data_15179 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Intrinsically unstructured proteins provide the specificity for protein phosphatase 1 regulation. ; _BMRB_accession_number 15179 _BMRB_flat_file_name bmr15179.str _Entry_type original _Submission_date 2007-03-16 _Accession_date 2007-03-16 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Assignment of backbone and sidechain atoms of protein phosphatase 1 Inhibitor-2 residues 9 - 164.' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Dancheck Barbara . . 2 Peti Wolfgang . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 781 "13C chemical shifts" 624 "15N chemical shifts" 141 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-10-26 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 4720 Inhibitor-2 stop_ _Original_release_date 2007-10-26 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural basis for spinophilin-neurabin receptor interaction' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 17279777 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kelker Matthew S. . 2 Dancheck Barbara . . 3 Ju Tingting . . 4 Kessler Rene P. . 5 Hudak Jebecka . . 6 Nairn Angus C. . 7 Peti Wolfgang . . stop_ _Journal_abbreviation Biochemistry _Journal_volume 46 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2333 _Page_last 2344 _Year 2007 _Details . loop_ _Keyword 'intrinsically unstructured' PP1 signaling stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Inhibitor-2 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Inhibitor-2 $Inhibitor-2 stop_ _System_molecular_weight 17960 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_Inhibitor-2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Inhibitor-2 _Molecular_mass 17960 _Mol_thiol_state 'all free' loop_ _Biological_function 'protein phosphatase 1 inhibitor' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 159 _Mol_residue_sequence ; GHMPIKGILKNKTSTTSSMV ASAEQPRGNVDEELSKKSQK WDEMNILATYHPADKDYGLM KIDEPSTPYHSMMGDDEDAC SDTEATEAMAPDILARKLAA AEGLEPKYRIQEQESSGEED SDLSPEEREKKRQFEMKRKL HYNEGLNIKLARQLISKDL ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 HIS 3 MET 4 PRO 5 ILE 6 LYS 7 GLY 8 ILE 9 LEU 10 LYS 11 ASN 12 LYS 13 THR 14 SER 15 THR 16 THR 17 SER 18 SER 19 MET 20 VAL 21 ALA 22 SER 23 ALA 24 GLU 25 GLN 26 PRO 27 ARG 28 GLY 29 ASN 30 VAL 31 ASP 32 GLU 33 GLU 34 LEU 35 SER 36 LYS 37 LYS 38 SER 39 GLN 40 LYS 41 TRP 42 ASP 43 GLU 44 MET 45 ASN 46 ILE 47 LEU 48 ALA 49 THR 50 TYR 51 HIS 52 PRO 53 ALA 54 ASP 55 LYS 56 ASP 57 TYR 58 GLY 59 LEU 60 MET 61 LYS 62 ILE 63 ASP 64 GLU 65 PRO 66 SER 67 THR 68 PRO 69 TYR 70 HIS 71 SER 72 MET 73 MET 74 GLY 75 ASP 76 ASP 77 GLU 78 ASP 79 ALA 80 CYS 81 SER 82 ASP 83 THR 84 GLU 85 ALA 86 THR 87 GLU 88 ALA 89 MET 90 ALA 91 PRO 92 ASP 93 ILE 94 LEU 95 ALA 96 ARG 97 LYS 98 LEU 99 ALA 100 ALA 101 ALA 102 GLU 103 GLY 104 LEU 105 GLU 106 PRO 107 LYS 108 TYR 109 ARG 110 ILE 111 GLN 112 GLU 113 GLN 114 GLU 115 SER 116 SER 117 GLY 118 GLU 119 GLU 120 ASP 121 SER 122 ASP 123 LEU 124 SER 125 PRO 126 GLU 127 GLU 128 ARG 129 GLU 130 LYS 131 LYS 132 ARG 133 GLN 134 PHE 135 GLU 136 MET 137 LYS 138 ARG 139 LYS 140 LEU 141 HIS 142 TYR 143 ASN 144 GLU 145 GLY 146 LEU 147 ASN 148 ILE 149 LYS 150 LEU 151 ALA 152 ARG 153 GLN 154 LEU 155 ILE 156 SER 157 LYS 158 ASP 159 LEU stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-10-28 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 4720 Inhibitor-2 99.37 173 99.37 99.37 1.03e-109 DBJ BAI46858 "protein phosphatase 1, regulatory (inhibitor) subunit 2 [synthetic construct]" 99.37 205 99.37 99.37 5.70e-110 EMBL CAA55475 "inhibitor 2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 EMBL CAA82754 "IPP-2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 EMBL CAB41680 "inhibitor 2 of protein phosphatase 1 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 GB AAC51206 "protein phosphatase inhibitor 2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 GB AAH07655 "Protein phosphatase 1, regulatory (inhibitor) subunit 2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 GB AAL48322 "inhibitor-2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 GB ABW23430 "cardiac inhibitor-2 [Canis lupus familiaris]" 99.37 205 98.73 98.73 4.02e-109 GB ADQ32784 "protein phosphatase 1, regulatory (inhibitor) subunit 2 [synthetic construct]" 99.37 205 99.37 99.37 5.70e-110 PRF 2007253A "protein phosphatase inhibitor 2" 99.37 205 99.37 99.37 5.70e-110 REF NP_001247610 "protein phosphatase inhibitor 2 [Macaca mulatta]" 99.37 205 97.47 98.73 5.47e-108 REF NP_001278433 "protein phosphatase inhibitor 2 isoform 1 [Homo sapiens]" 100.00 206 98.11 98.74 2.08e-107 REF NP_001303254 "protein phosphatase inhibitor 2 isoform 4 [Homo sapiens]" 57.86 185 97.83 97.83 1.58e-53 REF NP_006232 "protein phosphatase inhibitor 2 isoform 2 [Homo sapiens]" 99.37 205 99.37 99.37 5.70e-110 REF XP_002814482 "PREDICTED: protein phosphatase inhibitor 2 [Pongo abelii]" 99.37 205 98.10 98.73 1.07e-108 SP P41236 "RecName: Full=Protein phosphatase inhibitor 2; Short=IPP-2" 99.37 205 99.37 99.37 5.70e-110 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Inhibitor-2 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 $Inhibitor-2 'recombinant technology' . Escherichia coli 'BL21 DE3 RIL' RP1B 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 $Inhibitor-2 750 uM '[U-99% 15N]' 'sodium phosphate' 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' PMSF 250 uM 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Inhibitor-2 750 uM '[U-99% 13C; U-99% 15N]' 'sodium phosphate' 20 mM 'natural abundance' 'sodium chloride' 50 mM 'natural abundance' PMSF 250 uM 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 1.3 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing stop_ _Details . save_ save_XEASY _Saveframe_category software _Name XEASY _Version 1.5 loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_C(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_2 save_ save_3D_HCACO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCACO' _Sample_label $sample_2 save_ save_3D_HNCACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 save_ save_3D_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 70 . mM pH 6.5 . pH pressure 1 . atm temperature 298 . 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 DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $TOPSPIN stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HBHA(CO)NH' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name Inhibitor-2 _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 4 4 PRO HA H 4.338 0.01 . 2 4 4 PRO HB2 H 2.177 0.01 . 3 4 4 PRO HB3 H 1.780 0.01 . 4 4 4 PRO C C 176.632 0.23 . 5 4 4 PRO CA C 63.106 0.23 . 6 4 4 PRO CB C 31.951 0.23 . 7 4 4 PRO CD C 50.477 0.23 . 8 4 4 PRO CG C 27.416 0.23 . 9 5 5 ILE H H 8.222 0.01 . 10 5 5 ILE HA H 4.009 0.01 . 11 5 5 ILE HB H 1.722 0.01 . 12 5 5 ILE HD1 H 0.770 0.01 . 13 5 5 ILE HG12 H 1.410 0.01 . 14 5 5 ILE HG13 H 1.057 0.01 . 15 5 5 ILE HG2 H 0.809 0.01 . 16 5 5 ILE C C 176.299 0.23 . 17 5 5 ILE CA C 61.210 0.23 . 18 5 5 ILE CB C 38.650 0.23 . 19 5 5 ILE CD1 C 12.847 0.23 . 20 5 5 ILE CG1 C 27.230 0.23 . 21 5 5 ILE CG2 C 17.621 0.23 . 22 5 5 ILE N N 121.762 0.01 . 23 6 6 LYS H H 8.337 0.01 . 24 6 6 LYS HA H 4.207 0.01 . 25 6 6 LYS HB2 H 1.717 0.01 . 26 6 6 LYS HB3 H 1.655 0.01 . 27 6 6 LYS HG2 H 1.266 0.01 . 