data_5144 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR Structure of the Second Intracellular Loop of the alpha2A adrenergic receptor: evidence for a Novel Cytoplasmic Helix ; _BMRB_accession_number 5144 _BMRB_flat_file_name bmr5144.str _Entry_type original _Submission_date 2001-09-09 _Accession_date 2001-09-10 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details ; 1H backbone and side chain chemical shift assignments for a peptide, Rho-T3-I2-T4, derived from rhodopsin. ; loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Chung Duane A. . 2 Zuiderweg Erik R.P. . 3 Fowler Carol B. . 4 Soyer Orkun S. . 5 Mosberg Henry I. . 6 Neubig Richard R. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 163 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2002-04-09 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 5143 'wild type T3-I2 peptide' 5149 'D130I mutant T3-I2(D130I) peptide' 5150 'T3-I2-T4 peptide' stop_ _Original_release_date 2002-04-09 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR Structure of the Second Intracellular Loop of the alpha2A adrenergic receptor: evidence for a Novel Cytoplasmic Helix ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 11888275 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Chung Duane A. . 2 Zuiderweg Erik R.P. . 3 Fowler Carol B. . 4 Soyer Orkun S. . 5 Mosberg Henry I. . 6 Neubig Richard R. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 41 _Journal_issue 11 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3596 _Page_last 3604 _Year 2002 _Details . save_ ################################## # Molecular system description # ################################## save_system_rhodopsin _Saveframe_category molecular_system _Mol_system_name rhodopsin _Abbreviation_common rhodopsin _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'rhodopsin T3-I2-T4 peptide' $Rho-T3-I2-T4 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'all free' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Rho-T3-I2-T4 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'rhodopsin receptor peptide' _Abbreviation_common 'rhodopsin receptor peptide' _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 34 _Mol_residue_sequence ; LWSLVVLAIERYVVVCKPMS NFRFGENHAIMGVA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 125 LEU 2 126 TRP 3 127 SER 4 128 LEU 5 129 VAL 6 130 VAL 7 131 LEU 8 132 ALA 9 133 ILE 10 134 GLU 11 135 ARG 12 136 TYR 13 137 VAL 14 138 VAL 15 139 VAL 16 140 CYS 17 141 LYS 18 142 PRO 19 143 MET 20 144 SER 21 145 ASN 22 146 PHE 23 147 ARG 24 148 PHE 25 149 GLY 26 150 GLU 27 151 ASN 28 152 HIS 29 153 ALA 30 154 ILE 31 155 MET 32 156 GLY 33 157 VAL 34 158 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-28 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 5376 rhodopsin 100.00 348 100.00 100.00 1.52e-13 PDB 1F88 "Crystal Structure Of Bovine Rhodopsin" 100.00 348 100.00 100.00 1.52e-13 PDB 1GZM "Structure Of