################################ # Residual dipolar couplings # ################################ save_RDC_list_1 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_1 _RDC_list.Entry_ID 17141 _RDC_list.ID 1 _RDC_list.Sample_condition_list_ID 1 _RDC_list.Sample_condition_list_label $sample_conditions_1 _RDC_list.Spectrometer_frequency_1H 600 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details . _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 8 '3D HNCO JCACO' . . . 17141 1 9 '3D HNCO JNH' . . . 17141 1 10 '3D HNCOCA JCAHA' . . . 17141 1 11 '3D HNCO JCACO' . . . 17141 1 12 '3D HNCO JNH' . . . 17141 1 13 '3D HNCOCA JCAHA' . . . 17141 1 stop_ loop_ _RDC_software.Software_ID _RDC_software.Software_label _RDC_software.Method_ID _RDC_software.Method_label _RDC_software.Entry_ID _RDC_software.RDC_list_ID 1 $NMRPipe . . 17141 1 2 $NMRView . . 17141 1 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 DCCA . 1 1 7 7 GLY C C 13 . . 1 1 7 7 GLY CA C 13 . -2.44 . . . . . . 1 7 GLY C 1 7 GLY CA 17141 1 2 DCCA . 1 1 11 11 ASN C C 13 . . 1 1 11 11 ASN CA C 13 . -3.06 . . . . . . 1 11 ASN C 1 11 ASN CA 17141 1 3 DCCA . 1 1 12 12 LEU C C 13 . . 1 1 12 12 LEU CA C 13 . 0.17 . . . . . . 1 12 LEU C 1 12 LEU CA 17141 1 4 DCCA . 1 1 13 13 LEU C C 13 . . 1 1 13 13 LEU CA C 13 . 2.11 . . . . . . 1 13 LEU C 1 13 LEU CA 17141 1 5 DCCA . 1 1 14 14 GLN C C 13 . . 1 1 14 14 GLN CA C 13 . -4.26 . . . . . . 1 14 GLN C 1 14 GLN CA 17141 1 6 DCCA . 1 1 15 15 GLU C C 13 . . 1 1 15 15 GLU CA C 13 . -0.62 . . . . . . 1 15 GLU C 1 15 GLU CA 17141 1 7 DCCA . 1 1 16 16 TYR C C 13 . . 1 1 16 16 TYR CA C 13 . 0.21 . . . . . . 1 16 TYR C 1 16 TYR CA 17141 1 8 DCCA . 1 1 17 17 ALA C C 13 . . 1 1 17 17 ALA CA C 13 . 0.81 . . . . . . 1 17 ALA C 1 17 ALA CA 17141 1 9 DCCA . 1 1 18 18 GLN C C 13 . . 1 1 18 18 GLN CA C 13 . -5.50 . . . . . . 1 18 GLN C 1 18 GLN CA 17141 1 10 DCCA . 1 1 19 19 LYS C C 13 . . 1 1 19 19 LYS CA C 13 . 0.81 . . . . . . 1 19 LYS C 1 19 LYS CA 17141 1 11 DCCA . 1 1 20 20 MET C C 13 . . 1 1 20 20 MET CA C 13 . -0.88 . . . . . . 1 20 MET C 1 20 MET CA 17141 1 12 DCCA . 1 1 21 21 ASN C C 13 . . 