . . 182 HIS CB . 19884 1 725 . 1 1 182 182 HIS N N 15 122.260 0.003 . 1 . 969 . . 182 HIS N . 19884 1 726 . 1 1 183 183 LEU H H 1 9.457 0.014 . 1 . 316 . . 183 LEU H . 19884 1 727 . 1 1 183 183 LEU C C 13 181.166 0.01 . 1 . 806 . . 183 LEU C . 19884 1 728 . 1 1 183 183 LEU CA C 13 59.942 0.022 . 1 . 870 . . 183 LEU CA . 19884 1 729 . 1 1 183 183 LEU CB C 13 42.346 0.027 . 1 . 500 . . 183 LEU CB . 19884 1 730 . 1 1 183 183 LEU N N 15 132.497 0.114 . 1 . 317 . . 183 LEU N . 19884 1 731 . 1 1 184 184 LYS H H 1 9.251 0.012 . 1 . 15 . . 184 LYS H . 19884 1 732 . 1 1 184 184 LYS C C 13 177.360 0.003 . 1 . 715 . . 184 LYS C . 19884 1 733 . 1 1 184 184 LYS CA C 13 57.807 0.051 . 1 . 568 . . 184 LYS CA . 19884 1 734 . 1 1 184 184 LYS CB C 13 31.316 0.034 . 1 . 649 . . 184 LYS CB . 19884 1 735 . 1 1 184 184 LYS N N 15 114.477 0.125 . 1 . 16 . . 184 LYS N . 19884 1 736 . 1 1 185 185 ASN H H 1 8.442 0.013 . 1 . 174 . . 185 ASN H . 19884 1 737 . 1 1 185 185 ASN C C 13 176.467 . . 1 . 845 . . 185 ASN C . 19884 1 738 . 1 1 185 185 ASN CA C 13 54.038 . . 1 . 381 . . 185 ASN CA . 19884 1 739 . 1 1 185 185 ASN CB C 13 38.152 . . 1 . 480 . . 185 ASN CB . 19884 1 740 . 1 1 185 185 ASN N N 15 116.224 0.116 . 1 . 175 . . 185 ASN N . 19884 1 741 . 1 1 186 186 SER C C 13 176.606 . . 1 . 750 . . 186 SER C . 19884 1 742 . 1 1 186 186 SER CA C 13 59.403 0.032 . 1 . 1116 . . 186 SER CA . 19884 1 743 . 1 1 186 186 SER CB C 13 70.199 . . 1 . 680 . . 186 SER CB . 19884 1 744 . 1 1 187 187 GLY H H 1 8.958 0.017 . 1 . 344 . . 187 GLY H . 19884 1 745 . 1 1 187 187 GLY C C 13 172.341 0.01 . 1 . 1106 . . 187 GLY C . 19884 1 746 . 1 1 187 187 GLY CA C 13 45.699 0.026 . 1 . 611 . . 187 GLY CA . 19884 1 747 . 1 1 187 187 GLY N N 15 111.409 0.136 . 1 . 345 . . 187 GLY N . 19884 1 748 . 1 1 188 188 TYR H H 1 8.551 0.014 . 1 . 609 . . 188 TYR H . 19884 1 749 . 1 1 188 188 TYR C C 13 171.634 . . 1 . 1138 . . 188 TYR C . 19884 1 750 . 1 1 188 188 TYR CA C 13 59.009 0.016 . 1 . 1136 . . 188 TYR CA . 19884 1 751 . 1 1 188 188 TYR CB C 13 41.032 0.083 . 1 . 1137 . . 188 TYR CB . 19884 1 752 . 1 1 188 188 TYR N N 15 120.452 0.119 . 1 . 610 . . 188 TYR N . 19884 1 753 . 1 1 189 189 GLU H H 1 8.252 0.013 . 1 . 134 . . 189 GLU H . 19884 1 754 . 1 1 189 189 GLU C C 13 176.529 0.027 . 1 . 791 . . 189 GLU C . 19884 1 755 . 1 1 189 189 GLU CA C 13 55.254 0.055 . 1 . 468 . . 189 GLU CA . 19884 1 756 . 1 1 189 189 GLU CB C 13 33.351 0.015 . 1 . 545 . . 189 GLU CB . 19884 1 757 . 1 1 189 189 GLU N N 15 118.550 0.114 . 1 . 135 . . 189 GLU N . 19884 1 758 . 1 1 190 190 GLY H H 1 7.679 0.015 . 1 . 99 . . 190 GLY H . 19884 1 759 . 1 1 190 190 GLY CA C 13 42.992 . . 1 . 405 . . 190 GLY CA . 19884 1 760 . 1 1 190 190 GLY N N 15 118.230 0.133 . 1 . 100 . . 190 GLY N . 19884 1 761 . 1 1 193 193 GLY C C 13 171.870 0.01 . 1 . 723 . . 193 GLY C . 19884 1 762 . 1 1 193 193 GLY CA C 13 43.879 0.002 . 1 . 570 . . 193 GLY CA . 19884 1 763 . 1 1 194 194 ALA H H 1 9.201 0.021 . 1 . 180 . . 194 ALA H . 19884 1 764 . 1 1 194 194 ALA C C 13 178.925 0.022 . 1 . 844 . . 194 ALA C . 19884 1 765 . 1 1 194 194 ALA CA C 13 52.454 0.008 . 1 . 403 . . 194 ALA CA . 19884 1 766 . 1 1 194 194 ALA CB C 13 19.632 0.047 . 1 . 495 . . 194 ALA CB . 19884 1 767 . 1 1 194 194 ALA N N 15 122.380 0.088 . 1 . 181 . . 194 ALA N . 19884 1 768 . 1 1 195 195 ALA H H 1 8.262 0.015 . 1 . 909 . . 195 ALA H . 19884 1 769 . 1 1 195 195 ALA C C 13 177.390 0.007 . 1 . 972 . . 195 ALA C . 19884 1 770 . 1 1 195 195 ALA CA C 13 50.904 0.02 . 1 . 970 . . 195 ALA CA . 19884 1 771 . 1 1 195 195 ALA CB C 13 16.538 0.019 . 1 . 1014 . . 195 ALA CB . 19884 1 772 . 1 1 195 195 ALA N N 15 124.383 0.144 . 1 . 910 . . 195 ALA N . 19884 1 773 . 1 1 196 196 ASN H H 1 8.058 0.014 . 1 . 230 . . 196 ASN H . 19884 1 774 . 1 1 196 196 ASN C C 13 175.980 0.006 . 1 . 838 . . 196 ASN C . 19884 1 775 . 1 1 196 196 ASN CA C 13 54.300 0.012 . 1 . 434 . . 196 ASN CA . 19884 1 776 . 1 1 196 196 ASN CB C 13 38.181 0.047 . 1 . 519 . . 196 ASN CB . 19884 1 777 . 1 1 196 196 ASN N N 15 113.595 0.118 . 1 . 231 . . 196 ASN N . 19884 1 778 . 1 1 197 197 ASN H H 1 8.023 0.017 . 1 . 260 . . 197 ASN H . 19884 1 779 . 1 1 197 197 ASN C C 13 173.497 0.011 . 1 . 747 . . 197 ASN C . 19884 1 780 . 1 1 197 197 ASN CA C 13 51.831 0.031 . 1 . 394 . . 197 ASN CA . 19884 1 781 . 1 1 197 197 ASN CB C 13 37.143 0.042 . 1 . 644 . . 197 ASN CB . 19884 1 782 . 1 1 197 197 ASN N N 15 115.195 0.118 . 1 . 261 . . 197 ASN N . 19884 1 783 . 1 1 198 198 VAL H H 1 7.463 0.014 . 1 . 334 . . 198 VAL H . 19884 1 784 . 1 1 198 198 VAL C C 13 173.740 0.008 . 1 . 810 . . 198 VAL C . 19884 1 785 . 1 1 198 198 VAL CA C 13 60.789 0.011 . 1 . 393 . . 198 VAL CA . 19884 1 786 . 1 1 198 198 VAL CB C 13 34.095 0.019 . 1 . 491 . . 198 VAL CB . 19884 1 787 . 1 1 198 198 VAL N N 15 117.049 0.12 . 1 . 335 . . 198 VAL N . 19884 1 788 . 1 1 199 199 PHE H H 1 9.239 0.014 . 1 . 356 . . 199 PHE H . 19884 1 789 . 1 1 199 199 PHE C C 13 173.370 0.01 . 