################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52664 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'TOPBP1 linker67' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_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' . . . 52664 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 $software_1 . . 52664 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 3 3 SER H H 1 8.534839583 0.02037097979 . . . . . . . 1057 SER H . 52664 1 2 . 1 . 1 3 3 SER C C 13 177.6605492 . . . . . . . . 1057 SER C . 52664 1 3 . 1 . 1 3 3 SER CA C 13 58.66021776 0.0003620057763 . . . . . . . 1057 SER CA . 52664 1 4 . 1 . 1 3 3 SER CB C 13 63.32583704 . . . . . . . . 1057 SER CB . 52664 1 5 . 1 . 1 3 3 SER N N 15 116.9506927 0.05256911505 . . . . . . . 1057 SER N . 52664 1 6 . 1 . 1 4 4 LYS H H 1 8.492994096 0.02138470504 . . . . . . . 1058 LYS H . 52664 1 7 . 1 . 1 4 4 LYS C C 13 175.370578 . . . . . . . . 1058 LYS C . 52664 1 8 . 1 . 1 4 4 LYS CA C 13 56.41354711 . . . . . . . . 1058 LYS CA . 52664 1 9 . 1 . 1 4 4 LYS CB C 13 32.37840807 . . . . . . . . 1058 LYS CB . 52664 1 10 . 1 . 1 4 4 LYS N N 15 122.9591975 0.05520558576 . . . . . . . 1058 LYS N . 52664 1 11 . 1 . 1 5 5 GLY H H 1 8.430097849 0.02071336208 . . . . . . . 1059 GLY H . 52664 1 12 . 1 . 1 5 5 GLY C C 13 178.5412346 . . . . . . . . 1059 GLY C . 52664 1 13 . 1 . 1 5 5 GLY CA C 13 45.07092712 . . . . . . . . 1059 GLY CA . 52664 1 14 . 1 . 1 5 5 GLY N N 15 109.7141537 0.04189005369 . . . . . . . 1059 GLY N . 52664 1 15 . 1 . 1 6 6 VAL H H 1 8.11242444 0.02097682906 . . . . . . . 1060 VAL H . 52664 1 16 . 1 . 1 6 6 VAL C C 13 176.0549456 . . . . . . . . 1060 VAL C . 52664 1 17 . 1 . 1 6 6 VAL CA C 13 62.33137707 0.006257537788 . . . . . . . 1060 VAL CA . 52664 1 18 . 1 . 1 6 6 VAL CB C 13 32.41378607 . . . . . . . . 1060 VAL CB . 52664 1 19 . 1 . 1 6 6 VAL N N 15 119.832108 0.04121560508 . . . . . . . 1060 VAL N . 52664 1 20 . 1 . 1 7 7 LEU H H 1 8.523088423 0.01879922725 . . . . . . . 1061 LEU H . 52664 1 21 . 1 . 1 7 7 LEU C C 13 174.9644849 . . . . . . . . 1061 LEU C . 52664 1 22 . 1 . 1 7 7 LEU CA C 13 55.09881635 0.007039789289 . . . . . . . 1061 LEU CA . 52664 1 23 . 1 . 1 7 7 LEU CB C 13 41.9144137 . . . . . . . . 1061 LEU CB . 52664 1 24 . 1 . 1 7 7 LEU N N 15 126.0236623 0.03478972326 . . . . . . . 1061 LEU N . 52664 1 25 . 1 . 1 8 8 THR H H 1 8.224386167 0.01879481591 . . . . . . . 1062 THR H . 52664 1 26 . 1 . 1 8 8 THR C C 13 178.0764913 . . . . . . . . 1062 THR C . 52664 1 27 . 1 . 1 8 8 THR CA C 13 62.13647136 0.005762578576 . . . . . . . 1062 THR CA . 52664 1 28 . 1 . 1 8 8 THR CB C 13 69.42929509 . . . . . . . . 1062 THR CB . 52664 1 29 . 1 . 1 8 8 THR N N 15 116.0363427 0.06002355179 . . . . . . . 1062 THR N . 52664 1 30 . 1 . 1 9 9 GLN H H 1 8.513203285 0.02099647352 . . . . . . . 1063 GLN H . 52664 1 31 . 1 . 1 9 9 GLN C C 13 176.3180836 . . . . . . . . 1063 GLN C . 52664 1 32 . 1 . 1 9 9 GLN CA C 13 55.8637113 . . . . . . . . 1063 GLN CA . 52664 1 33 . 1 . 1 9 9 GLN CB C 13 29.4532004 . . . . . . . . 1063 GLN CB . 52664 1 34 . 1 . 1 9 9 GLN N N 15 123.1134107 0.04118365246 . . . . . . . 1063 GLN N . 52664 1 35 . 1 . 1 10 10 THR H H 1 8.243768616 0.022514479 . . . . . . . 1064 THR H . 52664 1 36 . 1 . 1 10 10 THR C C 13 177.7152939 . . . . . . . . 1064 THR C . 52664 1 37 . 1 . 1 10 10 THR CA C 13 61.91720943 . . . . . . . . 1064 THR CA . 52664 1 38 . 1 . 1 10 10 THR CB C 13 69.74046304 . . . . . . . . 1064 THR CB . 52664 1 39 . 1 . 1 10 10 THR N N 15 116.2939644 0.07534517656 . . . . . . . 1064 THR N . 52664 1 40 . 1 . 1 11 11 LEU H H 1 8.529099955 0.01862493286 . . . . . . . 1065 LEU H . 52664 1 41 . 1 . 1 11 11 LEU C C 13 174.6460709 . . . . . . . . 1065 LEU C . 52664 1 42 . 1 . 1 11 11 LEU CA C 13 56.39890991 0.00273518125 . . . . . . . 1065 LEU CA . 52664 1 43 . 1 . 1 11 11 LEU CB C 13 41.71518994 . . . . . . . . 1065 LEU CB . 52664 1 44 . 1 . 1 11 11 LEU N N 15 124.1556781 0.04603795479 . . . . . . . 1065 LEU N . 52664 1 45 . 1 . 1 12 12 GLU H H 1 8.553138861 0.01928494205 . . . . . . . 1066 GLU H . 52664 1 46 . 1 . 1 12 12 GLU C C 13 175.2225667 . . . . . . . . 1066 GLU C . 52664 1 47 . 1 . 1 12 12 GLU CA C 13 57.60777638 0.006774711546 . . . . . . . 1066 GLU CA . 52664 1 48 . 1 . 1 12 12 GLU CB C 13 29.54523205 . . . . . . . . 1066 GLU CB . 52664 1 49 . 1 . 1 12 12 GLU N N 15 120.6134292 0.05156449663 . . . . . . . 1066 GLU N . 52664 1 50 . 1 . 1 13 13 MET H H 1 8.212767695 0.02483712609 . . . . . . . 1067 MET H . 52664 1 51 . 1 . 1 13 13 MET C C 13 175.2330747 . . . . . . . . 1067 MET C . 52664 1 52 . 1 . 1 13 13 MET CA C 13 56.38660347 0.0000006743 . . . . . . . 1067 MET CA . 52664 1 53 . 1 . 1 13 13 MET CB C 13 32.47330191 . . . . . . . . 1067 MET CB . 52664 1 54 . 1 . 1 13 13 MET N N 15 120.7757142 0.05565477966 . . . . . . . 1067 MET N . 52664 1 55 . 1 . 1 14 14 ARG H H 1 8.353679135 0.02051033464 . . . . . . . 1068 ARG H . 52664 1 56 . 1 . 1 14 14 ARG C C 13 175.1265816 . . . . . . . . 1068 ARG C . 52664 1 57 . 1 . 1 14 14 ARG CA C 13 57.38733531 0.0001508419163 . . . . . . . 1068 ARG CA . 52664 1 58 . 1 . 1 14 14 ARG CB C 13 30.32943791 . . . . . . . . 1068 ARG CB . 52664 1 59 . 1 . 1 14 14 ARG N N 15 121.7799234 0.05259810176 . . . . . . . 1068 ARG N . 52664 1 60 . 1 . 1 15 15 GLU H H 1 8.607567565 0.02061281452 . . . . . . . 1069 GLU H . 52664 1 61 . 1 . 1 15 15 GLU C C 13 175.2079442 . . . . . . . . 1069 GLU C . 52664 1 62 . 1 . 1 15 15 GLU CA C 13 57.51946085 0.002401176659 . . . . . . . 1069 GLU CA . 52664 1 63 . 1 . 1 15 15 GLU CB C 13 29.71363873 . . . . . . . . 1069 GLU CB . 52664 1 64 . 1 . 1 15 15 GLU N N 15 121.192483 0.03493940001 . . . . . . . 1069 GLU N . 52664 1 65 . 1 . 1 16 16 ASN H H 1 8.456653839 0.02096157043 . . . . . . . 1070 ASN H . 52664 1 66 . 1 . 