1 1 21 21 ASN CA C 13 . -1.82 . . . . . . 1 21 ASN C 1 21 ASN CA 17141 1 13 DCCA . 1 1 22 22 TYR C C 13 . . 1 1 22 22 TYR CA C 13 . -2.63 . . . . . . 1 22 TYR C 1 22 TYR CA 17141 1 14 DCCA . 1 1 23 23 ALA C C 13 . . 1 1 23 23 ALA CA C 13 . -0.23 . . . . . . 1 23 ALA C 1 23 ALA CA 17141 1 15 DCCA . 1 1 25 25 PRO C C 13 . . 1 1 25 25 PRO CA C 13 . -5.35 . . . . . . 1 25 PRO C 1 25 PRO CA 17141 1 16 DCCA . 1 1 26 26 LEU C C 13 . . 1 1 26 26 LEU CA C 13 . 0.20 . . . . . . 1 26 LEU C 1 26 LEU CA 17141 1 17 DCCA . 1 1 27 27 TYR C C 13 . . 1 1 27 27 TYR CA C 13 . -4.38 . . . . . . 1 27 TYR C 1 27 TYR CA 17141 1 18 DCCA . 1 1 29 29 CYS C C 13 . . 1 1 29 29 CYS CA C 13 . -2.74 . . . . . . 1 29 CYS C 1 29 CYS CA 17141 1 19 DCCA . 1 1 30 30 GLN C C 13 . . 1 1 30 30 GLN CA C 13 . -0.58 . . . . . . 1 30 GLN C 1 30 GLN CA 17141 1 20 DCCA . 1 1 31 31 LYS C C 13 . . 1 1 31 31 LYS CA C 13 . 1.35 . . . . . . 1 31 LYS C 1 31 LYS CA 17141 1 21 DCCA . 1 1 32 32 VAL C C 13 . . 1 1 32 32 VAL CA C 13 . -1.92 . . . . . . 1 32 VAL C 1 32 VAL CA 17141 1 22 DCCA . 1 1 33 33 GLU C C 13 . . 1 1 33 33 GLU CA C 13 . 2.71 . . . . . . 1 33 GLU C 1 33 GLU CA 17141 1 23 DCCA . 1 1 36 36 GLY C C 13 . . 1 1 36 36 GLY CA C 13 . 1.31 . . . . . . 1 36 GLY C 1 36 GLY CA 17141 1 24 DCCA . 1 1 37 37 ARG C C 13 . . 1 1 37 37 ARG CA C 13 . -0.64 . . . . . . 1 37 ARG C 1 37 ARG CA 17141 1 25 DCCA . 1 1 38 38 VAL C C 13 . . 1 1 38 38 VAL CA C 13 . 0.01 . . . . . . 1 38 VAL C 1 38 VAL CA 17141 1 26 DCCA . 1 1 39 39 THR C C 13 . . 1 1 39 39 THR CA C 13 . -4.67 . . . . . . 1 39 THR C 1 39 THR CA 17141 1 27 DCCA . 1 1 40 40 GLN C C 13 . . 1 1 40 40 GLN CA C 13 . 0.61 . . . . . . 1 40 GLN C 1 40 GLN CA 17141 1 28 DCCA . 1 1 41 41 PHE C C 13 . . 1 1 41 41 PHE CA C 13 . -4.01 . . . . . . 1 41 PHE C 1 41 PHE CA 17141 1 29 DCCA . 1 1 42 42 THR C C 13 . . 1 1 42 42 THR CA C 13 . 1.32 . . . . . . 1 42 THR C 1 42 THR CA 17141 1 30 DCCA . 1 1 43 43 CYS C C 13 . . 1 1 43 43 CYS CA C 13 . -3.82 . . . . . . 1 43 CYS C 1 43 CYS CA 17141 1 31 DCCA . 1 1 44 44 THR C C 13 . . 1 1 44 44 THR CA C 13 . 1.64 . . . . . . 