1 . 739 . . 199 PHE C . 19884 1 790 . 1 1 199 199 PHE CA C 13 59.088 0.05 . 1 . 592 . . 199 PHE CA . 19884 1 791 . 1 1 199 199 PHE CB C 13 38.844 0.04 . 1 . 670 . . 199 PHE CB . 19884 1 792 . 1 1 199 199 PHE N N 15 128.588 0.115 . 1 . 357 . . 199 PHE N . 19884 1 793 . 1 1 200 200 THR H H 1 6.481 0.017 . 1 . 284 . . 200 THR H . 19884 1 794 . 1 1 200 200 THR C C 13 172.973 0.003 . 1 . 729 . . 200 THR C . 19884 1 795 . 1 1 200 200 THR CA C 13 59.844 0.025 . 1 . 1058 . . 200 THR CA . 19884 1 796 . 1 1 200 200 THR CB C 13 72.560 0.022 . 1 . 1059 . . 200 THR CB . 19884 1 797 . 1 1 200 200 THR N N 15 117.305 0.117 . 1 . 285 . . 200 THR N . 19884 1 798 . 1 1 201 201 ASN H H 1 8.499 0.014 . 1 . 226 . . 201 ASN H . 19884 1 799 . 1 1 201 201 ASN C C 13 175.237 0.013 . 1 . 1032 . . 201 ASN C . 19884 1 800 . 1 1 201 201 ASN CA C 13 52.212 0.013 . 1 . 553 . . 201 ASN CA . 19884 1 801 . 1 1 201 201 ASN CB C 13 36.307 0.05 . 1 . 489 . . 201 ASN CB . 19884 1 802 . 1 1 201 201 ASN N N 15 116.121 0.113 . 1 . 227 . . 201 ASN N . 19884 1 803 . 1 1 202 202 GLU H H 1 7.927 0.017 . 1 . 35 . . 202 GLU H . 19884 1 804 . 1 1 202 202 GLU C C 13 174.992 0.021 . 1 . 879 . . 202 GLU C . 19884 1 805 . 1 1 202 202 GLU CA C 13 59.162 0.266 . 1 . 580 . . 202 GLU CA . 19884 1 806 . 1 1 202 202 GLU CB C 13 27.907 0.083 . 1 . 1238 . . 202 GLU CB . 19884 1 807 . 1 1 202 202 GLU N N 15 118.919 0.123 . 1 . 36 . . 202 GLU N . 19884 1 808 . 1 1 203 203 PHE H H 1 6.573 0.017 . 1 . 232 . . 203 PHE H . 19884 1 809 . 1 1 203 203 PHE C C 13 173.988 . . 1 . 849 . . 203 PHE C . 19884 1 810 . 1 1 203 203 PHE CA C 13 59.911 . . 1 . 872 . . 203 PHE CA . 19884 1 811 . 1 1 203 203 PHE CB C 13 36.344 . . 1 . 1140 . . 203 PHE CB . 19884 1 812 . 1 1 203 203 PHE N N 15 116.454 0.128 . 1 . 233 . . 203 PHE N . 19884 1 813 . 1 1 204 204 TYR C C 13 177.343 . . 1 . 1223 . . 204 TYR C . 19884 1 814 . 1 1 204 204 TYR CB C 13 36.284 0.032 . 1 . 1224 . . 204 TYR CB . 19884 1 815 . 1 1 205 205 LEU H H 1 6.371 0.011 . 1 . 71 . . 205 LEU H . 19884 1 816 . 1 1 205 205 LEU C C 13 178.417 0.093 . 1 . 773 . . 205 LEU C . 19884 1 817 . 1 1 205 205 LEU CA C 13 56.897 0.08 . 1 . 414 . . 205 LEU CA . 19884 1 818 . 1 1 205 205 LEU CB C 13 40.209 0.106 . 1 . 503 . . 205 LEU CB . 19884 1 819 . 1 1 205 205 LEU N N 15 115.714 0.102 . 1 . 72 . . 205 LEU N . 19884 1 820 . 1 1 206 206 ASN H H 1 7.925 0.018 . 1 . 886 . . 206 ASN H . 19884 1 821 . 1 1 206 206 ASN C C 13 177.623 0.002 . 1 . 740 . . 206 ASN C . 19884 1 822 . 1 1 206 206 ASN CA C 13 54.233 0.015 . 1 . 383 . . 206 ASN CA . 19884 1 823 . 1 1 206 206 ASN CB C 13 33.900 0.001 . 1 . 876 . . 206 ASN CB . 19884 1 824 . 1 1 206 206 ASN N N 15 118.237 0.13 . 1 . 887 . . 206 ASN N . 19884 1 825 . 1 1 207 207 LEU H H 1 6.975 0.018 . 1 . 286 . . 207 LEU H . 19884 1 826 . 1 1 207 207 LEU C C 13 177.488 0.018 . 1 . 799 . . 207 LEU C . 19884 1 827 . 1 1 207 207 LEU CA C 13 57.405 0.039 . 1 . 377 . . 207 LEU CA . 19884 1 828 . 1 1 207 207 LEU CB C 13 39.704 0.036 . 1 . 476 . . 207 LEU CB . 19884 1 829 . 1 1 207 207 LEU N N 15 122.330 0.118 . 1 . 287 . . 207 LEU N . 19884 1 830 . 1 1 208 208 LEU H H 1 6.512 0.017 . 1 . 250 . . 208 LEU H . 19884 1 831 . 1 1 208 208 LEU C C 13 178.928 0.007 . 1 . 830 . . 208 LEU C . 19884 1 832 . 1 1 208 208 LEU CA C 13 55.730 0.041 . 1 . 473 . . 208 LEU CA . 19884 1 833 . 1 1 208 208 LEU CB C 13 41.745 0.024 . 1 . 549 . . 208 LEU CB . 19884 1 834 . 1 1 208 208 LEU N N 15 111.997 0.122 . 1 . 251 . . 208 LEU N . 19884 1 835 . 1 1 209 209 ASN H H 1 7.921 0.015 . 1 . 65 . . 209 ASN H . 19884 1 836 . 1 1 209 209 ASN C C 13 176.696 0.005 . 1 . 771 . . 209 ASN C . 19884 1 837 . 1 1 209 209 ASN CA C 13 53.947 0.012 . 1 . 449 . . 209 ASN CA . 19884 1 838 . 1 1 209 209 ASN CB C 13 39.246 0.038 . 1 . 532 . . 209 ASN CB . 19884 1 839 . 1 1 209 209 ASN N N 15 114.069 0.114 . 1 . 66 . . 209 ASN N . 19884 1 840 . 1 1 210 210 GLU H H 1 7.237 0.015 . 1 . 130 . . 210 GLU H . 19884 1 841 . 1 1 210 210 GLU C C 13 173.431 0.005 . 1 . 708 . . 210 GLU C . 19884 1 842 . 1 1 210 210 GLU CA C 13 54.528 0.011 . 1 . 456 . . 210 GLU CA . 19884 1 843 . 1 1 210 210 GLU CB C 13 28.754 0.021 . 1 . 537 . . 210 GLU CB . 19884 1 844 . 1 1 210 210 GLU N N 15 118.469 0.115 . 1 . 131 . . 210 GLU N . 19884 1 845 . 1 1 211 211 ASP H H 1 7.798 0.014 . 1 . 146 . . 211 ASP H . 19884 1 846 . 1 1 211 211 ASP C C 13 174.988 0.01 . 1 . 825 . . 211 ASP C . 19884 1 847 . 1 1 211 211 ASP CA C 13 52.143 0.014 . 1 . 1061 . . 211 ASP CA . 19884 1 848 . 1 1 211 211 ASP CB C 13 40.053 0.021 . 1 . 1060 . . 211 ASP CB . 19884 1 849 . 1 1 211 211 ASP N N 15 119.480 0.111 . 1 . 147 . . 211 ASP N . 19884 1 850 . 1 1 212 212 TRP H H 1 7.569 0.013 . 1 . 304 . . 212 TRP H . 19884 1 851 . 1 1 212 212 TRP C C 13 176.446 0.006 . 1 . 804 . . 212 TRP C . 19884 1 852 . 1 1 212 212 TRP CA C 13 55.797 0.015 . 1 . 581 . . 212 TRP CA . 19884 1 853 . 1 1 212 212 TRP CB C 13 32.217 0.031 . 1 . 663 . . 