data_6278 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for yeast Sed5p ; _BMRB_accession_number 6278 _BMRB_flat_file_name bmr6278.str _Entry_type original _Submission_date 2004-07-28 _Accession_date 2004-07-28 _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 Chen Xiaocheng . . 2 Rizo Josep . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 113 "13C chemical shifts" 341 "15N chemical shifts" 113 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2004-09-28 original author . stop_ _Original_release_date 2004-09-28 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Sly1 Binds to Golgi and ER Syntaxins via a Conserved N-Terminal Peptide Motif' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 11879635 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Yamaguchi Tomohiro . . 2 Dulubova Irina . . 3 Min Sang-Won . . 4 Chen Xiaocheng . . 5 Rizo Josep . . 6 Sudhof Thomas C. . stop_ _Journal_abbreviation 'Dev. Cell' _Journal_volume 2 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 295 _Page_last 305 _Year 2002 _Details . save_ ################################## # Molecular system description # ################################## save_system_Sed5p _Saveframe_category molecular_system _Mol_system_name 'yeast Sed5p' _Abbreviation_common Sed5p _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Yeast Sed5p' $Sed5p stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state monomer _System_paramagnetic no _System_thiol_state 'not present' _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Sed5p _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Sed5p _Abbreviation_common Sed5p _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 127 _Mol_residue_sequence ; KSVSEFQKKASGIAHEISST AQLLSKLAVLAKRKPMFNDN PVEIAELSFLIKRKIYAIEQ SLVQLSQLKKTDVNGNTSNQ SSKQPSAVQHSKNVVNLLNT QMKNISGSFKDVLEERQRLE MANKDRW ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 49 LYS 2 50 SER 3 51 VAL 4 52 SER 5 53 GLU 6 54 PHE 7 55 GLN 8 56 LYS 9 57 LYS 10 58 ALA 11 59 SER 12 60 GLY 13 61 ILE 14 62 ALA 15 63 HIS 16 64 GLU 17 65 ILE 18 66 SER 19 67 SER 20 68 THR 21 69 ALA 22 70 GLN 23 71 LEU 24 72 LEU 25 73 SER 26 74 LYS 27 75 LEU 28 76 ALA 29 77 VAL 30 78 LEU 31 79 ALA 32 80 LYS 33 81 ARG 34 82 LYS 35 83 PRO 36 84 MET 37 85 PHE 38 86 ASN 39 87 ASP 40 88 ASN 41 89 PRO 42 90 VAL 43 91 GLU 44 92 ILE 45 93 ALA 46 94 GLU 47 95 LEU 48 96 SER 49 97 PHE 50 98 LEU 51 99 ILE 52 100 LYS 53 101 ARG 54 102 LYS 55 103 ILE 56 104 TYR 57 105 ALA 58 106 ILE 59 107 GLU 60 108 GLN 61 109 SER 62 110 LEU 63 111 VAL 64 112 GLN 65 113 LEU 66 114 SER 67 115 GLN 68 116 LEU 69 117 LYS 70 118 LYS 71 119 THR 72 120 ASP 73 121 VAL 74 122 ASN 75 123 GLY 76 124 ASN 77 125 THR 78 126 SER 79 127 ASN 80 128 GLN 81 129 SER 82 130 SER 83 131 LYS 84 132 GLN 85 133 PRO 86 134 SER 87 135 ALA 88 136 VAL 89 137 GLN 90 138 HIS 91 139 SER 92 140 LYS 93 141 ASN 94 142 VAL 95 143 VAL 96 144 ASN 97 145 LEU 98 146 LEU 99 147 ASN 100 148 THR 101 149 GLN 102 150 MET 103 151 LYS 104 152 ASN 105 153 ILE 106 154 SER 107 155 GLY 108 156 SER 109 157 PHE 110 158 LYS 111 159 ASP 112 160 VAL 113 161 LEU 114 162 GLU 115 163 