1 16 16 ASN C C 13 176.5354082 . . . . . . . . 1070 ASN C . 52664 1 67 . 1 . 1 16 16 ASN CA C 13 54.05459652 0.01022407826 . . . . . . . 1070 ASN CA . 52664 1 68 . 1 . 1 16 16 ASN CB C 13 38.19612699 . . . . . . . . 1070 ASN CB . 52664 1 69 . 1 . 1 16 16 ASN N N 15 119.1206585 0.03331960986 . . . . . . . 1070 ASN N . 52664 1 70 . 1 . 1 17 17 PHE H H 1 8.25893585 0.01896272841 . . . . . . . 1071 PHE H . 52664 1 71 . 1 . 1 17 17 PHE C C 13 175.9966342 0 . . . . . . . 1071 PHE C . 52664 1 72 . 1 . 1 17 17 PHE CA C 13 59.10854629 0.02840568354 . . . . . . . 1071 PHE CA . 52664 1 73 . 1 . 1 17 17 PHE CB C 13 38.71169533 . . . . . . . . 1071 PHE CB . 52664 1 74 . 1 . 1 17 17 PHE N N 15 121.170202 0.0366364507 . . . . . . . 1071 PHE N . 52664 1 75 . 1 . 1 18 18 GLN H H 1 8.281309611 0.02343986021 . . . . . . . 1072 GLN H . 52664 1 76 . 1 . 1 18 18 GLN C C 13 175.6264071 . . . . . . . . 1072 GLN C . 52664 1 77 . 1 . 1 18 18 GLN CA C 13 56.83118918 0.003988310117 . . . . . . . 1072 GLN CA . 52664 1 78 . 1 . 1 18 18 GLN CB C 13 28.56204143 . . . . . . . . 1072 GLN CB . 52664 1 79 . 1 . 1 18 18 GLN N N 15 120.3211587 0.0572591644 . . . . . . . 1072 GLN N . 52664 1 80 . 1 . 1 19 19 LYS H H 1 8.210567478 0.01980362902 . . . . . . . 1073 LYS H . 52664 1 81 . 1 . 1 19 19 LYS C C 13 175.027534 . . . . . . . . 1073 LYS C . 52664 1 82 . 1 . 1 19 19 LYS CA C 13 57.67636713 0.02678121757 . . . . . . . 1073 LYS CA . 52664 1 83 . 1 . 1 19 19 LYS CB C 13 28.88663944 . . . . . . . . 1073 LYS CB . 52664 1 84 . 1 . 1 19 19 LYS N N 15 121.591939 0.06501909413 . . . . . . . 1073 LYS N . 52664 1 85 . 1 . 1 20 20 GLN H H 1 8.273298814 0.02753972691 . . . . . . . 1074 GLN H . 52664 1 86 . 1 . 1 20 20 GLN N N 15 120.4176077 0.02998162963 . . . . . . . 1074 GLN N . 52664 1 87 . 1 . 1 21 21 LEU H H 1 8.205440225 0.0214512947 . . . . . . . 1075 LEU H . 52664 1 88 . 1 . 1 21 21 LEU C C 13 174.5058547 . . . . . . . . 1075 LEU C . 52664 1 89 . 1 . 1 21 21 LEU CA C 13 56.08921975 0.04889141896 . . . . . . . 1075 LEU CA . 52664 1 90 . 1 . 1 21 21 LEU CB C 13 41.72141999 . . . . . . . . 1075 LEU CB . 52664 1 91 . 1 . 1 21 21 LEU N N 15 122.2690498 0.06610964483 . . . . . . . 1075 LEU N . 52664 1 92 . 1 . 1 22 22 GLN H H 1 8.251171288 0.0204982119 . . . . . . . 1076 GLN H . 52664 1 93 . 1 . 1 22 22 GLN C C 13 175.7527074 . . . . . . . . 1076 GLN C . 52664 1 94 . 1 . 1 22 22 GLN CA C 13 56.57316604 0.006105159598 . . . . . . . 1076 GLN CA . 52664 1 95 . 1 . 1 22 22 GLN CB C 13 28.77232646 . . . . . . . . 1076 GLN CB . 52664 1 96 . 1 . 1 22 22 GLN N N 15 119.830159 0.04115203507 . . . . . . . 1076 GLN N . 52664 1 97 . 1 . 1 23 23 GLU H H 1 8.295713179 0.021633118 . . . . . . . 1077 GLU H . 52664 1 98 . 1 . 1 23 23 GLU C C 13 175.1442501 . . . . . . . . 1077 GLU C . 52664 1 99 . 1 . 1 23 23 GLU CA C 13 57.23714761 0.05182682636 . . . . . . . 1077 GLU CA . 52664 1 100 . 1 . 1 23 23 GLU CB C 13 29.71242257 . . . . . . . . 1077 GLU CB . 52664 1 101 . 1 . 1 23 23 GLU N N 15 121.7061372 0.03602107181 . . . . . . . 1077 GLU N . 52664 1 102 . 1 . 1 24 24 ILE H H 1 8.19537387 0.01938995559 . . . . . . . 1078 ILE H . 52664 1 103 . 1 . 1 24 24 ILE C C 13 175.2500188 . . . . . . . . 1078 ILE C . 52664 1 104 . 1 . 1 24 24 ILE CA C 13 62.04590488 0.01871878147 . . . . . . . 1078 ILE CA . 52664 1 105 . 1 . 1 24 24 ILE CB C 13 38.2221744 . . . . . . . . 1078 ILE CB . 52664 1 106 . 1 . 1 24 24 ILE N N 15 121.8404284 0.0553751016 . . . . . . . 1078 ILE N . 52664 1 107 . 1 . 1 25 25 MET H H 1 8.46704673 0.01971936047 . . . . . . . 1079 MET H . 52664 1 108 . 1 . 1 25 25 MET C C 13 175.7354817 . . . . . . . . 1079 MET C . 52664 1 109 . 1 . 1 25 25 MET CA C 13 55.8712489 . . . . . . . . 1079 MET CA . 52664 1 110 . 1 . 1 25 25 MET CB C 13 32.29380257 . . . . . . . . 1079 MET CB . 52664 1 111 . 1 . 1 25 25 MET N N 15 123.2072724 0.0509222729 . . . . . . . 1079 MET N . 52664 1 112 . 1 . 1 26 26 SER H H 1 8.345647973 0.02311388062 . . . . . . . 1080 SER H . 52664 1 113 . 1 . 1 26 26 SER N N 15 116.5519135 0.03965266698 . . . . . . . 1080 SER N . 52664 1 114 . 1 . 1 27 27 ALA H H 1 8.352697211 0.02001234386 . . . . . . . 1081 ALA H . 52664 1 115 . 1 . 1 27 27 ALA C C 13 174.330187 . . . . . . . . 1081 ALA C . 52664 1 116 . 1 . 1 27 27 ALA CA C 13 52.92369541 0.03246633213 . . . . . . . 1081 ALA CA . 52664 1 117 . 1 . 1 27 27 ALA CB C 13 18.85407989 . . . . . . . . 1081 ALA CB . 52664 1 118 . 1 . 1 27 27 ALA N N 15 125.6989215 0.06789047359 . . . . . . . 1081 ALA N . 52664 1 119 . 1 . 1 28 28 THR H H 1 8.136113931 0.01922691151 . . . . . . . 1082 THR H . 52664 1 120 . 1 . 1 28 28 THR C C 13 177.9132925 . . . . . . . . 1082 THR C . 52664 1 121 . 1 . 1 28 28 THR CA C 13 61.80899882 . . . . . . . . 1082 THR CA . 52664 1 122 . 1 . 1 28 28 THR CB C 13 69.47576916 . . . . . . . . 1082 THR CB . 52664 1 123 . 1 . 1 28 28 THR N N 15 112.0435264 0.04975519641 . . . . . . . 1082 THR N . 52664 1 124 . 1 . 1 29 29 SER H H 1 8.22197209 0.01942209953 . . . . . . . 1083 SER H . 52664 1 125 . 1 . 1 29 29 SER C C 13 178.3659307 . . . . . . . . 1083 SER C . 52664 1 126 . 1 . 1 29 29 SER CA C 13 58.08031975 . . . . . . . . 1083 SER CA . 52664 1 127 . 1 . 1 29 29 SER CB C 13 63.58537995 . . . . . . . . 1083 SER CB . 52664 1 128 . 1 . 1 29 29 SER N N 15 118.291473 0.03978506269 . . . . . . . 1083 SER N . 52664 1 129 . 1 . 1 30 30 ILE H H 1 8.220615667 0.02167709974 . . . . . . . 1084 ILE H . 52664 1 130 . 1 . 1 30 30 ILE N N 15 122.9425593 0.08431595168 . . . . . . . 1084 ILE N . 52664 1 131 . 1 . 1 31 31 VAL H H 1 8.323102881 0.01726732998 . . . . . . . 1085 VAL H . 52664 1 132 . 1 . 1 31 31 VAL C C 13 176.7556385 . . . . . . . . 1085 VAL C . 52664 1 133 . 1 . 1 31 31 VAL CA C 13 62.02086297 0.001373044959 . . . . . . . 1085 VAL CA . 52664 1 134 . 1 . 1 31 31 VAL CB C 13 32.32533194 . . . . . . . . 