212 TRP CB . 19884 1 854 . 1 1 212 212 TRP N N 15 124.419 0.116 . 1 . 305 . . 212 TRP N . 19884 1 855 . 1 1 213 213 LYS H H 1 8.980 0.015 . 1 . 234 . . 213 LYS H . 19884 1 856 . 1 1 213 213 LYS C C 13 173.965 0.005 . 1 . 699 . . 213 LYS C . 19884 1 857 . 1 1 213 213 LYS CA C 13 54.645 0.012 . 1 . 560 . . 213 LYS CA . 19884 1 858 . 1 1 213 213 LYS CB C 13 34.980 0.015 . 1 . 672 . . 213 LYS CB . 19884 1 859 . 1 1 213 213 LYS N N 15 124.004 0.113 . 1 . 235 . . 213 LYS N . 19884 1 860 . 1 1 214 214 LEU H H 1 8.011 0.013 . 1 . 302 . . 214 LEU H . 19884 1 861 . 1 1 214 214 LEU C C 13 176.309 0.01 . 1 . 780 . . 214 LEU C . 19884 1 862 . 1 1 214 214 LEU CA C 13 54.450 0.015 . 1 . 419 . . 214 LEU CA . 19884 1 863 . 1 1 214 214 LEU CB C 13 39.245 0.056 . 1 . 507 . . 214 LEU CB . 19884 1 864 . 1 1 214 214 LEU N N 15 131.006 0.139 . 1 . 303 . . 214 LEU N . 19884 1 865 . 1 1 215 215 GLU H H 1 8.878 0.015 . 1 . 322 . . 215 GLU H . 19884 1 866 . 1 1 215 215 GLU C C 13 174.270 0.003 . 1 . 808 . . 215 GLU C . 19884 1 867 . 1 1 215 215 GLU CA C 13 54.042 0.033 . 1 . 464 . . 215 GLU CA . 19884 1 868 . 1 1 215 215 GLU CB C 13 31.642 0.026 . 1 . 544 . . 215 GLU CB . 19884 1 869 . 1 1 215 215 GLU N N 15 127.183 0.116 . 1 . 323 . . 215 GLU N . 19884 1 870 . 1 1 216 216 LYS H H 1 8.305 0.014 . 1 . 338 . . 216 LYS H . 19884 1 871 . 1 1 216 216 LYS C C 13 177.085 0.006 . 1 . 975 . . 216 LYS C . 19884 1 872 . 1 1 216 216 LYS CA C 13 55.219 0.022 . 1 . 953 . . 216 LYS CA . 19884 1 873 . 1 1 216 216 LYS CB C 13 32.705 0.026 . 1 . 890 . . 216 LYS CB . 19884 1 874 . 1 1 216 216 LYS N N 15 119.927 0.114 . 1 . 339 . . 216 LYS N . 19884 1 875 . 1 1 217 217 ASN H H 1 8.629 0.012 . 1 . 278 . . 217 ASN H . 19884 1 876 . 1 1 217 217 ASN C C 13 178.296 0.03 . 1 . 1125 . . 217 ASN C . 19884 1 877 . 1 1 217 217 ASN CA C 13 50.696 0.01 . 1 . 1126 . . 217 ASN CA . 19884 1 878 . 1 1 217 217 ASN CB C 13 38.875 0.038 . 1 . 1127 . . 217 ASN CB . 19884 1 879 . 1 1 217 217 ASN N N 15 122.963 0.106 . 1 . 279 . . 217 ASN N . 19884 1 880 . 1 1 218 218 ASP H H 1 8.906 0.011 . 1 . 136 . . 218 ASP H . 19884 1 881 . 1 1 218 218 ASP C C 13 176.885 0.005 . 1 . 748 . . 218 ASP C . 19884 1 882 . 1 1 218 218 ASP CA C 13 56.621 0.019 . 1 . 595 . . 218 ASP CA . 19884 1 883 . 1 1 218 218 ASP CB C 13 39.967 0.042 . 1 . 677 . . 218 ASP CB . 19884 1 884 . 1 1 218 218 ASP N N 15 117.614 0.108 . 1 . 137 . . 218 ASP N . 19884 1 885 . 1 1 219 219 ALA H H 1 8.362 0.014 . 1 . 336 . . 219 ALA H . 19884 1 886 . 1 1 219 219 ALA C C 13 176.076 0.013 . 1 . 696 . . 219 ALA C . 19884 1 887 . 1 1 219 219 ALA CA C 13 51.290 0.014 . 1 . 380 . . 219 ALA CA . 19884 1 888 . 1 1 219 219 ALA CB C 13 17.840 0.01 . 1 . 633 . . 219 ALA CB . 19884 1 889 . 1 1 219 219 ALA N N 15 122.733 0.119 . 1 . 337 . . 219 ALA N . 19884 1 890 . 1 1 220 220 ASN H H 1 8.378 0.015 . 1 . 81 . . 220 ASN H . 19884 1 891 . 1 1 220 220 ASN C C 13 174.005 0.017 . 1 . 690 . . 220 ASN C . 19884 1 892 . 1 1 220 220 ASN CA C 13 54.509 0.017 . 1 . 555 . . 220 ASN CA . 19884 1 893 . 1 1 220 220 ASN CB C 13 37.001 0.035 . 1 . 625 . . 220 ASN CB . 19884 1 894 . 1 1 220 220 ASN N N 15 112.952 0.115 . 1 . 82 . . 220 ASN N . 19884 1 895 . 1 1 221 221 ASN H H 1 7.705 0.013 . 1 . 45 . . 221 ASN H . 19884 1 896 . 1 1 221 221 ASN C C 13 174.655 0.006 . 1 . 766 . . 221 ASN C . 19884 1 897 . 1 1 221 221 ASN CA C 13 51.548 0.014 . 1 . 417 . . 221 ASN CA . 19884 1 898 . 1 1 221 221 ASN CB C 13 40.076 0.025 . 1 . 506 . . 221 ASN CB . 19884 1 899 . 1 1 221 221 ASN N N 15 115.820 0.112 . 1 . 46 . . 221 ASN N . 19884 1 900 . 1 1 222 222 GLU H H 1 8.550 0.012 . 1 . 43 . . 222 GLU H . 19884 1 901 . 1 1 222 222 GLU C C 13 175.480 0.004 . 1 . 765 . . 222 GLU C . 19884 1 902 . 1 1 222 222 GLU CA C 13 55.637 0.01 . 1 . 412 . . 222 GLU CA . 19884 1 903 . 1 1 222 222 GLU CB C 13 29.415 0.029 . 1 . 501 . . 222 GLU CB . 19884 1 904 . 1 1 222 222 GLU N N 15 120.093 0.118 . 1 . 44 . . 222 GLU N . 19884 1 905 . 1 1 223 223 GLN H H 1 8.892 0.013 . 1 . 891 . . 223 GLN H . 19884 1 906 . 1 1 223 223 GLN C C 13 171.936 0.025 . 1 . 978 . . 223 GLN C . 19884 1 907 . 1 1 223 223 GLN CA C 13 53.737 0.019 . 1 . 1066 . . 223 GLN CA . 19884 1 908 . 1 1 223 223 GLN N N 15 117.593 0.082 . 1 . 892 . . 223 GLN N . 19884 1 909 . 1 1 224 224 TRP H H 1 8.032 0.013 . 1 . 354 . . 224 TRP H . 19884 1 910 . 1 1 224 224 TRP C C 13 174.406 0.008 . 1 . 815 . . 224 TRP C . 19884 1 911 . 1 1 224 224 TRP CA C 13 55.505 0.01 . 1 . 439 . . 224 TRP CA . 19884 1 912 . 1 1 224 224 TRP CB C 13 28.440 0.029 . 1 . 854 . . 224 TRP CB . 19884 1 913 . 1 1 224 224 TRP N N 15 123.231 0.119 . 1 . 355 . . 224 TRP N . 19884 1 914 . 1 1 225 225 ASP H H 1 9.282 0.014 . 1 . 268 . . 225 ASP H . 19884 1 915 . 1 1 225 225 ASP C C 13 176.274 0.007 . 1 . 794 . . 225 ASP C . 19884 1 916 . 1 1 225 225 ASP CA C 13 51.679 0.01 . 1 . 1067 . . 225 ASP CA . 19884 1 917 . 1 1 225 225 ASP CB C 13 42.179 0.029 . 1 . 498 . . 225 ASP CB . 19884 1 918 . 