1 44 THR C 1 44 THR CA 17141 1 32 DCCA . 1 1 45 45 VAL C C 13 . . 1 1 45 45 VAL CA C 13 . -1.99 . . . . . . 1 45 VAL C 1 45 VAL CA 17141 1 33 DCCA . 1 1 46 46 GLU C C 13 . . 1 1 46 46 GLU CA C 13 . -1.74 . . . . . . 1 46 GLU C 1 46 GLU CA 17141 1 34 DCCA . 1 1 47 47 ILE C C 13 . . 1 1 47 47 ILE CA C 13 . -2.11 . . . . . . 1 47 ILE C 1 47 ILE CA 17141 1 35 DCCA . 1 1 48 48 GLY C C 13 . . 1 1 48 48 GLY CA C 13 . 1.25 . . . . . . 1 48 GLY C 1 48 GLY CA 17141 1 36 DCCA . 1 1 49 49 GLY C C 13 . . 1 1 49 49 GLY CA C 13 . 2.01 . . . . . . 1 49 GLY C 1 49 GLY CA 17141 1 37 DCCA . 1 1 50 50 ILE C C 13 . . 1 1 50 50 ILE CA C 13 . -3.05 . . . . . . 1 50 ILE C 1 50 ILE CA 17141 1 38 DCCA . 1 1 51 51 LYS C C 13 . . 1 1 51 51 LYS CA C 13 . 0.30 . . . . . . 1 51 LYS C 1 51 LYS CA 17141 1 39 DCCA . 1 1 52 52 TYR C C 13 . . 1 1 52 52 TYR CA C 13 . -4.61 . . . . . . 1 52 TYR C 1 52 TYR CA 17141 1 40 DCCA . 1 1 53 53 THR C C 13 . . 1 1 53 53 THR CA C 13 . 1.25 . . . . . . 1 53 THR C 1 53 THR CA 17141 1 41 DCCA . 1 1 54 54 GLY C C 13 . . 1 1 54 54 GLY CA C 13 . -0.43 . . . . . . 1 54 GLY C 1 54 GLY CA 17141 1 42 DCCA . 1 1 55 55 ALA C C 13 . . 1 1 55 55 ALA CA C 13 . -4.38 . . . . . . 1 55 ALA C 1 55 ALA CA 17141 1 43 DCCA . 1 1 56 56 ALA C C 13 . . 1 1 56 56 ALA CA C 13 . 0.01 . . . . . . 1 56 ALA C 1 56 ALA CA 17141 1 44 DCCA . 1 1 57 57 THR C C 13 . . 1 1 57 57 THR CA C 13 . -3.65 . . . . . . 1 57 THR C 1 57 THR CA 17141 1 45 DCCA . 1 1 58 58 ARG C C 13 . . 1 1 58 58 ARG CA C 13 . 1.39 . . . . . . 1 58 ARG C 1 58 ARG CA 17141 1 46 DCCA . 1 1 59 59 THR C C 13 . . 1 1 59 59 THR CA C 13 . -1.45 . . . . . . 1 59 THR C 1 59 THR CA 17141 1 47 DCCA . 1 1 60 60 LYS C C 13 . . 1 1 60 60 LYS CA C 13 . -2.85 . . . . . . 1 60 LYS C 1 60 LYS CA 17141 1 48 DCCA . 1 1 61 61 LYS C C 13 . . 1 1 61 61 LYS CA C 13 . -1.43 . . . . . . 1 61 LYS C 1 61 LYS CA 17141 1 49 DCCA . 1 1 62 62 ASP C C 13 . . 1 1 62 62 ASP CA C 13 . 0.37 . . . . . . 1 62 ASP C 1 62 ASP CA 17141 1 50 DCCA . 1 1 63 63 ALA C C 13 . . 1 1 63 63 ALA CA C 13 . -1.63 . . . . . . 1 63 ALA C 1 63 ALA CA 17141 1 51 DCCA . 1 1 64 64 GLU C C 13 . . 1 1 64 64 GLU CA C 13 . -4.16 . . . . . . 