GLU 116 164 ARG 117 165 GLN 118 166 ARG 119 167 LEU 120 168 GLU 121 169 MET 122 170 ALA 123 171 ASN 124 172 LYS 125 173 ASP 126 174 ARG 127 175 TRP 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 DBJ GAA24913 "K7_Sed5p [Saccharomyces cerevisiae Kyokai no. 7]" 100.00 340 99.21 100.00 8.73e-81 EMBL CAA47390 "39kDa integral membrane protein required for secretion [Saccharomyces cerevisiae]" 100.00 340 100.00 100.00 1.26e-81 EMBL CAA97549 "SED5 [Saccharomyces cerevisiae]" 100.00 340 100.00 100.00 1.26e-81 EMBL CAY81264 "Sed5p [Saccharomyces cerevisiae EC1118]" 100.00 340 100.00 100.00 1.26e-81 GB AHY78432 "Sed5p [Saccharomyces cerevisiae YJM993]" 100.00 340 100.00 100.00 1.26e-81 GB EDN59573 "suppressor of erd2 deletion [Saccharomyces cerevisiae YJM789]" 100.00 340 100.00 100.00 1.26e-81 GB EDV09334 "syntaxin family [Saccharomyces cerevisiae RM11-1a]" 100.00 340 99.21 100.00 2.48e-81 GB EDZ70730 "YLR026Cp-like protein [Saccharomyces cerevisiae AWRI1631]" 100.00 340 100.00 100.00 1.26e-81 GB EEU04509 "Sed5p [Saccharomyces cerevisiae JAY291]" 100.00 340 100.00 100.00 1.26e-81 REF NP_013126 "Sed5p [Saccharomyces cerevisiae S288c]" 100.00 340 100.00 100.00 1.26e-81 SP Q01590 "RecName: Full=Integral membrane protein SED5 [Saccharomyces cerevisiae S288c]" 100.00 340 100.00 100.00 1.26e-81 TPG DAA09344 "TPA: Sed5p [Saccharomyces cerevisiae S288c]" 100.00 340 100.00 100.00 1.26e-81 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Sed5p 'Baker's yeast' 4932 Eukaryota Fungi Saccharomyces cerevisiae 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 $Sed5p 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Sed5p 0.5 mM '[U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_NMRview _Saveframe_category software _Name NMRView _Version 4.12 loop_ _Task 'analyze NMR data' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _Sample_label . save_ save_1H-15N_NOESY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N NOESY' _Sample_label . save_ save_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _Sample_label . save_ save_CBCACONH_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _Sample_label . save_ save_NMR_spec_expt__0_1 _Saveframe_category NMR_applied_experiment _Experiment_name HNCO _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_2 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N NOESY' _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_3 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACB _BMRB_pulse_sequence_accession_number . _Details . save_ save_NMR_spec_expt__0_4 _Saveframe_category NMR_applied_experiment _Experiment_name CBCACONH _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6.5 0.2 n/a temperature 302 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 C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 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_ _Sample_label $sample_1 stop_ _Sample_conditions_label $Ex-cond_1 _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Yeast Sed5p' _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 49 1 LYS N N 120.990 0.15 1 2 49 1 LYS H H 8.260 0.03 1 3 49 1 LYS CA