1 1 225 225 ASP N N 15 119.977 0.113 . 1 . 269 . . 225 ASP N . 19884 1 919 . 1 1 226 226 SER H H 1 8.545 0.015 . 1 . 91 . . 226 SER H . 19884 1 920 . 1 1 226 226 SER C C 13 176.789 0.009 . 1 . 777 . . 226 SER C . 19884 1 921 . 1 1 226 226 SER CA C 13 54.522 0.005 . 1 . 384 . . 226 SER CA . 19884 1 922 . 1 1 226 226 SER CB C 13 64.897 0.092 . 1 . 484 . . 226 SER CB . 19884 1 923 . 1 1 226 226 SER N N 15 118.467 0.122 . 1 . 92 . . 226 SER N . 19884 1 924 . 1 1 227 227 LYS H H 1 8.489 0.015 . 1 . 122 . . 227 LYS H . 19884 1 925 . 1 1 227 227 LYS C C 13 177.442 0.01 . 1 . 787 . . 227 LYS C . 19884 1 926 . 1 1 227 227 LYS CA C 13 57.695 0.04 . 1 . 395 . . 227 LYS CA . 19884 1 927 . 1 1 227 227 LYS CB C 13 30.429 0.028 . 1 . 492 . . 227 LYS CB . 19884 1 928 . 1 1 227 227 LYS N N 15 124.718 0.111 . 1 . 123 . . 227 LYS N . 19884 1 929 . 1 1 228 228 SER H H 1 7.160 0.016 . 1 . 1028 . . 228 SER H . 19884 1 930 . 1 1 228 228 SER C C 13 172.913 0.013 . 1 . 832 . . 228 SER C . 19884 1 931 . 1 1 228 228 SER CA C 13 57.260 0.038 . 1 . 385 . . 228 SER CA . 19884 1 932 . 1 1 228 228 SER CB C 13 61.332 0.1 . 1 . 878 . . 228 SER CB . 19884 1 933 . 1 1 228 228 SER N N 15 112.755 0.107 . 1 . 1029 . . 228 SER N . 19884 1 934 . 1 1 229 229 GLY H H 1 7.383 0.016 . 1 . 101 . . 229 GLY H . 19884 1 935 . 1 1 229 229 GLY C C 13 173.835 . . 1 . 782 . . 229 GLY C . 19884 1 936 . 1 1 229 229 GLY CA C 13 43.986 . . 1 . 1068 . . 229 GLY CA . 19884 1 937 . 1 1 229 229 GLY N N 15 106.274 0.136 . 1 . 102 . . 229 GLY N . 19884 1 938 . 1 1 230 230 TYR C C 13 174.270 0.005 . 1 . 1184 . . 230 TYR C . 19884 1 939 . 1 1 230 230 TYR CA C 13 51.921 0.003 . 1 . 1182 . . 230 TYR CA . 19884 1 940 . 1 1 230 230 TYR CB C 13 38.408 0.005 . 1 . 1183 . . 230 TYR CB . 19884 1 941 . 1 1 231 231 MET H H 1 8.357 0.016 . 1 . 899 . . 231 MET H . 19884 1 942 . 1 1 231 231 MET C C 13 171.408 0.018 . 1 . 778 . . 231 MET C . 19884 1 943 . 1 1 231 231 MET CA C 13 52.511 0.026 . 1 . 957 . . 231 MET CA . 19884 1 944 . 1 1 231 231 MET CB C 13 36.247 0.009 . 1 . 901 . . 231 MET CB . 19884 1 945 . 1 1 231 231 MET N N 15 123.312 0.117 . 1 . 900 . . 231 MET N . 19884 1 946 . 1 1 232 232 MET H H 1 7.857 0.017 . 1 . 274 . . 232 MET H . 19884 1 947 . 1 1 232 232 MET C C 13 175.689 . . 1 . 795 . . 232 MET C . 19884 1 948 . 1 1 232 232 MET CA C 13 51.728 . . 1 . 401 . . 232 MET CA . 19884 1 949 . 1 1 232 232 MET CB C 13 34.064 . . 1 . 857 . . 232 MET CB . 19884 1 950 . 1 1 232 232 MET N N 15 111.730 0.114 . 1 . 275 . . 232 MET N . 19884 1 951 . 1 1 235 235 THR C C 13 178.068 . . 1 . 1166 . . 235 THR C . 19884 1 952 . 1 1 236 236 ASP H H 1 8.378 0.001 . 1 . 965 . . 236 ASP H . 19884 1 953 . 1 1 236 236 ASP C C 13 175.675 . . 1 . 1168 . . 236 ASP C . 19884 1 954 . 1 1 236 236 ASP CA C 13 55.840 0.027 . 1 . 967 . . 236 ASP CA . 19884 1 955 . 1 1 236 236 ASP CB C 13 44.140 . . 1 . 1167 . . 236 ASP CB . 19884 1 956 . 1 1 236 236 ASP N N 15 115.042 0.02 . 1 . 966 . . 236 ASP N . 19884 1 957 . 1 1 237 237 TYR H H 1 7.044 0.017 . 1 . 228 . . 237 TYR H . 19884 1 958 . 1 1 237 237 TYR C C 13 176.886 0.003 . 1 . 710 . . 237 TYR C . 19884 1 959 . 1 1 237 237 TYR CA C 13 59.478 0.034 . 1 . 599 . . 237 TYR CA . 19884 1 960 . 1 1 237 237 TYR CB C 13 38.281 0.044 . 1 . 647 . . 237 TYR CB . 19884 1 961 . 1 1 237 237 TYR N N 15 118.129 0.121 . 1 . 229 . . 237 TYR N . 19884 1 962 . 1 1 238 238 SER H H 1 7.423 0.019 . 1 . 154 . . 238 SER H . 19884 1 963 . 1 1 238 238 SER C C 13 175.356 . . 1 . 730 . . 238 SER C . 19884 1 964 . 1 1 238 238 SER CA C 13 61.479 . . 1 . 1141 . . 238 SER CA . 19884 1 965 . 1 1 238 238 SER CB C 13 62.328 0.005 . 1 . 681 . . 238 SER CB . 19884 1 966 . 1 1 238 238 SER N N 15 113.419 0.142 . 1 . 155 . . 238 SER N . 19884 1 967 . 1 1 239 239 LEU H H 1 6.977 0.018 . 1 . 366 . . 239 LEU H . 19884 1 968 . 1 1 239 239 LEU C C 13 176.123 0.017 . 1 . 819 . . 239 LEU C . 19884 1 969 . 1 1 239 239 LEU CA C 13 55.693 0.002 . 1 . 382 . . 239 LEU CA . 19884 1 970 . 1 1 239 239 LEU CB C 13 39.502 0.036 . 1 . 481 . . 239 LEU CB . 19884 1 971 . 1 1 239 239 LEU N N 15 119.968 0.132 . 1 . 367 . . 239 LEU N . 19884 1 972 . 1 1 240 240 ILE H H 1 6.671 0.018 . 1 . 601 . . 240 ILE H . 19884 1 973 . 1 1 240 240 ILE C C 13 176.961 0.011 . 1 . 1079 . . 240 ILE C . 19884 1 974 . 1 1 240 240 ILE CA C 13 59.186 0.009 . 1 . 1077 . . 240 ILE CA . 19884 1 975 . 1 1 240 240 ILE CB C 13 36.601 0.006 . 1 . 1078 . . 240 ILE CB . 19884 1 976 . 1 1 240 240 ILE N N 15 129.904 10.599 . 1 . 602 . . 240 ILE N . 19884 1 977 . 1 1 241 241 GLN H H 1 7.005 0.014 . 1 . 1075 . . 241 GLN H . 19884 1 978 . 1 1 241 241 GLN C C 13 175.814 0.008 . 1 . 709 . . 241 GLN C . 19884 1 979 . 1 1 241 241 GLN CA C 13 55.766 0.022 . 1 . 436 . . 241 GLN CA . 19884 1 980 . 1 1 241 241 GLN CB C 13 29.136 0.043 . 1 . 521 . . 241 GLN CB . 19884 1 981 . 1 1 241 241 GLN N N 15 120.586 0.117 . 1 . 1076 . . 241 GLN N . 19884 1 982 . 1 1 242 242 ASP H H 1 7.222 0.013 . 1 . 150 . . 242 ASP H . 