28 6 6 LYS HG3 H 1.266 0.01 . 29 6 6 LYS C C 176.837 0.23 . 30 6 6 LYS CA C 56.470 0.23 . 31 6 6 LYS CB C 33.089 0.23 . 32 6 6 LYS CD C 29.070 0.23 . 33 6 6 LYS CE C 41.857 0.23 . 34 6 6 LYS CG C 24.644 0.23 . 35 6 6 LYS N N 125.678 0.01 . 36 7 7 GLY H H 8.320 0.01 . 37 7 7 GLY HA2 H 3.852 0.01 . 38 7 7 GLY HA3 H 3.831 0.01 . 39 7 7 GLY C C 173.747 0.23 . 40 7 7 GLY CA C 45.159 0.23 . 41 7 7 GLY N N 110.282 0.01 . 42 8 8 ILE H H 7.919 0.01 . 43 8 8 ILE HA H 4.056 0.01 . 44 8 8 ILE HB H 1.743 0.01 . 45 8 8 ILE HD1 H 0.731 0.01 . 46 8 8 ILE HG12 H 1.070 0.01 . 47 8 8 ILE HG13 H 1.070 0.01 . 48 8 8 ILE HG2 H 0.770 0.01 . 49 8 8 ILE C C 176.220 0.23 . 50 8 8 ILE CA C 61.210 0.23 . 51 8 8 ILE CB C 38.776 0.23 . 52 8 8 ILE CD1 C 12.971 0.23 . 53 8 8 ILE CG1 C 27.230 0.23 . 54 8 8 ILE CG2 C 17.497 0.23 . 55 8 8 ILE N N 119.953 0.01 . 56 9 9 LEU H H 8.260 0.01 . 57 9 9 LEU HA H 4.264 0.01 . 58 9 9 LEU HB2 H 1.529 0.01 . 59 9 9 LEU HB3 H 1.456 0.01 . 60 9 9 LEU HD1 H 0.783 0.01 . 61 9 9 LEU HD2 H 0.783 0.01 . 62 9 9 LEU HG H 1.397 0.01 . 63 9 9 LEU C C 177.112 0.23 . 64 9 9 LEU CA C 55.017 0.23 . 65 9 9 LEU CB C 42.126 0.23 . 66 9 9 LEU CD1 C 24.890 0.23 . 67 9 9 LEU CD2 C 23.476 0.23 . 68 9 9 LEU CG C 26.796 0.23 . 69 9 9 LEU N N 126.411 0.01 . 70 10 10 LYS H H 8.252 0.01 . 71 10 10 LYS HA H 4.176 0.01 . 72 10 10 LYS HB2 H 1.691 0.01 . 73 10 10 LYS HB3 H 1.634 0.01 . 74 10 10 LYS HE2 H 2.821 0.01 . 75 10 10 LYS HE3 H 2.821 0.01 . 76 10 10 LYS C C 176.143 0.23 . 77 10 10 LYS CA C 56.365 0.23 . 78 10 10 LYS CB C 32.882 0.23 . 79 10 10 LYS CD C 29.089 0.23 . 80 10 10 LYS CE C 41.860 0.23 . 81 10 10 LYS CG C 24.688 0.23 . 82 10 10 LYS N N 122.689 0.01 . 83 11 11 ASN H H 8.328 0.01 . 84 11 11 ASN HA H 4.567 0.01 . 85 11 11 ASN HB2 H 2.704 0.01 . 86 11 11 ASN HB3 H 2.657 0.01 . 87 11 11 ASN C C 175.179 0.23 . 88 11 11 ASN CA C 53.121 0.23 . 89 11 11 ASN CB C 38.839 0.23 . 90 11 11 ASN N N 119.801 0.01 . 91 12 12 LYS H H 8.303 0.01 . 92 12 12 LYS HA H 4.264 0.01 . 93 12 12 LYS HB2 H 1.775 0.01 . 94 12 12 LYS HB3 H 1.675 0.01 . 95 12 12 LYS HD2 H 1.580 0.01 . 96 12 12 LYS HD3 H 1.580 0.01 . 97 12 12 LYS HG2 H 1.358 0.01 . 98 12 12 LYS HG3 H 1.358 0.01 . 99 12 12 LYS C C 176.707 0.23 . 100 12 12 LYS CA C 56.734 0.23 . 101 12 12 LYS CB C 32.899 0.23 . 102 12 12 LYS CD C 29.089 0.23 . 103 12 12 LYS CE C 41.922 0.23 . 104 12 12 LYS CG C 24.688 0.23 . 105 12 12 LYS N N 122.040 0.01 . 106 13 13 THR H H 8.173 0.01 . 107 13 13 THR HA H 4.285 0.01 . 108 13 13 THR HB H 4.144 0.01 . 109 13 13 THR HG2 H 1.070 0.01 . 110 13 13 THR C C 174.569 0.23 . 111 13 13 THR CA C 61.842 0.23 . 112 13 13 THR CB C 69.804 0.23 . 113 13 13 THR CG2 C 21.650 0.23 . 114 13 13 THR N N 115.332 0.01 . 115 14 14 SER H H 8.328 0.01 . 116 14 14 SER HA H 4.458 0.01 . 117 14 14 SER HB2 H 3.816 0.01 . 118 14 14 SER HB3 H 3.784 0.01 . 119 14 14 SER C C 174.782 0.23 . 120 14 14 SER CA C 58.429 0.23 . 121 14 14 SER CB C 63.801 0.23 . 122 14 14 SER N N 118.287 0.01 . 123 15 15 THR H H 8.245 0.01 . 124 15 15 THR HA H 4.353 0.01 . 125 15 15 THR HB H 4.197 0.01 . 126 15 15 THR HG2 H 1.110 0.01 . 127 15 15 THR C C 174.857 0.23 . 128 15 15 THR CA C 61.905 0.23 . 129 15 15 THR CB C 69.678 0.23 . 130 15 15 THR CG2 C 21.632 0.23 . 131 15 15 THR N N 116.043 0.01 . 132 16 16 THR H H 8.135 0.01 . 133 16 16 THR HA H 4.296 0.01 . 134 16 16 THR HB H 4.160 0.01 . 135 16 16 THR HG2 H 1.110 0.01 . 136 16 16 THR C C 174.713 0.23 . 137 16 16 THR CA C 61.960 0.23 . 138 16 16 THR CB C 69.951 0.23 . 139 16 16 THR CG2 C 21.650 0.23 . 140 16 16 THR N N 116.182 0.01 . 141 17 17 SER H H 8.295 0.01 . 142 17 17 SER HA H 4.379 0.01 . 143 17 17 SER HB2 H 3.805 0.01 . 144 17 17 SER HB3 H 3.763 0.01 . 145 17 17 SER C C 174.645 0.23 . 146 17 17 SER CA C 58.556 0.23 . 147 17 17 SER CB C 63.738 0.23 . 148 17 17 SER N N 118.280 0.01 . 149 18 18 SER H H 8.287 0.01 . 150 18 18 SER HA H 4.353 0.01 . 151 18 18 SER HB2 H 3.784 0.01 . 152 18 18 SER HB3 H 3.763 0.01 . 153 18 18 SER C C 174.508 0.23 . 154 18 18 SER CA C 58.660 0.23 . 155 18 18 SER CB C 63.681 0.23 . 156 18 18 SER N N 117.900 0.01 . 157 19 19 MET H H 8.243 0.01 . 158 19 19 MET HA H 4.385 0.01 . 159 19 19 MET HB2 H 1.983 0.01 . 160 19 19 MET HB3 H 1.895 0.01 . 161 19 19 MET HG2 H 2.246 0.01 . 162 19 19 MET HG3 H 2.246 0.01 . 163 19 19 MET C C 176.090 0.23 . 164 19 19 MET CA C 55.712 0.23 . 165 19 19 MET CB C 32.899 0.23 . 166 19 19 MET CG C 32.127 0.23 . 167 19 19 MET N N 122.359 0.01 . 168 20 20 VAL H H 7.994 0.01 . 169 20 20 VAL HA H 3.988 0.01 . 170 20 20 VAL HB H 1.952 0.01 . 171 20 20 VAL HG1 H 0.822 0.01 . 172 20 20 VAL HG2 H 0.822 0.01 . 173 20 20 VAL C C 175.809 0.23 . 174 20 20 VAL CA C 62.158 0.23 . 175 20 20 VAL CB C 32.710 0.23 . 176 20 20 VAL CG1 C 21.386 0.23 . 177 20 20 VAL CG2 C 20.956 0.23 . 178 20 20 VAL N N 121.360 0.01 . 179 21 21 ALA H H 8.339 0.01 . 180 21 21 ALA HA H 4.233 0.01 . 181 21 21 ALA HB H 1.289 0.01 . 182 21 21 ALA C C 177.673 0.23 . 183 21 21 ALA CA C 52.489 0.23 . 184 21 21 ALA CB C 19.112 0.23 . 185 21 21 ALA N N 128.061 0.01 . 186 22 22 SER H H 8.186 0.01 . 187 22 22 SER HA H 4.291 0.01 . 188 22 22 SER HB2 H 3.795 0.01 . 189 22 22 SER HB3 H 3.743 0.01 . 190 22 22 SER C C 174.439 0.23 . 191 22 22 SER CA C 58.240 0.23 . 192 22 22 SER CB C 63.801 0.23 . 193 22 22 SER N N 115.419 0.01 . 194 23 23 ALA H H 8.287 0.01 . 195 23 23 ALA HA H 4.223 0.01 . 196 23 23 ALA HB H 1.294 0.01 . 197 23 23 ALA C C 177.597 0.23 . 198 23 23 ALA CA C 52.679 0.23 . 199 23 23 ALA CB C 19.249 0.23 . 200 23 23 ALA N N 125.923 0.01 . 201 24 24 GLU H H 8.200 0.01 . 202 24 24 GLU HA H 4.150 0.01 . 203 24 24 GLU HB2 H 1.916 0.01 . 204 24 24 GLU HB3 H 1.801 0.01 . 205 24 24 GLU HG2 H 2.128 0.01 . 206 24 24 GLU HG3 H 2.128 0.01 . 207 24 24 GLU C C 176.220 0.23 . 208 24 24 GLU CA C 56.407 0.23 . 209 24 24 GLU CB C 30.308 0.23 . 210 24 24 GLU CG C 36.079 0.23 . 211 24 24 GLU N N 119.692 0.01 . 212 25 25 GLN H H 8.252 0.01 . 213 25 25 GLN HA H 4.479 0.01 . 214 25 25 GLN HB2 H 1.828 0.01 . 215 25 25 GLN HB3 H 1.828 0.01 . 216 25 25 GLN HG2 H 2.246 0.01 . 217 25 25 GLN HG3 H 2.246 0.01 . 218 25 25 GLN C C 173.869 0.23 . 219 25 25 GLN CA C 53.564 0.23 . 220 25 25 GLN CB C 28.728 0.23 . 221 25 25 GLN N N 122.675 0.01 . 222 26 26 PRO HA H 4.317 0.01 . 223 26 26 PRO HB2 H 2.192 0.01 . 224 26 26 PRO HB3 H 1.795 0.01 . 225 26 26 PRO C C 176.942 0.23 . 226 26 26 PRO CA C 63.295 0.23 . 227 26 26 PRO CB C 31.951 0.23 . 228 26 26 PRO CD C 50.464 0.23 . 229 26 26 PRO CG C 27.411 0.23 . 230 27 27 ARG H H 8.480 0.01 . 231 27 27 ARG HA H 4.228 0.01 . 232 27 27 ARG HB2 H 1.775 0.01 . 233 27 27 ARG HB3 H 1.670 0.01 . 234 27 27 ARG HD2 H 3.095 0.01 . 235 27 27 ARG HD3 H 3.095 0.01 . 236 27 27 ARG HG2 H 1.593 0.01 . 237 27 27 ARG HG3 H 1.593 0.01 . 238 27 27 ARG C C 176.905 0.23 . 239 27 27 ARG CA C 56.154 0.23 . 240 27 27 ARG CB C 30.877 0.23 . 241 27 27 ARG CD C 43.210 0.23 . 242 27 27 ARG CG C 27.165 0.23 . 243 27 27 ARG N N 121.845 0.01 . 244 28 28 GLY H H 8.354 0.01 . 245 28 28 GLY HA2 H 3.889 0.01 . 246 28 28 GLY HA3 H 3.810 0.01 . 247 28 28 GLY C C 173.613 0.23 . 248 28 28 GLY CA C 45.096 0.23 . 249 28 28 GLY N N 109.724 0.01 . 250 29 29 ASN H H 8.348 0.01 . 251 29 29 ASN HA H 4.635 0.01 . 252 29 29 ASN HB2 H 2.709 0.01 . 253 29 29 ASN HB3 H 2.652 0.01 . 254 29 29 ASN C C 175.474 0.23 . 255 29 29 ASN CA C 53.184 0.23 . 256 29 29 ASN CB C 38.903 0.23 . 