1085 VAL CB . 52664 1 135 . 1 . 1 31 31 VAL N N 15 125.5693468 0.07220332527 . . . . . . . 1085 VAL N . 52664 1 136 . 1 . 1 32 32 LYS H H 1 8.57753705 0.017732521 . . . . . . . 1086 LYS H . 52664 1 137 . 1 . 1 32 32 LYS C C 13 178.3302966 . . . . . . . . 1086 LYS C . 52664 1 138 . 1 . 1 32 32 LYS CA C 13 53.88764308 0.004763966624 . . . . . . . 1086 LYS CA . 52664 1 139 . 1 . 1 32 32 LYS CB C 13 32.18537028 . . . . . . . . 1086 LYS CB . 52664 1 140 . 1 . 1 32 32 LYS N N 15 127.7619815 0.05141966924 . . . . . . . 1086 LYS N . 52664 1 141 . 1 . 1 34 34 GLN H H 1 8.709842506 0.01878074477 . . . . . . . 1088 GLN H . 52664 1 142 . 1 . 1 34 34 GLN C C 13 175.8313205 . . . . . . . . 1088 GLN C . 52664 1 143 . 1 . 1 34 34 GLN CA C 13 55.82161391 0.00321815607 . . . . . . . 1088 GLN CA . 52664 1 144 . 1 . 1 34 34 GLN CB C 13 29.39307069 . . . . . . . . 1088 GLN CB . 52664 1 145 . 1 . 1 34 34 GLN N N 15 121.2671648 0.03341307968 . . . . . . . 1088 GLN N . 52664 1 146 . 1 . 1 35 35 GLY H H 1 8.590761292 0.02011435895 . . . . . . . 1089 GLY H . 52664 1 147 . 1 . 1 35 35 GLY C C 13 178.6177064 . . . . . . . . 1089 GLY C . 52664 1 148 . 1 . 1 35 35 GLY CA C 13 45.00006792 . . . . . . . . 1089 GLY CA . 52664 1 149 . 1 . 1 35 35 GLY N N 15 110.2080286 0.04306675294 . . . . . . . 1089 GLY N . 52664 1 150 . 1 . 1 36 36 GLN H H 1 8.40946952 0.01964823307 . . . . . . . 1090 GLN H . 52664 1 151 . 1 . 1 36 36 GLN C C 13 176.4596584 . . . . . . . . 1090 GLN C . 52664 1 152 . 1 . 1 36 36 GLN CA C 13 55.55922822 0.01972750125 . . . . . . . 1090 GLN CA . 52664 1 153 . 1 . 1 36 36 GLN CB C 13 29.36360041 . . . . . . . . 1090 GLN CB . 52664 1 154 . 1 . 1 36 36 GLN N N 15 120.0665386 0.03063483801 . . . . . . . 1090 GLN N . 52664 1 155 . 1 . 1 37 37 ARG H H 1 8.614131402 0.02048162377 . . . . . . . 1091 ARG H . 52664 1 156 . 1 . 1 37 37 ARG C C 13 175.9885216 . . . . . . . . 1091 ARG C . 52664 1 157 . 1 . 1 37 37 ARG CA C 13 56.10156596 . . . . . . . . 1091 ARG CA . 52664 1 158 . 1 . 1 37 37 ARG CB C 13 30.46208067 . . . . . . . . 1091 ARG CB . 52664 1 159 . 1 . 1 37 37 ARG N N 15 122.9978759 0.03399681488 . . . . . . . 1091 ARG N . 52664 1 160 . 1 . 1 38 38 THR H H 1 8.36578216 0.01886596847 . . . . . . . 1092 THR H . 52664 1 161 . 1 . 1 38 38 THR C C 13 178.0373358 . . . . . . . . 1092 THR C . 52664 1 162 . 1 . 1 38 38 THR CA C 13 61.61472869 0.02637940459 . . . . . . . 1092 THR CA . 52664 1 163 . 1 . 1 38 38 THR CB C 13 69.6780494 . . . . . . . . 1092 THR CB . 52664 1 164 . 1 . 1 38 38 THR N N 15 115.7572201 0.04307791936 . . . . . . . 1092 THR N . 52664 1 165 . 1 . 1 39 39 SER H H 1 8.516361937 0.01933035523 . . . . . . . 1093 SER H . 52664 1 166 . 1 . 1 39 39 SER C C 13 178.0093758 . . . . . . . . 1093 SER C . 52664 1 167 . 1 . 1 39 39 SER CA C 13 58.14624343 0.01230054803 . . . . . . . 1093 SER CA . 52664 1 168 . 1 . 1 39 39 SER N N 15 118.3688598 0.03717177154 . . . . . . . 1093 SER N . 52664 1 169 . 1 . 1 40 40 LEU H H 1 8.447441763 0.01928049798 . . . . . . . 1094 LEU H . 52664 1 170 . 1 . 1 40 40 LEU C C 13 174.9559054 0.02568374536 . . . . . . . 1094 LEU C . 52664 1 171 . 1 . 1 40 40 LEU CA C 13 55.10618469 0.01046149752 . . . . . . . 1094 LEU CA . 52664 1 172 . 1 . 1 40 40 LEU CB C 13 42.02392481 . . . . . . . . 1094 LEU CB . 52664 1 173 . 1 . 1 40 40 LEU N N 15 124.3940473 0.03035727959 . . . . . . . 1094 LEU N . 52664 1 174 . 1 . 1 41 41 SER H H 1 8.379369373 0.02105536479 . . . . . . . 1095 SER H . 52664 1 175 . 1 . 1 41 41 SER C C 13 176.4216371 1.422511988 . . . . . . . 1095 SER C . 52664 1 176 . 1 . 1 41 41 SER CA C 13 58.33821427 0.02832977735 . . . . . . . 1095 SER CA . 52664 1 177 . 1 . 1 41 41 SER CB C 13 63.51757314 . . . . . . . . 1095 SER CB . 52664 1 178 . 1 . 1 41 41 SER N N 15 116.7233008 0.03240037333 . . . . . . . 1095 SER N . 52664 1 179 . 1 . 1 42 42 ARG H H 1 8.538653275 0.02074261847 . . . . . . . 1096 ARG H . 52664 1 180 . 1 . 1 42 42 ARG C C 13 176.1900567 . . . . . . . . 1096 ARG C . 52664 1 181 . 1 . 1 42 42 ARG CA C 13 55.84058213 0.09334203462 . . . . . . . 1096 ARG CA . 52664 1 182 . 1 . 1 42 42 ARG N N 15 123.4649532 0.04810777736 . . . . . . . 1096 ARG N . 52664 1 183 . 1 . 1 43 43 SER H H 1 8.428541676 0.02007339844 . . . . . . . 1097 SER H . 52664 1 184 . 1 . 1 43 43 SER C C 13 176.1062358 . . . . . . . . 1097 SER C . 52664 1 185 . 1 . 1 43 43 SER CA C 13 58.44941435 . . . . . . . . 1097 SER CA . 52664 1 186 . 1 . 1 43 43 SER CB C 13 63.55268878 . . . . . . . . 1097 SER CB . 52664 1 187 . 1 . 1 43 43 SER N N 15 116.8308459 0.03324943906 . . . . . . . 1097 SER N . 52664 1 188 . 1 . 1 44 44 GLY H H 1 8.497913188 0.01939412765 . . . . . . . 1098 GLY H . 52664 1 189 . 1 . 1 44 44 GLY C C 13 178.8405158 0.1531838884 . . . . . . . 1098 GLY C . 52664 1 190 . 1 . 1 44 44 GLY CA C 13 44.9981709 0.001421865242 . . . . . . . 1098 GLY CA . 52664 1 191 . 1 . 1 44 44 GLY N N 15 110.906338 0.03954601924 . . . . . . . 1098 GLY N . 52664 1 192 . 1 . 1 45 45 CYS H H 1 8.220265722 0.02080778982 . . . . . . . 1099 CYS H . 52664 1 193 . 1 . 1 45 45 CYS CA C 13 57.73538922 0.01493774432 . . . . . . . 1099 CYS CA . 52664 1 194 . 1 . 1 45 45 CYS CB C 13 39.42564563 . . . . . . . . 1099 CYS CB . 52664 1 195 . 1 . 1 45 45 CYS N N 15 120.3531798 0.03344655213 . . . . . . . 1099 CYS N . 52664 1 196 . 1 . 1 46 46 ASN H H 1 8.523166053 0.01963573165 . . . . . . . 1100 ASN H . 52664 1 197 . 1 . 1 46 46 ASN CA C 13 52.7036721 0.0188382227 . . . . . . . 1100 ASN CA . 52664 1 198 . 1 . 1 46 46 ASN CB C 13 38.81705416 . . . . . . . . 1100 ASN CB . 52664 1 199 . 1 . 1 46 46 ASN N N 15 121.3527684 0.0392836906 . . . . . . . 1100 ASN N . 52664 1 200 . 1 . 1 47 47 SER H H 1 8.384423522 0.01876825968 . . . . . . . 1101 SER H . 52664 1 201 . 1 . 1 47 47 SER C C 13 178.0612003 . . . . . . . . 