19884 1 983 . 1 1 242 242 ASP C C 13 173.799 . . 1 . 827 . . 242 ASP C . 19884 1 984 . 1 1 242 242 ASP CA C 13 50.403 . . 1 . 864 . . 242 ASP CA . 19884 1 985 . 1 1 242 242 ASP CB C 13 43.910 . . 1 . 853 . . 242 ASP CB . 19884 1 986 . 1 1 242 242 ASP N N 15 122.782 0.117 . 1 . 151 . . 242 ASP N . 19884 1 987 . 1 1 243 243 PRO C C 13 179.402 0.003 . 1 . 746 . . 243 PRO C . 19884 1 988 . 1 1 243 243 PRO CA C 13 64.588 0.015 . 1 . 594 . . 243 PRO CA . 19884 1 989 . 1 1 243 243 PRO CB C 13 31.323 0.05 . 1 . 676 . . 243 PRO CB . 19884 1 990 . 1 1 244 244 LYS H H 1 7.439 0.015 . 1 . 330 . . 244 LYS H . 19884 1 991 . 1 1 244 244 LYS C C 13 180.297 0.011 . 1 . 1147 . . 244 LYS C . 19884 1 992 . 1 1 244 244 LYS CA C 13 58.184 0.015 . 1 . 437 . . 244 LYS CA . 19884 1 993 . 1 1 244 244 LYS CB C 13 30.673 0.028 . 1 . 522 . . 244 LYS CB . 19884 1 994 . 1 1 244 244 LYS N N 15 118.647 0.106 . 1 . 331 . . 244 LYS N . 19884 1 995 . 1 1 245 245 TYR H H 1 8.464 0.014 . 1 . 358 . . 245 TYR H . 19884 1 996 . 1 1 245 245 TYR C C 13 178.787 0.002 . 1 . 816 . . 245 TYR C . 19884 1 997 . 1 1 245 245 TYR CA C 13 57.246 0.029 . 1 . 428 . . 245 TYR CA . 19884 1 998 . 1 1 245 245 TYR CB C 13 36.756 0.027 . 1 . 516 . . 245 TYR CB . 19884 1 999 . 1 1 245 245 TYR N N 15 121.059 0.118 . 1 . 359 . . 245 TYR N . 19884 1 1000 . 1 1 246 246 LEU H H 1 8.555 0.013 . 1 . 144 . . 246 LEU H . 19884 1 1001 . 1 1 246 246 LEU C C 13 178.019 0.004 . 1 . 824 . . 246 LEU C . 19884 1 1002 . 1 1 246 246 LEU CA C 13 57.775 0.004 . 1 . 450 . . 246 LEU CA . 19884 1 1003 . 1 1 246 246 LEU CB C 13 40.318 0.021 . 1 . 533 . . 246 LEU CB . 19884 1 1004 . 1 1 246 246 LEU N N 15 121.919 0.116 . 1 . 145 . . 246 LEU N . 19884 1 1005 . 1 1 247 247 SER H H 1 6.906 0.013 . 1 . 13 . . 247 SER H . 19884 1 1006 . 1 1 247 247 SER C C 13 176.421 0.042 . 1 . 756 . . 247 SER C . 19884 1 1007 . 1 1 247 247 SER CA C 13 61.026 0.025 . 1 . 376 . . 247 SER CA . 19884 1 1008 . 1 1 247 247 SER CB C 13 62.717 0.022 . 1 . 475 . . 247 SER CB . 19884 1 1009 . 1 1 247 247 SER N N 15 109.766 0.123 . 1 . 14 . . 247 SER N . 19884 1 1010 . 1 1 248 248 ILE H H 1 7.086 0.016 . 1 . 170 . . 248 ILE H . 19884 1 1011 . 1 1 248 248 ILE C C 13 176.529 0.007 . 1 . 742 . . 248 ILE C . 19884 1 1012 . 1 1 248 248 ILE CA C 13 63.830 0.044 . 1 . 589 . . 248 ILE CA . 19884 1 1013 . 1 1 248 248 ILE CB C 13 37.191 0.016 . 1 . 671 . . 248 ILE CB . 19884 1 1014 . 1 1 248 248 ILE N N 15 123.299 0.105 . 1 . 171 . . 248 ILE N . 19884 1 1015 . 1 1 249 249 VAL H H 1 8.151 0.015 . 1 . 294 . . 249 VAL H . 19884 1 1016 . 1 1 249 249 VAL C C 13 177.966 0.007 . 1 . 802 . . 249 VAL C . 19884 1 1017 . 1 1 249 249 VAL CA C 13 65.929 0.051 . 1 . 459 . . 249 VAL CA . 19884 1 1018 . 1 1 249 249 VAL CB C 13 30.236 0.015 . 1 . 538 . . 249 VAL CB . 19884 1 1019 . 1 1 249 249 VAL N N 15 121.811 0.113 . 1 . 295 . . 249 VAL N . 19884 1 1020 . 1 1 250 250 LYS H H 1 7.761 0.015 . 1 . 17 . . 250 LYS H . 19884 1 1021 . 1 1 250 250 LYS C C 13 178.776 0.014 . 1 . 757 . . 250 LYS C . 19884 1 1022 . 1 1 250 250 LYS CA C 13 59.390 0.024 . 1 . 441 . . 250 LYS CA . 19884 1 1023 . 1 1 250 250 LYS CB C 13 31.603 0.022 . 1 . 524 . . 250 LYS CB . 19884 1 1024 . 1 1 250 250 LYS N N 15 115.171 0.117 . 1 . 18 . . 250 LYS N . 19884 1 1025 . 1 1 251 251 GLU H H 1 6.935 0.015 . 1 . 59 . . 251 GLU H . 19884 1 1026 . 1 1 251 251 GLU C C 13 179.845 0.024 . 1 . 980 . . 251 GLU C . 19884 1 1027 . 1 1 251 251 GLU CA C 13 58.782 0.039 . 1 . 551 . . 251 GLU CA . 19884 1 1028 . 1 1 251 251 GLU CB C 13 28.899 0.022 . 1 . 906 . . 251 GLU CB . 19884 1 1029 . 1 1 251 251 GLU N N 15 120.168 0.16 . 1 . 60 . . 251 GLU N . 19884 1 1030 . 1 1 252 252 TYR H H 1 7.378 0.015 . 1 . 904 . . 252 TYR H . 19884 1 1031 . 1 1 252 252 TYR C C 13 178.439 0.003 . 1 . 979 . . 252 TYR C . 19884 1 1032 . 1 1 252 252 TYR CA C 13 55.120 0.014 . 1 . 461 . . 252 TYR CA . 19884 1 1033 . 1 1 252 252 TYR CB C 13 34.921 0.018 . 1 . 539 . . 252 TYR CB . 19884 1 1034 . 1 1 252 252 TYR N N 15 119.499 0.116 . 1 . 905 . . 252 TYR N . 19884 1 1035 . 1 1 253 253 ALA H H 1 8.091 0.015 . 1 . 1 . . 253 ALA H . 19884 1 1036 . 1 1 253 253 ALA C C 13 177.255 0.006 . 1 . 753 . . 253 ALA C . 19884 1 1037 . 1 1 253 253 ALA CA C 13 53.937 0.02 . 1 . 448 . . 253 ALA CA . 19884 1 1038 . 1 1 253 253 ALA CB C 13 17.521 0.021 . 1 . 531 . . 253 ALA CB . 19884 1 1039 . 1 1 253 253 ALA N N 15 121.345 0.119 . 1 . 2 . . 253 ALA N . 19884 1 1040 . 1 1 254 254 ASN H H 1 6.934 0.015 . 1 . 272 . . 254 ASN H . 19884 1 1041 . 1 1 254 254 ASN C C 13 174.839 0.024 . 1 . 1088 . . 254 ASN C . 19884 1 1042 . 1 1 254 254 ASN CA C 13 53.534 0.011 . 1 . 1087 . . 254 ASN CA . 19884 1 1043 . 1 1 254 254 ASN CB C 13 39.550 0.018 . 1 . 1082 . . 254 ASN CB . 19884 1 1044 . 1 1 254 254 ASN N N 15 111.975 0.118 . 1 . 273 . . 254 ASN N . 19884 1 1045 . 1 1 255 255 ASP H H 1 7.436 0.013 . 1 . 222 . . 255 ASP H . 19884 1 1046 . 1 1 255 255 ASP C C 13 174.088 0.016 . 1 . 843 . . 