C 56.660 0.12 1 4 49 1 LYS CB C 33.590 0.12 1 5 49 1 LYS C C 174.463 0.12 1 6 50 2 SER N N 117.250 0.15 1 7 50 2 SER H H 8.380 0.03 1 8 50 2 SER CA C 58.830 0.12 1 9 50 2 SER CB C 64.080 0.12 1 10 50 2 SER C C 177.112 0.12 1 11 51 3 VAL N N 121.790 0.15 1 12 51 3 VAL H H 8.180 0.03 1 13 51 3 VAL CA C 62.620 0.12 1 14 51 3 VAL CB C 33.500 0.12 1 15 51 3 VAL C C 174.864 0.12 1 16 52 4 SER N N 120.060 0.15 1 17 52 4 SER H H 8.510 0.03 1 18 52 4 SER CA C 58.450 0.12 1 19 52 4 SER CB C 64.980 0.12 1 20 52 4 SER C C 176.488 0.12 1 21 53 5 GLU N N 122.990 0.15 1 22 53 5 GLU H H 8.900 0.03 1 23 53 5 GLU CA C 59.940 0.12 1 24 53 5 GLU CB C 29.970 0.12 1 25 53 5 GLU C C 175.407 0.12 1 26 54 6 PHE N N 119.520 0.15 1 27 54 6 PHE H H 8.610 0.03 1 28 54 6 PHE CA C 62.530 0.12 1 29 54 6 PHE CB C 40.150 0.12 1 30 54 6 PHE C C 178.988 0.12 1 31 55 7 GLN N N 118.450 0.15 1 32 55 7 GLN H H 8.200 0.03 1 33 55 7 GLN CA C 59.240 0.12 1 34 55 7 GLN CB C 29.050 0.12 1 35 55 7 GLN C C 176.497 0.12 1 36 56 8 LYS N N 120.860 0.15 1 37 56 8 LYS H H 8.370 0.03 1 38 56 8 LYS CA C 59.950 0.12 1 39 56 8 LYS CB C 33.020 0.12 1 40 56 8 LYS C C 179.422 0.12 1 41 57 9 LYS N N 120.860 0.15 1 42 57 9 LYS H H 8.210 0.03 1 43 57 9 LYS CA C 59.000 0.12 1 44 57 9 LYS CB C 32.550 0.12 1 45 57 9 LYS C C 180.238 0.12 1 46 58 10 ALA N N 122.460 0.15 1 47 58 10 ALA H H 8.730 0.03 1 48 58 10 ALA CA C 55.910 0.12 1 49 58 10 ALA CB C 18.300 0.12 1 50 58 10 ALA C C 179.723 0.12 1 51 59 11 SER N N 113.780 0.15 1 52 59 11 SER H H 8.340 0.03 1 53 59 11 SER CA C 61.990 0.12 1 54 59 11 SER CB C 63.050 0.12 1 55 59 11 SER C C 179.929 0.12 1 56 60 12 GLY N N 110.300 0.15 1 57 60 12 GLY H H 7.900 0.03 1 58 60 12 GLY CA C 47.660 0.12 1 59 60 12 GLY C C 177.781 0.12 1 60 61 13 ILE N N 123.530 0.15 1 61 61 13 ILE H H 8.060 0.03 1 62 61 13 ILE CA C 65.940 0.12 1 63 61 13 ILE CB C 38.580 0.12 1 64 61 13 ILE C C 177.028 0.12 1 65 62 14 ALA N N 122.190 0.15 1 66 62 14 ALA H H 8.400 0.03 1 67 62 14 ALA CA C 56.180 0.12 1 68 62 14 ALA CB C 18.350 0.12 1 69 62 14 ALA C C 178.169 0.12 1 70 63 15 HIS N N 117.520 0.15 1 71 63 15 HIS H H 8.050 0.03 1 72 63 15 HIS CA C 59.870 0.12 1 73 63 15 HIS CB C 29.940 0.12 1 74 63 15 HIS C C 181.059 0.12 1 75 64 16 GLU N N 121.660 0.15 1 76 64 16 GLU H H 8.130 0.03 1 77 64 16 GLU CA C 59.100 0.12 1 78 64 16 GLU CB C 29.900 0.12 1 79 64 16 GLU C C 178.344 0.12 1 80 65 17 ILE N N 124.860 0.15 1 81 65 17 ILE H H 9.090 0.03 1 82 65 17 ILE CA C 67.340 0.12 1 83 65 17 ILE CB C 38.250 0.12 1 84 65 17 ILE C C 181.188 0.12 1 85 66 18 SER N N 115.500 0.15 1 86 66 18 SER H H 8.050 0.03 1 87 66 18 SER CA C 56.61 0.12 1 88 66 18 SER CB C 62.97 0.12 1 89 66 18 SER C C 177.700 0.12 1 90 67 19 SER N N 116.980 0.15 1 91 67 19 SER H H 8.360 0.03 1 92 67 19 SER CA C 61.850 0.12 1 93 67 19 SER CB C 63.000 0.12 1 94 67 19 SER C C 178.235 0.12 1 95 68 20 THR N N 120.860 0.15 1 96 68 20 THR H H 8.280 0.03 1 97 68 20 THR CA C 68.700 0.12 1 98 68 20 THR CB C 67.600 0.12 1 99 68 20 THR C C 177.620 0.12 1 100 69 21 ALA N N 125.000 0.15 1 101 69 21 ALA H H 8.770 0.03 1 102 69 21 ALA CA C 55.900 0.12 1 103 69 21 ALA CB C 