1 64 GLU C 1 64 GLU CA 17141 1 52 DCCA . 1 1 65 65 ILE C C 13 . . 1 1 65 65 ILE CA C 13 . 1.53 . . . . . . 1 65 ILE C 1 65 ILE CA 17141 1 53 DCCA . 1 1 66 66 SER C C 13 . . 1 1 66 66 SER CA C 13 . -1.30 . . . . . . 1 66 SER C 1 66 SER CA 17141 1 54 DCCA . 1 1 67 67 ALA C C 13 . . 1 1 67 67 ALA CA C 13 . -2.50 . . . . . . 1 67 ALA C 1 67 ALA CA 17141 1 55 DCCA . 1 1 68 68 GLY C C 13 . . 1 1 68 68 GLY CA C 13 . -1.76 . . . . . . 1 68 GLY C 1 68 GLY CA 17141 1 56 DCCA . 1 1 69 69 ARG C C 13 . . 1 1 69 69 ARG CA C 13 . 0.93 . . . . . . 1 69 ARG C 1 69 ARG CA 17141 1 57 DCCA . 1 1 70 70 THR C C 13 . . 1 1 70 70 THR CA C 13 . -1.17 . . . . . . 1 70 THR C 1 70 THR CA 17141 1 58 DCCA . 1 1 71 71 ALA C C 13 . . 1 1 71 71 ALA CA C 13 . -3.32 . . . . . . 1 71 ALA C 1 71 ALA CA 17141 1 59 DCCA . 1 1 72 72 LEU C C 13 . . 1 1 72 72 LEU CA C 13 . 0.04 . . . . . . 1 72 LEU C 1 72 LEU CA 17141 1 60 DCCA . 1 1 73 73 LEU C C 13 . . 1 1 73 73 LEU CA C 13 . -0.65 . . . . . . 1 73 LEU C 1 73 LEU CA 17141 1 61 DCCA . 1 1 74 74 ALA C C 13 . . 1 1 74 74 ALA CA C 13 . -1.35 . . . . . . 1 74 ALA C 1 74 ALA CA 17141 1 62 DCCA . 1 1 75 75 ILE C C 13 . . 1 1 75 75 ILE CA C 13 . -2.08 . . . . . . 1 75 ILE C 1 75 ILE CA 17141 1 63 DCCA . 1 1 76 76 GLN C C 13 . . 1 1 76 76 GLN CA C 13 . 0.18 . . . . . . 1 76 GLN C 1 76 GLN CA 17141 1 64 DCAHA . 1 1 11 11 ASN CA C 13 . . 1 1 11 11 ASN HA H 1 . 9.78 . . . . . . 1 11 ASN CA 1 11 ASN HA 17141 1 65 DCAHA . 1 1 12 12 LEU CA C 13 . . 1 1 12 12 LEU HA H 1 . -7.58 . . . . . . 1 12 LEU CA 1 12 LEU HA 17141 1 66 DCAHA . 1 1 13 13 LEU CA C 13 . . 1 1 13 13 LEU HA H 1 . -19.48 . . . . . . 1 13 LEU CA 1 13 LEU HA 17141 1 67 DCAHA . 1 1 15 15 GLU CA C 13 . . 1 1 15 15 GLU HA H 1 . 29.25 . . . . . . 1 15 GLU CA 1 15 GLU HA 17141 1 68 DCAHA . 1 1 16 16 TYR CA C 13 . . 1 1 16 16 TYR HA H 1 . -40.68 . . . . . . 1 16 TYR CA 1 16 TYR HA 17141 1 69 DCAHA . 1 1 17 17 ALA CA C 13 . . 1 1 17 17 ALA HA H 1 . 10.85 . . . . . . 1 17 ALA CA 1 17 ALA HA 17141 1 70 DCAHA . 1 1 18 18 GLN CA C 13 . . 1 1 18 18 GLN HA H 1 . 4.55 . . . . . . 1 18 GLN CA 1 18 GLN HA 17141 1 71 DCAHA . 