255 ASP C . 19884 1 1047 . 1 1 255 255 ASP CA C 13 52.604 0.028 . 1 . 472 . . 255 ASP CA . 19884 1 1048 . 1 1 255 255 ASP CB C 13 41.041 0.014 . 1 . 1113 . . 255 ASP CB . 19884 1 1049 . 1 1 255 255 ASP N N 15 120.151 0.099 . 1 . 223 . . 255 ASP N . 19884 1 1050 . 1 1 256 256 GLN H H 1 8.935 0.009 . 1 . 142 . . 256 GLN H . 19884 1 1051 . 1 1 256 256 GLN C C 13 176.686 0.008 . 1 . 725 . . 256 GLN C . 19884 1 1052 . 1 1 256 256 GLN CA C 13 59.145 0.006 . 1 . 577 . . 256 GLN CA . 19884 1 1053 . 1 1 256 256 GLN CB C 13 29.436 0.019 . 1 . 657 . . 256 GLN CB . 19884 1 1054 . 1 1 256 256 GLN N N 15 125.685 0.1 . 1 . 143 . . 256 GLN N . 19884 1 1055 . 1 1 257 257 ASP H H 1 8.019 0.014 . 1 . 204 . . 257 ASP H . 19884 1 1056 . 1 1 257 257 ASP C C 13 178.372 0.011 . 1 . 735 . . 257 ASP C . 19884 1 1057 . 1 1 257 257 ASP CA C 13 57.432 0.01 . 1 . 585 . . 257 ASP CA . 19884 1 1058 . 1 1 257 257 ASP CB C 13 40.244 0.017 . 1 . 666 . . 257 ASP CB . 19884 1 1059 . 1 1 257 257 ASP N N 15 118.676 0.116 . 1 . 205 . . 257 ASP N . 19884 1 1060 . 1 1 258 258 LYS H H 1 7.526 0.014 . 1 . 252 . . 258 LYS H . 19884 1 1061 . 1 1 258 258 LYS C C 13 177.980 0.039 . 1 . 714 . . 258 LYS C . 19884 1 1062 . 1 1 258 258 LYS CA C 13 58.222 0.007 . 1 . 566 . . 258 LYS CA . 19884 1 1063 . 1 1 258 258 LYS CB C 13 31.377 0.015 . 1 . 862 . . 258 LYS CB . 19884 1 1064 . 1 1 258 258 LYS N N 15 121.816 0.115 . 1 . 253 . . 258 LYS N . 19884 1 1065 . 1 1 259 259 PHE H H 1 7.288 0.015 . 1 . 166 . . 259 PHE H . 19884 1 1066 . 1 1 259 259 PHE C C 13 175.954 0.025 . 1 . 684 . . 259 PHE C . 19884 1 1067 . 1 1 259 259 PHE CA C 13 58.271 0.021 . 1 . 391 . . 259 PHE CA . 19884 1 1068 . 1 1 259 259 PHE CB C 13 36.812 0.066 . 1 . 1101 . . 259 PHE CB . 19884 1 1069 . 1 1 259 259 PHE N N 15 118.395 0.122 . 1 . 167 . . 259 PHE N . 19884 1 1070 . 1 1 260 260 PHE H H 1 8.906 0.014 . 1 . 7 . . 260 PHE H . 19884 1 1071 . 1 1 260 260 PHE C C 13 178.295 0.019 . 1 . 1033 . . 260 PHE C . 19884 1 1072 . 1 1 260 260 PHE CA C 13 59.717 0.03 . 1 . 608 . . 260 PHE CA . 19884 1 1073 . 1 1 260 260 PHE CB C 13 36.662 . . 1 . 619 . . 260 PHE CB . 19884 1 1074 . 1 1 260 260 PHE N N 15 121.045 0.123 . 1 . 8 . . 260 PHE N . 19884 1 1075 . 1 1 261 261 LYS H H 1 7.915 0.015 . 1 . 907 . . 261 LYS H . 19884 1 1076 . 1 1 261 261 LYS C C 13 179.899 0.039 . 1 . 1237 . . 261 LYS C . 19884 1 1077 . 1 1 261 261 LYS CB C 13 31.768 0.081 . 1 . 893 . . 261 LYS CB . 19884 1 1078 . 1 1 261 261 LYS N N 15 118.876 0.124 . 1 . 908 . . 261 LYS N . 19884 1 1079 . 1 1 262 262 ASP H H 1 8.405 0.015 . 1 . 31 . . 262 ASP H . 19884 1 1080 . 1 1 262 262 ASP C C 13 180.053 0.02 . 1 . 1181 . . 262 ASP C . 19884 1 1081 . 1 1 262 262 ASP CA C 13 56.866 0.014 . 1 . 569 . . 262 ASP CA . 19884 1 1082 . 1 1 262 262 ASP CB C 13 38.495 0.034 . 1 . 628 . . 262 ASP CB . 19884 1 1083 . 1 1 262 262 ASP N N 15 121.816 0.123 . 1 . 32 . . 262 ASP N . 19884 1 1084 . 1 1 263 263 PHE H H 1 9.931 0.016 . 1 . 178 . . 263 PHE H . 19884 1 1085 . 1 1 263 263 PHE C C 13 176.659 0.034 . 1 . 1093 . . 263 PHE C . 19884 1 1086 . 1 1 263 263 PHE CA C 13 63.003 0.034 . 1 . 559 . . 263 PHE CA . 19884 1 1087 . 1 1 263 263 PHE CB C 13 38.375 0.064 . 1 . 635 . . 263 PHE CB . 19884 1 1088 . 1 1 263 263 PHE N N 15 123.675 0.123 . 1 . 179 . . 263 PHE N . 19884 1 1089 . 1 1 264 264 SER H H 1 8.436 0.014 . 1 . 87 . . 264 SER H . 19884 1 1090 . 1 1 264 264 SER C C 13 176.723 0.024 . 1 . 776 . . 264 SER C . 19884 1 1091 . 1 1 264 264 SER CA C 13 61.481 0.011 . 1 . 408 . . 264 SER CA . 19884 1 1092 . 1 1 264 264 SER CB C 13 62.493 0.031 . 1 . 624 . . 264 SER CB . 19884 1 1093 . 1 1 264 264 SER N N 15 112.992 0.177 . 1 . 88 . . 264 SER N . 19884 1 1094 . 1 1 265 265 LYS H H 1 7.311 0.014 . 1 . 39 . . 265 LYS H . 19884 1 1095 . 1 1 265 265 LYS C C 13 179.655 0.041 . 1 . 882 . . 265 LYS C . 19884 1 1096 . 1 1 265 265 LYS CA C 13 58.738 0.083 . 1 . 579 . . 265 LYS CA . 19884 1 1097 . 1 1 265 265 LYS CB C 13 32.270 0.044 . 1 . 662 . . 265 LYS CB . 19884 1 1098 . 1 1 265 265 LYS N N 15 117.411 0.111 . 1 . 40 . . 265 LYS N . 19884 1 1099 . 1 1 266 266 ALA H H 1 8.336 0.014 . 1 . 93 . . 266 ALA H . 19884 1 1100 . 1 1 266 266 ALA C C 13 179.140 0.042 . 1 . 993 . . 266 ALA C . 19884 1 1101 . 1 1 266 266 ALA CA C 13 55.196 0.035 . 1 . 1094 . . 266 ALA CA . 19884 1 1102 . 1 1 266 266 ALA CB C 13 17.716 0.036 . 1 . 947 . . 266 ALA CB . 19884 1 1103 . 1 1 266 266 ALA N N 15 123.287 0.114 . 1 . 94 . . 266 ALA N . 19884 1 1104 . 1 1 267 267 PHE H H 1 9.782 0.018 . 1 . 945 . . 267 PHE H . 19884 1 1105 . 1 1 267 267 PHE C C 13 177.863 0.025 . 1 . 1096 . . 267 PHE C . 19884 1 1106 . 1 1 267 267 PHE CA C 13 60.333 0.05 . 1 . 1095 . . 267 PHE CA . 19884 1 1107 . 1 1 267 267 PHE CB C 13 39.237 0.035 . 1 . 1097 . . 267 PHE CB . 19884 1 1108 . 1 1 267 267 PHE N N 15 120.724 0.13 . 1 . 946 . . 267 PHE N . 19884 1 1109 . 1 1 268 268 GLU H H 1 8.199 0.015 . 1 . 156 . . 268 GLU H . 19884 1 1110 . 1 1 268 268 GLU C C 13 177.340 0.006 . 