data_15970 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; SOLUTION STRUCTURE OF THE LSM DOMAIN OF DROSOPHILA MELANOGASTER TRAL (TRAILER HITCH) ; _BMRB_accession_number 15970 _BMRB_flat_file_name bmr15970.str _Entry_type original _Submission_date 2008-10-02 _Accession_date 2008-10-02 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Tritschler F. . . 2 Coles M. . . 3 Truffault V. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 450 "13C chemical shifts" 327 "15N chemical shifts" 71 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-03-18 original author . stop_ _Original_release_date 2009-03-18 save_ ############################# # Citation for this entry # ############################# save_citations _Saveframe_category entry_citation _Citation_full . _Citation_title 'Similar Modes of Interaction Enable Trailer Hitch and Edc3 to Associate with Dcp1 and Me31B in Distinct Protein Complexes' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 18765641 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Tritschler F. . . 2 Eulalio A. . . 3 Helms S. . . 4 Weichenrieder O. . . 5 Schmidt S. . . 6 Izaurralde E. . . 7 Truffault V. . . stop_ _Journal_abbreviation 'Mol. Cell. Biol' _Journal_volume 28 _Journal_issue 21 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 6695 _Page_last 6708 _Year 2008 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'TRAL-TRAILER HITCH' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'TRAL-TRAILER HITCH' $TRAL-TRAILER_HITCH stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_TRAL-TRAILER_HITCH _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common TRAL-TRAILER_HITCH _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 88 _Mol_residue_sequence ; GAMAMSGGLPELGSKISLIS KADIRYEGRLYTVDPQECTI ALSSVRSFGTEDRDTQFQIA PQSQIYDYILFRGSDIKDIR VVNNHTLP ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 ALA 3 MET 4 ALA 5 MET 6 SER 7 GLY 8 GLY 9 LEU 10 PRO 11 GLU 12 LEU 13 GLY 14 SER 15 LYS 16 ILE 17 SER 18 LEU 19 ILE 20 SER 21 LYS 22 ALA 23 ASP 24 ILE 25 ARG 26 TYR 27 GLU 28 GLY 29 ARG 30 LEU 31 TYR 32 THR 33 VAL 34 ASP 35 PRO 36 GLN 37 GLU 38 CYS 39 THR 40 ILE 41 ALA 42 LEU 43 SER 44 SER 45 VAL 46 ARG 47 SER 48 PHE 49 GLY 50 THR 51 GLU 52 ASP 53 ARG 54 ASP 55 THR 56 GLN 57 PHE 58 GLN 59 ILE 60 ALA 61 PRO 62 GLN 63 SER 64 GLN 65 ILE 66 TYR 67 ASP 68 TYR 69 ILE 70 LEU 71 PHE 72 ARG 73 GLY 74 SER 75 ASP 76 ILE 77 LYS 78 ASP 79 ILE 80 ARG 81 VAL 82 VAL 83 ASN 84 ASN 85 HIS 86 THR 87 LEU 88 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-30 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 PDB 2VXE "Solution Structure Of The Lsm Domain Of Drosophila Melanogaster Tral (trailer Hitch)" 100.00 88 100.00 100.00 5.55e-57 GB AAF49905 "trailer hitch, isoform A [Drosophila melanogaster]" 95.45 652 100.00 100.00 7.40e-48 GB AAL39211 "GH08269p [Drosophila melanogaster]" 95.45 652 100.00 100.00 7.40e-48 GB AGB94462 "trailer hitch, isoform B [Drosophila melanogaster]" 95.45 652 100.00 100.00 7.40e-48 GB AGB94463 "trailer hitch, isoform C [Drosophila melanogaster]" 95.45 656 100.00 100.00 7.99e-48 GB AGB94464 "trailer hitch, isoform D [Drosophila melanogaster]" 95.45 646 100.00 100.00 8.79e-48 REF NP_001261769 "trailer hitch, isoform B [Drosophila melanogaster]" 95.45 652 100.00 100.00 7.40e-48 REF NP_001261770 "trailer hitch, isoform C [Drosophila melanogaster]" 95.45 656 100.00 100.00 7.99e-48 REF NP_001261771 "trailer hitch, isoform D [Drosophila melanogaster]" 95.45 646 100.00 100.00 8.79e-48 REF NP_001261772 "trailer hitch, isoform E [Drosophila melanogaster]" 95.45 642 100.00 100.00 8.30e-48 REF NP_001261773 "trailer hitch, isoform F [Drosophila melanogaster]" 95.45 653 100.00 100.00 7.81e-48 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Cell_line $TRAL-TRAILER_HITCH 'FRUIT FLY' 7227 Eukaryota Metazoa DROSOPHILA MELANOGASTER 