1 1 19 19 LYS CA C 13 . . 1 1 19 19 LYS HA H 1 . 14.87 . . . . . . 1 19 LYS CA 1 19 LYS HA 17141 1 72 DCAHA . 1 1 20 20 MET CA C 13 . . 1 1 20 20 MET HA H 1 . -42.76 . . . . . . 1 20 MET CA 1 20 MET HA 17141 1 73 DCAHA . 1 1 21 21 ASN CA C 13 . . 1 1 21 21 ASN HA H 1 . 15.66 . . . . . . 1 21 ASN CA 1 21 ASN HA 17141 1 74 DCAHA . 1 1 22 22 TYR CA C 13 . . 1 1 22 22 TYR HA H 1 . 12.70 . . . . . . 1 22 TYR CA 1 22 TYR HA 17141 1 75 DCAHA . 1 1 23 23 ALA CA C 13 . . 1 1 23 23 ALA HA H 1 . 29.53 . . . . . . 1 23 ALA CA 1 23 ALA HA 17141 1 76 DCAHA . 1 1 25 25 PRO CA C 13 . . 1 1 25 25 PRO HA H 1 . 15.90 . . . . . . 1 25 PRO CA 1 25 PRO HA 17141 1 77 DCAHA . 1 1 26 26 LEU CA C 13 . . 1 1 26 26 LEU HA H 1 . 20.33 . . . . . . 1 26 LEU CA 1 26 LEU HA 17141 1 78 DCAHA . 1 1 27 27 TYR CA C 13 . . 1 1 27 27 TYR HA H 1 . 8.17 . . . . . . 1 27 TYR CA 1 27 TYR HA 17141 1 79 DCAHA . 1 1 29 29 CYS CA C 13 . . 1 1 29 29 CYS HA H 1 . 1.64 . . . . . . 1 29 CYS CA 1 29 CYS HA 17141 1 80 DCAHA . 1 1 30 30 GLN CA C 13 . . 1 1 30 30 GLN HA H 1 . 1.16 . . . . . . 1 30 GLN CA 1 30 GLN HA 17141 1 81 DCAHA . 1 1 31 31 LYS CA C 13 . . 1 1 31 31 LYS HA H 1 . -4.99 . . . . . . 1 31 LYS CA 1 31 LYS HA 17141 1 82 DCAHA . 1 1 32 32 VAL CA C 13 . . 1 1 32 32 VAL HA H 1 . -4.54 . . . . . . 1 32 VAL CA 1 32 VAL HA 17141 1 83 DCAHA . 1 1 33 33 GLU CA C 13 . . 1 1 33 33 GLU HA H 1 . 5.84 . . . . . . 1 33 GLU CA 1 33 GLU HA 17141 1 84 DCAHA . 1 1 37 37 ARG CA C 13 . . 1 1 37 37 ARG HA H 1 . 2.11 . . . . . . 1 37 ARG CA 1 37 ARG HA 17141 1 85 DCAHA . 1 1 38 38 VAL CA C 13 . . 1 1 38 38 VAL HA H 1 . 0.78 . . . . . . 1 38 VAL CA 1 38 VAL HA 17141 1 86 DCAHA . 1 1 39 39 THR CA C 13 . . 1 1 39 39 THR HA H 1 . 17.41 . . . . . . 1 39 THR CA 1 39 THR HA 17141 1 87 DCAHA . 1 1 40 40 GLN CA C 13 . . 1 1 40 40 GLN HA H 1 . 12.81 . . . . . . 1 40 GLN CA 1 40 GLN HA 17141 1 88 DCAHA . 1 1 41 41 PHE CA C 13 . . 1 1 41 41 PHE HA H 1 . -7.46 . . . . . . 1 41 PHE CA 1 41 PHE HA 17141 1 89 DCAHA . 1 1 42 42 THR CA C 13 . . 1 1 42 42 THR HA H 1 . -5.39 . . . . . . 1 42 THR CA 1 42 THR HA 17141 1 90 DCAHA . 1 1 43 43 CYS CA C 13 . . 