257 29 29 ASN N N 119.121 0.01 . 258 30 30 VAL H H 8.110 0.01 . 259 30 30 VAL HA H 3.967 0.01 . 260 30 30 VAL HB H 1.999 0.01 . 261 30 30 VAL HG1 H 0.822 0.01 . 262 30 30 VAL HG2 H 0.770 0.01 . 263 30 30 VAL C C 175.946 0.23 . 264 30 30 VAL CA C 62.853 0.23 . 265 30 30 VAL CB C 32.583 0.23 . 266 30 30 VAL CG1 C 20.906 0.23 . 267 30 30 VAL CG2 C 20.720 0.23 . 268 30 30 VAL N N 120.434 0.01 . 269 31 31 ASP H H 8.278 0.01 . 270 31 31 ASP HA H 4.463 0.01 . 271 31 31 ASP HB2 H 2.631 0.01 . 272 31 31 ASP HB3 H 2.511 0.01 . 273 31 31 ASP C C 176.893 0.23 . 274 31 31 ASP CA C 54.954 0.23 . 275 31 31 ASP CB C 40.988 0.23 . 276 31 31 ASP N N 123.240 0.01 . 277 32 32 GLU H H 8.296 0.01 . 278 32 32 GLU HA H 4.082 0.01 . 279 32 32 GLU HB2 H 1.952 0.01 . 280 32 32 GLU HB3 H 1.863 0.01 . 281 32 32 GLU HG2 H 2.142 0.01 . 282 32 32 GLU HG3 H 2.142 0.01 . 283 32 32 GLU C C 177.255 0.23 . 284 32 32 GLU CA C 57.545 0.23 . 285 32 32 GLU CB C 30.119 0.23 . 286 32 32 GLU CG C 36.281 0.23 . 287 32 32 GLU N N 122.306 0.01 . 288 33 33 GLU H H 8.309 0.01 . 289 33 33 GLU HA H 4.066 0.01 . 290 33 33 GLU HB2 H 1.942 0.01 . 291 33 33 GLU HB3 H 1.916 0.01 . 292 33 33 GLU HG2 H 2.233 0.01 . 293 33 33 GLU HG3 H 2.233 0.01 . 294 33 33 GLU C C 177.673 0.23 . 295 33 33 GLU CA C 57.482 0.23 . 296 33 33 GLU CB C 29.740 0.23 . 297 33 33 GLU CG C 36.263 0.23 . 298 33 33 GLU N N 120.880 0.01 . 299 34 34 LEU H H 8.069 0.01 . 300 34 34 LEU HA H 4.124 0.01 . 301 34 34 LEU HB2 H 1.618 0.01 . 302 34 34 LEU HB3 H 1.503 0.01 . 303 34 34 LEU HD1 H 0.809 0.01 . 304 34 34 LEU HD2 H 0.809 0.01 . 305 34 34 LEU HG H 1.423 0.01 . 306 34 34 LEU C C 178.495 0.23 . 307 34 34 LEU CA C 56.407 0.23 . 308 34 34 LEU CB C 41.873 0.23 . 309 34 34 LEU CD1 C 24.829 0.23 . 310 34 34 LEU CD2 C 23.415 0.23 . 311 34 34 LEU CG C 26.796 0.23 . 312 34 34 LEU N N 121.692 0.01 . 313 35 35 SER H H 8.076 0.01 . 314 35 35 SER HA H 4.223 0.01 . 315 35 35 SER HB2 H 3.805 0.01 . 316 35 35 SER HB3 H 3.769 0.01 . 317 35 35 SER C C 175.254 0.23 . 318 35 35 SER CA C 59.377 0.23 . 319 35 35 SER CB C 63.295 0.23 . 320 35 35 SER N N 115.254 0.01 . 321 36 36 LYS H H 7.924 0.01 . 322 36 36 LYS HA H 4.144 0.01 . 323 36 36 LYS HB2 H 1.764 0.01 . 324 36 36 LYS HB3 H 1.681 0.01 . 325 36 36 LYS HG2 H 1.306 0.01 . 326 36 36 LYS HG3 H 1.306 0.01 . 327 36 36 LYS C C 177.125 0.23 . 328 36 36 LYS CA C 57.102 0.23 . 329 36 36 LYS CB C 32.646 0.23 . 330 36 36 LYS CD C 29.151 0.23 . 331 36 36 LYS CE C 42.232 0.23 . 332 36 36 LYS CG C 25.060 0.23 . 333 36 36 LYS N N 122.208 0.01 . 334 37 37 LYS H H 7.987 0.01 . 335 37 37 LYS HA H 4.134 0.01 . 336 37 37 LYS HB2 H 1.743 0.01 . 337 37 37 LYS HB3 H 1.691 0.01 . 338 37 37 LYS HD2 H 1.502 0.01 . 339 37 37 LYS HD3 H 1.502 0.01 . 340 37 37 LYS HE2 H 2.821 0.01 . 341 37 37 LYS HE3 H 2.821 0.01 . 342 37 37 LYS HG2 H 1.306 0.01 . 343 37 37 LYS HG3 H 1.306 0.01 . 344 37 37 LYS C C 176.926 0.23 . 345 37 37 LYS CA C 56.913 0.23 . 346 37 37 LYS CB C 32.747 0.23 . 347 37 37 LYS CD C 29.070 0.23 . 348 37 37 LYS CE C 42.103 0.23 . 349 37 37 LYS CG C 24.829 0.23 . 350 37 37 LYS N N 121.014 0.01 . 351 38 38 SER H H 8.116 0.01 . 352 38 38 SER HA H 4.291 0.01 . 353 38 38 SER HB2 H 3.795 0.01 . 354 38 38 SER HB3 H 3.769 0.01 . 355 38 38 SER C C 174.645 0.23 . 356 38 38 SER CA C 58.682 0.23 . 357 38 38 SER CB C 63.611 0.23 . 358 38 38 SER N N 116.189 0.01 . 359 39 39 GLN H H 8.204 0.01 . 360 39 39 GLN HA H 4.165 0.01 . 361 39 39 GLN HB2 H 1.853 0.01 . 362 39 39 GLN HB3 H 1.795 0.01 . 363 39 39 GLN HG2 H 2.155 0.01 . 364 39 39 GLN HG3 H 2.155 0.01 . 365 39 39 GLN C C 175.953 0.23 . 366 39 39 GLN CA C 56.154 0.23 . 367 39 39 GLN CB C 29.234 0.23 . 368 39 39 GLN CG C 33.739 0.23 . 369 39 39 GLN N N 122.197 0.01 . 370 40 40 LYS H H 8.158 0.01 . 371 40 40 LYS HA H 4.150 0.01 . 372 40 40 LYS HB2 H 1.639 0.01 . 373 40 40 LYS HB3 H 1.576 0.01 . 374 40 40 LYS HD2 H 1.515 0.01 . 375 40 40 LYS HD3 H 1.515 0.01 . 376 40 40 LYS HE2 H 2.873 0.01 . 377 40 40 LYS HE3 H 2.873 0.01 . 378 40 40 LYS HG2 H 1.227 0.01 . 379 40 40 LYS HG3 H 1.227 0.01 . 380 40 40 LYS C C 176.714 0.23 . 381 40 40 LYS CA C 56.673 0.23 . 382 40 40 LYS CB C 32.646 0.23 . 383 40 40 LYS CD C 29.027 0.23 . 384 40 40 LYS CE C 41.860 0.23 . 385 40 40 LYS CG C 24.502 0.23 . 386 40 40 LYS N N 121.810 0.01 . 387 41 41 TRP H H 8.058 0.01 . 388 41 41 TRP HA H 4.468 0.01 . 389 41 41 TRP HB2 H 3.215 0.01 . 390 41 41 TRP HB3 H 3.153 0.01 . 391 41 41 TRP C C 176.357 0.23 . 392 41 41 TRP CA C 57.987 0.23 . 393 41 41 TRP CB C 29.297 0.23 . 394 41 41 TRP N N 122.132 0.01 . 395 42 42 ASP H H 8.115 0.01 . 396 42 42 ASP HA H 4.336 0.01 . 397 42 42 ASP HB2 H 2.416 0.01 . 398 42 42 ASP HB3 H 2.416 0.01 . 399 42 42 ASP C C 175.460 0.23 . 400 42 42 ASP CA C 54.764 0.23 . 401 42 42 ASP CB C 40.735 0.23 . 402 42 42 ASP N N 121.121 0.01 . 403 43 43 GLU HA H 3.983 0.01 . 404 43 43 GLU HB2 H 1.947 0.01 . 405 43 43 GLU HB3 H 1.869 0.01 . 406 43 43 GLU C C 176.998 0.23 . 407 43 43 GLU CA C 57.229 0.23 . 408 43 43 GLU CB C 30.056 0.23 . 409 43 43 GLU CG C 36.343 0.23 . 410 44 44 MET H H 8.084 0.01 . 411 44 44 MET HA H 4.254 0.01 . 412 44 44 MET HB2 H 1.931 0.01 . 413 44 44 MET HB3 H 1.931 0.01 . 414 44 44 MET HG2 H 2.429 0.01 . 415 44 44 MET HG3 H 2.429 0.01 . 416 44 44 MET C C 176.433 0.23 . 417 44 44 MET CA C 56.091 0.23 . 418 44 44 MET CB C 32.267 0.23 . 419 44 44 MET CG C 32.021 0.23 . 420 44 44 MET N N 118.855 0.01 . 421 45 45 ASN H H 8.102 0.01 . 422 45 45 ASN HA H 4.520 0.01 . 423 45 45 ASN HB2 H 2.641 0.01 . 424 45 45 ASN HB3 H 2.490 0.01 . 425 45 45 ASN C C 175.495 0.23 . 426 45 45 ASN CA C 53.564 0.23 . 427 45 45 ASN CB C 38.587 0.23 . 428 45 45 ASN N N 119.146 0.01 . 429 46 46 ILE H H 7.931 0.01 . 430 46 46 ILE HA H 3.983 0.01 . 431 46 46 ILE HB H 1.790 0.01 . 432 46 46 ILE HD1 H 0.718 0.01 . 433 46 46 ILE HG12 H 1.057 0.01 . 434 46 46 ILE HG13 H 1.057 0.01 . 435 46 46 ILE HG2 H 0.770 0.01 . 436 46 46 ILE C C 176.570 0.23 . 437 46 46 ILE CA C 61.905 0.23 . 438 46 46 ILE CB C 38.839 0.23 . 439 46 46 ILE CD1 C 13.157 0.23 . 440 46 46 ILE CG1 C 27.478 0.23 . 441 46 46 ILE CG2 C 17.683 0.23 . 442 46 46 ILE N N 120.905 0.01 . 443 47 47 LEU H H 8.077 0.01 . 444 47 47 LEU HA H 4.191 0.01 . 445 47 47 LEU HB2 H 1.561 0.01 . 446 47 47 LEU HB3 H 1.472 0.01 . 447 47 47 LEU HD1 H 0.757 0.01 . 448 47 47 LEU HD2 H 0.757 0.01 . 449 47 47 LEU HG H 1.503 0.01 . 450 47 47 LEU C C 177.323 0.23 . 451 47 47 LEU CA C 55.270 0.23 . 452 47 47 LEU CB C 41.936 0.23 . 453 47 47 LEU CD1 C 24.998 0.23 . 454 47 47 LEU CD2 C 23.324 0.23 . 455 47 47 LEU CG C 26.982 0.23 . 456 47 47 LEU N N 124.301 0.01 . 457 48 48 ALA H H 7.996 0.01 . 458 48 48 ALA HA H 4.191 0.01 . 459 48 48 ALA HB H 1.279 0.01 . 460 48 48 ALA C C 177.728 0.23 . 461 48 48 ALA CA C 52.805 0.23 . 462 48 48 ALA CB C 19.060 0.23 . 463 48 48 ALA N N 123.754 0.01 . 464 49 49 THR H H 7.802 0.01 . 465 49 49 THR HA H 4.139 0.01 . 466 49 49 THR HB H 4.030 0.01 . 467 49 49 THR HG2 H 0.992 0.01 . 468 49 49 THR C C 173.891 0.23 . 469 49 49 THR CA C 61.842 0.23 . 470 49 49 THR CB C 69.804 0.23 . 471 49 49 THR CG2 C 21.588 0.23 . 472 49 49 THR N N 112.033 0.01 . 473 50 50 TYR H H 7.967 0.01 . 474 50 50 TYR HA H 4.421 0.01 . 475 50 50 TYR HB2 H 2.834 0.01 . 476 50 50 TYR HB3 H 2.803 0.01 . 477 50 50 TYR C C 174.713 0.23 . 478 50 50 TYR CA C 57.734 0.23 . 479 50 50 TYR CB C 38.903 0.23 . 480 50 50 TYR N N 122.980 0.01 . 