'S2 CELLS - SCHNEIDER CELLS' 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 $TRAL-TRAILER_HITCH 'recombinant technology' . ESCHERICHIA COLI K12 PETM60 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '1X PBS, 1 MM DTT, PH7.2, 10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TRAL-TRAILER_HITCH 0.6 mM [U-15N] DTT 1 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '1X PBS, 1 MM DTT, PH7.2, 10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TRAL-TRAILER_HITCH 0.6 mM '[U-15N; U-13C]' DTT 1 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR _Saveframe_category software _Name X-PLOR _Version 2.9.4 loop_ _Vendor _Address _Electronic_address BRUNGER . . stop_ loop_ _Task refinement stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer BRUKER _Model OTHER _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_HNCACO_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACO _Sample_label $sample_1 save_ save_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label $sample_1 save_ save_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label $sample_1 save_ save_CBCACONH_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label $sample_1 save_ save_HNHA_5 _Saveframe_category NMR_applied_experiment _Experiment_name HNHA _Sample_label $sample_1 save_ save_HNHB_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNHB _Sample_label $sample_1 save_ save_CCH-_COSY_7 _Saveframe_category NMR_applied_experiment _Experiment_name 'CCH- COSY' _Sample_label $sample_1 save_ save_CCH-TOCSY_8 _Saveframe_category NMR_applied_experiment _Experiment_name CCH-TOCSY _Sample_label $sample_1 save_ save_HNH-NOESY_9 _Saveframe_category NMR_applied_experiment _Experiment_name HNH-NOESY _Sample_label $sample_1 save_ save_NNH-NOESY_10 _Saveframe_category NMR_applied_experiment _Experiment_name NNH-NOESY _Sample_label $sample_1 save_ save_CNH-NOESY_11 _Saveframe_category NMR_applied_experiment _Experiment_name CNH-NOESY _Sample_label $sample_1 save_ save_HCH-_NOESY_12 _Saveframe_category NMR_applied_experiment _Experiment_name 'HCH- NOESY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details 15N loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 150 . mM pH 7.2 . pH pressure 1.0 . atm temperature 298.0 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _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 water H 1 protons ppm 4.7 na direct . . . 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $SPARKY stop_ loop_ _Experiment_label HNCACO HNCO HNCACB CBCACONH HNHA HNHB 'CCH- COSY' CCH-TOCSY stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'TRAL-TRAILER HITCH' _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 1 GLY HA2 H 3.75 . . 2 1 1 GLY HA3 H 3.75 . . 3 1 1 GLY CA C 43.62 . . 4 7 7 GLY HA2 H 3.91 . . 5 7 7 GLY HA3 H 3.98 . . 6 7 7 GLY C C 174.22 . . 7 7 7 GLY CA C 45.47 . . 8 8 8 GLY H H 7.97 . . 9 8 8 GLY HA2 H 3.89 . . 10 8 8 GLY HA3 H 3.89 . . 11 8 8 GLY C C 173.47 . . 12 8 8 GLY CA C 44.91 . . 13 8 8 GLY N N 108.37 . . 14 9 9 LEU H H 8.03 . . 15 9 9 LEU HA H 4.48 . . 16 9 9 LEU HB2 H 1.33 . . 17 9 9 LEU HB3 H 1.33 . . 18 9 9 LEU HD1 H 0.84 . . 19 9 9 LEU HG H 1.61 . . 20 9 9 LEU C C 174.96 . . 21 9 9 LEU CA C 52.76 . . 22 9 9 LEU CB C 41.94 . . 23 9 9 LEU CD1 C 23.34 . . 24 9 9 LEU CD2 C 23.34 . . 25 9 9 LEU CG C 26.91 . . 26 9 9 LEU N N 122.21 . . 27 10 10 PRO HA H 4.48 . . 28 10 10 PRO HB2 H 1.82 . . 29 10 10 PRO HB3 H 2.14 . . 30 10 10 PRO HD2 H 3.57 . . 31 10 10 PRO HD3 H 3.72 . . 32 10 10 PRO HG2 H 1.92 . . 33 10 10 PRO HG3 H 1.92 . . 34 10 10 PRO CA C 61.60 . . 35 10 10 PRO CB C 31.93 . . 36 10 10 PRO CD C 50.22 . . 37 10 10 PRO CG C 27.20 . . 38 11 11 GLU H H 8.14 . . 39 11 11 GLU HA H 4.15 . . 40 11 11 GLU HB2 H 1.95 . . 41 11 11 GLU HB3 H 1.83 . . 42 11 11 GLU HG2 H 2.12 . . 43 11 11 GLU HG3 H 2.28 . . 44 11 11 GLU C C 178.19 . . 