18.060 0.12 1 104 69 21 ALA C C 176.253 0.12 1 105 70 22 GLN N N 118.180 0.15 1 106 70 22 GLN H H 7.770 0.03 1 107 70 22 GLN CA C 59.490 0.12 1 108 70 22 GLN CB C 28.680 0.12 1 109 70 22 GLN C C 180.913 0.12 1 110 71 23 LEU N N 121.390 0.15 1 111 71 23 LEU H H 7.720 0.03 1 112 71 23 LEU CA C 58.370 0.12 1 113 71 23 LEU CB C 42.480 0.12 1 114 71 23 LEU C C 179.878 0.12 1 115 72 24 LEU N N 120.720 0.15 1 116 72 24 LEU H H 8.530 0.03 1 117 72 24 LEU CA C 58.300 0.12 1 118 72 24 LEU CB C 41.990 0.12 1 119 72 24 LEU C C 179.250 0.12 1 120 73 25 SER N N 115.110 0.15 1 121 73 25 SER H H 8.090 0.03 1 122 73 25 SER CA C 62.050 0.12 1 123 73 25 SER CB C 63.000 0.12 1 124 73 25 SER C C 178.427 0.12 1 125 74 26 LYS N N 121.520 0.15 1 126 74 26 LYS H H 7.430 0.03 1 127 74 26 LYS CA C 59.690 0.12 1 128 74 26 LYS CB C 32.660 0.12 1 129 74 26 LYS C C 177.116 0.12 1 130 75 27 LEU N N 121.120 0.15 1 131 75 27 LEU H H 8.450 0.03 1 132 75 27 LEU CA C 58.400 0.12 1 133 75 27 LEU CB C 41.740 0.12 1 134 75 27 LEU C C 179.129 0.12 1 135 76 28 ALA N N 119.650 0.15 1 136 76 28 ALA H H 8.820 0.03 1 137 76 28 ALA CA C 55.700 0.12 1 138 76 28 ALA CB C 18.270 0.12 1 139 76 28 ALA C C 177.682 0.12 1 140 77 29 VAL N N 116.200 0.15 1 141 77 29 VAL H H 7.300 0.03 1 142 77 29 VAL CA C 66.300 0.12 1 143 77 29 VAL CB C 32.700 0.12 1 144 78 30 LEU N N 120.190 0.15 1 145 78 30 LEU H H 7.830 0.03 1 146 78 30 LEU CA C 58.090 0.12 1 147 78 30 LEU CB C 42.970 0.12 1 148 78 30 LEU C C 179.485 0.12 1 149 79 31 ALA N N 117.920 0.15 1 150 79 31 ALA H H 9.000 0.03 1 151 79 31 ALA CA C 54.140 0.12 1 152 79 31 ALA CB C 19.020 0.12 1 153 79 31 ALA C C 180.051 0.12 1 154 80 32 LYS N N 116.180 0.15 1 155 80 32 LYS H H 7.280 0.03 1 156 80 32 LYS CA C 56.880 0.12 1 157 80 32 LYS CB C 33.520 0.12 1 158 80 32 LYS C C 178.907 0.12 1 159 81 33 ARG N N 119.920 0.15 1 160 81 33 ARG H H 7.330 0.03 1 161 81 33 ARG CA C 56.770 0.12 1 162 81 33 ARG CB C 31.270 0.12 1 163 81 33 ARG C C 176.820 0.12 1 164 82 34 LYS N N 125.000 0.15 1 165 82 34 LYS H H 8.450 0.03 1 166 82 34 LYS CA C 55.430 0.12 1 167 82 34 LYS CB C 32.690 0.12 1 168 82 34 LYS C C 176.108 0.12 1 169 83 35 PRO CA C 63.960 0.12 1 170 83 35 PRO CB C 32.420 0.12 1 171 84 36 MET N N 119.650 0.15 1 172 84 36 MET H H 8.480 0.03 1 173 84 36 MET CA C 55.640 0.12 1 174 84 36 MET CB C 33.970 0.12 1 175 84 36 MET C C 176.883 0.12 1 176 85 37 PHE N N 120.000 0.15 1 177 85 37 PHE H H 8.270 0.03 1 178 85 37 PHE CA C 59.100 0.12 1 179 85 37 PHE CB C 39.400 0.12 1 180 86 38 ASN N N 117.520 0.15 1 181 86 38 ASN H H 8.130 0.03 1 182 86 38 ASN CA C 53.310 0.12 1 183 86 38 ASN CB C 38.250 0.12 1 184 86 38 ASN C C 175.820 0.12 1 185 87 39 ASP N N 119.520 0.15 1 186 87 39 ASP H H 7.880 0.03 1 187 87 39 ASP CA C 54.810 0.12 1 188 87 39 ASP CB C 42.050 0.12 1 189 87 39 ASP C C 174.951 0.12 1 190 88 40 ASN N N 119.250 0.15 1 191 88 40 ASN H H 8.540 0.03 1 192 88 40 ASN CA C 51.250 0.12 1 193 88 40 ASN CB C 39.360 0.12 1 194 88 40 ASN C C 175.963 0.12 1 195 89 41 PRO CA C 64.740 0.12 1 196 89 41 PRO CB C 32.360 0.12 1 197 90 42 VAL N N 119.390 0.15 1 198 90 42 VAL H H 7.950 0.03 1 199 90 