481 51 51 HIS H H 8.157 0.01 . 482 51 51 HIS HA H 4.362 0.01 . 483 51 51 HIS HB2 H 2.834 0.01 . 484 51 51 HIS HB3 H 2.834 0.01 . 485 51 51 HIS C C 171.969 0.23 . 486 51 51 HIS CA C 52.995 0.23 . 487 51 51 HIS CB C 29.487 0.23 . 488 51 51 HIS N N 123.485 0.01 . 489 52 52 PRO HA H 4.144 0.01 . 490 52 52 PRO HB2 H 2.145 0.01 . 491 52 52 PRO HB3 H 1.801 0.01 . 492 52 52 PRO C C 176.674 0.23 . 493 52 52 PRO CA C 63.295 0.23 . 494 52 52 PRO CB C 31.951 0.23 . 495 52 52 PRO CD C 50.291 0.23 . 496 52 52 PRO CG C 27.168 0.23 . 497 53 53 ALA H H 8.458 0.01 . 498 53 53 ALA HA H 4.191 0.01 . 499 53 53 ALA HB H 1.289 0.01 . 500 53 53 ALA C C 177.587 0.23 . 501 53 53 ALA CA C 52.489 0.23 . 502 53 53 ALA CB C 19.060 0.23 . 503 53 53 ALA N N 123.980 0.01 . 504 54 54 ASP H H 8.185 0.01 . 505 54 54 ASP HA H 4.421 0.01 . 506 54 54 ASP HB2 H 2.573 0.01 . 507 54 54 ASP HB3 H 2.552 0.01 . 508 54 54 ASP C C 176.436 0.23 . 509 54 54 ASP CA C 54.575 0.23 . 510 54 54 ASP CB C 41.051 0.23 . 511 54 54 ASP N N 119.458 0.01 . 512 55 55 LYS H H 8.070 0.01 . 513 55 55 LYS HA H 4.082 0.01 . 514 55 55 LYS HB2 H 1.571 0.01 . 515 55 55 LYS HB3 H 1.503 0.01 . 516 55 55 LYS HD2 H 1.436 0.01 . 517 55 55 LYS HD3 H 1.436 0.01 . 518 55 55 LYS HE2 H 2.834 0.01 . 519 55 55 LYS HE3 H 2.834 0.01 . 520 55 55 LYS HG2 H 1.175 0.01 . 521 55 55 LYS HG3 H 1.175 0.01 . 522 55 55 LYS C C 175.816 0.23 . 523 55 55 LYS CA C 56.660 0.23 . 524 55 55 LYS CB C 32.836 0.23 . 525 55 55 LYS CD C 29.027 0.23 . 526 55 55 LYS CE C 42.418 0.23 . 527 55 55 LYS CG C 24.440 0.23 . 528 55 55 LYS N N 121.005 0.01 . 529 56 56 ASP H H 8.147 0.01 . 530 56 56 ASP HA H 4.369 0.01 . 531 56 56 ASP HB2 H 2.568 0.01 . 532 56 56 ASP HB3 H 2.453 0.01 . 533 56 56 ASP C C 176.223 0.23 . 534 56 56 ASP CA C 54.322 0.23 . 535 56 56 ASP CB C 40.925 0.23 . 536 56 56 ASP N N 120.520 0.01 . 537 57 57 TYR H H 8.039 0.01 . 538 57 57 TYR HA H 4.359 0.01 . 539 57 57 TYR HB2 H 2.996 0.01 . 540 57 57 TYR HB3 H 2.845 0.01 . 541 57 57 TYR C C 176.638 0.23 . 542 57 57 TYR CA C 58.935 0.23 . 543 57 57 TYR CB C 38.397 0.23 . 544 57 57 TYR N N 121.600 0.01 . 545 58 58 GLY H H 8.325 0.01 . 546 58 58 GLY HA2 H 3.803 0.01 . 547 58 58 GLY HA3 H 3.753 0.01 . 548 58 58 GLY C C 174.165 0.23 . 549 58 58 GLY CA C 45.412 0.23 . 550 58 58 GLY N N 109.922 0.01 . 551 59 59 LEU H H 7.818 0.01 . 552 59 59 LEU HA H 4.218 0.01 . 553 59 59 LEU HB2 H 1.524 0.01 . 554 59 59 LEU HB3 H 1.493 0.01 . 555 59 59 LEU HD1 H 0.770 0.01 . 556 59 59 LEU HD2 H 0.770 0.01 . 557 59 59 LEU HG H 1.306 0.01 . 558 59 59 LEU C C 177.322 0.23 . 559 59 59 LEU CA C 55.270 0.23 . 560 59 59 LEU CB C 42.189 0.23 . 561 59 59 LEU CD1 C 24.874 0.23 . 562 59 59 LEU CD2 C 26.982 0.23 . 563 59 59 LEU CG C 23.510 0.23 . 564 59 59 LEU N N 121.146 0.01 . 565 60 60 MET H H 8.154 0.01 . 566 60 60 MET HA H 4.322 0.01 . 567 60 60 MET HB2 H 1.921 0.01 . 568 60 60 MET HB3 H 1.889 0.01 . 569 60 60 MET HG2 H 2.142 0.01 . 570 60 60 MET HG3 H 2.142 0.01 . 571 60 60 MET C C 175.741 0.23 . 572 60 60 MET CA C 55.270 0.23 . 573 60 60 MET CB C 32.836 0.23 . 574 60 60 MET CG C 32.127 0.23 . 575 60 60 MET N N 120.746 0.01 . 576 61 61 LYS H H 8.208 0.01 . 577 61 61 LYS HA H 4.218 0.01 . 578 61 61 LYS HB2 H 1.681 0.01 . 579 61 61 LYS HB3 H 1.602 0.01 . 580 61 61 LYS HE2 H 2.864 0.01 . 581 61 61 LYS HE3 H 2.864 0.01 . 582 61 61 LYS HG2 H 1.253 0.01 . 583 61 61 LYS HG3 H 1.253 0.01 . 584 61 61 LYS C C 176.152 0.23 . 585 61 61 LYS CA C 56.091 0.23 . 586 61 61 LYS CB C 32.820 0.23 . 587 61 61 LYS CD C 29.027 0.23 . 588 61 61 LYS CE C 41.860 0.23 . 589 61 61 LYS CG C 24.626 0.23 . 590 61 61 LYS N N 123.345 0.01 . 591 62 62 ILE H H 8.151 0.01 . 592 62 62 ILE HA H 4.061 0.01 . 593 62 62 ILE HB H 1.733 0.01 . 594 62 62 ILE HD1 H 0.731 0.01 . 595 62 62 ILE HG12 H 1.031 0.01 . 596 62 62 ILE HG13 H 1.031 0.01 . 597 62 62 ILE HG2 H 0.770 0.01 . 598 62 62 ILE C C 175.687 0.23 . 599 62 62 ILE CA C 61.084 0.23 . 600 62 62 ILE CB C 38.903 0.23 . 601 62 62 ILE CD1 C 13.033 0.23 . 602 62 62 ILE CG1 C 27.230 0.23 . 603 62 62 ILE CG2 C 17.497 0.23 . 604 62 62 ILE N N 122.810 0.01 . 605 63 63 ASP H H 8.340 0.01 . 606 63 63 ASP HA H 4.494 0.01 . 607 63 63 ASP HB2 H 2.552 0.01 . 608 63 63 ASP HB3 H 2.448 0.01 . 609 63 63 ASP C C 175.522 0.23 . 610 63 63 ASP CA C 54.275 0.23 . 611 63 63 ASP CB C 41.178 0.23 . 612 63 63 ASP N N 124.430 0.01 . 613 64 64 GLU H H 8.123 0.01 . 614 64 64 GLU HA H 3.996 0.01 . 615 64 64 GLU HB2 H 1.750 0.01 . 616 64 64 GLU HB3 H 1.750 0.01 . 617 64 64 GLU HG2 H 2.181 0.01 . 618 64 64 GLU HG3 H 2.181 0.01 . 619 64 64 GLU C C 174.371 0.23 . 620 64 64 GLU CA C 57.656 0.23 . 621 64 64 GLU CB C 29.870 0.23 . 622 64 64 GLU N N 122.519 0.01 . 623 65 65 PRO HA H 4.338 0.01 . 624 65 65 PRO HB2 H 2.187 0.01 . 625 65 65 PRO HB3 H 1.832 0.01 . 626 65 65 PRO C C 176.942 0.23 . 627 65 65 PRO CA C 63.106 0.23 . 628 65 65 PRO CB C 32.015 0.23 . 629 65 65 PRO CD C 50.477 0.23 . 630 65 65 PRO CG C 27.230 0.23 . 631 66 66 SER H H 8.388 0.01 . 632 66 66 SER HA H 4.364 0.01 . 633 66 66 SER HB2 H 3.769 0.01 . 634 66 66 SER HB3 H 3.769 0.01 . 635 66 66 SER C C 174.371 0.23 . 636 66 66 SER CA C 58.303 0.23 . 637 66 66 SER CB C 63.801 0.23 . 638 66 66 SER N N 116.193 0.01 . 639 67 67 THR H H 8.069 0.01 . 640 67 67 THR HA H 4.493 0.01 . 641 67 67 THR HB H 3.996 0.01 . 642 67 67 THR HG2 H 1.110 0.01 . 643 67 67 THR C C 175.200 0.23 . 644 67 67 THR CA C 59.630 0.23 . 645 67 67 THR CB C 69.741 0.23 . 646 67 67 THR N N 118.003 0.01 . 647 68 68 PRO HA H 4.275 0.01 . 648 68 68 PRO HB2 H 2.103 0.01 . 649 68 68 PRO HB3 H 1.628 0.01 . 650 68 68 PRO C C 176.421 0.23 . 651 68 68 PRO CA C 63.295 0.23 . 652 68 68 PRO CB C 32.015 0.23 . 653 68 68 PRO CD C 50.787 0.23 . 654 68 68 PRO CG C 27.230 0.23 . 655 69 69 TYR H H 8.119 0.01 . 656 69 69 TYR HA H 4.358 0.01 . 657 69 69 TYR HB2 H 2.839 0.01 . 658 69 69 TYR HB3 H 2.839 0.01 . 659 69 69 TYR C C 175.460 0.23 . 660 69 69 TYR CA C 58.050 0.23 . 661 69 69 TYR CB C 38.661 0.23 . 662 69 69 TYR N N 120.897 0.01 . 663 70 70 HIS H H 8.030 0.01 . 664 70 70 HIS HA H 4.484 0.01 . 665 70 70 HIS HB2 H 3.043 0.01 . 666 70 70 HIS HB3 H 2.944 0.01 . 667 70 70 HIS C C 174.021 0.23 . 668 70 70 HIS CA C 55.259 0.23 . 669 70 70 HIS CB C 30.054 0.23 . 670 70 70 HIS N N 121.548 0.01 . 671 71 71 SER H H 8.266 0.01 . 672 71 71 SER HA H 4.223 0.01 . 673 71 71 SER HB2 H 3.774 0.01 . 674 71 71 SER HB3 H 3.727 0.01 . 675 71 71 SER C C 174.576 0.23 . 676 71 71 SER CA C 58.556 0.23 . 677 71 71 SER CB C 63.738 0.23 . 678 71 71 SER N N 117.621 0.01 . 679 72 72 MET H H 8.470 0.01 . 680 72 72 MET HA H 4.395 0.01 . 681 72 72 MET HB2 H 2.015 0.01 . 682 72 72 MET HB3 H 1.905 0.01 . 683 72 72 MET HG2 H 2.429 0.01 . 684 72 72 MET HG3 H 2.429 0.01 . 685 72 72 MET C C 176.217 0.23 . 686 72 72 MET CA C 55.523 0.23 . 687 72 72 MET CB C 32.646 0.23 . 688 72 72 MET CG C 32.127 0.23 . 689 72 72 MET N N 122.514 0.01 . 690 73 73 MET H H 8.279 0.01 . 691 73 73 MET HA H 4.379 0.01 . 692 73 73 MET HB2 H 1.994 0.01 . 693 73 73 MET HB3 H 1.874 0.01 . 694 73 73 MET HG2 H 2.429 0.01 . 695 73 73 MET HG3 H 2.429 0.01 . 696 73 73 MET C C 176.637 0.23 . 697 73 73 MET CA C 55.505 0.23 . 698 73 73 MET CB C 32.646 0.23 . 699 73 73 MET CG C 32.127 0.23 . 700 73 73 MET N N 120.684 0.01 . 701 74 74 GLY H H 8.321 0.01 . 702 74 74 GLY HA2 H 3.863 0.01 . 703 74 74 GLY HA3 H 3.836 0.01 . 704 74 74 GLY C C 173.747 0.23 . 