1 . 846 . . 268 GLU C . 19884 1 1111 . 1 1 268 268 GLU CA C 13 59.917 0.074 . 1 . 869 . . 268 GLU CA . 19884 1 1112 . 1 1 268 268 GLU CB C 13 25.874 0.056 . 1 . 514 . . 268 GLU CB . 19884 1 1113 . 1 1 268 268 GLU N N 15 117.849 0.129 . 1 . 157 . . 268 GLU N . 19884 1 1114 . 1 1 269 269 LYS H H 1 7.829 0.013 . 1 . 132 . . 269 LYS H . 19884 1 1115 . 1 1 269 269 LYS C C 13 179.039 0.038 . 1 . 790 . . 269 LYS C . 19884 1 1116 . 1 1 269 269 LYS CA C 13 59.428 0.056 . 1 . 867 . . 269 LYS CA . 19884 1 1117 . 1 1 269 269 LYS CB C 13 32.320 0.037 . 1 . 525 . . 269 LYS CB . 19884 1 1118 . 1 1 269 269 LYS N N 15 118.977 0.12 . 1 . 133 . . 269 LYS N . 19884 1 1119 . 1 1 270 270 LEU H H 1 8.703 0.013 . 1 . 949 . . 270 LEU H . 19884 1 1120 . 1 1 270 270 LEU C C 13 179.842 . . 1 . 1231 . . 270 LEU C . 19884 1 1121 . 1 1 270 270 LEU CB C 13 42.343 . . 1 . 1112 . . 270 LEU CB . 19884 1 1122 . 1 1 270 270 LEU N N 15 120.151 0.144 . 1 . 950 . . 270 LEU N . 19884 1 1123 . 1 1 271 271 LEU C C 13 178.182 . . 1 . 1228 . . 271 LEU C . 19884 1 1124 . 1 1 271 271 LEU CA C 13 56.258 . . 1 . 1229 . . 271 LEU CA . 19884 1 1125 . 1 1 271 271 LEU CB C 13 40.407 . . 1 . 1230 . . 271 LEU CB . 19884 1 1126 . 1 1 272 272 GLU H H 1 7.757 0.019 . 1 . 112 . . 272 GLU H . 19884 1 1127 . 1 1 272 272 GLU C C 13 176.213 0.016 . 1 . 786 . . 272 GLU C . 19884 1 1128 . 1 1 272 272 GLU CA C 13 55.197 0.038 . 1 . 426 . . 272 GLU CA . 19884 1 1129 . 1 1 272 272 GLU CB C 13 29.437 0.028 . 1 . 513 . . 272 GLU CB . 19884 1 1130 . 1 1 272 272 GLU N N 15 119.870 0.129 . 1 . 113 . . 272 GLU N . 19884 1 1131 . 1 1 273 273 ASN H H 1 7.280 0.014 . 1 . 103 . . 273 ASN H . 19884 1 1132 . 1 1 273 273 ASN C C 13 176.482 0.003 . 1 . 783 . . 273 ASN C . 19884 1 1133 . 1 1 273 273 ASN CA C 13 53.045 0.011 . 1 . 453 . . 273 ASN CA . 19884 1 1134 . 1 1 273 273 ASN CB C 13 36.867 0.025 . 1 . 536 . . 273 ASN CB . 19884 1 1135 . 1 1 273 273 ASN N N 15 123.292 0.113 . 1 . 104 . . 273 ASN N . 19884 1 1136 . 1 1 274 274 GLY H H 1 8.365 0.014 . 1 . 128 . . 274 GLY H . 19884 1 1137 . 1 1 274 274 GLY C C 13 174.591 0.008 . 1 . 789 . . 274 GLY C . 19884 1 1138 . 1 1 274 274 GLY CA C 13 45.327 0.021 . 1 . 567 . . 274 GLY CA . 19884 1 1139 . 1 1 274 274 GLY N N 15 109.970 0.125 . 1 . 129 . . 274 GLY N . 19884 1 1140 . 1 1 275 275 ILE H H 1 7.614 0.012 . 1 . 168 . . 275 ILE H . 19884 1 1141 . 1 1 275 275 ILE C C 13 175.229 0.017 . 1 . 847 . . 275 ILE C . 19884 1 1142 . 1 1 275 275 ILE CA C 13 60.960 0.053 . 1 . 1070 . . 275 ILE CA . 19884 1 1143 . 1 1 275 275 ILE CB C 13 37.642 0.022 . 1 . 665 . . 275 ILE CB . 19884 1 1144 . 1 1 275 275 ILE N N 15 121.810 0.088 . 1 . 169 . . 275 ILE N . 19884 1 1145 . 1 1 276 276 THR H H 1 8.750 0.015 . 1 . 248 . . 276 THR H . 19884 1 1146 . 1 1 276 276 THR C C 13 172.626 0.005 . 1 . 839 . . 276 THR C . 19884 1 1147 . 1 1 276 276 THR CA C 13 61.466 0.039 . 1 . 571 . . 276 THR CA . 19884 1 1148 . 1 1 276 276 THR CB C 13 69.299 0.025 . 1 . 650 . . 276 THR CB . 19884 1 1149 . 1 1 276 276 THR N N 15 124.956 0.113 . 1 . 249 . . 276 THR N . 19884 1 1150 . 1 1 277 277 PHE H H 1 9.136 0.012 . 1 . 182 . . 277 PHE H . 19884 1 1151 . 1 1 277 277 PHE C C 13 173.731 . . 1 . 829 . . 277 PHE C . 19884 1 1152 . 1 1 277 277 PHE CA C 13 55.495 . . 1 . 424 . . 277 PHE CA . 19884 1 1153 . 1 1 277 277 PHE CB C 13 38.082 . . 1 . 512 . . 277 PHE CB . 19884 1 1154 . 1 1 277 277 PHE N N 15 129.216 0.117 . 1 . 183 . . 277 PHE N . 19884 1 1155 . 1 1 278 278 PRO C C 13 177.144 0.005 . 1 . 721 . . 278 PRO C . 19884 1 1156 . 1 1 278 278 PRO CA C 13 61.921 0.006 . 1 . 573 . . 278 PRO CA . 19884 1 1157 . 1 1 278 278 PRO CB C 13 32.191 0.006 . 1 . 653 . . 278 PRO CB . 19884 1 1158 . 1 1 279 279 LYS H H 1 8.802 0.013 . 1 . 192 . . 279 LYS H . 19884 1 1159 . 1 1 279 279 LYS C C 13 176.810 0.004 . 1 . 831 . . 279 LYS C . 19884 1 1160 . 1 1 279 279 LYS CA C 13 58.441 0.006 . 1 . 443 . . 279 LYS CA . 19884 1 1161 . 1 1 279 279 LYS CB C 13 31.168 0.024 . 1 . 527 . . 279 LYS CB . 19884 1 1162 . 1 1 279 279 LYS N N 15 121.813 0.12 . 1 . 193 . . 279 LYS N . 19884 1 1163 . 1 1 280 280 ASP H H 1 8.178 0.014 . 1 . 79 . . 280 ASP H . 19884 1 1164 . 1 1 280 280 ASP C C 13 175.820 0.009 . 1 . 737 . . 280 ASP C . 19884 1 1165 . 1 1 280 280 ASP CA C 13 52.544 0.017 . 1 . 587 . . 280 ASP CA . 19884 1 1166 . 1 1 280 280 ASP CB C 13 38.937 0.03 . 1 . 668 . . 280 ASP CB . 19884 1 1167 . 1 1 280 280 ASP N N 15 115.041 0.112 . 1 . 80 . . 280 ASP N . 19884 1 1168 . 1 1 281 281 ALA H H 1 7.518 0.014 . 1 . 266 . . 281 ALA H . 19884 1 1169 . 1 1 281 281 ALA C C 13 175.356 . . 1 . 793 . . 281 ALA C . 19884 1 1170 . 1 1 281 281 ALA CA C 13 50.503 . . 1 . 444 . . 281 ALA CA . 19884 1 1171 . 1 1 281 281 ALA CB C 13 16.996 . . 1 . 528 . . 281 ALA CB . 19884 1 1172 . 1 1 281 281 ALA N N 15 124.144 0.113 . 1 . 267 . . 281 ALA N . 19884 1 1173 . 1 1 282 282 PRO C C 13 176.880 0.002 . 1 . 719 . . 282 PRO C . 19884 1 1174 . 