Bovine Rhodopsin In A Trigonal Crystal Form" 100.00 349 100.00 100.00 1.53e-13 PDB 1HZX "Crystal Structure Of Bovine Rhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 1JFP "Structure Of Bovine Rhodopsin (Dark Adapted)" 100.00 348 100.00 100.00 1.52e-13 PDB 1L9H "Crystal Structure Of Bovine Rhodopsin At 2.6 Angstroms Resolution" 100.00 349 100.00 100.00 1.53e-13 PDB 1LN6 "Structure Of Bovine Rhodopsin (Metarhodopsin Ii)" 100.00 348 100.00 100.00 1.52e-13 PDB 1U19 "Crystal Structure Of Bovine Rhodopsin At 2.2 Angstroms Resolution" 100.00 349 100.00 100.00 1.53e-13 PDB 2G87 "Crystallographic Model Of Bathorhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2HPY "Crystallographic Model Of Lumirhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2I35 "Crystal Structure Of Rhombohedral Crystal Form Of Ground-State Rhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2I36 "Crystal Structure Of Trigonal Crystal Form Of Ground-State Rhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2I37 "Crystal Structure Of A Photoactivated Rhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2J4Y "Crystal Structure Of A Rhodopsin Stabilizing Mutant Expressed In Mammalian Cells" 100.00 349 100.00 100.00 5.87e-14 PDB 2PED "Crystallographic Model Of 9-Cis-Rhodopsin" 100.00 349 100.00 100.00 1.53e-13 PDB 2X72 "Crystal Structure Of The Constitutively Active E113q,N2c, D282c Rhodopsin Mutant With Bound Galphact Peptide" 100.00 349 100.00 100.00 1.88e-13 PDB 3C9L "Structure Of Ground-State Bovine Rhodospin In A Hexagonal Crystal Form" 100.00 348 100.00 100.00 1.52e-13 PDB 3C9M "Structure Of A Mutant Bovine Rhodopsin In Hexagonal Crystal Form" 100.00 348 100.00 100.00 5.80e-14 PDB 3CAP "Crystal Structure Of Native Opsin: The G Protein-Coupled Receptor Rhodopsin In Its Ligand-Free State" 100.00 348 100.00 100.00 1.52e-13 PDB 3DQB "Crystal Structure Of The Active G-protein-coupled Receptor Opsin In Complex With A C-terminal Peptide Derived From The Galpha S" 100.00 348 100.00 100.00 1.52e-13 PDB 3OAX "Crystal Structure Of Bovine Rhodopsin With Beta-Ionone" 100.00 349 100.00 100.00 1.53e-13 PDB 3PQR "Crystal Structure Of Metarhodopsin Ii In Complex With A C-Terminal Peptide Derived From The Galpha Subunit Of Transducin" 100.00 348 100.00 100.00 1.52e-13 PDB 3PXO "Crystal Structure Of Metarhodopsin Ii" 100.00 348 100.00 100.00 1.52e-13 PDB 4A4M "Crystal Structure Of The Light-Activated Constitutively Active N2c,M257y,D282c Rhodopsin Mutant In Complex With A Peptide Resem" 100.00 349 100.00 100.00 1.84e-13 PDB 4BEY "Night Blindness Causing G90d Rhodopsin In Complex With Gact2 Peptide" 100.00 349 100.00 100.00 1.72e-13 PDB 4BEZ "Night Blindness Causing G90d Rhodopsin In The Active Conformation" 100.00 349 100.00 100.00 1.72e-13 PDB 4J4Q "Crystal Structure Of Active Conformation Of Gpcr Opsin Stabilized By Octylglucoside" 100.00 348 100.00 100.00 1.52e-13 PDB 4PXF "Crystal Structure Of The Active G-protein-coupled