705 74 74 GLY CA C 45.285 0.23 . 706 74 74 GLY N N 110.197 0.01 . 707 75 75 ASP H H 8.222 0.01 . 708 75 75 ASP HA H 4.520 0.01 . 709 75 75 ASP HB2 H 2.594 0.01 . 710 75 75 ASP HB3 H 2.516 0.01 . 711 75 75 ASP C C 176.022 0.23 . 712 75 75 ASP CA C 54.575 0.23 . 713 75 75 ASP CB C 41.178 0.23 . 714 75 75 ASP N N 120.533 0.01 . 715 76 76 ASP H H 8.298 0.01 . 716 76 76 ASP HA H 4.484 0.01 . 717 76 76 ASP HB2 H 2.610 0.01 . 718 76 76 ASP HB3 H 2.516 0.01 . 719 76 76 ASP C C 176.351 0.23 . 720 76 76 ASP CA C 54.511 0.23 . 721 76 76 ASP CB C 40.874 0.23 . 722 76 76 ASP N N 120.165 0.01 . 723 77 77 GLU H H 8.268 0.01 . 724 77 77 GLU HA H 4.129 0.01 . 725 77 77 GLU HB2 H 1.952 0.01 . 726 77 77 GLU HB3 H 1.837 0.01 . 727 77 77 GLU HG2 H 2.142 0.01 . 728 77 77 GLU HG3 H 2.142 0.01 . 729 77 77 GLU C C 176.326 0.23 . 730 77 77 GLU CA C 57.042 0.23 . 731 77 77 GLU CB C 30.119 0.23 . 732 77 77 GLU CG C 36.281 0.23 . 733 77 77 GLU N N 121.096 0.01 . 734 78 78 ASP H H 8.298 0.01 . 735 78 78 ASP HA H 4.479 0.01 . 736 78 78 ASP HB2 H 2.615 0.01 . 737 78 78 ASP HB3 H 2.505 0.01 . 738 78 78 ASP C C 176.090 0.23 . 739 78 78 ASP CA C 54.583 0.23 . 740 78 78 ASP CB C 40.988 0.23 . 741 78 78 ASP N N 121.247 0.01 . 742 79 79 ALA H H 8.062 0.01 . 743 79 79 ALA HA H 4.212 0.01 . 744 79 79 ALA HB H 1.294 0.01 . 745 79 79 ALA C C 177.724 0.23 . 746 79 79 ALA CA C 52.677 0.23 . 747 79 79 ALA CB C 19.235 0.23 . 748 79 79 ALA N N 124.387 0.01 . 749 80 80 CYS H H 8.300 0.01 . 750 80 80 CYS HA H 4.400 0.01 . 751 80 80 CYS HB2 H 2.839 0.01 . 752 80 80 CYS HB3 H 2.839 0.01 . 753 80 80 CYS C C 174.706 0.23 . 754 80 80 CYS CA C 58.619 0.23 . 755 80 80 CYS CB C 27.907 0.23 . 756 80 80 CYS N N 118.529 0.01 . 757 81 81 SER H H 8.346 0.01 . 758 81 81 SER HA H 4.322 0.01 . 759 81 81 SER HB2 H 3.763 0.01 . 760 81 81 SER HB3 H 3.763 0.01 . 761 81 81 SER C C 175.905 0.23 . 762 81 81 SER CA C 58.456 0.23 . 763 81 81 SER CB C 63.804 0.23 . 764 81 81 SER N N 118.599 0.01 . 765 82 82 ASP H H 8.381 0.01 . 766 82 82 ASP HA H 4.588 0.01 . 767 82 82 ASP HB2 H 2.636 0.01 . 768 82 82 ASP HB3 H 2.558 0.01 . 769 82 82 ASP C C 176.527 0.23 . 770 82 82 ASP CA C 54.398 0.23 . 771 82 82 ASP CB C 40.935 0.23 . 772 82 82 ASP N N 122.884 0.01 . 773 83 83 THR H H 8.061 0.01 . 774 83 83 THR HA H 4.176 0.01 . 775 83 83 THR HB H 4.134 0.01 . 776 83 83 THR HG2 H 1.070 0.01 . 777 83 83 THR C C 174.850 0.23 . 778 83 83 THR CA C 62.411 0.23 . 779 83 83 THR CB C 69.615 0.23 . 780 83 83 THR CG2 C 21.650 0.23 . 781 83 83 THR N N 114.557 0.01 . 782 84 84 GLU H H 8.332 0.01 . 783 84 84 GLU HA H 4.155 0.01 . 784 84 84 GLU HB2 H 1.957 0.01 . 785 84 84 GLU HB3 H 1.863 0.01 . 786 84 84 GLU HG2 H 2.142 0.01 . 787 84 84 GLU HG3 H 2.142 0.01 . 788 84 84 GLU C C 176.440 0.23 . 789 84 84 GLU CA C 56.919 0.23 . 790 84 84 GLU CB C 30.116 0.23 . 791 84 84 GLU CG C 36.263 0.23 . 792 84 84 GLU N N 123.234 0.01 . 793 85 85 ALA H H 8.211 0.01 . 794 85 85 ALA HA H 4.254 0.01 . 795 85 85 ALA HB H 1.305 0.01 . 796 85 85 ALA C C 178.084 0.23 . 797 85 85 ALA CA C 52.742 0.23 . 798 85 85 ALA CB C 18.997 0.23 . 799 85 85 ALA N N 125.066 0.01 . 800 86 86 THR H H 8.023 0.01 . 801 86 86 THR HA H 4.176 0.01 . 802 86 86 THR HB H 4.139 0.01 . 803 86 86 THR HG2 H 1.084 0.01 . 804 86 86 THR C C 175.049 0.23 . 805 86 86 THR CA C 62.158 0.23 . 806 86 86 THR CB C 69.741 0.23 . 807 86 86 THR CG2 C 21.650 0.23 . 808 86 86 THR N N 113.528 0.01 . 809 87 87 GLU H H 8.324 0.01 . 810 87 87 GLU HA H 4.144 0.01 . 811 87 87 GLU HB2 H 1.947 0.01 . 812 87 87 GLU HB3 H 1.863 0.01 . 813 87 87 GLU HG2 H 2.155 0.01 . 814 87 87 GLU HG3 H 2.155 0.01 . 815 87 87 GLU C C 176.296 0.23 . 816 87 87 GLU CA C 56.913 0.23 . 817 87 87 GLU CB C 30.056 0.23 . 818 87 87 GLU CG C 36.202 0.23 . 819 87 87 GLU N N 123.001 0.01 . 820 88 88 ALA H H 8.132 0.01 . 821 88 88 ALA HA H 4.144 0.01 . 822 88 88 ALA HB H 1.289 0.01 . 823 88 88 ALA C C 177.529 0.23 . 824 88 88 ALA CA C 52.742 0.23 . 825 88 88 ALA CB C 19.060 0.23 . 826 88 88 ALA N N 124.260 0.01 . 827 89 89 MET H H 8.067 0.01 . 828 89 89 MET HA H 4.338 0.01 . 829 89 89 MET HB2 H 1.942 0.01 . 830 89 89 MET HB3 H 1.910 0.01 . 831 89 89 MET HG2 H 2.455 0.01 . 832 89 89 MET HG3 H 2.455 0.01 . 833 89 89 MET C C 175.453 0.23 . 834 89 89 MET CA C 55.017 0.23 . 835 89 89 MET CB C 33.342 0.23 . 836 89 89 MET CG C 32.083 0.23 . 837 89 89 MET N N 119.070 0.01 . 838 90 90 ALA H H 8.158 0.01 . 839 90 90 ALA HA H 4.427 0.01 . 840 90 90 ALA HB H 1.306 0.01 . 841 90 90 ALA C C 176.029 0.23 . 842 90 90 ALA CA C 51.099 0.23 . 843 90 90 ALA CB C 17.922 0.23 . 844 90 90 ALA N N 126.507 0.01 . 845 91 91 PRO HA H 4.218 0.01 . 846 91 91 PRO HB2 H 2.234 0.01 . 847 91 91 PRO HB3 H 1.842 0.01 . 848 91 91 PRO C C 177.739 0.23 . 849 91 91 PRO CA C 64.496 0.23 . 850 91 91 PRO CB C 31.888 0.23 . 851 91 91 PRO CD C 50.279 0.23 . 852 91 91 PRO CG C 27.657 0.23 . 853 92 92 ASP H H 8.442 0.01 . 854 92 92 ASP HA H 4.400 0.01 . 855 92 92 ASP HB2 H 2.573 0.01 . 856 92 92 ASP HB3 H 2.573 0.01 . 857 92 92 ASP C C 177.395 0.23 . 858 92 92 ASP CA C 55.270 0.23 . 859 92 92 ASP CB C 40.293 0.23 . 860 92 92 ASP N N 118.258 0.01 . 861 93 93 ILE H H 7.629 0.01 . 862 93 93 ILE HA H 3.784 0.01 . 863 93 93 ILE HB H 1.884 0.01 . 864 93 93 ILE HD1 H 0.770 0.01 . 865 93 93 ILE HG12 H 1.384 0.01 . 866 93 93 ILE HG13 H 1.123 0.01 . 867 93 93 ILE HG2 H 0.822 0.01 . 868 93 93 ILE C C 177.680 0.23 . 869 93 93 ILE CA C 63.106 0.23 . 870 93 93 ILE CB C 37.702 0.23 . 871 93 93 ILE CD1 C 12.595 0.23 . 872 93 93 ILE CG1 C 28.025 0.23 . 873 93 93 ILE CG2 C 17.390 0.23 . 874 93 93 ILE N N 121.518 0.01 . 875 94 94 LEU H H 7.963 0.01 . 876 94 94 LEU HA H 4.050 0.01 . 877 94 94 LEU HB2 H 1.545 0.01 . 878 94 94 LEU HB3 H 1.545 0.01 . 879 94 94 LEU HD1 H 0.757 0.01 . 880 94 94 LEU HD2 H 0.757 0.01 . 881 94 94 LEU HG H 1.306 0.01 . 882 94 94 LEU C C 178.221 0.23 . 883 94 94 LEU CA C 57.102 0.23 . 884 94 94 LEU CB C 41.620 0.23 . 885 94 94 LEU CD1 C 24.398 0.23 . 886 94 94 LEU CD2 C 24.091 0.23 . 887 94 94 LEU CG C 26.980 0.23 . 888 94 94 LEU N N 122.518 0.01 . 889 95 95 ALA H H 7.939 0.01 . 890 95 95 ALA HA H 4.040 0.01 . 891 95 95 ALA HB H 1.475 0.01 . 892 95 95 ALA C C 179.598 0.23 . 893 95 95 ALA CA C 54.132 0.23 . 894 95 95 ALA CB C 18.365 0.23 . 895 95 95 ALA N N 121.370 0.01 . 896 96 96 ARG H H 7.771 0.01 . 897 96 96 ARG HA H 4.061 0.01 . 898 96 96 ARG HB2 H 1.785 0.01 . 899 96 96 ARG HB3 H 1.785 0.01 . 900 96 96 ARG HD2 H 2.821 0.01 . 901 96 96 ARG HD3 H 2.821 0.01 . 902 96 96 ARG HG2 H 1.554 0.01 . 903 96 96 ARG HG3 H 1.554 0.01 . 904 96 96 ARG C C 177.865 0.23 . 905 96 96 ARG CA C 57.861 0.23 . 906 96 96 ARG CB C 30.372 0.23 . 907 96 96 ARG CD C 43.517 0.23 . 908 96 96 ARG CG C 27.472 0.23 . 909 96 96 ARG N N 118.683 0.01 . 910 97 97 LYS H H 8.036 0.01 . 911 97 97 LYS HA H 4.066 0.01 . 912 97 97 LYS HB2 H 1.790 0.01 . 913 97 97 LYS HB3 H 1.790 0.01 . 914 97 97 LYS HD2 H 1.502 0.01 . 915 97 97 LYS HD3 H 1.502 0.01 . 916 97 97 LYS HG2 H 1.319 0.01 . 917 97 97 LYS HG3 H 1.319 0.01 . 918 97 97 LYS C C 178.171 0.23 . 919 97 97 LYS CA C 57.779 0.23 . 920 97 97 LYS CB C 32.513 0.23 . 921 97 97 LYS CD C 29.771 0.23 . 922 97 97 LYS CE C 41.860 0.23 . 923 97 97 LYS CG C 25.060 0.23 . 924 97 97 LYS N N 121.680 0.01 . 925 98 98 LEU H H 8.149 0.01 . 926 98 98 LEU HA H 4.118 0.01 . 927 98 98 LEU HB2 H 1.608 0.01 . 928 98 98 LEU HB3 H 1.472 0.01 . 