45 11 11 GLU CA C 55.91 . . 46 11 11 GLU CB C 30.43 . . 47 11 11 GLU CG C 36.24 . . 48 11 11 GLU N N 115.96 . . 49 12 12 LEU H H 8.65 . . 50 12 12 LEU HA H 3.77 . . 51 12 12 LEU HB2 H 1.39 . . 52 12 12 LEU HB3 H 1.70 . . 53 12 12 LEU HD1 H 0.89 . . 54 12 12 LEU HD2 H 0.67 . . 55 12 12 LEU HG H 1.73 . . 56 12 12 LEU C C 177.90 . . 57 12 12 LEU CA C 57.24 . . 58 12 12 LEU CB C 40.91 . . 59 12 12 LEU CD1 C 22.63 . . 60 12 12 LEU CD2 C 25.17 . . 61 12 12 LEU CG C 26.96 . . 62 12 12 LEU N N 123.45 . . 63 13 13 GLY H H 9.24 . . 64 13 13 GLY HA2 H 3.56 . . 65 13 13 GLY HA3 H 4.44 . . 66 13 13 GLY C C 174.38 . . 67 13 13 GLY CA C 44.86 . . 68 13 13 GLY N N 111.31 . . 69 14 14 SER H H 7.80 . . 70 14 14 SER HA H 4.34 . . 71 14 14 SER HB2 H 3.83 . . 72 14 14 SER HB3 H 3.65 . . 73 14 14 SER C C 172.59 . . 74 14 14 SER CA C 60.09 . . 75 14 14 SER CB C 63.89 . . 76 14 14 SER N N 116.28 . . 77 15 15 LYS H H 8.90 . . 78 15 15 LYS HA H 4.53 . . 79 15 15 LYS HB2 H 1.68 . . 80 15 15 LYS HB3 H 1.82 . . 81 15 15 LYS HD2 H 1.59 . . 82 15 15 LYS HD3 H 1.59 . . 83 15 15 LYS HE2 H 2.86 . . 84 15 15 LYS HE3 H 2.86 . . 85 15 15 LYS HG2 H 1.19 . . 86 15 15 LYS HG3 H 1.33 . . 87 15 15 LYS C C 175.06 . . 88 15 15 LYS CA C 56.94 . . 89 15 15 LYS CB C 32.20 . . 90 15 15 LYS CD C 29.29 . . 91 15 15 LYS CE C 42.25 . . 92 15 15 LYS CG C 25.49 . . 93 15 15 LYS N N 125.24 . . 94 16 16 ILE H H 8.97 . . 95 16 16 ILE HA H 4.92 . . 96 16 16 ILE HB H 1.80 . . 97 16 16 ILE HD1 H 0.62 . . 98 16 16 ILE HG12 H 1.35 . . 99 16 16 ILE HG13 H 1.35 . . 100 16 16 ILE HG2 H 1.12 . . 101 16 16 ILE C C 174.38 . . 102 16 16 ILE CA C 57.69 . . 103 16 16 ILE CB C 40.95 . . 104 16 16 ILE CD1 C 12.39 . . 105 16 16 ILE CG1 C 27.00 . . 106 16 16 ILE CG2 C 19.06 . . 107 16 16 ILE N N 123.91 . . 108 17 17 SER H H 8.69 . . 109 17 17 SER HA H 5.50 . . 110 17 17 SER HB2 H 3.55 . . 111 17 17 SER HB3 H 3.41 . . 112 17 17 SER C C 173.60 . . 113 17 17 SER CA C 56.00 . . 114 17 17 SER CB C 64.24 . . 115 17 17 SER N N 117.31 . . 116 18 18 LEU H H 9.40 . . 117 18 18 LEU HA H 5.14 . . 118 18 18 LEU HB2 H 1.31 . . 119 18 18 LEU HB3 H 1.23 . . 120 18 18 LEU HD1 H -0.01 . . 121 18 18 LEU HD2 H 0.01 . . 122 18 18 LEU HG H 1.32 . . 123 18 18 LEU C C 174.39 . . 124 18 18 LEU CA C 53.92 . . 125 18 18 LEU CB C 46.78 . . 126 18 18 LEU CD1 C 24.39 . . 127 18 18 LEU CD2 C 26.28 . . 128 18 18 LEU CG C 26.51 . . 129 18 18 LEU N N 131.52 . . 130 19 19 ILE H H 8.85 . . 131 19 19 ILE HA H 5.13 . . 132 19 19 ILE HB H 1.52 . . 133 19 19 ILE HD1 H 0.71 . . 134 19 19 ILE HG12 H 0.59 . . 135 19 19 ILE HG13 H 0.59 . . 136 19 19 ILE HG2 H 1.75 . . 137 19 19 ILE C C 176.36 . . 138 19 19 ILE CA C 59.75 . . 139 19 19 ILE CB C 39.45 . . 140 19 19 ILE CD1 C 12.92 . . 141 19 19 ILE CG1 C 28.34 . . 142 19 19 ILE CG2 C 17.44 . . 143 19 19 ILE N N 124.33 . . 144 20 20 SER H H 9.38 . . 145 20 20 SER HA H 5.22 . . 146 20 20 SER HB2 H 4.82 . . 147 20 20 SER HB3 H 4.02 . . 148 20 20 SER C C 176.18 . . 149 20 20 SER CA C 56.97 . . 150 20 20 SER CB C 67.03 . . 151 20 20 SER N N 125.37 . . 152 21 21 LYS H H 8.44 . . 153 21 21 LYS HA H 3.96 . . 154 21 21 LYS HB2 H 1.94 . . 155 21 21 LYS HB3 H 1.94 . . 156 21 21 LYS HD2 H 1.69 . . 157 21 21 LYS HD3 H 1.76 . . 158 21 21 LYS HE2 H 2.88 . . 159 21 21 LYS HE3 H 2.96 . . 160 21 21 LYS HG2 H 1.28 . . 161 21 21 LYS HG3 H 1.48 . . 162 21 21 LYS C C 176.17 . . 163 21 21 LYS CA C 58.94 . . 164 21 21 LYS CB C 31.92 . . 165 21 21 LYS CD C 29.27 . . 166 21 21 LYS CE C 42.30 . . 167 21 21 LYS CG C 26.21 . . 168 21 21 LYS N N 119.39 . . 169 22 22 ALA H H 7.68 . . 170 22 22 ALA HA H 4.47 . . 171 22 22 ALA HB H 1.36 . . 172 22 22 ALA C C 175.01 . . 173 22 22 ALA CA C 51.86 . . 174 22 22 ALA CB C 18.63 . . 175 22 22 ALA N N 121.33 . . 176 23 23 ASP H H 8.33 . . 177 23 23 ASP HA H 4.29 . . 178 23 23 ASP HB2 H 2.66 . . 179 23 23 ASP HB3 H 2.97 . . 180 23 23 ASP C C 175.08 . . 