Receptor Opsin In Complex With The Finger-loop Peptide Derived From The Full-" 100.00 348 100.00 100.00 1.52e-13 DBJ BAA00610 "rhodopsin [Gallus gallus]" 100.00 351 97.06 100.00 8.97e-14 DBJ BAB55452 "visual pigment [Cynops pyrrhogaster]" 97.06 354 100.00 100.00 2.59e-13 DBJ BAB83621 "rhodopsin [synthetic construct]" 100.00 348 100.00 100.00 1.52e-13 DBJ BAC05894 "seven transmembrane helix receptor [Homo sapiens]" 100.00 348 100.00 100.00 5.18e-14 DBJ BAC31871 "unnamed protein product [Mus musculus]" 97.06 348 100.00 100.00 6.41e-13 EMBL CAA43398 "opsin [Cricetulus griseus]" 97.06 348 96.97 100.00 2.79e-13 EMBL CAA50502 "rod opsin [Canis lupus familiaris]" 100.00 348 100.00 100.00 4.97e-14 EMBL CAA70209 "unnamed protein product [Canis lupus familiaris]" 100.00 358 100.00 100.00 5.09e-14 EMBL CAA87081 "rhodopsin [Rattus norvegicus]" 100.00 348 100.00 100.00 1.72e-13 EMBL CAB91997 "rod opsin, partial [Serinus canaria]" 100.00 320 100.00 100.00 2.12e-13 GB AAA30674 "rhodopsin [Bos taurus]" 100.00 348 100.00 100.00 1.52e-13 GB AAA30675 "rhodopsin, partial [Bos taurus]" 100.00 343 100.00 100.00 1.77e-13 GB AAA39861 "opsin [Mus musculus]" 97.06 348 100.00 100.00 5.67e-13 GB AAA63392 "opsin [Mus musculus]" 97.06 348 100.00 100.00 5.67e-13 GB AAA84439 "opsin [Rattus norvegicus]" 100.00 348 100.00 100.00 1.86e-13 PRF 0811197A rhodopsin 100.00 347 100.00 100.00 1.50e-13 PRF 0901188A rhodopsin 100.00 348 100.00 100.00 1.52e-13 PRF 0901212A rhodopsin 100.00 348 100.00 100.00 1.52e-13 PRF 1001148A rhodopsin 100.00 348 100.00 100.00 1.52e-13 PRF 1413373A "rhodopsin [Gallus gallus]" 100.00 351 97.06 100.00 8.97e-14 REF NP_000530 "rhodopsin [Homo sapiens]" 100.00 348 100.00 100.00 5.18e-14 REF NP_001008277 "rhodopsin [Canis lupus familiaris]" 100.00 358 100.00 100.00 5.09e-14 REF NP_001009242 "rhodopsin [Felis catus]" 100.00 348 100.00 100.00 4.87e-14 REF NP_001014890 "rhodopsin [Bos taurus]" 100.00 348 100.00 100.00 1.52e-13 REF NP_001025777 "rhodopsin [Gallus gallus]" 100.00 351 97.06 100.00 8.97e-14 SP O18766 "RecName: Full=Rhodopsin [Sus scrofa]" 100.00 348 97.06 100.00 3.60e-13 SP O62791 "RecName: Full=Rhodopsin [Delphinus delphis]" 100.00 348 97.06 100.00 1.23e-13 SP O62792 "RecName: Full=Rhodopsin [Globicephala melas]" 100.00 348 97.06 100.00 1.22e-13 SP O62793 "RecName: Full=Rhodopsin [Mesoplodon bidens]" 100.00 348 97.06 100.00 1.33e-13 SP O62794 "RecName: Full=Rhodopsin [Phoca vitulina]" 100.00 348 97.06 97.06 1.84e-13 TPG DAA16827 "TPA: rhodopsin [Bos taurus]" 100.00 348 100.00 100.00 1.52e-13 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Rho-T3-I2-T4 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $Rho-T3-I2-T4 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type micelles _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Rho-T3-I2-T4 0.9 mM . dodecyphosphocholine 460 mM . NaCl 50 mM . NaH2PO4 10 mM . H2O 90 % . D2O 10 % . stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H-1H_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H NOESY' _Sample_label . save_ save_1H-1H_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H TOCSY' _Sample_label . save_ save_1H-1H_COSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H COSY' _Sample_label . save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H TOCSY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-1H COSY' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_cond-1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 4.5 0.2 na temperature 303 1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS H 1 'methyl protons' ppm 0.00 internal direct cylindrical internal parallel 1.0 stop_ save_ ################################### # 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_Shift_set_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H-1H NOESY' '1H-1H TOCSY' '1H-1H COSY' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $cond-1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'rhodopsin T3-I2-T4 peptide' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 1 LEU H H 8.90 0.02 1 2 . 1 LEU HA H 4.11 0.02 1 3 . 1 LEU HB2 H 1.74 0.02 2 4 . 1 LEU HB3 H 1.60 0.02 2 5 . 1 LEU HG H 2.21 0.02 1 6 . 2 TRP H H 8.78 0.02 1 7 . 2 TRP HA H 4.44 0.02 1 8 . 2 TRP HB2 H 3.42 0.02 2 9 . 2 TRP HB3 H 3.35 0.02 2 10 . 3 SER H H 7.97 0.02 1 11 . 3 SER HA H 4.04 0.02 1 12 . 3 SER HB2 H 3.93 0.02 2 13 . 3 SER HB3 H 3.88 0.02 2 14 . 4 LEU H H 7.58 0.02 1 15 . 4 LEU HA H 4.16 0.02 1 16 . 4 LEU HB2 H 1.99 0.02 2 17 . 4 LEU HB3 H 1.71 0.02 2 18 . 4 LEU HG H 1.84 0.02 1 19 . 5 VAL H H 8.06 0.02 1 20 . 5 VAL HA H 3.53 0.02 1 21 . 5 VAL HB H 2.26 0.02 1 22 . 5 VAL HG1 H 1.05 0.02 2 23 . 5 VAL HG2 H 0.89 0.02 2 24 . 6 VAL H H 8.01 0.02 1 25 . 6 VAL HA H 3.37 0.02 1 26 . 6 VAL HB H 1.94 0.02 1 27 . 6 VAL HG1 H 0.86 0.02 2 28 . 6 VAL HG2 H 0.66 0.02 2 29 . 7 LEU H H 7.83 0.02 1 30 . 7 LEU HA H 4.09 0.02 1 31 . 7 LEU HB2 H 1.90 0.02 2 32 . 7 LEU HB3 H 1.67 0.02 2 33 . 7 LEU HG H 1.79 0.02 1 34 . 8 ALA H H 8.15 0.02 1 35 . 8 ALA HA H 4.11 0.02 1 36 . 8 ALA HB H 1.60 0.02 1 37 . 9 ILE H H 8.36 0.02 1 38 . 9 ILE HA H 3.76 0.02 1 39 . 9 ILE HB H 2.07 0.02 1 40 . 9 ILE HG2 H 0.95 0.02 1 41 . 9 ILE HD1 H 0.83 0.02 1 42 . 10 GLU H H 8.59 0.02 1 43 . 10 GLU HA H 3.95 0.02 1 44 . 10 GLU HB2 H 2.40 0.02 2 45 . 10 GLU HB3 H 2.14 0.02 2 46 . 10 GLU HG2 H 2.38 0.02 1 47 . 10 GLU HG3 H 2.38 0.02 1 48 . 11 ARG H H 8.17 0.02 1 49 . 11 ARG HA H 4.11 0.02 1 50 . 11 ARG HB2 H 1.93 0.02 2 51 . 11 ARG HB3 H 1.79 0.02 2 52 . 11 ARG HG2 H 1.66 0.02 2 53 . 11 ARG HD2 H 3.15 0.02 1 54 . 11 ARG HD3 H 3.15 0.02 1 55 . 12 TYR H H 8.11 0.02 1 56 . 12 TYR HA H 4.42 0.02 1 57 . 12 TYR HB2 H 3.22 0.02 2 58 . 12 TYR HB3 H 3.07 0.02 2 59 . 12 TYR HD1 H 7.11 0.02 1 60 . 12 TYR HD2 H 7.11 0.02 1 61 . 13 VAL H H 8.30 0.02 1 62 . 13 VAL HA H 3.81 0.02 1 63 . 13 VAL HB H 2.37 0.02 1 64 . 13 VAL HG1 H 1.14 0.02 2 65 . 13 VAL HG2 H 1.03 0.02 2 66 . 