1101 SER C . 52664 1 202 . 1 . 1 47 47 SER CA C 13 58.41458033 0.007734620726 . . . . . . . 1101 SER CA . 52664 1 203 . 1 . 1 47 47 SER CB C 13 63.50897899 . . . . . . . . 1101 SER CB . 52664 1 204 . 1 . 1 47 47 SER N N 15 117.1102904 0.03666106514 . . . . . . . 1101 SER N . 52664 1 205 . 1 . 1 48 48 ALA H H 1 8.46422162 0.01951044178 . . . . . . . 1102 ALA H . 52664 1 206 . 1 . 1 48 48 ALA C C 13 174.7361221 . . . . . . . . 1102 ALA C . 52664 1 207 . 1 . 1 48 48 ALA CA C 13 52.559088 0.001657900879 . . . . . . . 1102 ALA CA . 52664 1 208 . 1 . 1 48 48 ALA CB C 13 18.86168294 . . . . . . . . 1102 ALA CB . 52664 1 209 . 1 . 1 48 48 ALA N N 15 125.8625183 0.02951523303 . . . . . . . 1102 ALA N . 52664 1 210 . 1 . 1 49 49 SER H H 1 8.282949378 0.01924617858 . . . . . . . 1103 SER H . 52664 1 211 . 1 . 1 49 49 SER C C 13 178.0566197 . . . . . . . . 1103 SER C . 52664 1 212 . 1 . 1 49 49 SER CA C 13 58.07623059 0.02907118586 . . . . . . . 1103 SER CA . 52664 1 213 . 1 . 1 49 49 SER CB C 13 63.59380396 . . . . . . . . 1103 SER CB . 52664 1 214 . 1 . 1 49 49 SER N N 15 114.6976183 0.03488405902 . . . . . . . 1103 SER N . 52664 1 215 . 1 . 1 50 50 SER H H 1 8.383833776 0.02080569199 . . . . . . . 1104 SER H . 52664 1 216 . 1 . 1 50 50 SER CA C 13 58.11084554 . . . . . . . . 1104 SER CA . 52664 1 217 . 1 . 1 50 50 SER CB C 13 63.59137072 . . . . . . . . 1104 SER CB . 52664 1 218 . 1 . 1 50 50 SER N N 15 118.0153802 0.03914819504 . . . . . . . 1104 SER N . 52664 1 219 . 1 . 1 51 51 THR H H 1 8.335545533 0.0184128126 . . . . . . . 1105 THR H . 52664 1 220 . 1 . 1 51 51 THR C C 13 179.5639077 . . . . . . . . 1105 THR C . 52664 1 221 . 1 . 1 51 51 THR CA C 13 59.60919606 0.01281832803 . . . . . . . 1105 THR CA . 52664 1 222 . 1 . 1 51 51 THR CB C 13 69.43278863 . . . . . . . . 1105 THR CB . 52664 1 223 . 1 . 1 51 51 THR N N 15 118.1078257 0.03915873493 . . . . . . . 1105 THR N . 52664 1 224 . 1 . 1 53 53 ASP H H 1 8.573855242 0.01814263494 . . . . . . . 1107 ASP H . 52664 1 225 . 1 . 1 53 53 ASP C C 13 175.7441377 . . . . . . . . 1107 ASP C . 52664 1 226 . 1 . 1 53 53 ASP CA C 13 54.34639788 0.003316276385 . . . . . . . 1107 ASP CA . 52664 1 227 . 1 . 1 53 53 ASP CB C 13 40.85429311 . . . . . . . . 1107 ASP CB . 52664 1 228 . 1 . 1 53 53 ASP N N 15 120.6738139 0.02886528699 . . . . . . . 1107 ASP N . 52664 1 229 . 1 . 1 54 54 SER H H 1 8.540099543 0.01906727126 . . . . . . . 1108 SER H . 52664 1 230 . 1 . 1 54 54 SER C C 13 177.1195942 . . . . . . . . 1108 SER C . 52664 1 231 . 1 . 1 54 54 SER CA C 13 58.96720324 0.03410863949 . . . . . . . 1108 SER CA . 52664 1 232 . 1 . 1 54 54 SER CB C 13 63.28496518 . . . . . . . . 1108 SER CB . 52664 1 233 . 1 . 1 54 54 SER N N 15 117.6466018 0.04811039889 . . . . . . . 1108 SER N . 52664 1 234 . 1 . 1 55 55 THR H H 1 8.321127261 0.02078652785 . . . . . . . 1109 THR H . 52664 1 235 . 1 . 1 55 55 THR CA C 13 62.70088956 0.0183849083 . . . . . . . 1109 THR CA . 52664 1 236 . 1 . 1 55 55 THR CB C 13 69.29907957 . . . . . . . . 1109 THR CB . 52664 1 237 . 1 . 1 55 55 THR N N 15 115.7025009 0.04208712058 . . . . . . . 1109 THR N . 52664 1 238 . 1 . 1 56 56 ARG H H 1 8.207279893 0.02227072141 . . . . . . . 1110 ARG H . 52664 1 239 . 1 . 1 56 56 ARG N N 15 122.9606765 0.06602698646 . . . . . . . 1110 ARG N . 52664 1 240 . 1 . 1 57 57 SER H H 1 8.352465677 0.01938740042 . . . . . . . 1111 SER H . 52664 1 241 . 1 . 1 57 57 SER C C 13 177.8533776 . . . . . . . . 1111 SER C . 52664 1 242 . 1 . 1 57 57 SER CA C 13 58.54790007 0.008996513542 . . . . . . . 1111 SER CA . 52664 1 243 . 1 . 1 57 57 SER CB C 13 63.50387121 . . . . . . . . 1111 SER CB . 52664 1 244 . 1 . 1 57 57 SER N N 15 116.7144755 0.05662048873 . . . . . . . 1111 SER N . 52664 1 245 . 1 . 1 58 58 ALA H H 1 8.426558404 0.01929410962 . . . . . . . 1112 ALA H . 52664 1 246 . 1 . 1 58 58 ALA C C 13 174.3800826 . . . . . . . . 1112 ALA C . 52664 1 247 . 1 . 1 58 58 ALA CA C 13 52.78449294 0.007550005899 . . . . . . . 1112 ALA CA . 52664 1 248 . 1 . 1 58 58 ALA CB C 13 18.79207203 . . . . . . . . 1112 ALA CB . 52664 1 249 . 1 . 1 58 58 ALA N N 15 126.0958521 0.03320454773 . . . . . . . 1112 ALA N . 52664 1 250 . 1 . 1 59 59 ARG H H 1 8.365699228 0.01995572776 . . . . . . . 1113 ARG H . 52664 1 251 . 1 . 1 59 59 ARG C C 13 175.898944 0 . . . . . . . 1113 ARG C . 52664 1 252 . 1 . 1 59 59 ARG CA C 13 56.29005399 . . . . . . . . 1113 ARG CA . 52664 1 253 . 1 . 1 59 59 ARG CB C 13 30.37717143 . . . . . . . . 1113 ARG CB . 52664 1 254 . 1 . 1 59 59 ARG N N 15 119.7716371 0.04165952612 . . . . . . . 1113 ARG N . 52664 1 255 . 1 . 1 60 60 SER H H 1 8.365437583 0.02395173561 . . . . . . . 1114 SER H . 52664 1 256 . 1 . 1 60 60 SER C C 13 175.855122 . . . . . . . . 1114 SER C . 52664 1 257 . 1 . 1 60 60 SER N N 15 116.7263178 0.04443216536 . . . . . . . 1114 SER N . 52664 1 258 . 1 . 1 61 61 GLY H H 1 8.559101644 0.02251324417 . . . . . . . 1115 GLY H . 52664 1 259 . 1 . 1 61 61 GLY CA C 13 45.38738547 0.06179474065 . . . . . . . 1115 GLY CA . 52664 1 260 . 1 . 1 61 61 GLY N N 15 110.9199207 0.03345084046 . . . . . . . 1115 GLY N . 52664 1 261 . 1 . 1 62 62 ARG H H 1 8.291241623 0.02156042582 . . . . . . . 1116 ARG H . 52664 1 262 . 1 . 1 62 62 ARG C C 13 175.5002329 0.2391968749 . . . . . . . 1116 ARG C . 52664 1 263 . 1 . 1 62 62 ARG CA C 13 56.51999127 0.8635583952 . . . . . . . 1116 ARG CA . 52664 1 264 . 1 . 1 62 62 ARG CB C 13 30.41394565 . . . . . . . . 1116 ARG CB . 52664 1 265 . 1 . 1 62 62 ARG N N 15 120.7756809 0.2609558083 . . . . . . . 1116 ARG N . 52664 1 266 . 1 . 1 63 63 SER H H 1 8.465540898 0.01933897236 . . . . . . . 1117 SER H . 52664 1 267 . 1 . 1 63 63 SER C C 13 175.7643591 . . . . . . . . 1117 SER C . 52664 1 268 . 1 . 1 63 63 SER CA C 13 58.7561446 . . . . . . . . 1117 SER CA . 52664 1 269 . 1 . 