929 98 98 LEU HD1 H 0.770 0.01 . 930 98 98 LEU HD2 H 0.770 0.01 . 931 98 98 LEU C C 178.180 0.23 . 932 98 98 LEU CA C 56.407 0.23 . 933 98 98 LEU CB C 41.873 0.23 . 934 98 98 LEU CD1 C 24.936 0.23 . 935 98 98 LEU CD2 C 23.076 0.23 . 936 98 98 LEU CG C 26.734 0.23 . 937 98 98 LEU N N 121.653 0.01 . 938 99 99 ALA H H 7.920 0.01 . 939 99 99 ALA HA H 4.134 0.01 . 940 99 99 ALA HB H 1.331 0.01 . 941 99 99 ALA C C 178.550 0.23 . 942 99 99 ALA CA C 53.248 0.23 . 943 99 99 ALA CB C 18.618 0.23 . 944 99 99 ALA N N 122.895 0.01 . 945 100 100 ALA H H 7.894 0.01 . 946 100 100 ALA HA H 4.144 0.01 . 947 100 100 ALA HB H 1.336 0.01 . 948 100 100 ALA C C 178.214 0.23 . 949 100 100 ALA CA C 52.995 0.23 . 950 100 100 ALA CB C 18.681 0.23 . 951 100 100 ALA N N 121.755 0.01 . 952 101 101 ALA H H 7.900 0.01 . 953 101 101 ALA HA H 4.165 0.01 . 954 101 101 ALA HB H 1.341 0.01 . 955 101 101 ALA C C 178.190 0.23 . 956 101 101 ALA CA C 52.932 0.23 . 957 101 101 ALA CB C 18.927 0.23 . 958 101 101 ALA N N 122.132 0.01 . 959 102 102 GLU H H 8.077 0.01 . 960 102 102 GLU HA H 4.139 0.01 . 961 102 102 GLU HB2 H 1.968 0.01 . 962 102 102 GLU HB3 H 1.895 0.01 . 963 102 102 GLU HG2 H 2.155 0.01 . 964 102 102 GLU HG3 H 2.155 0.01 . 965 102 102 GLU C C 177.186 0.23 . 966 102 102 GLU CA C 57.039 0.23 . 967 102 102 GLU CB C 30.308 0.23 . 968 102 102 GLU CG C 36.325 0.23 . 969 102 102 GLU N N 119.154 0.01 . 970 103 103 GLY H H 8.171 0.01 . 971 103 103 GLY HA2 H 3.842 0.01 . 972 103 103 GLY HA3 H 3.842 0.01 . 973 103 103 GLY C C 174.035 0.23 . 974 103 103 GLY CA C 45.538 0.23 . 975 103 103 GLY N N 108.859 0.01 . 976 104 104 LEU H H 7.883 0.01 . 977 104 104 LEU HA H 4.264 0.01 . 978 104 104 LEU HB2 H 1.524 0.01 . 979 104 104 LEU HB3 H 1.477 0.01 . 980 104 104 LEU HD1 H 0.770 0.01 . 981 104 104 LEU HD2 H 0.770 0.01 . 982 104 104 LEU HG H 1.319 0.01 . 983 104 104 LEU C C 177.186 0.23 . 984 104 104 LEU CA C 54.764 0.23 . 985 104 104 LEU CB C 42.505 0.23 . 986 104 104 LEU CD1 C 24.874 0.23 . 987 104 104 LEU CD2 C 23.262 0.23 . 988 104 104 LEU CG C 26.734 0.23 . 989 104 104 LEU N N 120.962 0.01 . 990 105 105 GLU H H 8.280 0.01 . 991 105 105 GLU HA H 4.467 0.01 . 992 105 105 GLU HB2 H 1.828 0.01 . 993 105 105 GLU HB3 H 1.828 0.01 . 994 105 105 GLU HG2 H 2.233 0.01 . 995 105 105 GLU HG3 H 2.233 0.01 . 996 105 105 GLU C C 174.569 0.23 . 997 105 105 GLU CA C 55.259 0.23 . 998 105 105 GLU CB C 29.424 0.23 . 999 105 105 GLU N N 122.765 0.01 . 1000 106 106 PRO HA H 4.207 0.01 . 1001 106 106 PRO HB2 H 2.114 0.01 . 1002 106 106 PRO HB3 H 1.660 0.01 . 1003 106 106 PRO C C 176.984 0.23 . 1004 106 106 PRO CA C 63.548 0.23 . 1005 106 106 PRO CB C 31.960 0.23 . 1006 106 106 PRO CD C 50.587 0.23 . 1007 106 106 PRO CG C 27.472 0.23 . 1008 107 107 LYS H H 8.258 0.01 . 1009 107 107 LYS HA H 4.077 0.01 . 1010 107 107 LYS HB2 H 1.561 0.01 . 1011 107 107 LYS HB3 H 1.535 0.01 . 1012 107 107 LYS HE2 H 2.899 0.01 . 1013 107 107 LYS HE3 H 2.899 0.01 . 1014 107 107 LYS HG2 H 1.110 0.01 . 1015 107 107 LYS HG3 H 1.110 0.01 . 1016 107 107 LYS C C 176.308 0.23 . 1017 107 107 LYS CA C 56.660 0.23 . 1018 107 107 LYS CB C 32.646 0.23 . 1019 107 107 LYS CD C 29.070 0.23 . 1020 107 107 LYS CE C 41.919 0.23 . 1021 107 107 LYS CG C 24.521 0.23 . 1022 107 107 LYS N N 120.379 0.01 . 1023 108 108 TYR H H 7.926 0.01 . 1024 108 108 TYR HA H 4.489 0.01 . 1025 108 108 TYR HB2 H 2.965 0.01 . 1026 108 108 TYR HB3 H 2.782 0.01 . 1027 108 108 TYR C C 175.391 0.23 . 1028 108 108 TYR CA C 57.533 0.23 . 1029 108 108 TYR CB C 38.845 0.23 . 1030 108 108 TYR N N 119.953 0.01 . 1031 109 109 ARG H H 8.049 0.01 . 1032 109 109 ARG HA H 4.202 0.01 . 1033 109 109 ARG HB2 H 1.675 0.01 . 1034 109 109 ARG HB3 H 1.592 0.01 . 1035 109 109 ARG HD2 H 3.069 0.01 . 1036 109 109 ARG HD3 H 3.069 0.01 . 1037 109 109 ARG HG2 H 1.410 0.01 . 1038 109 109 ARG HG3 H 1.410 0.01 . 1039 109 109 ARG C C 175.809 0.23 . 1040 109 109 ARG CA C 55.965 0.23 . 1041 109 109 ARG CB C 30.877 0.23 . 1042 109 109 ARG CD C 43.286 0.23 . 1043 109 109 ARG CG C 27.230 0.23 . 1044 109 109 ARG N N 122.704 0.01 . 1045 110 110 ILE H H 8.110 0.01 . 1046 110 110 ILE HA H 3.988 0.01 . 1047 110 110 ILE HB H 1.728 0.01 . 1048 110 110 ILE HD1 H 0.692 0.01 . 1049 110 110 ILE HG12 H 1.057 0.01 . 1050 110 110 ILE HG13 H 1.057 0.01 . 1051 110 110 ILE HG2 H 0.770 0.01 . 1052 110 110 ILE C C 176.159 0.23 . 1053 110 110 ILE CA C 61.468 0.23 . 1054 110 110 ILE CB C 38.599 0.23 . 1055 110 110 ILE CD1 C 12.971 0.23 . 1056 110 110 ILE CG1 C 27.292 0.23 . 1057 110 110 ILE CG2 C 17.497 0.23 . 1058 110 110 ILE N N 122.564 0.01 . 1059 111 111 GLN H H 8.398 0.01 . 1060 111 111 GLN HA H 4.218 0.01 . 1061 111 111 GLN HB2 H 1.999 0.01 . 1062 111 111 GLN HB3 H 1.889 0.01 . 1063 111 111 GLN HG2 H 2.233 0.01 . 1064 111 111 GLN HG3 H 2.233 0.01 . 1065 111 111 GLN C C 175.823 0.23 . 1066 111 111 GLN CA C 55.965 0.23 . 1067 111 111 GLN CB C 29.360 0.23 . 1068 111 111 GLN CG C 33.739 0.23 . 1069 111 111 GLN N N 124.452 0.01 . 1070 112 112 GLU H H 8.450 0.01 . 1071 112 112 GLU HA H 4.139 0.01 . 1072 112 112 GLU HB2 H 1.952 0.01 . 1073 112 112 GLU HB3 H 1.842 0.01 . 1074 112 112 GLU HG2 H 2.155 0.01 . 1075 112 112 GLU HG3 H 2.155 0.01 . 1076 112 112 GLU C C 176.427 0.23 . 1077 112 112 GLU CA C 56.786 0.23 . 1078 112 112 GLU CB C 30.119 0.23 . 1079 112 112 GLU CG C 36.263 0.23 . 1080 112 112 GLU N N 122.640 0.01 . 1081 113 113 GLN H H 8.332 0.01 . 1082 113 113 GLN HA H 4.207 0.01 . 1083 113 113 GLN HB2 H 1.983 0.01 . 1084 113 113 GLN HB3 H 1.879 0.01 . 1085 113 113 GLN HG2 H 2.233 0.01 . 1086 113 113 GLN HG3 H 2.233 0.01 . 1087 113 113 GLN C C 175.885 0.23 . 1088 113 113 GLN CA C 55.775 0.23 . 1089 113 113 GLN CB C 29.685 0.23 . 1090 113 113 GLN CG C 33.739 0.23 . 1091 113 113 GLN N N 120.918 0.01 . 1092 114 114 GLU H H 8.428 0.01 . 1093 114 114 GLU HA H 4.186 0.01 . 1094 114 114 GLU HB2 H 1.957 0.01 . 1095 114 114 GLU HB3 H 1.858 0.01 . 1096 114 114 GLU HG2 H 2.142 0.01 . 1097 114 114 GLU HG3 H 2.142 0.01 . 1098 114 114 GLU C C 176.433 0.23 . 1099 114 114 GLU CA C 56.857 0.23 . 1100 114 114 GLU CB C 30.143 0.23 . 1101 114 114 GLU CG C 36.095 0.23 . 1102 114 114 GLU N N 122.712 0.01 . 1103 115 115 SER H H 8.354 0.01 . 1104 115 115 SER HA H 4.411 0.01 . 1105 115 115 SER HB2 H 3.800 0.01 . 1106 115 115 SER HB3 H 3.753 0.01 . 1107 115 115 SER C C 174.645 0.23 . 1108 115 115 SER CA C 57.987 0.23 . 1109 115 115 SER CB C 63.801 0.23 . 1110 115 115 SER N N 117.123 0.01 . 1111 116 116 SER H H 8.491 0.01 . 1112 116 116 SER HA H 4.379 0.01 . 1113 116 116 SER HB2 H 3.831 0.01 . 1114 116 116 SER HB3 H 3.779 0.01 . 1115 116 116 SER C C 175.117 0.23 . 1116 116 116 SER CA C 58.517 0.23 . 1117 116 116 SER CB C 64.117 0.23 . 1118 116 116 SER N N 118.511 0.01 . 1119 117 117 GLY H H 8.422 0.01 . 1120 117 117 GLY HA2 H 3.889 0.01 . 1121 117 117 GLY HA3 H 3.889 0.01 . 1122 117 117 GLY C C 174.234 0.23 . 1123 117 117 GLY CA C 45.348 0.23 . 1124 117 117 GLY N N 111.089 0.01 . 1125 118 118 GLU H H 8.262 0.01 . 1126 118 118 GLU HA H 4.191 0.01 . 1127 118 118 GLU HB2 H 1.963 0.01 . 1128 118 118 GLU HB3 H 1.795 0.01 . 1129 118 118 GLU HG2 H 2.142 0.01 . 1130 118 118 GLU HG3 H 2.142 0.01 . 1131 118 118 GLU C C 176.844 0.23 . 1132 118 118 GLU CA C 56.660 0.23 . 1133 118 118 GLU CB C 30.119 0.23 . 1134 118 118 GLU CG C 36.033 0.23 . 1135 118 118 GLU N N 120.596 0.01 . 1136 119 119 GLU H H 8.577 0.01 . 