14 VAL H H 7.80 0.02 1 67 . 14 VAL HA H 3.94 0.02 1 68 . 14 VAL HB H 2.27 0.02 1 69 . 14 VAL HG1 H 1.10 0.02 2 70 . 14 VAL HG2 H 1.03 0.02 2 71 . 15 VAL H H 7.74 0.02 1 72 . 15 VAL HA H 4.13 0.02 1 73 . 15 VAL HB H 2.27 0.02 1 74 . 15 VAL HG1 H 1.04 0.02 2 75 . 15 VAL HG2 H 1.02 0.02 2 76 . 16 CYS H H 8.00 0.02 1 77 . 16 CYS HA H 4.44 0.02 1 78 . 16 CYS HB2 H 2.90 0.02 2 79 . 16 CYS HB3 H 2.81 0.02 2 80 . 17 LYS H H 8.18 0.02 1 81 . 17 LYS HA H 4.43 0.02 1 82 . 17 LYS HB2 H 1.89 0.02 1 83 . 17 LYS HB3 H 1.89 0.02 1 84 . 17 LYS HE2 H 2.90 0.02 2 85 . 17 LYS HE3 H 2.82 0.02 2 86 . 18 PRO HA H 4.48 0.02 1 87 . 18 PRO HB2 H 2.36 0.02 2 88 . 18 PRO HB3 H 1.93 0.02 2 89 . 18 PRO HG2 H 2.05 0.02 2 90 . 18 PRO HG3 H 1.99 0.02 2 91 . 18 PRO HD2 H 3.76 0.02 2 92 . 18 PRO HD3 H 3.70 0.02 2 93 . 19 MET H H 8.44 0.02 1 94 . 19 MET HA H 4.49 0.02 1 95 . 19 MET HB2 H 2.21 0.02 2 96 . 19 MET HB3 H 2.15 0.02 2 97 . 20 SER H H 8.13 0.02 1 98 . 20 SER HA H 4.36 0.02 1 99 . 20 SER HB2 H 3.95 0.02 2 100 . 20 SER HB3 H 3.88 0.02 2 101 . 21 ASN H H 8.34 0.02 1 102 . 21 ASN HA H 4.73 0.02 1 103 . 21 ASN HB2 H 2.80 0.02 2 104 . 21 ASN HB3 H 2.70 0.02 2 105 . 21 ASN HD21 H 7.61 0.02 2 106 . 22 PHE H H 8.06 0.02 1 107 . 22 PHE HA H 4.53 0.02 1 108 . 22 PHE HB2 H 3.05 0.02 1 109 . 22 PHE HB3 H 3.05 0.02 1 110 . 23 ARG H H 8.04 0.02 1 111 . 23 ARG HA H 4.31 0.02 1 112 . 23 ARG HB2 H 1.76 0.02 2 113 . 23 ARG HB3 H 1.67 0.02 2 114 . 23 ARG HG2 H 1.50 0.02 1 115 . 23 ARG HG3 H 1.50 0.02 1 116 . 24 PHE H H 8.14 0.02 1 117 . 24 PHE HA H 4.58 0.02 1 118 . 24 PHE HB2 H 3.23 0.02 2 119 . 24 PHE HB3 H 3.04 0.02 2 120 . 24 PHE HE1 H 7.33 0.02 1 121 . 24 PHE HE2 H 7.33 0.02 1 122 . 25 GLY H H 8.54 0.02 1 123 . 25 GLY HA2 H 3.97 0.02 1 124 . 25 GLY HA3 H 3.97 0.02 1 125 . 26 GLU H H 8.19 0.02 1 126 . 26 GLU HA H 4.32 0.02 1 127 . 26 GLU HB2 H 2.12 0.02 2 128 . 26 GLU HB3 H 1.98 0.02 2 129 . 26 GLU HG2 H 2.42 0.02 1 130 . 26 GLU HG3 H 2.42 0.02 1 131 . 27 ASN H H 8.42 0.02 1 132 . 27 ASN HA H 4.61 0.02 1 133 . 27 ASN HB2 H 2.79 0.02 1 134 . 27 ASN HB3 H 2.79 0.02 1 135 . 27 ASN HD21 H 7.67 0.02 2 136 . 28 HIS H H 8.40 0.02 1 137 . 28 HIS HA H 4.63 0.02 1 138 . 28 HIS HB2 H 3.31 0.02 2 139 . 28 HIS HB3 H 3.19 0.02 2 140 . 28 HIS HD2 H 7.29 0.02 1 141 . 29 ALA H H 8.33 0.02 1 142 . 29 ALA HA H 4.38 0.02 1 143 . 29 ALA HB H 1.43 0.02 1 144 . 30 ILE H H 8.28 0.02 1 145 . 30 ILE HA H 4.13 0.02 1 146 . 30 ILE HB H 1.96 0.02 1 147 . 31 MET H H 8.41 0.02 1 148 . 31 MET HA H 4.45 0.02 1 149 . 31 MET HB2 H 2.18 0.02 2 150 . 31 MET HB3 H 2.09 0.02 2 151 . 31 MET HG2 H 2.68 0.02 2 152 . 31 MET HG3 H 2.58 0.02 2 153 . 32 GLY H H 8.27 0.02 1 154 . 32 GLY HA2 H 3.98 0.02 1 155 . 32 GLY HA3 H 3.98 0.02 1 156 . 33 VAL H H 7.92 0.02 1 157 . 33 VAL HA H 4.14 0.02 1 158 . 33 VAL HB H 2.20 0.02 1 159 . 33 VAL HG1 H 1.00 0.02 1 160 . 33 VAL HG2 H 1.00 0.02 1 161 . 34 ALA H H 8.21 0.02 1 162 . 34 ALA HA H 4.32 0.02 1 163 . 34 ALA HB H 1.44 0.02 1 stop_ save_