1 63 63 SER CB C 13 63.39196784 0 . . . . . . . 1117 SER CB . 52664 1 270 . 1 . 1 63 63 SER N N 15 116.7077807 0.05364515951 . . . . . . . 1117 SER N . 52664 1 271 . 1 . 1 64 64 ARG H H 1 8.469084518 0.02034051686 . . . . . . . 1118 ARG H . 52664 1 272 . 1 . 1 64 64 ARG C C 13 175.2672664 0 . . . . . . . 1118 ARG C . 52664 1 273 . 1 . 1 64 64 ARG CA C 13 57.02740365 0.03501060371 . . . . . . . 1118 ARG CA . 52664 1 274 . 1 . 1 64 64 ARG CB C 13 30.18231978 . . . . . . . . 1118 ARG CB . 52664 1 275 . 1 . 1 64 64 ARG N N 15 123.6289362 0.03732457571 . . . . . . . 1118 ARG N . 52664 1 276 . 1 . 1 65 65 VAL H H 1 8.103383568 0.01994691129 . . . . . . . 1119 VAL H . 52664 1 277 . 1 . 1 65 65 VAL C C 13 175.5494716 . . . . . . . . 1119 VAL C . 52664 1 278 . 1 . 1 65 65 VAL CA C 13 63.73792101 0.006091074968 . . . . . . . 1119 VAL CA . 52664 1 279 . 1 . 1 65 65 VAL CB C 13 32.11398736 . . . . . . . . 1119 VAL CB . 52664 1 280 . 1 . 1 65 65 VAL N N 15 121.4270922 0.0463962671 . . . . . . . 1119 VAL N . 52664 1 281 . 1 . 1 66 66 LEU H H 1 8.250979017 0.01810080199 . . . . . . . 1120 LEU H . 52664 1 282 . 1 . 1 66 66 LEU C C 13 174.1062883 0 . . . . . . . 1120 LEU C . 52664 1 283 . 1 . 1 66 66 LEU CA C 13 56.05006361 0.02110846509 . . . . . . . 1120 LEU CA . 52664 1 284 . 1 . 1 66 66 LEU CB C 13 41.68486202 . . . . . . . . 1120 LEU CB . 52664 1 285 . 1 . 1 66 66 LEU N N 15 123.7755956 0.04292815195 . . . . . . . 1120 LEU N . 52664 1 286 . 1 . 1 67 67 GLU H H 1 8.360964577 0.0193252904 . . . . . . . 1121 GLU H . 52664 1 287 . 1 . 1 67 67 GLU C C 13 175.3465849 . . . . . . . . 1121 GLU C . 52664 1 288 . 1 . 1 67 67 GLU CA C 13 57.40748094 0.01999478753 . . . . . . . 1121 GLU CA . 52664 1 289 . 1 . 1 67 67 GLU CB C 13 29.68773423 . . . . . . . . 1121 GLU CB . 52664 1 290 . 1 . 1 67 67 GLU N N 15 121.5096141 0.05746343219 . . . . . . . 1121 GLU N . 52664 1 291 . 1 . 1 68 68 ALA H H 1 8.191492049 0.0180396994 . . . . . . . 1122 ALA H . 52664 1 292 . 1 . 1 68 68 ALA C C 13 173.6119983 . . . . . . . . 1122 ALA C . 52664 1 293 . 1 . 1 68 68 ALA CA C 13 53.32155814 0.006844506151 . . . . . . . 1122 ALA CA . 52664 1 294 . 1 . 1 68 68 ALA CB C 13 18.35623197 . . . . . . . . 1122 ALA CB . 52664 1 295 . 1 . 1 68 68 ALA N N 15 123.532911 0.03376703926 . . . . . . . 1122 ALA N . 52664 1 296 . 1 . 1 69 69 LEU H H 1 8.106897368 0.02317920571 . . . . . . . 1123 LEU H . 52664 1 297 . 1 . 1 69 69 LEU C C 13 174.2663179 . . . . . . . . 1123 LEU C . 52664 1 298 . 1 . 1 69 69 LEU CA C 13 55.80583147 . . . . . . . . 1123 LEU CA . 52664 1 299 . 1 . 1 69 69 LEU CB C 13 41.87976654 . . . . . . . . 1123 LEU CB . 52664 1 300 . 1 . 1 69 69 LEU N N 15 120.3009254 0.04182299138 . . . . . . . 1123 LEU N . 52664 1 301 . 1 . 1 70 70 ARG H H 1 8.210465492 0.01962468069 . . . . . . . 1124 ARG H . 52664 1 302 . 1 . 1 70 70 ARG C C 13 175.3592939 . . . . . . . . 1124 ARG C . 52664 1 303 . 1 . 1 70 70 ARG CA C 13 57.06878499 0.005773611418 . . . . . . . 1124 ARG CA . 52664 1 304 . 1 . 1 70 70 ARG CB C 13 30.20559371 0 . . . . . . . 1124 ARG CB . 52664 1 305 . 1 . 1 70 70 ARG N N 15 121.1429239 0.0516074345 . . . . . . . 1124 ARG N . 52664 1 306 . 1 . 1 71 71 GLN H H 1 8.358132207 0.01903184503 . . . . . . . 1125 GLN H . 52664 1 307 . 1 . 1 71 71 GLN C C 13 175.9996803 . . . . . . . . 1125 GLN C . 52664 1 308 . 1 . 1 71 71 GLN CA C 13 56.26278366 0.02727033239 . . . . . . . 1125 GLN CA . 52664 1 309 . 1 . 1 71 71 GLN CB C 13 28.96234232 . . . . . . . . 1125 GLN CB . 52664 1 310 . 1 . 1 71 71 GLN N N 15 120.0620784 0.05177782686 . . . . . . . 1125 GLN N . 52664 1 311 . 1 . 1 72 72 SER H H 1 8.317185939 0.01826699382 . . . . . . . 1126 SER H . 52664 1 312 . 1 . 1 72 72 SER CA C 13 58.63191575 . . . . . . . . 1126 SER CA . 52664 1 313 . 1 . 1 72 72 SER CB C 13 63.50005631 0 . . . . . . . 1126 SER CB . 52664 1 314 . 1 . 1 72 72 SER N N 15 116.4990885 0.03970087291 . . . . . . . 1126 SER N . 52664 1 315 . 1 . 1 73 73 ARG H H 1 8.30447401 0.02308155234 . . . . . . . 1127 ARG H . 52664 1 316 . 1 . 1 73 73 ARG C C 13 176.4550268 . . . . . . . . 1127 ARG C . 52664 1 317 . 1 . 1 73 73 ARG CA C 13 55.98776441 0.003911278932 . . . . . . . 1127 ARG CA . 52664 1 318 . 1 . 1 73 73 ARG CB C 13 30.421961 . . . . . . . . 1127 ARG CB . 52664 1 319 . 1 . 1 73 73 ARG N N 15 122.2716179 0.03349629627 . . . . . . . 1127 ARG N . 52664 1 320 . 1 . 1 74 74 GLN H H 1 8.40678863 0.02268995438 . . . . . . . 1128 GLN H . 52664 1 321 . 1 . 1 74 74 GLN C C 13 176.5356671 . . . . . . . . 1128 GLN C . 52664 1 322 . 1 . 1 74 74 GLN CA C 13 55.72789523 0.02070522353 . . . . . . . 1128 GLN CA . 52664 1 323 . 1 . 1 74 74 GLN CB C 13 30.35423071 . . . . . . . . 1128 GLN CB . 52664 1 324 . 1 . 1 74 74 GLN N N 15 121.1629644 0.03396368661 . . . . . . . 1128 GLN N . 52664 1 325 . 1 . 1 75 75 THR H H 1 8.333961674 0.02061994236 . . . . . . . 1129 THR H . 52664 1 326 . 1 . 1 75 75 THR CA C 13 61.92464528 0.004194157238 . . . . . . . 1129 THR CA . 52664 1 327 . 1 . 1 75 75 THR CB C 13 69.62104279 . . . . . . . . 1129 THR CB . 52664 1 328 . 1 . 1 75 75 THR N N 15 116.413614 0.0566361772 . . . . . . . 1129 THR N . 52664 1 329 . 1 . 1 76 76 VAL H H 1 8.32655601 0.01718046815 . . . . . . . 1130 VAL H . 52664 1 330 . 1 . 1 76 76 VAL C C 13 178.4266758 . . . . . . . . 1130 VAL C . 52664 1 331 . 1 . 1 76 76 VAL CA C 13 59.5248292 . . . . . . . . 1130 VAL CA . 52664 1 332 . 1 . 1 76 76 VAL CB C 13 32.41178197 . . . . . . . . 1130 VAL CB . 52664 1 333 . 1 . 1 76 76 VAL N N 15 123.9719273 0.0702914605 . . . . . . . 1130 VAL N . 52664 1 334 . 1 . 1 78 78 ASP H H 1 8.516264505 0.01760946416 . . . . . . . 1132 ASP H . 52664 1 335 . 1 . 1 78 78 ASP C C 13 176.1102088 . . . . . . . . 1132 ASP C . 52664 1 336 . 1 . 1 78 78 ASP CA C 13 54.0912072 0.000686272215 . . . . . . . 1132 ASP CA . 52664 1 337 . 