1 1 43 43 CYS HA H 1 . -15.40 . . . . . . 1 43 CYS CA 1 43 CYS HA 17141 1 91 DCAHA . 1 1 44 44 THR CA C 13 . . 1 1 44 44 THR HA H 1 . -2.41 . . . . . . 1 44 THR CA 1 44 THR HA 17141 1 92 DCAHA . 1 1 45 45 VAL CA C 13 . . 1 1 45 45 VAL HA H 1 . 0.67 . . . . . . 1 45 VAL CA 1 45 VAL HA 17141 1 93 DCAHA . 1 1 46 46 GLU CA C 13 . . 1 1 46 46 GLU HA H 1 . 23.39 . . . . . . 1 46 GLU CA 1 46 GLU HA 17141 1 94 DCAHA . 1 1 47 47 ILE CA C 13 . . 1 1 47 47 ILE HA H 1 . 27.04 . . . . . . 1 47 ILE CA 1 47 ILE HA 17141 1 95 DCAHA . 1 1 50 50 ILE CA C 13 . . 1 1 50 50 ILE HA H 1 . 17.96 . . . . . . 1 50 ILE CA 1 50 ILE HA 17141 1 96 DCAHA . 1 1 51 51 LYS CA C 13 . . 1 1 51 51 LYS HA H 1 . 32.52 . . . . . . 1 51 LYS CA 1 51 LYS HA 17141 1 97 DCAHA . 1 1 52 52 TYR CA C 13 . . 1 1 52 52 TYR HA H 1 . 28.20 . . . . . . 1 52 TYR CA 1 52 TYR HA 17141 1 98 DCAHA . 1 1 53 53 THR CA C 13 . . 1 1 53 53 THR HA H 1 . 11.83 . . . . . . 1 53 THR CA 1 53 THR HA 17141 1 99 DCAHA . 1 1 55 55 ALA CA C 13 . . 1 1 55 55 ALA HA H 1 . 2.12 . . . . . . 1 55 ALA CA 1 55 ALA HA 17141 1 100 DCAHA . 1 1 56 56 ALA CA C 13 . . 1 1 56 56 ALA HA H 1 . 22.33 . . . . . . 1 56 ALA CA 1 56 ALA HA 17141 1 101 DCAHA . 1 1 57 57 THR CA C 13 . . 1 1 57 57 THR HA H 1 . 19.97 . . . . . . 1 57 THR CA 1 57 THR HA 17141 1 102 DCAHA . 1 1 58 58 ARG CA C 13 . . 1 1 58 58 ARG HA H 1 . -0.49 . . . . . . 1 58 ARG CA 1 58 ARG HA 17141 1 103 DCAHA . 1 1 59 59 THR CA C 13 . . 1 1 59 59 THR HA H 1 . -42.28 . . . . . . 1 59 THR CA 1 59 THR HA 17141 1 104 DCAHA . 1 1 61 61 LYS CA C 13 . . 1 1 61 61 LYS HA H 1 . 3.01 . . . . . . 1 61 LYS CA 1 61 LYS HA 17141 1 105 DCAHA . 1 1 62 62 ASP CA C 13 . . 1 1 62 62 ASP HA H 1 . -22.07 . . . . . . 1 62 ASP CA 1 62 ASP HA 17141 1 106 DCAHA . 1 1 63 63 ALA CA C 13 . . 1 1 63 63 ALA HA H 1 . 13.70 . . . . . . 1 63 ALA CA 1 63 ALA HA 17141 1 107 DCAHA . 1 1 64 64 GLU CA C 13 . . 1 1 64 64 GLU HA H 1 . 8.35 . . . . . . 1 64 GLU CA 1 64 GLU HA 17141 1 108 DCAHA . 1 1 65 65 ILE CA C 13 . . 1 1 65 65 ILE HA H 1 . -2.23 . . . . . . 1 65 ILE CA 1 65 ILE HA 17141 1 109 DCAHA . 1 1 66 66 SER CA C 13 . . 