181 23 23 ASP CA C 56.59 . . 182 23 23 ASP CB C 38.31 . . 183 23 23 ASP N N 111.79 . . 184 24 24 ILE H H 6.88 . . 185 24 24 ILE HA H 3.73 . . 186 24 24 ILE HB H 1.54 . . 187 24 24 ILE HD1 H 0.80 . . 188 24 24 ILE HG12 H 0.46 . . 189 24 24 ILE HG13 H 0.46 . . 190 24 24 ILE HG2 H 1.48 . . 191 24 24 ILE C C 173.78 . . 192 24 24 ILE CA C 60.30 . . 193 24 24 ILE CB C 38.49 . . 194 24 24 ILE CD1 C 13.43 . . 195 24 24 ILE CG1 C 28.96 . . 196 24 24 ILE CG2 C 18.22 . . 197 24 24 ILE N N 119.71 . . 198 25 25 ARG H H 7.51 . . 199 25 25 ARG HA H 5.58 . . 200 25 25 ARG HB2 H 1.78 . . 201 25 25 ARG HB3 H 1.35 . . 202 25 25 ARG HD2 H 2.55 . . 203 25 25 ARG HD3 H 2.55 . . 204 25 25 ARG HG2 H 1.30 . . 205 25 25 ARG HG3 H 1.30 . . 206 25 25 ARG C C 173.35 . . 207 25 25 ARG CA C 53.89 . . 208 25 25 ARG CB C 35.24 . . 209 25 25 ARG CD C 43.31 . . 210 25 25 ARG CG C 28.69 . . 211 25 25 ARG N N 126.85 . . 212 26 26 TYR H H 9.60 . . 213 26 26 TYR HA H 5.78 . . 214 26 26 TYR HB2 H 2.72 . . 215 26 26 TYR HB3 H 2.48 . . 216 26 26 TYR HD1 H 6.90 . . 217 26 26 TYR HD2 H 6.90 . . 218 26 26 TYR HE1 H 6.62 . . 219 26 26 TYR HE2 H 6.62 . . 220 26 26 TYR C C 175.85 . . 221 26 26 TYR CA C 55.97 . . 222 26 26 TYR CB C 41.72 . . 223 26 26 TYR N N 125.10 . . 224 27 27 GLU H H 9.00 . . 225 27 27 GLU HA H 5.88 . . 226 27 27 GLU HB2 H 2.08 . . 227 27 27 GLU HB3 H 2.08 . . 228 27 27 GLU HG2 H 2.18 . . 229 27 27 GLU HG3 H 2.32 . . 230 27 27 GLU C C 176.49 . . 231 27 27 GLU CA C 54.26 . . 232 27 27 GLU CB C 34.42 . . 233 27 27 GLU CG C 37.05 . . 234 27 27 GLU N N 118.16 . . 235 28 28 GLY H H 8.57 . . 236 28 28 GLY HA2 H 4.66 . . 237 28 28 GLY HA3 H 3.75 . . 238 28 28 GLY C C 170.61 . . 239 28 28 GLY CA C 45.88 . . 240 28 28 GLY N N 108.99 . . 241 29 29 ARG H H 8.94 . . 242 29 29 ARG HA H 5.01 . . 243 29 29 ARG HB2 H 1.53 . . 244 29 29 ARG HB3 H 1.83 . . 245 29 29 ARG HD2 H 3.11 . . 246 29 29 ARG HD3 H 3.11 . . 247 29 29 ARG HG2 H 1.40 . . 248 29 29 ARG HG3 H 1.67 . . 249 29 29 ARG C C 176.93 . . 250 29 29 ARG CA C 54.37 . . 251 29 29 ARG CB C 31.34 . . 252 29 29 ARG CD C 43.34 . . 253 29 29 ARG CG C 27.76 . . 254 29 29 ARG N N 120.18 . . 255 30 30 LEU H H 9.00 . . 256 30 30 LEU HA H 4.22 . . 257 30 30 LEU HB2 H 2.00 . . 258 30 30 LEU HB3 H 1.22 . . 259 30 30 LEU HD1 H 0.81 . . 260 30 30 LEU HD2 H 0.66 . . 261 30 30 LEU HG H 1.38 . . 262 30 30 LEU C C 175.50 . . 263 30 30 LEU CA C 56.89 . . 264 30 30 LEU CB C 41.64 . . 265 30 30 LEU CD1 C 26.74 . . 266 30 30 LEU CD2 C 24.28 . . 267 30 30 LEU CG C 26.92 . . 268 30 30 LEU N N 124.31 . . 269 31 31 TYR H H 9.32 . . 270 31 31 TYR HA H 4.84 . . 271 31 31 TYR HB2 H 2.71 . . 272 31 31 TYR HB3 H 3.11 . . 273 31 31 TYR HD1 H 7.14 . . 274 31 31 TYR HD2 H 7.14 . . 275 31 31 TYR HE1 H 6.77 . . 276 31 31 TYR HE2 H 6.77 . . 277 31 31 TYR C C 174.52 . . 278 31 31 TYR CA C 59.70 . . 279 31 31 TYR CB C 40.80 . . 280 31 31 TYR N N 133.61 . . 281 32 32 THR H H 7.62 . . 282 32 32 THR HA H 4.47 . . 283 32 32 THR HB H 3.91 . . 284 32 32 THR HG2 H 0.83 . . 285 32 32 THR C C 172.37 . . 286 32 32 THR CA C 61.15 . . 287 32 32 THR CB C 72.12 . . 288 32 32 THR CG2 C 21.58 . . 289 32 32 THR N N 108.34 . . 290 33 33 VAL H H 8.30 . . 291 33 33 VAL HA H 4.49 . . 292 33 33 VAL HB H 1.89 . . 293 33 33 VAL HG1 H 0.87 . . 294 33 33 VAL HG2 H 0.82 . . 295 33 33 VAL C C 174.02 . . 296 33 33 VAL CA C 61.41 . . 297 33 33 VAL CB C 35.15 . . 298 33 33 VAL CG1 C 20.86 . . 299 33 33 VAL CG2 C 21.50 . . 300 33 33 VAL N N 120.44 . . 301 34 34 ASP H H 8.47 . . 302 34 34 ASP HA H 5.23 . . 303 34 34 ASP HB2 H 2.33 . . 304 34 34 ASP HB3 H 3.21 . . 305 34 34 ASP CA C 50.14 . . 306 34 34 ASP CB C 42.07 . . 307 34 34 ASP N N 125.33 . . 308 35 35 PRO HA H 4.16 . . 309 35 35 PRO HD2 H 3.73 . . 310 35 35 PRO HD3 H 3.98 . . 311 35 35 PRO CA C 63.88 . . 312 35 35 PRO CB C 32.35 . . 313 35 35 PRO CD C 50.99 . . 314 35 35 PRO CG C 27.41 . . 