1 . 1 78 78 ASP CB C 13 41.02437204 . . . . . . . . 1132 ASP CB . 52664 1 338 . 1 . 1 78 78 ASP N N 15 121.0842261 0.05898700116 . . . . . . . 1132 ASP N . 52664 1 339 . 1 . 1 79 79 VAL H H 1 8.233288362 0.01989823791 . . . . . . . 1133 VAL H . 52664 1 340 . 1 . 1 79 79 VAL C C 13 176.7458476 . . . . . . . . 1133 VAL C . 52664 1 341 . 1 . 1 79 79 VAL CA C 13 62.15611771 . . . . . . . . 1133 VAL CA . 52664 1 342 . 1 . 1 79 79 VAL CB C 13 32.42013111 . . . . . . . . 1133 VAL CB . 52664 1 343 . 1 . 1 79 79 VAL N N 15 120.2109073 0.04883265541 . . . . . . . 1133 VAL N . 52664 1 344 . 1 . 1 80 80 ASN H H 1 8.670454508 0.0175852617 . . . . . . . 1134 ASN H . 52664 1 345 . 1 . 1 80 80 ASN C C 13 177.2408947 . . . . . . . . 1134 ASN C . 52664 1 346 . 1 . 1 80 80 ASN CA C 13 53.18004052 0.00533852129 . . . . . . . 1134 ASN CA . 52664 1 347 . 1 . 1 80 80 ASN CB C 13 38.73259571 . . . . . . . . 1134 ASN CB . 52664 1 348 . 1 . 1 80 80 ASN N N 15 121.8951085 0.0451265609 . . . . . . . 1134 ASN N . 52664 1 349 . 1 . 1 81 81 THR H H 1 8.174595207 0.0169887755 . . . . . . . 1135 THR H . 52664 1 350 . 1 . 1 81 81 THR C C 13 178.284703 . . . . . . . . 1135 THR C . 52664 1 351 . 1 . 1 81 81 THR CA C 13 61.6370321 0.01344896527 . . . . . . . 1135 THR CA . 52664 1 352 . 1 . 1 81 81 THR CB C 13 69.51384715 . . . . . . . . 1135 THR CB . 52664 1 353 . 1 . 1 81 81 THR N N 15 114.761042 0.05049006128 . . . . . . . 1135 THR N . 52664 1 354 . 1 . 1 82 82 GLU H H 1 8.455423778 0.01848230677 . . . . . . . 1136 GLU H . 52664 1 355 . 1 . 1 82 82 GLU C C 13 178.0395735 . . . . . . . . 1136 GLU C . 52664 1 356 . 1 . 1 82 82 GLU CA C 13 54.22064584 0.006140190001 . . . . . . . 1136 GLU CA . 52664 1 357 . 1 . 1 82 82 GLU CB C 13 29.38091623 . . . . . . . . 1136 GLU CB . 52664 1 358 . 1 . 1 82 82 GLU N N 15 124.9456716 0.03246291185 . . . . . . . 1136 GLU N . 52664 1 359 . 1 . 1 84 84 SER H H 1 8.606152417 0.01871341168 . . . . . . . 1138 SER H . 52664 1 360 . 1 . 1 84 84 SER C C 13 176.5677772 1.104087468 . . . . . . . 1138 SER C . 52664 1 361 . 1 . 1 84 84 SER CA C 13 58.66435104 0.6007883447 . . . . . . . 1138 SER CA . 52664 1 362 . 1 . 1 84 84 SER CB C 13 63.66845459 . . . . . . . . 1138 SER CB . 52664 1 363 . 1 . 1 84 84 SER N N 15 116.3827449 0.04540088482 . . . . . . . 1138 SER N . 52664 1 364 . 1 . 1 85 85 GLN H H 1 8.59723763 0.01838854849 . . . . . . . 1139 GLN H . 52664 1 365 . 1 . 1 85 85 GLN C C 13 176.7300531 . . . . . . . . 1139 GLN C . 52664 1 366 . 1 . 1 85 85 GLN CA C 13 55.88192894 0.007314925706 . . . . . . . 1139 GLN CA . 52664 1 367 . 1 . 1 85 85 GLN CB C 13 29.04277784 . . . . . . . . 1139 GLN CB . 52664 1 368 . 1 . 1 85 85 GLN N N 15 122.2305853 0.0675909134 . . . . . . . 1139 GLN N . 52664 1 369 . 1 . 1 86 86 ASN H H 1 8.490144421 0.01787063535 . . . . . . . 1140 ASN H . 52664 1 370 . 1 . 1 86 86 ASN C C 13 177.3328299 . . . . . . . . 1140 ASN C . 52664 1 371 . 1 . 1 86 86 ASN CA C 13 53.33638286 0.008844044147 . . . . . . . 1140 ASN CA . 52664 1 372 . 1 . 1 86 86 ASN CB C 13 38.6498339 . . . . . . . . 1140 ASN CB . 52664 1 373 . 1 . 1 86 86 ASN N N 15 119.2976842 0.03261867914 . . . . . . . 1140 ASN N . 52664 1 374 . 1 . 1 87 87 GLU H H 1 8.459613163 0.01848711347 . . . . . . . 1141 GLU H . 52664 1 375 . 1 . 1 87 87 GLU C C 13 176.2042343 0 . . . . . . . 1141 GLU C . 52664 1 376 . 1 . 1 87 87 GLU CA C 13 56.6264126 0.005700441783 . . . . . . . 1141 GLU CA . 52664 1 377 . 1 . 1 87 87 GLU CB C 13 29.92376546 . . . . . . . . 1141 GLU CB . 52664 1 378 . 1 . 1 87 87 GLU N N 15 121.2909082 0.0299462649 . . . . . . . 1141 GLU N . 52664 1 379 . 1 . 1 88 88 GLN H H 1 8.439857261 0.01864732158 . . . . . . . 1142 GLN H . 52664 1 380 . 1 . 1 88 88 GLN C C 13 176.769434 0.05616205335 . . . . . . . 1142 GLN C . 52664 1 381 . 1 . 1 88 88 GLN CA C 13 55.72967755 0.01868116602 . . . . . . . 1142 GLN CA . 52664 1 382 . 1 . 1 88 88 GLN CB C 13 29.13676312 . . . . . . . . 1142 GLN CB . 52664 1 383 . 1 . 1 88 88 GLN N N 15 121.3387212 0.04857976537 . . . . . . . 1142 GLN N . 52664 1 384 . 1 . 1 89 89 ILE H H 1 8.211226332 0.01921789005 . . . . . . . 1143 ILE H . 52664 1 385 . 1 . 1 89 89 ILE C C 13 176.5553875 . . . . . . . . 1143 ILE C . 52664 1 386 . 1 . 1 89 89 ILE CA C 13 61.02695861 0.01004970347 . . . . . . . 1143 ILE CA . 52664 1 387 . 1 . 1 89 89 ILE CB C 13 38.36976871 . . . . . . . . 1143 ILE CB . 52664 1 388 . 1 . 1 89 89 ILE N N 15 122.8031145 0.06148324621 . . . . . . . 1143 ILE N . 52664 1 389 . 1 . 1 90 90 ILE H H 1 8.250599864 0.0212924812 . . . . . . . 1144 ILE H . 52664 1 390 . 1 . 1 90 90 ILE C C 13 176.6948404 . . . . . . . . 1144 ILE C . 52664 1 391 . 1 . 1 90 90 ILE CA C 13 60.66929416 0.09873594844 . . . . . . . 1144 ILE CA . 52664 1 392 . 1 . 1 90 90 ILE CB C 13 38.23621278 . . . . . . . . 1144 ILE CB . 52664 1 393 . 1 . 1 90 90 ILE N N 15 125.5271258 0.0665856625 . . . . . . . 1144 ILE N . 52664 1 394 . 1 . 1 91 91 TRP H H 1 8.39211577 0.01850501963 . . . . . . . 1145 TRP H . 52664 1 395 . 1 . 1 91 91 TRP C C 13 176.904222 . . . . . . . . 1145 TRP C . 52664 1 396 . 1 . 1 91 91 TRP CA C 13 57.15292386 0.0008851271687 . . . . . . . 1145 TRP CA . 52664 1 397 . 1 . 1 91 91 TRP CB C 13 29.58545991 . . . . . . . . 1145 TRP CB . 52664 1 398 . 1 . 1 91 91 TRP N N 15 126.4759551 0.05487810999 . . . . . . . 1145 TRP N . 52664 1 399 . 1 . 1 92 92 ASP H H 1 8.275653683 0.02342942388 . . . . . . . 1146 ASP H . 52664 1 400 . 1 . 1 92 92 ASP C C 13 177.8262904 . . . . . . . . 1146 ASP C . 52664 1 401 . 1 . 1 92 92 ASP CA C 13 53.46206725 0.005537027661 . . . . . . . 1146 ASP CA . 52664 1 402 . 1 . 1 92 92 ASP CB C 13 41.08314987 . . . . . . . . 1146 ASP CB . 52664 1 403 . 1 . 1 92 92 ASP N N 15 122.2681153 0.03265237992 . . . . . . . 1146 ASP N . 52664 1 404 . 1 . 1 93 93 ASP H H 1 7.94987363 0.0235397156 . . . . . . . 