42 VAL CA C 64.900 0.12 1 200 90 42 VAL CB C 32.500 0.12 1 201 90 42 VAL C C 178.610 0.12 1 202 91 43 GLU N N 120.990 0.15 1 203 91 43 GLU H H 7.890 0.03 1 204 91 43 GLU CA C 60.000 0.12 1 205 91 43 GLU CB C 30.140 0.12 1 206 91 43 GLU C C 177.332 0.12 1 207 92 44 ILE N N 117.920 0.15 1 208 92 44 ILE H H 7.810 0.03 1 209 92 44 ILE CA C 65.630 0.12 1 210 92 44 ILE CB C 38.210 0.12 1 211 92 44 ILE C C 179.517 0.12 1 212 93 45 ALA N N 125.000 0.15 1 213 93 45 ALA H H 7.930 0.03 1 214 93 45 ALA CA C 55.950 0.12 1 215 93 45 ALA CB C 18.670 0.12 1 216 93 45 ALA C C 178.410 0.12 1 217 94 46 GLU N N 118.590 0.15 1 218 94 46 GLU H H 8.630 0.03 1 219 94 46 GLU CA C 60.080 0.12 1 220 94 46 GLU CB C 30.090 0.12 1 221 94 46 GLU C C 180.800 0.12 1 222 95 47 LEU N N 120.720 0.15 1 223 95 47 LEU H H 8.180 0.03 1 224 95 47 LEU CA C 58.33 0.12 1 225 95 47 LEU CB C 42.96 0.12 1 226 95 47 LEU C C 175.812 0.12 1 227 96 48 SER N N 114.180 0.15 1 228 96 48 SER H H 8.510 0.03 1 229 96 48 SER CA C 63.340 0.12 1 230 96 48 SER C C 179.032 0.12 1 231 97 49 PHE N N 121.390 0.15 1 232 97 49 PHE H H 8.160 0.03 1 233 97 49 PHE CA C 61.290 0.12 1 234 97 49 PHE CB C 39.280 0.12 1 235 97 49 PHE C C 176.066 0.12 1 236 98 50 LEU N N 120.460 0.15 1 237 98 50 LEU H H 8.070 0.03 1 238 98 50 LEU CA C 58.610 0.12 1 239 98 50 LEU CB C 42.550 0.12 1 240 98 50 LEU C C 177.887 0.12 1 241 99 51 ILE N N 119.120 0.15 1 242 99 51 ILE H H 8.450 0.03 1 243 99 51 ILE CA C 66.740 0.12 1 244 99 51 ILE CB C 38.180 0.12 1 245 99 51 ILE C C 179.411 0.12 1 246 100 52 LYS N N 119.250 0.15 1 247 100 52 LYS H H 8.120 0.03 1 248 100 52 LYS CA C 60.910 0.12 1 249 100 52 LYS CB C 33.100 0.12 1 250 100 52 LYS C C 177.266 0.12 1 251 101 53 ARG N N 118.180 0.15 1 252 101 53 ARG H H 7.880 0.03 1 253 101 53 ARG CA C 59.510 0.12 1 254 101 53 ARG CB C 30.290 0.12 1 255 101 53 ARG C C 179.736 0.12 1 256 102 54 LYS N N 122.460 0.15 1 257 102 54 LYS H H 8.410 0.03 1 258 102 54 LYS CA C 59.970 0.12 1 259 102 54 LYS CB C 32.950 0.12 1 260 102 54 LYS C C 179.970 0.12 1 261 103 55 ILE N N 119.390 0.15 1 262 103 55 ILE H H 8.750 0.03 1 263 103 55 ILE CA C 66.700 0.12 1 264 103 55 ILE CB C 38.350 0.12 1 265 103 55 ILE C C 179.622 0.12 1 266 104 56 TYR N N 119.120 0.15 1 267 104 56 TYR H H 7.780 0.03 1 268 104 56 TYR CA C 61.450 0.12 1 269 104 56 TYR CB C 38.380 0.12 1 270 104 56 TYR C C 177.675 0.12 1 271 105 57 ALA N N 120.860 0.15 1 272 105 57 ALA H H 7.940 0.03 1 273 105 57 ALA CA C 55.490 0.12 1 274 105 57 ALA CB C 18.710 0.12 1 275 105 57 ALA C C 178.156 0.12 1 276 106 58 ILE N N 121.790 0.15 1 277 106 58 ILE H H 8.680 0.03 1 278 106 58 ILE CA C 66.250 0.12 1 279 106 58 ILE CB C 38.520 0.12 1 280 106 58 ILE C C 181.795 0.12 1 281 107 59 GLU N N 120.860 0.15 1 282 107 59 GLU H H 8.780 0.03 1 283 107 59 GLU CA C 60.920 0.12 1 284 107 59 GLU CB C 29.750 0.12 1 285 107 59 GLU C C 178.822 0.12 1 286 108 60 GLN N N 116.850 0.15 1 287 108 60 GLN H H 7.970 0.03 1 288 108 60 GLN CA C 58.790 0.12 1 289 108 60 GLN CB C 28.700 0.12 1 290 108 60 GLN C C 180.465 0.12 1 291 109 61 SER N N 118.180 0.15 1 292 109 61 SER H H 8.340 0.03 1 293 109 61 SER CA