315 36 36 GLN H H 8.13 . . 316 36 36 GLN HA H 4.23 . . 317 36 36 GLN HB2 H 2.18 . . 318 36 36 GLN HB3 H 2.18 . . 319 36 36 GLN HE21 H 6.79 . . 320 36 36 GLN HE22 H 7.58 . . 321 36 36 GLN HG2 H 2.34 . . 322 36 36 GLN HG3 H 2.34 . . 323 36 36 GLN C C 177.30 . . 324 36 36 GLN CA C 58.23 . . 325 36 36 GLN CB C 28.69 . . 326 36 36 GLN CG C 34.47 . . 327 36 36 GLN N N 118.16 . . 328 37 37 GLU H H 7.55 . . 329 37 37 GLU HA H 4.11 . . 330 37 37 GLU HB2 H 1.61 . . 331 37 37 GLU HB3 H 2.07 . . 332 37 37 GLU HG2 H 2.13 . . 333 37 37 GLU HG3 H 2.28 . . 334 37 37 GLU C C 175.90 . . 335 37 37 GLU CA C 55.73 . . 336 37 37 GLU CB C 29.94 . . 337 37 37 GLU CG C 36.42 . . 338 37 37 GLU N N 116.92 . . 339 38 38 CYS H H 8.01 . . 340 38 38 CYS HA H 4.01 . . 341 38 38 CYS HB2 H 3.07 . . 342 38 38 CYS HB3 H 3.10 . . 343 38 38 CYS C C 173.75 . . 344 38 38 CYS CA C 60.13 . . 345 38 38 CYS CB C 24.77 . . 346 38 38 CYS N N 116.24 . . 347 39 39 THR H H 7.85 . . 348 39 39 THR HA H 5.08 . . 349 39 39 THR HB H 4.00 . . 350 39 39 THR HG2 H 1.03 . . 351 39 39 THR C C 173.56 . . 352 39 39 THR CA C 59.44 . . 353 39 39 THR CB C 71.88 . . 354 39 39 THR CG2 C 21.93 . . 355 39 39 THR N N 109.79 . . 356 40 40 ILE H H 8.77 . . 357 40 40 ILE HA H 4.77 . . 358 40 40 ILE HB H 1.66 . . 359 40 40 ILE HD1 H 0.57 . . 360 40 40 ILE HG12 H 0.87 . . 361 40 40 ILE HG13 H 0.87 . . 362 40 40 ILE HG2 H 1.40 . . 363 40 40 ILE C C 173.47 . . 364 40 40 ILE CA C 59.63 . . 365 40 40 ILE CB C 41.89 . . 366 40 40 ILE CD1 C 14.12 . . 367 40 40 ILE CG1 C 27.18 . . 368 40 40 ILE CG2 C 17.88 . . 369 40 40 ILE N N 118.25 . . 370 41 41 ALA H H 8.87 . . 371 41 41 ALA HA H 5.55 . . 372 41 41 ALA HB H 1.32 . . 373 41 41 ALA C C 176.06 . . 374 41 41 ALA CA C 50.18 . . 375 41 41 ALA CB C 21.95 . . 376 41 41 ALA N N 125.67 . . 377 42 42 LEU H H 8.69 . . 378 42 42 LEU HA H 5.49 . . 379 42 42 LEU HB2 H 1.24 . . 380 42 42 LEU HB3 H 1.63 . . 381 42 42 LEU HD1 H 0.59 . . 382 42 42 LEU HD2 H 0.63 . . 383 42 42 LEU HG H 1.57 . . 384 42 42 LEU C C 174.49 . . 385 42 42 LEU CA C 52.39 . . 386 42 42 LEU CB C 46.19 . . 387 42 42 LEU CD1 C 24.94 . . 388 42 42 LEU CD2 C 23.71 . . 389 42 42 LEU CG C 27.94 . . 390 42 42 LEU N N 121.29 . . 391 43 43 SER H H 9.53 . . 392 43 43 SER HA H 5.20 . . 393 43 43 SER HB2 H 3.38 . . 394 43 43 SER HB3 H 3.83 . . 395 43 43 SER C C 174.71 . . 396 43 43 SER CA C 55.45 . . 397 43 43 SER CB C 66.98 . . 398 43 43 SER N N 114.55 . . 399 44 44 SER H H 7.90 . . 400 44 44 SER HA H 3.78 . . 401 44 44 SER HB2 H 3.97 . . 402 44 44 SER HB3 H 3.84 . . 403 44 44 SER C C 173.68 . . 404 44 44 SER CA C 59.12 . . 405 44 44 SER CB C 61.71 . . 406 44 44 SER N N 116.79 . . 407 45 45 VAL H H 8.98 . . 408 45 45 VAL HA H 4.81 . . 409 45 45 VAL HB H 2.04 . . 410 45 45 VAL HG1 H 0.73 . . 411 45 45 VAL HG2 H 1.05 . . 412 45 45 VAL C C 175.30 . . 413 45 45 VAL CA C 60.79 . . 414 45 45 VAL CB C 34.53 . . 415 45 45 VAL CG1 C 23.98 . . 416 45 45 VAL CG2 C 24.47 . . 417 45 45 VAL N N 120.21 . . 418 46 46 ARG H H 9.06 . . 419 46 46 ARG HA H 4.99 . . 420 46 46 ARG HB2 H 1.56 . . 421 46 46 ARG HB3 H 1.56 . . 422 46 46 ARG HD2 H 3.08 . . 423 46 46 ARG HG2 H 1.07 . . 424 46 46 ARG HG3 H 1.47 . . 425 46 46 ARG C C 175.38 . . 426 46 46 ARG CA C 53.95 . . 427 46 46 ARG CB C 33.84 . . 428 46 46 ARG CD C 43.45 . . 429 46 46 ARG CG C 27.16 . . 430 46 46 ARG N N 125.84 . . 431 47 47 SER H H 9.70 . . 432 47 47 SER HA H 4.86 . . 433 47 47 SER HB2 H 3.79 . . 434 47 47 SER HB3 H 3.58 . . 435 47 47 SER C C 175.72 . . 436 47 47 SER CA C 55.88 . . 437 47 47 SER CB C 64.62 . . 438 47 47 SER N N 117.51 . . 439 48 48 PHE H H 9.37 . . 440 48 48 PHE HA H 4.31 . . 441 48 48 PHE HB2 H 3.30 . . 442 48 48 PHE HB3 H 2.47 . . 443 48 48 PHE HE1 H 7.15 . . 444 48 48 PHE HE2 H 7.15 . . 445 48 48 PHE C C 175.21 . . 446 48 48 PHE CA C 58.67 . . 447 48 48 PHE CB C 39.67 . . 