1147 ASP H . 52664 1 405 . 1 . 1 93 93 ASP C C 13 177.5644652 . . . . . . . . 1147 ASP C . 52664 1 406 . 1 . 1 93 93 ASP CA C 13 51.67774053 0.01139992813 . . . . . . . 1147 ASP CA . 52664 1 407 . 1 . 1 93 93 ASP CB C 13 41.34780232 . . . . . . . . 1147 ASP CB . 52664 1 408 . 1 . 1 93 93 ASP N N 15 122.0042518 0.07522889627 . . . . . . . 1147 ASP N . 52664 1 409 . 1 . 1 95 95 THR H H 1 8.257023383 0.02392755962 . . . . . . . 1149 THR H . 52664 1 410 . 1 . 1 95 95 THR C C 13 174.1316548 . . . . . . . . 1149 THR C . 52664 1 411 . 1 . 1 95 95 THR CB C 13 68.51246495 . . . . . . . . 1149 THR CB . 52664 1 412 . 1 . 1 95 95 THR N N 15 113.8379497 0.06039707919 . . . . . . . 1149 THR N . 52664 1 413 . 1 . 1 96 96 ALA H H 1 7.918277293 0.02152147082 . . . . . . . 1150 ALA H . 52664 1 414 . 1 . 1 96 96 ALA C C 13 173.1608638 . . . . . . . . 1150 ALA C . 52664 1 415 . 1 . 1 96 96 ALA CA C 13 53.75698528 . . . . . . . . 1150 ALA CA . 52664 1 416 . 1 . 1 96 96 ALA CB C 13 18.37588106 . . . . . . . . 1150 ALA CB . 52664 1 417 . 1 . 1 96 96 ALA N N 15 125.7934193 0.08405585241 . . . . . . . 1150 ALA N . 52664 1 418 . 1 . 1 97 97 ARG H H 1 8.109545292 0.02014862766 . . . . . . . 1151 ARG H . 52664 1 419 . 1 . 1 97 97 ARG C C 13 174.1462264 . . . . . . . . 1151 ARG C . 52664 1 420 . 1 . 1 97 97 ARG CA C 13 58.4974362 0.003627412183 . . . . . . . 1151 ARG CA . 52664 1 421 . 1 . 1 97 97 ARG CB C 13 30.32047366 . . . . . . . . 1151 ARG CB . 52664 1 422 . 1 . 1 97 97 ARG N N 15 119.0283834 0.03893145428 . . . . . . . 1151 ARG N . 52664 1 423 . 1 . 1 98 98 GLU H H 1 8.264931266 0.02178611569 . . . . . . . 1152 GLU H . 52664 1 424 . 1 . 1 98 98 GLU C C 13 174.2175619 . . . . . . . . 1152 GLU C . 52664 1 425 . 1 . 1 98 98 GLU CA C 13 58.25574243 0.03655624627 . . . . . . . 1152 GLU CA . 52664 1 426 . 1 . 1 98 98 GLU CB C 13 30.13434828 . . . . . . . . 1152 GLU CB . 52664 1 427 . 1 . 1 98 98 GLU N N 15 120.927742 0.03537923892 . . . . . . . 1152 GLU N . 52664 1 428 . 1 . 1 99 99 GLU H H 1 8.242348787 0.02464448093 . . . . . . . 1153 GLU H . 52664 1 429 . 1 . 1 99 99 GLU C C 13 174.3312877 . . . . . . . . 1153 GLU C . 52664 1 430 . 1 . 1 99 99 GLU CA C 13 58.1310551 0.03635585474 . . . . . . . 1153 GLU CA . 52664 1 431 . 1 . 1 99 99 GLU CB C 13 29.15728806 . . . . . . . . 1153 GLU CB . 52664 1 432 . 1 . 1 99 99 GLU N N 15 121.4156871 0.05116205387 . . . . . . . 1153 GLU N . 52664 1 433 . 1 . 1 100 100 ARG H H 1 8.211858023 0.02255578637 . . . . . . . 1154 ARG H . 52664 1 434 . 1 . 1 100 100 ARG C C 13 174.2762349 . . . . . . . . 1154 ARG C . 52664 1 435 . 1 . 1 100 100 ARG CA C 13 58.3966883 0.02699066835 . . . . . . . 1154 ARG CA . 52664 1 436 . 1 . 1 100 100 ARG CB C 13 29.94426555 . . . . . . . . 1154 ARG CB . 52664 1 437 . 1 . 1 100 100 ARG N N 15 119.6931561 0.05922433124 . . . . . . . 1154 ARG N . 52664 1 438 . 1 . 1 101 101 ALA H H 1 8.011342609 0.02411776059 . . . . . . . 1155 ALA H . 52664 1 439 . 1 . 1 101 101 ALA C C 13 173.2218054 . . . . . . . . 1155 ALA C . 52664 1 440 . 1 . 1 101 101 ALA CA C 13 53.83160765 . . . . . . . . 1155 ALA CA . 52664 1 441 . 1 . 1 101 101 ALA CB C 13 18.05214525 . . . . . . . . 1155 ALA CB . 52664 1 442 . 1 . 1 101 101 ALA N N 15 122.4256323 0.05091041533 . . . . . . . 1155 ALA N . 52664 1 443 . 1 . 1 102 102 ARG H H 1 8.085215773 0.02169409467 . . . . . . . 1156 ARG H . 52664 1 444 . 1 . 1 102 102 ARG C C 13 174.5119862 . . . . . . . . 1156 ARG C . 52664 1 445 . 1 . 1 102 102 ARG CA C 13 57.83490486 0.004993950457 . . . . . . . 1156 ARG CA . 52664 1 446 . 1 . 1 102 102 ARG CB C 13 30.22667515 . . . . . . . . 1156 ARG CB . 52664 1 447 . 1 . 1 102 102 ARG N N 15 119.9672519 0.08723514625 . . . . . . . 1156 ARG N . 52664 1 448 . 1 . 1 103 103 LEU H H 1 8.08636098 0.02080718383 . . . . . . . 1157 LEU H . 52664 1 449 . 1 . 1 103 103 LEU C C 13 174.3472396 . . . . . . . . 1157 LEU C . 52664 1 450 . 1 . 1 103 103 LEU CA C 13 56.02313428 0.007321199804 . . . . . . . 1157 LEU CA . 52664 1 451 . 1 . 1 103 103 LEU CB C 13 41.84804612 . . . . . . . . 1157 LEU CB . 52664 1 452 . 1 . 1 103 103 LEU N N 15 121.0227099 0.06213674374 . . . . . . . 1157 LEU N . 52664 1 453 . 1 . 1 104 104 ALA H H 1 8.051844339 0.02455477727 . . . . . . . 1158 ALA H . 52664 1 454 . 1 . 1 104 104 ALA C C 13 173.9822277 . . . . . . . . 1158 ALA C . 52664 1 455 . 1 . 1 104 104 ALA CA C 13 53.22426667 0.03211506847 . . . . . . . 1158 ALA CA . 52664 1 456 . 1 . 1 104 104 ALA CB C 13 18.39303279 . . . . . . . . 1158 ALA CB . 52664 1 457 . 1 . 1 104 104 ALA N N 15 122.5150084 0.08340464207 . . . . . . . 1158 ALA N . 52664 1 458 . 1 . 1 105 105 SER H H 1 8.097636881 0.02155840907 . . . . . . . 1159 SER H . 52664 1 459 . 1 . 1 105 105 SER C C 13 177.858198 . . . . . . . . 1159 SER C . 52664 1 460 . 1 . 1 105 105 SER CA C 13 59.0793691 0.007107289787 . . . . . . . 1159 SER CA . 52664 1 461 . 1 . 1 105 105 SER CB C 13 63.34841776 . . . . . . . . 1159 SER CB . 52664 1 462 . 1 . 1 105 105 SER N N 15 113.9746665 0.03074981509 . . . . . . . 1159 SER N . 52664 1 463 . 1 . 1 106 106 ASN H H 1 8.225327244 0.02498379857 . . . . . . . 1160 ASN H . 52664 1 464 . 1 . 1 106 106 ASN CA C 13 57.74917114 0.02174157559 . . . . . . . 1160 ASN CA . 52664 1 465 . 1 . 1 106 106 ASN CB C 13 39.42540128 . . . . . . . . 1160 ASN CB . 52664 1 466 . 1 . 1 106 106 ASN N N 15 120.0439779 0.03696842032 . . . . . . . 1160 ASN N . 52664 1 467 . 1 . 1 107 107 LEU H H 1 8.007572427 0.02223548657 . . . . . . . 1161 LEU H . 52664 1 468 . 1 . 1 107 107 LEU C C 13 175.5908 . . . . . . . . 1161 LEU C . 52664 1 469 . 1 . 1 107 107 LEU CA C 13 55.10904293 0.001891122463 . . . . . . . 1161 LEU CA . 52664 1 470 . 1 . 1 107 107 LEU CB C 13 41.86377222 . . . . . . . . 1161 LEU CB . 52664 1 471 . 1 . 1 107 107 LEU N N 15 121.1717723 0.05510213054 . . . . . . . 