1 1 66 66 SER HA H 1 . -21.22 . . . . . . 1 66 SER CA 1 66 SER HA 17141 1 110 DCAHA . 1 1 67 67 ALA CA C 13 . . 1 1 67 67 ALA HA H 1 . 29.22 . . . . . . 1 67 ALA CA 1 67 ALA HA 17141 1 111 DCAHA . 1 1 69 69 ARG CA C 13 . . 1 1 69 69 ARG HA H 1 . -11.78 . . . . . . 1 69 ARG CA 1 69 ARG HA 17141 1 112 DCAHA . 1 1 70 70 THR CA C 13 . . 1 1 70 70 THR HA H 1 . 7.56 . . . . . . 1 70 THR CA 1 70 THR HA 17141 1 113 DCAHA . 1 1 71 71 ALA CA C 13 . . 1 1 71 71 ALA HA H 1 . 17.11 . . . . . . 1 71 ALA CA 1 71 ALA HA 17141 1 114 DCAHA . 1 1 72 72 LEU CA C 13 . . 1 1 72 72 LEU HA H 1 . 0.84 . . . . . . 1 72 LEU CA 1 72 LEU HA 17141 1 115 DCAHA . 1 1 73 73 LEU CA C 13 . . 1 1 73 73 LEU HA H 1 . -18.09 . . . . . . 1 73 LEU CA 1 73 LEU HA 17141 1 116 DCAHA . 1 1 74 74 ALA CA C 13 . . 1 1 74 74 ALA HA H 1 . 18.16 . . . . . . 1 74 ALA CA 1 74 ALA HA 17141 1 117 DCAHA . 1 1 75 75 ILE CA C 13 . . 1 1 75 75 ILE HA H 1 . 7.50 . . . . . . 1 75 ILE CA 1 75 ILE HA 17141 1 118 DCAHA . 1 1 76 76 GLN CA C 13 . . 1 1 76 76 GLN HA H 1 . 6.53 . . . . . . 1 76 GLN CA 1 76 GLN HA 17141 1 119 DHN . 1 1 8 8 LEU H H 1 . . 1 1 8 8 LEU N N 15 . -0.06 . . . . . . 1 8 LEU H 1 8 LEU N 17141 1 120 DHN . 1 1 12 12 LEU H H 1 . . 1 1 12 12 LEU N N 15 . 2.08 . . . . . . 1 12 LEU H 1 12 LEU N 17141 1 121 DHN . 1 1 13 13 LEU H H 1 . . 1 1 13 13 LEU N N 15 . 14.10 . . . . . . 1 13 LEU H 1 13 LEU N 17141 1 122 DHN . 1 1 14 14 GLN H H 1 . . 1 1 14 14 GLN N N 15 . 2.99 . . . . . . 1 14 GLN H 1 14 GLN N 17141 1 123 DHN . 1 1 15 15 GLU H H 1 . . 1 1 15 15 GLU N N 15 . -1.48 . . . . . . 1 15 GLU H 1 15 GLU N 17141 1 124 DHN . 1 1 16 16 TYR H H 1 . . 1 1 16 16 TYR N N 15 . 7.63 . . . . . . 1 16 TYR H 1 16 TYR N 17141 1 125 DHN . 1 1 17 17 ALA H H 1 . . 1 1 17 17 ALA N N 15 . 10.11 . . . . . . 1 17 ALA H 1 17 ALA N 17141 1 126 DHN . 1 1 18 18 GLN H H 1 . . 1 1 18 18 GLN N N 15 . 0.30 . . . . . . 1 18 GLN H 1 18 GLN N 17141 1 127 DHN . 1 1 19 19 LYS H H 1 . . 1 1 19 19 LYS N N 15 . -0.67 . . . . . . 1 19 LYS H 1 19 LYS N 17141 1 128 DHN . 1 1 20 20 MET H H 1 . . 1 1 20 20 MET N N 15 . 12.70 . . . . . . 1 20 MET H 1 20 MET N 17141 1 129 DHN . 1 1 21 21 ASN H H 1 . . 