448 48 48 PHE N N 125.15 . . 449 49 49 GLY H H 7.58 . . 450 49 49 GLY HA2 H 4.14 . . 451 49 49 GLY HA3 H 3.30 . . 452 49 49 GLY C C 174.01 . . 453 49 49 GLY CA C 45.33 . . 454 49 49 GLY N N 106.39 . . 455 50 50 THR H H 8.65 . . 456 50 50 THR HA H 4.74 . . 457 50 50 THR HB H 4.41 . . 458 50 50 THR HG2 H 1.24 . . 459 50 50 THR C C 174.26 . . 460 50 50 THR CA C 62.95 . . 461 50 50 THR CB C 69.48 . . 462 50 50 THR CG2 C 22.71 . . 463 50 50 THR N N 111.94 . . 464 51 51 GLU H H 9.03 . . 465 51 51 GLU HA H 3.76 . . 466 51 51 GLU HB2 H 2.01 . . 467 51 51 GLU HB3 H 2.13 . . 468 51 51 GLU HG2 H 2.11 . . 469 51 51 GLU HG3 H 2.20 . . 470 51 51 GLU C C 175.61 . . 471 51 51 GLU CA C 57.66 . . 472 51 51 GLU CB C 28.27 . . 473 51 51 GLU CG C 38.69 . . 474 51 51 GLU N N 118.33 . . 475 52 52 ASP H H 8.55 . . 476 52 52 ASP HA H 4.68 . . 477 52 52 ASP HB2 H 2.59 . . 478 52 52 ASP HB3 H 2.84 . . 479 52 52 ASP C C 176.76 . . 480 52 52 ASP CA C 57.42 . . 481 52 52 ASP CB C 39.62 . . 482 52 52 ASP N N 121.88 . . 483 53 53 ARG H H 8.27 . . 484 53 53 ARG HA H 4.06 . . 485 53 53 ARG HB2 H 1.57 . . 486 53 53 ARG HB3 H 2.21 . . 487 53 53 ARG HD2 H 2.88 . . 488 53 53 ARG HG2 H 1.71 . . 489 53 53 ARG C C 176.25 . . 490 53 53 ARG CA C 57.48 . . 491 53 53 ARG CB C 29.69 . . 492 53 53 ARG CD C 41.85 . . 493 53 53 ARG CG C 28.7 . . 494 53 53 ARG N N 121.36 . . 495 54 54 ASP H H 8.27 . . 496 54 54 ASP HA H 4.55 . . 497 54 54 ASP HB2 H 2.49 . . 498 54 54 ASP HB3 H 2.65 . . 499 54 54 ASP C C 175.51 . . 500 54 54 ASP CA C 54.20 . . 501 54 54 ASP CB C 40.50 . . 502 54 54 ASP N N 121.73 . . 503 55 55 THR H H 7.79 . . 504 55 55 THR HA H 4.45 . . 505 55 55 THR HB H 4.12 . . 506 55 55 THR HG2 H 1.01 . . 507 55 55 THR C C 173.60 . . 508 55 55 THR CA C 60.42 . . 509 55 55 THR CB C 68.92 . . 510 55 55 THR CG2 C 20.19 . . 511 55 55 THR N N 117.80 . . 512 56 56 GLN H H 8.38 . . 513 56 56 GLN HA H 3.96 . . 514 56 56 GLN HB2 H 1.77 . . 515 56 56 GLN HB3 H 1.67 . . 516 56 56 GLN HE21 H 6.73 . . 517 56 56 GLN HE22 H 7.34 . . 518 56 56 GLN HG2 H 1.76 . . 519 56 56 GLN HG3 H 2.00 . . 520 56 56 GLN C C 175.80 . . 521 56 56 GLN CA C 57.94 . . 522 56 56 GLN CB C 28.97 . . 523 56 56 GLN CG C 33.58 . . 524 56 56 GLN N N 123.30 . . 525 57 57 PHE H H 8.11 . . 526 57 57 PHE HA H 4.72 . . 527 57 57 PHE HB2 H 3.02 . . 528 57 57 PHE HB3 H 2.79 . . 529 57 57 PHE HE1 H 7.27 . . 530 57 57 PHE HE2 H 7.27 . . 531 57 57 PHE C C 174.28 . . 532 57 57 PHE CA C 56.14 . . 533 57 57 PHE CB C 39.62 . . 534 57 57 PHE N N 118.73 . . 535 58 58 GLN H H 8.32 . . 536 58 58 GLN HA H 4.26 . . 537 58 58 GLN HB2 H 1.88 . . 538 58 58 GLN HB3 H 1.88 . . 539 58 58 GLN HE21 H 6.79 . . 540 58 58 GLN HE22 H 7.45 . . 541 58 58 GLN HG2 H 2.19 . . 542 58 58 GLN HG3 H 2.28 . . 543 58 58 GLN C C 175.74 . . 544 58 58 GLN CA C 56.32 . . 545 58 58 GLN CB C 29.29 . . 546 58 58 GLN CG C 34.15 . . 547 58 58 GLN N N 123.11 . . 548 59 59 ILE H H 8.52 . . 549 59 59 ILE HA H 4.29 . . 550 59 59 ILE HB H 1.66 . . 551 59 59 ILE HD1 H 0.77 . . 552 59 59 ILE HG12 H 1.29 . . 553 59 59 ILE HG13 H 1.29 . . 554 59 59 ILE HG2 H 1.41 . . 555 59 59 ILE C C 175.59 . . 556 59 59 ILE CA C 59.58 . . 557 59 59 ILE CB C 40.21 . . 558 59 59 ILE CD1 C 11.57 . . 559 59 59 ILE CG1 C 26.79 . . 560 59 59 ILE CG2 C 17.03 . . 561 59 59 ILE N N 125.18 . . 562 60 60 ALA H H 8.67 . . 563 60 60 ALA HA H 4.58 . . 564 60 60 ALA HB H 1.38 . . 565 60 60 ALA C C 178.76 . . 566 60 60 ALA CA C 51.26 . . 567 60 60 ALA CB C 17.63 . . 568 60 60 ALA N N 132.41 . . 569 61 61 PRO HA H 3.99 . . 570 61 61 PRO HB2 H 1.83 . . 571 61 61 PRO HB3 H 2.22 . . 572 61 61 PRO HD2 H 3.84 . . 573 61 61 PRO HD3 H 3.60 . . 574 61 61 PRO HG2 H 2.02 . . 575 61 61 PRO HG3 H 2.09 . . 576 61 61 PRO CA C 62.95 . . 577 61 61 PRO CB C 32.34 . . 578 61 61 PRO CD C 50.22 . . 579 61 61 PRO CG C 27.61 . . 580 62 62 GLN H H 7.58 . . 581 62 62 GLN HA H 4.67 . . 