1161 LEU N . 52664 1 472 . 1 . 1 108 108 GLN H H 1 8.144600291 0.02208609582 . . . . . . . 1162 GLN H . 52664 1 473 . 1 . 1 108 108 GLN C C 13 177.3411626 . . . . . . . . 1162 GLN C . 52664 1 474 . 1 . 1 108 108 GLN CA C 13 55.39760481 . . . . . . . . 1162 GLN CA . 52664 1 475 . 1 . 1 108 108 GLN CB C 13 29.19094287 . . . . . . . . 1162 GLN CB . 52664 1 476 . 1 . 1 108 108 GLN N N 15 119.8111083 0.02508825918 . . . . . . . 1162 GLN N . 52664 1 477 . 1 . 1 109 109 TRP H H 1 8.268011946 0.02042324172 . . . . . . . 1163 TRP H . 52664 1 478 . 1 . 1 109 109 TRP C C 13 178.4085119 . . . . . . . . 1163 TRP C . 52664 1 479 . 1 . 1 109 109 TRP CA C 13 54.5806591 0.05125663057 . . . . . . . 1163 TRP CA . 52664 1 480 . 1 . 1 109 109 TRP CB C 13 28.95502052 . . . . . . . . 1163 TRP CB . 52664 1 481 . 1 . 1 109 109 TRP N N 15 123.1085638 0.04556163098 . . . . . . . 1163 TRP N . 52664 1 482 . 1 . 1 111 111 SER H H 1 8.443793989 0.02003192769 . . . . . . . 1165 SER H . 52664 1 483 . 1 . 1 111 111 SER C C 13 178.6452735 . . . . . . . . 1165 SER C . 52664 1 484 . 1 . 1 111 111 SER CA C 13 58.11099431 . . . . . . . . 1165 SER CA . 52664 1 485 . 1 . 1 111 111 SER CB C 13 63.7312015 . . . . . . . . 1165 SER CB . 52664 1 486 . 1 . 1 111 111 SER N N 15 116.1229512 0.04080829901 . . . . . . . 1165 SER N . 52664 1 487 . 1 . 1 112 112 CYS H H 1 8.39452889 0.01791831008 . . . . . . . 1166 CYS H . 52664 1 488 . 1 . 1 112 112 CYS C C 13 177.6662219 . . . . . . . . 1166 CYS C . 52664 1 489 . 1 . 1 112 112 CYS CA C 13 51.63702361 0.05826014721 . . . . . . . 1166 CYS CA . 52664 1 490 . 1 . 1 112 112 CYS CB C 13 41.02655031 0.02722935612 . . . . . . . 1166 CYS CB . 52664 1 491 . 1 . 1 112 112 CYS N N 15 123.0895549 0.05480789571 . . . . . . . 1166 CYS N . 52664 1 492 . 1 . 1 114 114 THR H H 1 8.392129902 0.02066008489 . . . . . . . 1168 THR H . 52664 1 493 . 1 . 1 114 114 THR C C 13 177.7272494 . . . . . . . . 1168 THR C . 52664 1 494 . 1 . 1 114 114 THR CA C 13 62.71586913 0.01059873699 . . . . . . . 1168 THR CA . 52664 1 495 . 1 . 1 114 114 THR CB C 13 69.27121466 . . . . . . . . 1168 THR CB . 52664 1 496 . 1 . 1 114 114 THR N N 15 113.38491 0.05138869172 . . . . . . . 1168 THR N . 52664 1 497 . 1 . 1 115 115 GLN H H 1 8.086379235 0.01976791734 . . . . . . . 1169 GLN H . 52664 1 498 . 1 . 1 115 115 GLN C C 13 177.1076163 . . . . . . . . 1169 GLN C . 52664 1 499 . 1 . 1 115 115 GLN CA C 13 55.46153775 . . . . . . . . 1169 GLN CA . 52664 1 500 . 1 . 1 115 115 GLN CB C 13 29.1384196 . . . . . . . . 1169 GLN CB . 52664 1 501 . 1 . 1 115 115 GLN N N 15 121.8474078 0.04358682214 . . . . . . . 1169 GLN N . 52664 1 502 . 1 . 1 116 116 TYR H H 1 8.196464716 0.02276468741 . . . . . . . 1170 TYR H . 52664 1 503 . 1 . 1 116 116 TYR N N 15 121.3805143 0.06579713514 . . . . . . . 1170 TYR N . 52664 1 504 . 1 . 1 117 117 SER H H 1 8.217287541 0.01912014685 . . . . . . . 1171 SER H . 52664 1 505 . 1 . 1 117 117 SER C C 13 176.7685416 . . . . . . . . 1171 SER C . 52664 1 506 . 1 . 1 117 117 SER CA C 13 57.96855224 0 . . . . . . . 1171 SER CA . 52664 1 507 . 1 . 1 117 117 SER CB C 13 63.72397585 . . . . . . . . 1171 SER CB . 52664 1 508 . 1 . 1 117 117 SER N N 15 117.9511024 0.04918274618 . . . . . . . 1171 SER N . 52664 1 509 . 1 . 1 118 118 GLU H H 1 8.554014328 0.02282368878 . . . . . . . 1172 GLU H . 52664 1 510 . 1 . 1 118 118 GLU C C 13 176.3038912 . . . . . . . . 1172 GLU C . 52664 1 511 . 1 . 1 118 118 GLU CA C 13 56.29638783 . . . . . . . . 1172 GLU CA . 52664 1 512 . 1 . 1 118 118 GLU CB C 13 29.89699035 . . . . . . . . 1172 GLU CB . 52664 1 513 . 1 . 1 118 118 GLU N N 15 123.0167212 0.03101973477 . . . . . . . 1172 GLU N . 52664 1 514 . 1 . 1 119 119 LEU H H 1 8.238390735 0.01905587992 . . . . . . . 1173 LEU H . 52664 1 515 . 1 . 1 119 119 LEU C C 13 175.5604496 . . . . . . . . 1173 LEU C . 52664 1 516 . 1 . 1 119 119 LEU CA C 13 54.87235534 . . . . . . . . 1173 LEU CA . 52664 1 517 . 1 . 1 119 119 LEU CB C 13 41.91580629 0.1459842335 . . . . . . . 1173 LEU CB . 52664 1 518 . 1 . 1 119 119 LEU N N 15 122.8378433 0.04144760086 . . . . . . . 1173 LEU N . 52664 1 519 . 1 . 1 120 120 GLN H H 1 8.457288802 0.01967731431 . . . . . . . 1174 GLN H . 52664 1 520 . 1 . 1 120 120 GLN C C 13 177.0113491 . . . . . . . . 1174 GLN C . 52664 1 521 . 1 . 1 120 120 GLN CA C 13 55.2195651 0.03622508741 . . . . . . . 1174 GLN CA . 52664 1 522 . 1 . 1 120 120 GLN CB C 13 29.09328215 . . . . . . . . 1174 GLN CB . 52664 1 523 . 1 . 1 120 120 GLN N N 15 122.5276959 0.04149317804 . . . . . . . 1174 GLN N . 52664 1 524 . 1 . 1 121 121 VAL H H 1 8.269111887 0.01974268224 . . . . . . . 1175 VAL H . 52664 1 525 . 1 . 1 121 121 VAL C C 13 177.0288107 . . . . . . . . 1175 VAL C . 52664 1 526 . 1 . 1 121 121 VAL CA C 13 61.66394373 0.006099002033 . . . . . . . 1175 VAL CA . 52664 1 527 . 1 . 1 121 121 VAL CB C 13 32.94656135 . . . . . . . . 1175 VAL CB . 52664 1 528 . 1 . 1 121 121 VAL N N 15 121.6303231 0.06644233263 . . . . . . . 1175 VAL N . 52664 1 529 . 1 . 1 122 122 ASP H H 1 8.553727999 0.0180270968 . . . . . . . 1176 ASP H . 52664 1 530 . 1 . 1 122 122 ASP C C 13 177.6267628 . . . . . . . . 1176 ASP C . 52664 1 531 . 1 . 1 122 122 ASP CA C 13 54.19223026 0.003101468084 . . . . . . . 1176 ASP CA . 52664 1 532 . 1 . 1 122 122 ASP CB C 13 40.85553233 . . . . . . . . 1176 ASP CB . 52664 1 533 . 1 . 1 122 122 ASP N N 15 124.7910066 0.04117851496 . . . . . . . 1176 ASP N . 52664 1 534 . 1 . 1 123 123 ILE H H 1 7.768123219 0.01952654018 . . . . . . . 1177 ILE H . 52664 1 535 . 1 . 1 123 123 ILE C C 13 175.9466006 . . . . . . . . 1177 ILE C . 52664 1 536 . 1 . 1 123 123 ILE CA C 13 62.63678404 . . . . . . . . 1177 ILE CA . 52664 1 537 . 1 . 1 123 123 ILE N N 15 125.1392442 0.04849816123 . . . . . . . 1177 ILE N . 52664 1 stop_ save_