1 1 282 282 PRO CA C 13 62.125 0.013 . 1 . 574 . . 282 PRO CA . 19884 1 1175 . 1 1 282 282 PRO CB C 13 31.008 0.019 . 1 . 654 . . 282 PRO CB . 19884 1 1176 . 1 1 283 283 SER H H 1 8.343 0.012 . 1 . 196 . . 283 SER H . 19884 1 1177 . 1 1 283 283 SER C C 13 171.205 . . 1 . 837 . . 283 SER C . 19884 1 1178 . 1 1 283 283 SER CA C 13 57.865 . . 1 . 407 . . 283 SER CA . 19884 1 1179 . 1 1 283 283 SER CB C 13 60.929 . . 1 . 875 . . 283 SER CB . 19884 1 1180 . 1 1 283 283 SER N N 15 119.147 0.121 . 1 . 197 . . 283 SER N . 19884 1 1181 . 1 1 284 284 PRO C C 13 175.702 0.004 . 1 . 686 . . 284 PRO C . 19884 1 1182 . 1 1 284 284 PRO CA C 13 62.976 0.01 . 1 . 550 . . 284 PRO CA . 19884 1 1183 . 1 1 284 284 PRO CB C 13 31.533 0.016 . 1 . 621 . . 284 PRO CB . 19884 1 1184 . 1 1 285 285 PHE H H 1 9.055 0.014 . 1 . 19 . . 285 PHE H . 19884 1 1185 . 1 1 285 285 PHE C C 13 174.919 0.004 . 1 . 758 . . 285 PHE C . 19884 1 1186 . 1 1 285 285 PHE CA C 13 54.245 0.032 . 1 . 1071 . . 285 PHE CA . 19884 1 1187 . 1 1 285 285 PHE CB C 13 39.561 0.028 . 1 . 482 . . 285 PHE CB . 19884 1 1188 . 1 1 285 285 PHE N N 15 124.455 0.119 . 1 . 20 . . 285 PHE N . 19884 1 1189 . 1 1 286 286 ILE H H 1 7.913 0.012 . 1 . 256 . . 286 ILE H . 19884 1 1190 . 1 1 286 286 ILE C C 13 176.811 0.046 . 1 . 842 . . 286 ILE C . 19884 1 1191 . 1 1 286 286 ILE CA C 13 58.908 0.063 . 1 . 462 . . 286 ILE CA . 19884 1 1192 . 1 1 286 286 ILE CB C 13 36.928 . . 1 . 543 . . 286 ILE CB . 19884 1 1193 . 1 1 286 286 ILE N N 15 120.307 0.112 . 1 . 257 . . 286 ILE N . 19884 1 1194 . 1 1 287 287 PHE H H 1 10.001 0.014 . 1 . 962 . . 287 PHE H . 19884 1 1195 . 1 1 287 287 PHE C C 13 177.228 0.002 . 1 . 964 . . 287 PHE C . 19884 1 1196 . 1 1 287 287 PHE CA C 13 58.935 0.025 . 1 . 1124 . . 287 PHE CA . 19884 1 1197 . 1 1 287 287 PHE CB C 13 38.986 0.037 . 1 . 1017 . . 287 PHE CB . 19884 1 1198 . 1 1 287 287 PHE N N 15 130.181 0.11 . 1 . 963 . . 287 PHE N . 19884 1 1199 . 1 1 288 288 LYS H H 1 8.782 0.015 . 1 . 290 . . 288 LYS H . 19884 1 1200 . 1 1 288 288 LYS C C 13 176.622 0.039 . 1 . 801 . . 288 LYS C . 19884 1 1201 . 1 1 288 288 LYS CA C 13 54.827 0.018 . 1 . 607 . . 288 LYS CA . 19884 1 1202 . 1 1 288 288 LYS CB C 13 33.493 0.064 . 1 . 548 . . 288 LYS CB . 19884 1 1203 . 1 1 288 288 LYS N N 15 123.827 0.117 . 1 . 291 . . 288 LYS N . 19884 1 1204 . 1 1 289 289 THR H H 1 8.615 0.021 . 1 . 920 . . 289 THR H . 19884 1 1205 . 1 1 289 289 THR C C 13 179.242 0.031 . 1 . 999 . . 289 THR C . 19884 1 1206 . 1 1 289 289 THR CA C 13 59.812 0.048 . 1 . 440 . . 289 THR CA . 19884 1 1207 . 1 1 289 289 THR CB C 13 70.422 0.035 . 1 . 863 . . 289 THR CB . 19884 1 1208 . 1 1 289 289 THR N N 15 109.584 0.126 . 1 . 921 . . 289 THR N . 19884 1 1209 . 1 1 290 290 LEU H H 1 9.606 0.016 . 1 . 116 . . 290 LEU H . 19884 1 1210 . 1 1 290 290 LEU C C 13 180.551 0.006 . 1 . 743 . . 290 LEU C . 19884 1 1211 . 1 1 290 290 LEU CA C 13 59.115 . . 1 . 1072 . . 290 LEU CA . 19884 1 1212 . 1 1 290 290 LEU CB C 13 39.008 0.035 . 1 . 673 . . 290 LEU CB . 19884 1 1213 . 1 1 290 290 LEU N N 15 122.591 0.115 . 1 . 117 . . 290 LEU N . 19884 1 1214 . 1 1 291 291 GLU H H 1 8.927 0.017 . 1 . 310 . . 291 GLU H . 19884 1 1215 . 1 1 291 291 GLU C C 13 180.957 0.008 . 1 . 731 . . 291 GLU C . 19884 1 1216 . 1 1 291 291 GLU CA C 13 59.001 . . 1 . 871 . . 291 GLU CA . 19884 1 1217 . 1 1 291 291 GLU CB C 13 28.603 0.023 . 1 . 667 . . 291 GLU CB . 19884 1 1218 . 1 1 291 291 GLU N N 15 120.222 0.117 . 1 . 311 . . 291 GLU N . 19884 1 1219 . 1 1 292 292 GLU H H 1 8.057 0.014 . 1 . 264 . . 292 GLU H . 19884 1 1220 . 1 1 292 292 GLU C C 13 178.655 0.004 . 1 . 792 . . 292 GLU C . 19884 1 1221 . 1 1 292 292 GLU CA C 13 58.384 0.024 . 1 . 866 . . 292 GLU CA . 19884 1 1222 . 1 1 292 292 GLU CB C 13 29.642 0.023 . 1 . 1012 . . 292 GLU CB . 19884 1 1223 . 1 1 292 292 GLU N N 15 120.428 0.121 . 1 . 265 . . 292 GLU N . 19884 1 1224 . 1 1 293 293 GLN H H 1 7.603 0.015 . 1 . 362 . . 293 GLN H . 19884 1 1225 . 1 1 293 293 GLN C C 13 175.808 0.001 . 1 . 817 . . 293 GLN C . 19884 1 1226 . 1 1 293 293 GLN CA C 13 55.721 0.007 . 1 . 948 . . 293 GLN CA . 19884 1 1227 . 1 1 293 293 GLN CB C 13 32.790 0.044 . 1 . 520 . . 293 GLN CB . 19884 1 1228 . 1 1 293 293 GLN N N 15 116.385 0.098 . 1 . 363 . . 293 GLN N . 19884 1 1229 . 1 1 294 294 GLY H H 1 7.978 0.015 . 1 . 89 . . 294 GLY H . 19884 1 1230 . 1 1 294 294 GLY C C 13 174.129 0.008 . 1 . 736 . . 294 GLY C . 19884 1 1231 . 1 1 294 294 GLY CA C 13 45.831 0.015 . 1 . 586 . . 294 GLY CA . 19884 1 1232 . 1 1 294 294 GLY N N 15 110.269 0.118 . 1 . 90 . . 294 GLY N . 19884 1 1233 . 1 1 295 295 LEU H H 1 7.734 0.011 . 1 . 262 . . 295 LEU H . 19884 1 1234 . 1 1 295 295 LEU C C 13 182.344 . . 1 . 834 . . 295 LEU C . 19884 1 1235 . 1 1 295 295 LEU CA C 13 54.851 . . 1 . 396 . . 295 LEU CA . 19884 1 1236 . 1 1 295 295 LEU CB C 13 44.267 . . 1 . 493 . . 295 LEU CB . 19884 1 1237 . 1 1 295 295 LEU N N 15 126.104 0.088 . 1 . 263 . . 295 LEU N . 19884 1 stop_ save_