1137 119 119 GLU HA H 4.150 0.01 . 1138 119 119 GLU HB2 H 1.936 0.01 . 1139 119 119 GLU HB3 H 1.837 0.01 . 1140 119 119 GLU HG2 H 2.142 0.01 . 1141 119 119 GLU HG3 H 2.142 0.01 . 1142 119 119 GLU C C 176.563 0.23 . 1143 119 119 GLU CA C 56.986 0.23 . 1144 119 119 GLU CB C 30.119 0.23 . 1145 119 119 GLU CG C 36.219 0.23 . 1146 119 119 GLU N N 121.942 0.01 . 1147 120 120 ASP H H 8.393 0.01 . 1148 120 120 ASP HA H 4.499 0.01 . 1149 120 120 ASP HB2 H 2.610 0.01 . 1150 120 120 ASP HB3 H 2.573 0.01 . 1151 120 120 ASP C C 176.885 0.23 . 1152 120 120 ASP CA C 54.754 0.23 . 1153 120 120 ASP CB C 40.682 0.23 . 1154 120 120 ASP N N 121.146 0.01 . 1155 121 121 SER H H 8.091 0.01 . 1156 121 121 SER HA H 4.165 0.01 . 1157 121 121 SER HB2 H 3.826 0.01 . 1158 121 121 SER HB3 H 3.758 0.01 . 1159 121 121 SER C C 174.439 0.23 . 1160 121 121 SER CA C 59.630 0.23 . 1161 121 121 SER CB C 63.548 0.23 . 1162 121 121 SER N N 115.763 0.01 . 1163 122 122 ASP H H 8.429 0.01 . 1164 122 122 ASP HA H 4.531 0.01 . 1165 122 122 ASP HB2 H 2.615 0.01 . 1166 122 122 ASP HB3 H 2.542 0.01 . 1167 122 122 ASP C C 175.946 0.23 . 1168 122 122 ASP CA C 54.337 0.23 . 1169 122 122 ASP CB C 40.735 0.23 . 1170 122 122 ASP N N 120.813 0.01 . 1171 123 123 LEU H H 7.504 0.01 . 1172 123 123 LEU HA H 4.374 0.01 . 1173 123 123 LEU HB2 H 1.576 0.01 . 1174 123 123 LEU HB3 H 1.409 0.01 . 1175 123 123 LEU HD1 H 0.731 0.01 . 1176 123 123 LEU HD2 H 0.731 0.01 . 1177 123 123 LEU C C 177.185 0.23 . 1178 123 123 LEU CA C 54.337 0.23 . 1179 123 123 LEU CB C 43.453 0.23 . 1180 123 123 LEU CD1 C 25.628 0.23 . 1181 123 123 LEU CD2 C 22.984 0.23 . 1182 123 123 LEU CG C 26.734 0.23 . 1183 123 123 LEU N N 120.795 0.01 . 1184 124 124 SER H H 8.807 0.01 . 1185 124 124 SER HA H 4.610 0.01 . 1186 124 124 SER HB2 H 4.231 0.01 . 1187 124 124 SER HB3 H 3.931 0.01 . 1188 124 124 SER C C 173.065 0.23 . 1189 124 124 SER CA C 56.850 0.23 . 1190 124 124 SER CB C 62.663 0.23 . 1191 124 124 SER N N 119.878 0.01 . 1192 125 125 PRO HA H 4.077 0.01 . 1193 125 125 PRO HB2 H 2.307 0.01 . 1194 125 125 PRO HB3 H 1.869 0.01 . 1195 125 125 PRO C C 179.611 0.23 . 1196 125 125 PRO CA C 66.076 0.23 . 1197 125 125 PRO CB C 31.509 0.23 . 1198 125 125 PRO CD C 49.981 0.23 . 1199 125 125 PRO CG C 28.098 0.23 . 1200 126 126 GLU H H 8.780 0.01 . 1201 126 126 GLU HA H 3.983 0.01 . 1202 126 126 GLU HB2 H 1.994 0.01 . 1203 126 126 GLU HB3 H 1.837 0.01 . 1204 126 126 GLU HG2 H 2.220 0.01 . 1205 126 126 GLU HG3 H 2.220 0.01 . 1206 126 126 GLU C C 179.454 0.23 . 1207 126 126 GLU CA C 59.946 0.23 . 1208 126 126 GLU CB C 28.981 0.23 . 1209 126 126 GLU CG C 36.715 0.23 . 1210 126 126 GLU N N 117.814 0.01 . 1211 127 127 GLU H H 7.797 0.01 . 1212 127 127 GLU HA H 3.919 0.01 . 1213 127 127 GLU HB2 H 2.156 0.01 . 1214 127 127 GLU HB3 H 1.957 0.01 . 1215 127 127 GLU HG2 H 2.220 0.01 . 1216 127 127 GLU HG3 H 2.220 0.01 . 1217 127 127 GLU C C 179.578 0.23 . 1218 127 127 GLU CA C 59.070 0.23 . 1219 127 127 GLU CB C 29.931 0.23 . 1220 127 127 GLU CG C 36.963 0.23 . 1221 127 127 GLU N N 121.173 0.01 . 1222 128 128 ARG H H 8.684 0.01 . 1223 128 128 ARG HA H 3.793 0.01 . 1224 128 128 ARG HB3 H 1.811 0.01 . 1225 128 128 ARG HD2 H 3.082 0.01 . 1226 128 128 ARG HD3 H 3.082 0.01 . 1227 128 128 ARG HG2 H 1.488 0.01 . 1228 128 128 ARG HG3 H 1.488 0.01 . 1229 128 128 ARG C C 178.837 0.23 . 1230 128 128 ARG CA C 59.883 0.23 . 1231 128 128 ARG CB C 30.056 0.23 . 1232 128 128 ARG CD C 43.517 0.23 . 1233 128 128 ARG CG C 28.456 0.23 . 1234 128 128 ARG N N 121.292 0.01 . 1235 129 129 GLU H H 7.923 0.01 . 1236 129 129 GLU HA H 4.202 0.01 . 1237 129 129 GLU HB2 H 2.020 0.01 . 1238 129 129 GLU HB3 H 1.942 0.01 . 1239 129 129 GLU HG2 H 2.142 0.01 . 1240 129 129 GLU HG3 H 2.142 0.01 . 1241 129 129 GLU C C 178.289 0.23 . 1242 129 129 GLU CA C 58.640 0.23 . 1243 129 129 GLU CB C 28.763 0.23 . 1244 129 129 GLU CG C 35.103 0.23 . 1245 129 129 GLU N N 120.510 0.01 . 1246 130 130 LYS H H 7.740 0.01 . 1247 130 130 LYS HA H 3.910 0.01 . 1248 130 130 LYS HB2 H 1.785 0.01 . 1249 130 130 LYS HB3 H 1.785 0.01 . 1250 130 130 LYS HD2 H 1.541 0.01 . 1251 130 130 LYS HD3 H 1.541 0.01 . 1252 130 130 LYS HE2 H 2.808 0.01 . 1253 130 130 LYS HE3 H 2.808 0.01 . 1254 130 130 LYS HG2 H 1.384 0.01 . 1255 130 130 LYS HG3 H 1.384 0.01 . 1256 130 130 LYS C C 179.310 0.23 . 1257 130 130 LYS CA C 59.630 0.23 . 1258 130 130 LYS CB C 32.394 0.23 . 1259 130 130 LYS CD C 29.399 0.23 . 1260 130 130 LYS CE C 41.860 0.23 . 1261 130 130 LYS CG C 25.308 0.23 . 1262 130 130 LYS N N 120.176 0.01 . 1263 131 131 LYS H H 7.850 0.01 . 1264 131 131 LYS HA H 4.056 0.01 . 1265 131 131 LYS HB2 H 1.858 0.01 . 1266 131 131 LYS HB3 H 1.754 0.01 . 1267 131 131 LYS HD2 H 1.475 0.01 . 1268 131 131 LYS HD3 H 1.475 0.01 . 1269 131 131 LYS HG2 H 1.293 0.01 . 1270 131 131 LYS HG3 H 1.293 0.01 . 1271 131 131 LYS C C 178.221 0.23 . 1272 131 131 LYS CA C 59.314 0.23 . 1273 131 131 LYS CB C 32.452 0.23 . 1274 131 131 LYS CD C 29.523 0.23 . 1275 131 131 LYS CE C 41.984 0.23 . 1276 131 131 LYS CG C 24.998 0.23 . 1277 131 131 LYS N N 120.230 0.01 . 1278 132 132 ARG H H 7.989 0.01 . 1279 132 132 ARG HA H 4.023 0.01 . 1280 132 132 ARG HB2 H 1.874 0.01 . 1281 132 132 ARG HB3 H 1.874 0.01 . 1282 132 132 ARG HG2 H 1.554 0.01 . 1283 132 132 ARG HG3 H 1.554 0.01 . 1284 132 132 ARG C C 179.242 0.23 . 1285 132 132 ARG CA C 59.193 0.23 . 1286 132 132 ARG CB C 30.308 0.23 . 1287 132 132 ARG CD C 43.271 0.23 . 1288 132 132 ARG CG C 27.657 0.23 . 1289 132 132 ARG N N 120.304 0.01 . 1290 133 133 GLN H H 8.202 0.01 . 1291 133 133 GLN HA H 3.931 0.01 . 1292 133 133 GLN HB2 H 2.020 0.01 . 1293 133 133 GLN HB3 H 2.020 0.01 . 1294 133 133 GLN HG2 H 2.390 0.01 . 1295 133 133 GLN HG3 H 2.390 0.01 . 1296 133 133 GLN C C 178.289 0.23 . 1297 133 133 GLN CA C 58.745 0.23 . 1298 133 133 GLN CB C 28.033 0.23 . 1299 133 133 GLN CG C 33.739 0.23 . 1300 133 133 GLN N N 118.102 0.01 . 1301 134 134 PHE H H 8.086 0.01 . 1302 134 134 PHE HA H 4.218 0.01 . 1303 134 134 PHE HB2 H 3.184 0.01 . 1304 134 134 PHE HB3 H 3.184 0.01 . 1305 134 134 PHE C C 177.878 0.23 . 1306 134 134 PHE CA C 60.831 0.23 . 1307 134 134 PHE CB C 38.903 0.23 . 1308 134 134 PHE N N 120.736 0.01 . 1309 135 135 GLU H H 8.295 0.01 . 1310 135 135 GLU HA H 3.915 0.01 . 1311 135 135 GLU HB2 H 2.056 0.01 . 1312 135 135 GLU HB3 H 1.978 0.01 . 1313 135 135 GLU HG2 H 2.173 0.01 . 1314 135 135 GLU HG3 H 2.173 0.01 . 1315 135 135 GLU C C 178.632 0.23 . 1316 135 135 GLU CA C 58.493 0.23 . 1317 135 135 GLU CB C 29.424 0.23 . 1318 135 135 GLU CG C 36.281 0.23 . 1319 135 135 GLU N N 119.613 0.01 . 1320 136 136 MET H H 8.018 0.01 . 1321 136 136 MET HA H 4.118 0.01 . 1322 136 136 MET HB2 H 2.051 0.01 . 1323 136 136 MET HB3 H 2.051 0.01 . 1324 136 136 MET HG2 H 2.520 0.01 . 1325 136 136 MET HG3 H 2.520 0.01 . 1326 136 136 MET C C 177.940 0.23 . 1327 136 136 MET CA C 57.798 0.23 . 1328 136 136 MET CB C 32.021 0.23 . 1329 136 136 MET CG C 32.021 0.23 . 1330 136 136 MET N N 118.942 0.01 . 1331 137 137 LYS H H 7.752 0.01 . 1332 137 137 LYS HA H 3.962 0.01 . 1333 137 137 LYS HB2 H 1.722 0.01 . 1334 137 137 LYS HB3 H 1.722 0.01 . 1335 137 137 LYS HG2 H 1.371 0.01 . 1336 137 137 LYS HG3 H 1.371 0.01 . 1337 137 137 LYS C C 177.878 0.23 . 1338 137 137 LYS CA C 58.271 0.23 . 1339 137 137 LYS CB C 32.329 0.23 . 1340 137 137 LYS CD C 29.337 0.23 . 1341 137 137 LYS CE C 41.860 0.23 . 