582 62 62 GLN HB2 H 2.21 . . 583 62 62 GLN HB3 H 2.29 . . 584 62 62 GLN HE21 H 6.82 . . 585 62 62 GLN HE22 H 7.50 . . 586 62 62 GLN HG2 H 2.41 . . 587 62 62 GLN HG3 H 2.46 . . 588 62 62 GLN C C 177.20 . . 589 62 62 GLN CA C 54.35 . . 590 62 62 GLN CB C 31.39 . . 591 62 62 GLN CG C 33.86 . . 592 62 62 GLN N N 118.80 . . 593 63 63 SER HA H 4.22 . . 594 63 63 SER HB2 H 3.76 . . 595 63 63 SER HB3 H 3.76 . . 596 63 63 SER C C 174.54 . . 597 63 63 SER CA C 59.39 . . 598 63 63 SER CB C 63.78 . . 599 64 64 GLN H H 7.74 . . 600 64 64 GLN HA H 4.00 . . 601 64 64 GLN HB2 H 1.61 . . 602 64 64 GLN HB3 H 1.79 . . 603 64 64 GLN HE21 H 6.73 . . 604 64 64 GLN HE22 H 7.14 . . 605 64 64 GLN HG2 H 1.82 . . 606 64 64 GLN HG3 H 1.88 . . 607 64 64 GLN C C 173.75 . . 608 64 64 GLN CA C 55.89 . . 609 64 64 GLN CB C 29.27 . . 610 64 64 GLN CG C 33.05 . . 611 64 64 GLN N N 121.73 . . 612 65 65 ILE H H 8.06 . . 613 65 65 ILE HA H 4.35 . . 614 65 65 ILE HB H 1.61 . . 615 65 65 ILE HD1 H 0.68 . . 616 65 65 ILE HG12 H 1.36 . . 617 65 65 ILE HG13 H 1.36 . . 618 65 65 ILE HG2 H 1.02 . . 619 65 65 ILE C C 176.96 . . 620 65 65 ILE CA C 59.30 . . 621 65 65 ILE CB C 38.13 . . 622 65 65 ILE CD1 C 12.16 . . 623 65 65 ILE CG1 C 27.33 . . 624 65 65 ILE CG2 C 17.28 . . 625 65 65 ILE N N 123.29 . . 626 66 66 TYR H H 9.42 . . 627 66 66 TYR HA H 4.54 . . 628 66 66 TYR HB2 H 2.83 . . 629 66 66 TYR HB3 H 2.66 . . 630 66 66 TYR HD1 H 7.14 . . 631 66 66 TYR HD2 H 7.14 . . 632 66 66 TYR HE1 H 6.75 . . 633 66 66 TYR HE2 H 6.75 . . 634 66 66 TYR C C 176.44 . . 635 66 66 TYR CA C 57.12 . . 636 66 66 TYR CB C 39.05 . . 637 66 66 TYR N N 128.35 . . 638 67 67 ASP H H 8.92 . . 639 67 67 ASP HA H 4.18 . . 640 67 67 ASP HB2 H 2.59 . . 641 67 67 ASP HB3 H 2.59 . . 642 67 67 ASP C C 177.29 . . 643 67 67 ASP CA C 57.95 . . 644 67 67 ASP CB C 40.00 . . 645 67 67 ASP N N 124.76 . . 646 68 68 TYR H H 7.74 . . 647 68 68 TYR HA H 5.21 . . 648 68 68 TYR HB2 H 2.63 . . 649 68 68 TYR HB3 H 2.63 . . 650 68 68 TYR HD1 H 6.63 . . 651 68 68 TYR HD2 H 6.63 . . 652 68 68 TYR HE1 H 6.38 . . 653 68 68 TYR HE2 H 6.38 . . 654 68 68 TYR C C 174.62 . . 655 68 68 TYR CA C 57.48 . . 656 68 68 TYR CB C 41.99 . . 657 68 68 TYR N N 117.02 . . 658 69 69 ILE H H 8.28 . . 659 69 69 ILE HA H 3.72 . . 660 69 69 ILE HB H 1.04 . . 661 69 69 ILE HD1 H 0.20 . . 662 69 69 ILE HG12 H 1.01 . . 663 69 69 ILE HG13 H 1.01 . . 664 69 69 ILE HG2 H 0.60 . . 665 69 69 ILE C C 172.32 . . 666 69 69 ILE CA C 61.72 . . 667 69 69 ILE CB C 41.84 . . 668 69 69 ILE CD1 C 13.30 . . 669 69 69 ILE CG1 C 27.40 . . 670 69 69 ILE CG2 C 17.23 . . 671 69 69 ILE N N 123.51 . . 672 70 70 LEU H H 7.91 . . 673 70 70 LEU HA H 4.51 . . 674 70 70 LEU HB2 H 1.33 . . 675 70 70 LEU HB3 H 1.51 . . 676 70 70 LEU HD1 H 0.79 . . 677 70 70 LEU HD2 H 0.74 . . 678 70 70 LEU HG H 1.29 . . 679 70 70 LEU C C 175.22 . . 680 70 70 LEU CA C 53.99 . . 681 70 70 LEU CB C 43.84 . . 682 70 70 LEU CD1 C 25.29 . . 683 70 70 LEU CD2 C 24.40 . . 684 70 70 LEU CG C 27.51 . . 685 70 70 LEU N N 128.13 . . 686 71 71 PHE H H 9.39 . . 687 71 71 PHE HA H 4.59 . . 688 71 71 PHE HB2 H 2.64 . . 689 71 71 PHE HB3 H 2.64 . . 690 71 71 PHE HE1 H 6.45 . . 691 71 71 PHE HE2 H 6.45 . . 692 71 71 PHE HZ H 5.45 . . 693 71 71 PHE C C 175.20 . . 694 71 71 PHE CA C 57.06 . . 695 71 71 PHE CB C 41.41 . . 696 71 71 PHE N N 124.63 . . 697 72 72 ARG H H 8.96 . . 698 72 72 ARG HA H 4.60 . . 699 72 72 ARG HB2 H 1.68 . . 700 72 72 ARG HB3 H 1.95 . . 701 72 72 ARG HD2 H 3.10 . . 702 72 72 ARG HD3 H 3.10 . . 703 72 72 ARG HG2 H 1.58 . . 704 72 72 ARG HG3 H 1.68 . . 705 72 72 ARG C C 178.68 . . 706 72 72 ARG CA C 55.48 . . 707 72 72 ARG CB C 30.63 . . 708 72 72 ARG CD C 43.29 . . 709 72 72 ARG CG C 27.56 . . 710 72 72 ARG N N 121.68 . . 711 73 73 GLY H H 8.88 . . 712 73 73 GLY HA2 H 3.60 . . 713 73 73 GLY HA3 H 3.98 . . 714 73 73 GLY C C 176.14 . . 715 73 73 GLY CA C 48.19 . . 