save_polymer _Saveframe_category monomeric_polymer ############################## # Polymer residue sequence # ############################## _Residue_count 91 _Mol_residue_sequence ; MGHHHHHHSHMLTKHGKNPV MELNEKRRGLKYELISETGG SHDKRFVMEVEVDGQKFQGA GSNKKVAKAYAALAALEKLF PDTPLALDANK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 GLY 3 3 HIS 4 4 HIS 6 6 HIS 7 7 HIS 8 8 HIS 9 9 SER 11 11 MET 12 12 LEU 13 13 THR 14 14 LYS 16 16 GLY 17 17 LYS 18 18 ASN 19 19 PRO 21 21 MET 22 22 GLU 23 23 LEU 24 24 ASN 26 26 LYS 27 27 ARG 28 28 ARG 29 29 GLY 31 31 LYS 32 32 TYR 33 33 GLU 34 34 LEU 36 36 SER 37 37 GLU 38 38 THR 39 39 GLY 41 41 SER 42 42 HIS 43 43 ASP 44 44 LYS 46 46 PHE 47 47 VAL 48 48 MET 49 49 GLU 51 51 GLU 52 52 VAL 53 53 ASP 54 54 GLY 56 56 LYS 57 57 PHE 58 58 GLN 59 59 GLY 61 61 GLY 62 62 SER 63 63 ASN 64 64 LYS 66 66 VAL 67 67 ALA 68 68 LYS 69 69 ALA 71 71 ALA 72 72 ALA 73 73 LEU 74 74 ALA 76 76 LEU 77 77 GLU 78 78 LYS 79 79 LEU 81 81 PRO 82 82 ASP 83 83 THR 84 84 PRO 86 86 ALA 87 87 LEU 88 88 ASP 89 89 ALA 91 91 LYS stop_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # Index Value Definition # # # # 1 Unique # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups # # 3 Aromatic atoms on opposite sides of the ring # # (e.g. Tyr HE1 and HE2 protons) # # 4 Intraresidue ambiguities (e.g. Lys HG and # # HD protons) # # 5 Interresidue ambiguities (Lys 12 vs. Lys 27) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Saveframe_category assigned_chemical_shifts 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_type 1 10 10 HIS C C 174.789 0.400 1 2 11 11 MET C C 174.881 0.400 1 3 12 12 LEU C C 177.367 0.400 1 4 15 15 HIS C C 175.064 0.400 1 5 16 16 GLY C C 173.711 0.400 1 6 17 17 LYS C C 175.594 0.400 1 7 19 19 PRO C C 177.111 0.400 1 8 20 20 VAL C C 178.921 0.400 1 9 21 21 MET C C 178.483 0.400 1 10 22 22 GLU C C 178.921 0.400 1 11 23 23 LEU C C 177.770 0.400 1 12 24 24 ASN C C 175.941 0.400 1 13 25 25 GLU C C 178.007 0.400 1 14 26 26 LYS C C 177.824 0.400 1 15 27 27 ARG C C 173.034 0.400 1 16 28 28 ARG C C 178.062 0.400 1 17 29 29 GLY C C 174.991 0.400 1 18 30 30 LEU C C 176.929 0.400 1 19 31 31 LYS C C 174.204 0.400 1 20 32 32 TYR C C 175.630 0.400 1 21 33 33 GLU C C 174.808 0.400 1 22 34 34 LEU C C 176.508 0.400 1 23 35 35 ILE C C 176.398 0.400 1 24 36 36 SER C C 171.681 0.400 1 25 37 37 GLU C C 174.753 0.400 1 26 38 38 THR C C 173.967 0.400 1 27 39 39 GLY C C 174.844 0.400 1 28 43 43 ASP C C 174.442 0.400 1 29 46 46 PHE C C 174.808 0.400 1 30 47 47 VAL C C 175.704 0.400 1 31 48 48 MET C C 174.168 0.400 1 32 49 49 GLU C C 173.583 0.400 1 33 50 50 VAL C C 171.809 0.400 1 34 51 51 GLU C C 175.667 0.400 1 35 52 52 VAL C C 174.369 0.400 1 36 53 53 ASP C C 176.380 0.400 1 37 54 54 GLY C C 173.601 0.400 1 38 55 55 GLN C C 173.016 0.400 1 39 56 56 LYS C C 175.576 0.400 1 40 57 57 PHE C C 174.204 0.400 1 41 58 58 GLN C C 175.228 0.400 1 42 59 59 GLY C C 170.475 0.400 1 43 60 60 ALA C C 177.002 0.400 1 44 61 61 GLY C C 172.760 0.400 1 45 62 62 SER C C 172.888 0.400 1 46 63 63 ASN C C 174.278 0.400 1 47 64 64 LYS C C 177.093 0.400 1 48 65 65 LYS C C 179.635 0.400 1 49 66 66 VAL C C 176.526 0.400 1 50 67 67 ALA C C 178.958 0.400 1 51 68 68 LYS C C 177.020 0.400 1 52 69 69 ALA C C 179.580 0.400 1 53 70 70 TYR C C 179.031 0.400 1 54 71 71 ALA C C 177.916 0.400 1 55 72 72 ALA C C 179.561 0.400 1 56 73 73 LEU C C 178.099 0.400 1 57 74 74 ALA C C 179.872 0.400 1 58 75 75 ALA C C 179.232 0.400 1 59 76 76 LEU C C 179.104 0.400 1 60 77 77 GLU C C 177.660 0.400 1 61 78 78 LYS C C 177.770 0.400 1 62 79 79 LEU C C 176.819 0.400 1 63 81 81 PRO C C 177.148 0.400 1 64 82 82 ASP C C 176.088 0.400 1 65 84 84 PRO C C 176.654 0.400 1 66 85 85 LEU C C 176.929 0.400 1 67 86 86 ALA C C 177.404 0.400 1 68 87 87 LEU C C 177.038 0.400 1 69 88 88 ASP C C 175.850 0.400 1 70 89 89 ALA C C 177.331 0.400 1 71 90 90 ASN C C 174.022 0.400 1 stop_ save_