1342 137 137 LYS CG C 25.246 0.23 . 1343 137 137 LYS N N 119.492 0.01 . 1344 138 138 ARG H H 7.762 0.01 . 1345 138 138 ARG HA H 3.962 0.01 . 1346 138 138 ARG HB2 H 1.686 0.01 . 1347 138 138 ARG HB3 H 1.571 0.01 . 1348 138 138 ARG HD2 H 2.977 0.01 . 1349 138 138 ARG HD3 H 2.977 0.01 . 1350 138 138 ARG HG2 H 1.358 0.01 . 1351 138 138 ARG HG3 H 1.358 0.01 . 1352 138 138 ARG C C 177.392 0.23 . 1353 138 138 ARG CA C 57.718 0.23 . 1354 138 138 ARG CB C 30.177 0.23 . 1355 138 138 ARG CD C 43.517 0.23 . 1356 138 138 ARG CG C 26.980 0.23 . 1357 138 138 ARG N N 119.845 0.01 . 1358 139 139 LYS H H 7.823 0.01 . 1359 139 139 LYS HA H 4.036 0.01 . 1360 139 139 LYS HB2 H 1.763 0.01 . 1361 139 139 LYS HB3 H 1.763 0.01 . 1362 139 139 LYS HD2 H 1.449 0.01 . 1363 139 139 LYS HD3 H 1.449 0.01 . 1364 139 139 LYS HE2 H 2.821 0.01 . 1365 139 139 LYS HE3 H 2.821 0.01 . 1366 139 139 LYS HG2 H 1.319 0.01 . 1367 139 139 LYS HG3 H 1.319 0.01 . 1368 139 139 LYS C C 177.179 0.23 . 1369 139 139 LYS CA C 57.472 0.23 . 1370 139 139 LYS CB C 32.520 0.23 . 1371 139 139 LYS N N 119.957 0.01 . 1372 140 140 LEU HA H 4.097 0.01 . 1373 140 140 LEU HB2 H 1.524 0.01 . 1374 140 140 LEU HB3 H 1.326 0.01 . 1375 140 140 LEU C C 177.659 0.23 . 1376 140 140 LEU CA C 56.155 0.23 . 1377 140 140 LEU CB C 42.103 0.23 . 1378 140 140 LEU CD1 C 24.936 0.23 . 1379 140 140 LEU CD2 C 23.448 0.23 . 1380 140 140 LEU CG C 26.734 0.23 . 1381 141 141 HIS H H 8.068 0.01 . 1382 141 141 HIS HA H 4.493 0.01 . 1383 141 141 HIS HB2 H 3.017 0.01 . 1384 141 141 HIS HB3 H 3.017 0.01 . 1385 141 141 HIS C C 172.791 0.23 . 1386 141 141 HIS CA C 58.271 0.23 . 1387 141 141 HIS CB C 29.378 0.23 . 1388 141 141 HIS N N 117.826 0.01 . 1389 144 144 GLU HA H 4.077 0.01 . 1390 144 144 GLU HB2 H 1.968 0.01 . 1391 144 144 GLU HB3 H 1.900 0.01 . 1392 144 144 GLU C C 177.252 0.23 . 1393 144 144 GLU CA C 57.482 0.23 . 1394 144 144 GLU CB C 29.929 0.23 . 1395 144 144 GLU CG C 36.263 0.23 . 1396 145 145 GLY H H 8.225 0.01 . 1397 145 145 GLY HA2 H 3.805 0.01 . 1398 145 145 GLY HA3 H 3.805 0.01 . 1399 145 145 GLY C C 174.576 0.23 . 1400 145 145 GLY CA C 45.601 0.23 . 1401 145 145 GLY N N 108.702 0.01 . 1402 146 146 LEU H H 7.832 0.01 . 1403 146 146 LEU HA H 4.139 0.01 . 1404 146 146 LEU HB2 H 1.503 0.01 . 1405 146 146 LEU HB3 H 1.456 0.01 . 1406 146 146 LEU HD1 H 0.796 0.01 . 1407 146 146 LEU HD2 H 0.796 0.01 . 1408 146 146 LEU HG H 1.306 0.01 . 1409 146 146 LEU C C 177.323 0.23 . 1410 146 146 LEU CA C 55.523 0.23 . 1411 146 146 LEU CB C 42.126 0.23 . 1412 146 146 LEU CD1 C 24.812 0.23 . 1413 146 146 LEU CD2 C 23.510 0.23 . 1414 146 146 LEU CG C 26.920 0.23 . 1415 146 146 LEU N N 121.384 0.01 . 1416 147 147 ASN H H 8.258 0.01 . 1417 147 147 ASN HA H 4.515 0.01 . 1418 147 147 ASN HB2 H 2.730 0.01 . 1419 147 147 ASN HB3 H 2.672 0.01 . 1420 147 147 ASN C C 175.761 0.23 . 1421 147 147 ASN CA C 53.816 0.23 . 1422 147 147 ASN CB C 38.271 0.23 . 1423 147 147 ASN N N 118.974 0.01 . 1424 148 148 ILE H H 7.894 0.01 . 1425 148 148 ILE HA H 3.946 0.01 . 1426 148 148 ILE HB H 1.769 0.01 . 1427 148 148 ILE HD1 H 0.639 0.01 . 1428 148 148 ILE HG12 H 1.472 0.01 . 1429 148 148 ILE HG13 H 1.472 0.01 . 1430 148 148 ILE HG2 H 0.718 0.01 . 1431 148 148 ILE C C 176.501 0.23 . 1432 148 148 ILE CA C 61.968 0.23 . 1433 148 148 ILE CB C 38.397 0.23 . 1434 148 148 ILE CD1 C 13.087 0.23 . 1435 148 148 ILE CG1 C 27.534 0.23 . 1436 148 148 ILE CG2 C 17.575 0.23 . 1437 148 148 ILE N N 121.272 0.01 . 1438 149 149 LYS H H 8.104 0.01 . 1439 149 149 LYS HA H 4.113 0.01 . 1440 149 149 LYS HB2 H 1.702 0.01 . 1441 149 149 LYS HB3 H 1.702 0.01 . 1442 149 149 LYS HD2 H 1.528 0.01 . 1443 149 149 LYS HD3 H 1.528 0.01 . 1444 149 149 LYS HE2 H 2.860 0.01 . 1445 149 149 LYS HE3 H 2.860 0.01 . 1446 149 149 LYS HG2 H 1.253 0.01 . 1447 149 149 LYS HG3 H 1.253 0.01 . 1448 149 149 LYS C C 177.179 0.23 . 1449 149 149 LYS CA C 57.166 0.23 . 1450 149 149 LYS CB C 32.646 0.23 . 1451 149 149 LYS CD C 29.132 0.23 . 1452 149 149 LYS CE C 42.042 0.23 . 1453 149 149 LYS CG C 25.136 0.23 . 1454 149 149 LYS N N 123.820 0.01 . 1455 150 150 LEU H H 8.020 0.01 . 1456 150 150 LEU HA H 4.165 0.01 . 1457 150 150 LEU HB2 H 1.540 0.01 . 1458 150 150 LEU HB3 H 1.467 0.01 . 1459 150 150 LEU C C 177.522 0.23 . 1460 150 150 LEU CA C 55.333 0.23 . 1461 150 150 LEU CB C 42.189 0.23 . 1462 150 150 LEU CD1 C 24.936 0.23 . 1463 150 150 LEU CD2 C 23.510 0.23 . 1464 150 150 LEU CG C 27.106 0.23 . 1465 150 150 LEU N N 122.153 0.01 . 1466 151 151 ALA H H 8.073 0.01 . 1467 151 151 ALA HA H 4.218 0.01 . 1468 151 151 ALA HB H 1.306 0.01 . 1469 151 151 ALA C C 177.879 0.23 . 1470 151 151 ALA CA C 52.868 0.23 . 1471 151 151 ALA CB C 18.933 0.23 . 1472 151 151 ALA N N 124.023 0.01 . 1473 153 153 GLN HA H 4.186 0.01 . 1474 153 153 GLN HB2 H 1.989 0.01 . 1475 153 153 GLN HB3 H 1.942 0.01 . 1476 153 153 GLN C C 176.143 0.23 . 1477 153 153 GLN CA C 55.997 0.23 . 1478 153 153 GLN CB C 29.132 0.23 . 1479 153 153 GLN CG C 33.743 0.23 . 1480 154 154 LEU H H 8.116 0.01 . 1481 154 154 LEU HA H 4.050 0.01 . 1482 154 154 LEU HB2 H 1.550 0.01 . 1483 154 154 LEU HB3 H 1.472 0.01 . 1484 154 154 LEU HD1 H 0.770 0.01 . 1485 154 154 LEU HD2 H 0.770 0.01 . 1486 154 154 LEU C C 177.221 0.23 . 1487 154 154 LEU CA C 55.443 0.23 . 1488 154 154 LEU CB C 42.103 0.23 . 1489 154 154 LEU CD1 C 24.874 0.23 . 1490 154 154 LEU CD2 C 23.510 0.23 . 1491 154 154 LEU CG C 26.982 0.23 . 1492 154 154 LEU N N 122.775 0.01 . 1493 155 155 ILE H H 7.944 0.01 . 1494 155 155 ILE HA H 4.087 0.01 . 1495 155 155 ILE HB H 1.780 0.01 . 1496 155 155 ILE HD1 H 0.692 0.01 . 1497 155 155 ILE HG12 H 1.018 0.01 . 1498 155 155 ILE HG13 H 1.018 0.01 . 1499 155 155 ILE HG2 H 0.770 0.01 . 1500 155 155 ILE C C 176.090 0.23 . 1501 155 155 ILE CA C 61.210 0.23 . 1502 155 155 ILE CB C 38.713 0.23 . 1503 155 155 ILE CD1 C 12.847 0.23 . 1504 155 155 ILE CG1 C 27.292 0.23 . 1505 155 155 ILE CG2 C 17.497 0.23 . 1506 155 155 ILE N N 121.200 0.01 . 1507 156 156 SER H H 8.230 0.01 . 1508 156 156 SER HA H 4.332 0.01 . 1509 156 156 SER HB2 H 3.758 0.01 . 1510 156 156 SER HB3 H 3.727 0.01 . 1511 156 156 SER C C 174.371 0.23 . 1512 156 156 SER CA C 58.177 0.23 . 1513 156 156 SER CB C 63.801 0.23 . 1514 156 156 SER N N 119.844 0.01 . 1515 157 157 LYS H H 8.267 0.01 . 1516 157 157 LYS HA H 4.238 0.01 . 1517 157 157 LYS HB2 H 1.759 0.01 . 1518 157 157 LYS HB3 H 1.649 0.01 . 1519 157 157 LYS HG2 H 1.279 0.01 . 1520 157 157 LYS HG3 H 1.279 0.01 . 1521 157 157 LYS C C 175.885 0.23 . 1522 157 157 LYS CA C 56.407 0.23 . 1523 157 157 LYS CB C 32.899 0.23 . 1524 157 157 LYS CD C 29.089 0.23 . 1525 157 157 LYS CE C 41.922 0.23 . 1526 157 157 LYS CG C 24.440 0.23 . 1527 157 157 LYS N N 123.513 0.01 . 1528 158 158 ASP H H 8.222 0.01 . 1529 158 158 ASP HA H 4.510 0.01 . 1530 158 158 ASP HB2 H 2.641 0.01 . 1531 158 158 ASP HB3 H 2.432 0.01 . 1532 158 158 ASP C C 174.992 0.23 . 1533 158 158 ASP CA C 54.575 0.23 . 1534 158 158 ASP CB C 41.051 0.23 . 1535 158 158 ASP N N 121.561 0.01 . 1536 159 159 LEU H H 7.668 0.01 . 1537 159 159 LEU HA H 4.034 0.01 . 1538 159 159 LEU HB2 H 1.452 0.01 . 1539 159 159 LEU HB3 H 1.452 0.01 . 1540 159 159 LEU HD1 H 0.718 0.01 . 1541 159 159 LEU HD2 H 0.718 0.01 . 1542 159 159 LEU HG H 1.400 0.01 . 1543 159 159 LEU C C 173.610 0.23 . 1544 159 159 LEU CA C 56.850 0.23 . 1545 159 159 LEU CB C 43.326 0.23 . 1546 159 159 LEU N N 127.601 0.01 . stop_ save_