C 59.000 0.12 1 294 109 61 SER C C 179.625 0.12 1 295 110 62 LEU N N 124.860 0.15 1 296 110 62 LEU H H 8.680 0.03 1 297 110 62 LEU CA C 58.460 0.12 1 298 110 62 LEU CB C 42.160 0.12 1 299 110 62 LEU C C 177.185 0.12 1 300 111 63 VAL N N 122.460 0.15 1 301 111 63 VAL H H 7.820 0.03 1 302 111 63 VAL CA C 67.030 0.12 1 303 111 63 VAL CB C 31.860 0.12 1 304 111 63 VAL C C 180.265 0.12 1 305 112 64 GLN N N 118.300 0.15 1 306 112 64 GLN H H 7.530 0.03 1 307 112 64 GLN CA C 59.100 0.12 1 308 112 64 GLN CB C 28.460 0.12 1 309 112 64 GLN C C 179.923 0.12 1 310 113 65 LEU CA C 58.150 0.12 1 311 113 65 LEU CB C 42.580 0.12 1 312 114 66 SER N N 112.170 0.15 1 313 114 66 SER H H 7.920 0.03 1 314 114 66 SER CA C 61.440 0.12 1 315 114 66 SER CB C 63.670 0.12 1 316 114 66 SER C C 178.789 0.12 1 317 115 67 GLN N N 119.250 0.15 1 318 115 67 GLN H H 7.580 0.03 1 319 115 67 GLN CA C 56.770 0.12 1 320 115 67 GLN CB C 29.230 0.12 1 321 115 67 GLN C C 175.589 0.12 1 322 116 68 LEU N N 121.120 0.15 1 323 116 68 LEU H H 7.660 0.03 1 324 116 68 LEU CA C 56.340 0.12 1 325 116 68 LEU CB C 43.020 0.12 1 326 116 68 LEU C C 177.015 0.12 1 327 117 69 LYS N N 121.260 0.15 1 328 117 69 LYS H H 8.220 0.03 1 329 117 69 LYS CA C 56.800 0.12 1 330 117 69 LYS CB C 33.300 0.12 1 331 117 69 LYS C C 177.798 0.12 1 332 118 70 LYS N N 121.790 0.15 1 333 118 70 LYS H H 8.210 0.03 1 334 118 70 LYS CA C 57.000 0.12 1 335 118 70 LYS CB C 33.400 0.12 1 336 118 70 LYS C C 176.854 0.12 1 337 119 71 THR N N 113.600 0.15 1 338 119 71 THR H H 8.030 0.03 1 339 119 71 THR CA C 62.300 0.12 1 340 119 71 THR CB C 70.000 0.12 1 341 120 72 ASP N N 122.860 0.15 1 342 120 72 ASP H H 8.280 0.03 1 343 120 72 ASP CA C 54.660 0.12 1 344 120 72 ASP CB C 41.910 0.12 1 345 120 72 ASP C C 174.575 0.12 1 346 121 73 VAL N N 119.390 0.15 1 347 121 73 VAL H H 8.090 0.03 1 348 121 73 VAL CA C 63.010 0.12 1 349 121 73 VAL CB C 32.990 0.12 1 350 121 73 VAL C C 176.787 0.12 1 351 122 74 ASN N N 120.860 0.15 1 352 122 74 ASN H H 8.450 0.03 1 353 122 74 ASN CA C 53.880 0.12 1 354 122 74 ASN CB C 39.550 0.12 1 355 122 74 ASN C C 176.425 0.12 1 356 123 75 GLY N N 108.97 0.15 1 357 123 75 GLY H H 8.310 0.03 1 358 123 75 GLY CA C 45.990 0.12 1 359 123 75 GLY C C 176.022 0.12 1 360 124 76 ASN N N 118.990 0.15 1 361 124 76 ASN H H 8.380 0.03 1 362 124 76 ASN CA C 53.710 0.12 1 363 124 76 ASN CB C 39.360 0.12 1 364 124 76 ASN C C 174.339 0.12 1 365 125 77 THR N N 113.640 0.15 1 366 125 77 THR H H 8.030 0.03 1 367 125 77 THR CA C 62.400 0.12 1 368 125 77 THR CB C 70.000 0.12 1 369 125 77 THR C C 176.171 0.12 1 370 126 78 SER N N 117.650 0.15 1 371 126 78 SER H H 8.350 0.03 1 372 126 78 SER CA C 59.000 0.12 1 373 126 78 SER CB C 64.160 0.12 1 374 126 78 SER C C 175.223 0.12 1 375 127 79 ASN N N 120.460 0.15 1 376 127 79 ASN H H 8.440 0.03 1 377 127 79 ASN CA C 53.860 0.12 1 378 127 79 ASN CB C 39.230 0.12 1 379 127 79 ASN C C 174.803 0.12 1 380 133 85 PRO CA C 64.300 0.12 1 381 133 85 PRO CB C 32.500 0.12 1 382 134 86 SER N N 115.780 0.15 1 383 134 86 SER H H 8.370 0.03 1 384 134 86 SER CA C 58.810 0.12 1 385 134 86 SER CB C 63.700 0.12 1 386 134 