716 73 73 GLY N N 111.54 . . 717 74 74 SER HA H 4.20 . . 718 74 74 SER HB2 H 3.81 . . 719 74 74 SER HB3 H 4.00 . . 720 74 74 SER C C 174.70 . . 721 74 74 SER CA C 59.67 . . 722 74 74 SER CB C 62.84 . . 723 75 75 ASP H H 8.04 . . 724 75 75 ASP HA H 4.92 . . 725 75 75 ASP HB2 H 2.88 . . 726 75 75 ASP HB3 H 3.16 . . 727 75 75 ASP C C 175.42 . . 728 75 75 ASP CA C 54.94 . . 729 75 75 ASP CB C 42.76 . . 730 75 75 ASP N N 120.42 . . 731 76 76 ILE H H 7.32 . . 732 76 76 ILE HA H 3.87 . . 733 76 76 ILE HB H 1.82 . . 734 76 76 ILE HD1 H 0.59 . . 735 76 76 ILE HG2 H 1.80 . . 736 76 76 ILE C C 174.89 . . 737 76 76 ILE CA C 62.51 . . 738 76 76 ILE CB C 39.69 . . 739 76 76 ILE CD1 C 14.00 . . 740 76 76 ILE CG1 C 27.02 . . 741 76 76 ILE CG2 C 17.93 . . 742 76 76 ILE N N 119.40 . . 743 77 77 LYS H H 9.06 . . 744 77 77 LYS HA H 4.38 . . 745 77 77 LYS HB2 H 1.56 . . 746 77 77 LYS HB3 H 1.31 . . 747 77 77 LYS HD2 H 1.63 . . 748 77 77 LYS HD3 H 1.63 . . 749 77 77 LYS HE2 H 2.88 . . 750 77 77 LYS HE3 H 2.88 . . 751 77 77 LYS HG2 H 1.23 . . 752 77 77 LYS HG3 H 1.23 . . 753 77 77 LYS C C 175.41 . . 754 77 77 LYS CA C 57.53 . . 755 77 77 LYS CB C 34.56 . . 756 77 77 LYS CD C 30.31 . . 757 77 77 LYS CE C 41.85 . . 758 77 77 LYS CG C 25.45 . . 759 77 77 LYS N N 127.27 . . 760 78 78 ASP H H 7.81 . . 761 78 78 ASP HA H 4.78 . . 762 78 78 ASP HB2 H 2.31 . . 763 78 78 ASP HB3 H 2.51 . . 764 78 78 ASP C C 173.52 . . 765 78 78 ASP CA C 54.34 . . 766 78 78 ASP CB C 45.67 . . 767 78 78 ASP N N 118.00 . . 768 79 79 ILE H H 8.18 . . 769 79 79 ILE HA H 4.80 . . 770 79 79 ILE HB H 1.55 . . 771 79 79 ILE HD1 H 0.66 . . 772 79 79 ILE HG12 H 0.75 . . 773 79 79 ILE HG13 H 0.75 . . 774 79 79 ILE HG2 H 1.42 . . 775 79 79 ILE C C 173.17 . . 776 79 79 ILE CA C 60.61 . . 777 79 79 ILE CB C 41.13 . . 778 79 79 ILE CD1 C 14.45 . . 779 79 79 ILE CG1 C 28.77 . . 780 79 79 ILE CG2 C 16.07 . . 781 79 79 ILE N N 122.64 . . 782 80 80 ARG H H 8.79 . . 783 80 80 ARG HA H 4.74 . . 784 80 80 ARG HB2 H 1.84 . . 785 80 80 ARG HB3 H 1.63 . . 786 80 80 ARG HD2 H 3.10 . . 787 80 80 ARG HG2 H 1.41 . . 788 80 80 ARG HG3 H 1.50 . . 789 80 80 ARG C C 174.31 . . 790 80 80 ARG CA C 54.15 . . 791 80 80 ARG CB C 33.24 . . 792 80 80 ARG CD C 43.31 . . 793 80 80 ARG CG C 26.48 . . 794 80 80 ARG N N 124.73 . . 795 81 81 VAL H H 8.55 . . 796 81 81 VAL HA H 4.32 . . 797 81 81 VAL HB H 1.93 . . 798 81 81 VAL HG1 H 0.92 . . 799 81 81 VAL HG2 H 0.92 . . 800 81 81 VAL C C 176.09 . . 801 81 81 VAL CA C 62.30 . . 802 81 81 VAL CB C 32.48 . . 803 81 81 VAL CG1 C 21.41 . . 804 81 81 VAL CG2 C 21.41 . . 805 81 81 VAL N N 122.39 . . 806 82 82 VAL H H 8.30 . . 807 82 82 VAL HA H 4.03 . . 808 82 82 VAL HB H 1.75 . . 809 82 82 VAL HG1 H 0.70 . . 810 82 82 VAL HG2 H 0.70 . . 811 82 82 VAL C C 175.23 . . 812 82 82 VAL CA C 62.18 . . 813 82 82 VAL CB C 32.44 . . 814 82 82 VAL CG1 C 20.66 . . 815 82 82 VAL N N 126.43 . . 816 84 84 ASN HA H 4.64 . . 817 84 84 ASN HB2 H 2.66 . . 818 84 84 ASN CA C 53.13 . . 819 84 84 ASN CB C 39.00 . . 820 86 86 THR HA H 4.22 . . 821 86 86 THR HB H 4.07 . . 822 86 86 THR HG2 H 1.09 . . 823 86 86 THR C C 173.88 . . 824 86 86 THR CA C 62.04 . . 825 86 86 THR CB C 69.78 . . 826 86 86 THR CG2 C 21.55 . . 827 87 87 LEU H H 8.17 . . 828 87 87 LEU HA H 4.56 . . 829 87 87 LEU HB2 H 1.55 . . 830 87 87 LEU HB3 H 1.55 . . 831 87 87 LEU C C 174.28 . . 832 87 87 LEU CA C 52.84 . . 833 87 87 LEU CB C 41.52 . . 834 87 87 LEU CD1 C 25.2 . . 835 87 87 LEU CD2 C 23.4 . . 836 87 87 LEU CG C 27.23 . . 837 87 87 LEU N N 126.86 . . 838 88 88 PRO HA H 4.25 . . 839 88 88 PRO HB2 H 2.03 . . 840 88 88 PRO HB3 H 2.24 . . 841 88 88 PRO HD2 H 3.37 . . 842 88 88 PRO HD3 H 3.52 . . 843 88 88 PRO HG2 H 1.80 . . 844 88 88 PRO HG3 H 1.82 . . 845 88 88 PRO CA C 64.63 . . 846 88 88 PRO CB C 34.27 . . 847 88 88 PRO CD C 50.00 . . 848 88 88 PRO CG C 24.95 . . stop_ save_