86 SER C C 177.288 0.12 1 387 135 87 ALA N N 125.930 0.15 1 388 135 87 ALA H H 8.340 0.03 1 389 135 87 ALA CA C 53.010 0.12 1 390 135 87 ALA CB C 19.750 0.12 1 391 135 87 ALA C C 174.752 0.12 1 392 136 88 VAL N N 118.850 0.15 1 393 136 88 VAL H H 8.010 0.03 1 394 136 88 VAL CA C 62.820 0.12 1 395 136 88 VAL CB C 32.990 0.12 1 396 136 88 VAL C C 178.089 0.12 1 397 137 89 GLN N N 123.800 0.15 1 398 137 89 GLN H H 8.340 0.03 1 399 137 89 GLN CA C 56.100 0.12 1 400 137 89 GLN CB C 29.950 0.12 1 401 137 89 GLN C C 176.474 0.12 1 402 138 90 HIS CA C 56.600 0.12 1 403 138 90 HIS CB C 29.700 0.12 1 404 139 91 SER N N 116.600 0.15 1 405 139 91 SER H H 8.350 0.03 1 406 139 91 SER CA C 59.100 0.12 1 407 139 91 SER CB C 64.100 0.12 1 408 140 92 LYS N N 122.730 0.15 1 409 140 92 LYS H H 8.420 0.03 1 410 140 92 LYS CA C 57.030 0.12 1 411 140 92 LYS CB C 33.240 0.12 1 412 140 92 LYS C C 174.903 0.12 1 413 141 93 ASN N N 119.390 0.15 1 414 141 93 ASN H H 8.380 0.03 1 415 141 93 ASN CA C 53.780 0.12 1 416 141 93 ASN CB C 39.230 0.12 1 417 141 93 ASN C C 176.566 0.12 1 418 142 94 VAL N N 120.460 0.15 1 419 142 94 VAL H H 8.050 0.03 1 420 142 94 VAL CA C 62.930 0.12 1 421 142 94 VAL CB C 33.100 0.12 1 422 142 94 VAL C C 175.434 0.12 1 423 143 95 VAL N N 123.260 0.15 1 424 143 95 VAL H H 8.140 0.03 1 425 143 95 VAL CA C 62.900 0.12 1 426 143 95 VAL CB C 33.200 0.12 1 427 143 95 VAL C C 176.429 0.12 1 428 144 96 ASN N N 117.780 0.15 1 429 144 96 ASN H H 8.110 0.03 1 430 144 96 ASN CA C 56.820 0.12 1 431 144 96 ASN CB C 38.400 0.12 1 432 144 96 ASN C C 178.263 0.12 1 433 145 97 LEU N N 122.990 0.15 1 434 145 97 LEU H H 8.240 0.03 1 435 145 97 LEU CA C 58.650 0.12 1 436 145 97 LEU CB C 33.000 0.12 1 437 145 97 LEU C C 178.525 0.12 1 438 146 98 LEU N N 119.520 0.15 1 439 146 98 LEU H H 8.240 0.03 1 440 146 98 LEU CA C 58.800 0.12 1 441 146 98 LEU CB C 42.400 0.12 1 442 146 98 LEU C C 179.935 0.12 1 443 147 99 ASN N N 117.520 0.15 1 444 147 99 ASN H H 8.600 0.03 1 445 147 99 ASN CA C 57.350 0.12 1 446 147 99 ASN CB C 39.450 0.12 1 447 147 99 ASN C C 179.388 0.12 1 448 148 100 THR N N 118.050 0.15 1 449 148 100 THR H H 8.420 0.03 1 450 148 100 THR CA C 67.640 0.12 1 451 148 100 THR CB C 68.850 0.12 1 452 148 100 THR C C 178.801 0.12 1 453 150 102 MET CA C 58.200 0.12 1 454 150 102 MET CB C 32.160 0.12 1 455 151 103 LYS N N 122.190 0.15 1 456 151 103 LYS H H 8.440 0.03 1 457 151 103 LYS CA C 59.910 0.12 1 458 151 103 LYS CB C 32.200 0.12 1 459 151 103 LYS C C 178.804 0.12 1 460 152 104 ASN N N 119.250 0.15 1 461 152 104 ASN H H 8.070 0.03 1 462 152 104 ASN CA C 57.900 0.12 1 463 152 104 ASN CB C 38.310 0.12 1 464 152 104 ASN C C 180.335 0.12 1 465 153 105 ILE N N 121.660 0.15 1 466 153 105 ILE H H 8.170 0.03 1 467 153 105 ILE CA C 65.300 0.12 1 468 153 105 ILE C C 178.727 0.12 1 469 154 106 SER N N 116.450 0.15 1 470 154 106 SER H H 8.830 0.03 1 471 154 106 SER CA C 63.13 0.12 1 472 154 106 SER CB C 62.16 0.12 1 473 154 106 SER C C 177.778 0.12 1 474 155 107 GLY N N 109.770 0.15 1 475 155 107 GLY H H 8.420 0.03 1 476 155 107 GLY CA C 47.760 0.12 1 477 155 107 GLY C C 178.147 0.12 1 478 156 108 SER N N 118.320 0.15 1 479 156 108 SER H H 8.110 0.03 1 480 156 108 SER CA C 62.240 0.12 1 481 156 108 SER CB C 63.360 0.12 1 482 156 108 SER C C 176.146 0.12 1 483 157 109 PHE N N 121.260 0.15 1 484 157 109 PHE H H 8.660 0.03 1 485 157 109 PHE CA C 59.390 0.12 1 486 157 109 PHE C C 176.548 0.12 1 487 158 110 LYS N N 118.450 0.15 1 488 158 110 LYS H H 7.780 0.03 1 489 158 110 LYS CA C 59.800 0.12 1 490 158 110 LYS CB C 32.200 0.12 1 491 158 110 LYS C C 176.353 0.12 1 492 159 111 ASP N N 119.120 0.15 1 493 159 111 ASP H H 7.980 0.03 1 494 159 111 ASP CA C 58.140 0.12 1 495 159 111 ASP CB C 40.810 0.12 1 496 159 111 ASP C C 179.031 0.12 1 497 160 112 VAL N N 121.390 0.15 1 498 160 112 VAL H H 8.380 0.03 1 499 160 112 VAL CA C 66.500 0.12 1 500 160 112 VAL CB C 32.000 0.12 1 501 161 113 LEU N N 123.660 0.15 1 502 161 113 LEU H H 8.150 0.03 1 503 161 113 LEU CA C 56.850 0.12 1 504 161 113 LEU CB C 42.300 0.12 1 505 161 113 LEU C C 177.243 0.12 1 506 162 114 GLU N N 120.720 0.15 1 507 162 114 GLU H H 8.290 0.03 1 508 162 114 GLU CA C 58.330 0.12 1 509 162 114 GLU CB C 30.360 0.12 1 510 162 114 GLU C C 178.650 0.12 1 511 164 116 ARG CA C 58.150 0.12 1 512 164 116 ARG CB C 29.670 0.12 1 513 165 117 GLN N N 119.100 0.15 1 514 165 117 GLN H H 8.040 0.03 1 515 165 117 GLN CA C 58.980 0.12 1 516 165 117 GLN CB C 28.920 0.12 1 517 165 117 GLN C C 178.238 0.12 1 518 166 118 ARG N N 119.120 0.15 1 519 166 118 ARG H H 7.910 0.03 1 520 166 118 ARG CA C 59.720 0.12 1 521 166 118 ARG CB C 30.620 0.12 1 522 166 118 ARG C C 178.694 0.12 1 523 167 119 LEU N N 121.520 0.15 1 524 167 119 LEU H H 8.090 0.03 1 525 167 119 LEU CA C 58.190 0.12 1 526 167 119 LEU CB C 42.510 0.12 1 527 167 119 LEU C C 179.476 0.12 1 528 168 120 GLU N N 119.100 0.15 1 529 168 120 GLU H H 8.390 0.03 1 530 168 120 GLU CA C 58.200 0.12 1 531 168 120 GLU CB C 30.230 0.12 1 532 168 120 GLU C C 179.817 0.12 1 533 169 121 MET N N 117.780 0.15 1 534 169 121 MET H H 8.060 0.03 1 535 169 121 MET CA C 57.410 0.12 1 536 169 121 MET CB C 32.870 0.12 1 537 169 121 MET C C 179.271 0.12 1 538 170 122 ALA N N 121.660 0.15 1 539 170 122 ALA H H 7.830 0.03 1 540 170 122 ALA CA C 53.820 0.12 1 541 170 122 ALA CB C 19.280 0.12 1 542 170 122 ALA C C 177.740 0.12 1 543 171 123 ASN N N 116.310 0.15 1 544 171 123 ASN H H 7.860 0.03 1 545 171 123 ASN CA C 53.910 0.12 1 546 171 123 ASN CB C 39.820 0.12 1 547 171 123 ASN C C 178.343 0.12 1 548 172 124 LYS N N 120.860 0.15 1 549 172 124 LYS H H 7.860 0.03 1 550 172 124 LYS CA C 57.440 0.12 1 551 172 124 LYS CB C 33.250 0.12 1 552 172 124 LYS C C 175.390 0.12 1 553 173 125 ASP N N 119.920 0.15 1 554 173 125 ASP H H 8.250 0.03 1 555 173 125 ASP CA C 55.150 0.12 1 556 173 125 ASP CB C 41.330 0.12 1 557 173 125 ASP C C 176.685 0.12 1 558 174 126 ARG N N 119.520 0.15 1 559 174 126 ARG H H 7.810 0.03 1 560 174 126 ARG CA C 56.270 0.12 1 561 174 126 ARG CB C 31.410 0.12 1 562 174 126 ARG C C 176.093 0.12 1 563 175 127 TRP N N 109.500 0.15 1 564 175 127 TRP H H 7.650 0.03 1 565 175 127 TRP CA C 58.800 0.12 1 566 175 127 TRP CB C 30.680 0.12 1 567 175 127 TRP C C 175.189 0.12 1 stop_ save_