1 1 21 21 ASN N N 15 . -6.77 . . . . . . 1 21 ASN H 1 21 ASN N 17141 1 130 DHN . 1 1 22 22 TYR H H 1 . . 1 1 22 22 TYR N N 15 . -4.59 . . . . . . 1 22 TYR H 1 22 TYR N 17141 1 131 DHN . 1 1 23 23 ALA H H 1 . . 1 1 23 23 ALA N N 15 . -12.83 . . . . . . 1 23 ALA H 1 23 ALA N 17141 1 132 DHN . 1 1 24 24 ILE H H 1 . . 1 1 24 24 ILE N N 15 . -8.06 . . . . . . 1 24 ILE H 1 24 ILE N 17141 1 133 DHN . 1 1 26 26 LEU H H 1 . . 1 1 26 26 LEU N N 15 . -2.55 . . . . . . 1 26 LEU H 1 26 LEU N 17141 1 134 DHN . 1 1 27 27 TYR H H 1 . . 1 1 27 27 TYR N N 15 . -12.20 . . . . . . 1 27 TYR H 1 27 TYR N 17141 1 135 DHN . 1 1 28 28 GLN H H 1 . . 1 1 28 28 GLN N N 15 . 2.46 . . . . . . 1 28 GLN H 1 28 GLN N 17141 1 136 DHN . 1 1 30 30 GLN H H 1 . . 1 1 30 30 GLN N N 15 . 4.32 . . . . . . 1 30 GLN H 1 30 GLN N 17141 1 137 DHN . 1 1 31 31 LYS H H 1 . . 1 1 31 31 LYS N N 15 . -0.81 . . . . . . 1 31 LYS H 1 31 LYS N 17141 1 138 DHN . 1 1 32 32 VAL H H 1 . . 1 1 32 32 VAL N N 15 . -1.57 . . . . . . 1 32 VAL H 1 32 VAL N 17141 1 139 DHN . 1 1 33 33 GLU H H 1 . . 1 1 33 33 GLU N N 15 . -2.10 . . . . . . 1 33 GLU H 1 33 GLU N 17141 1 140 DHN . 1 1 34 34 THR H H 1 . . 1 1 34 34 THR N N 15 . -4.53 . . . . . . 1 34 THR H 1 34 THR N 17141 1 141 DHN . 1 1 37 37 ARG H H 1 . . 1 1 37 37 ARG N N 15 . -3.02 . . . . . . 1 37 ARG H 1 37 ARG N 17141 1 142 DHN . 1 1 38 38 VAL H H 1 . . 1 1 38 38 VAL N N 15 . -6.48 . . . . . . 1 38 VAL H 1 38 VAL N 17141 1 143 DHN . 1 1 39 39 THR H H 1 . . 1 1 39 39 THR N N 15 . -0.18 . . . . . . 1 39 THR H 1 39 THR N 17141 1 144 DHN . 1 1 40 40 GLN H H 1 . . 1 1 40 40 GLN N N 15 . -2.32 . . . . . . 1 40 GLN H 1 40 GLN N 17141 1 145 DHN . 1 1 41 41 PHE H H 1 . . 1 1 41 41 PHE N N 15 . -0.11 . . . . . . 1 41 PHE H 1 41 PHE N 17141 1 146 DHN . 1 1 42 42 THR H H 1 . . 1 1 42 42 THR N N 15 . 3.80 . . . . . . 1 42 THR H 1 42 THR N 17141 1 147 DHN . 1 1 43 43 CYS H H 1 . . 1 1 43 43 CYS N N 15 . 1.97 . . . . . . 1 43 CYS H 1 43 CYS N 17141 1 148 DHN . 1 1 44 44 THR H H 1 . . 1 1 44 44 THR N N 15 . 3.07 . . . . . . 1 44 THR H 1 44 THR N 17141 1 149 DHN . 1 1 45 45 VAL H H 1 . . 1 1 45 45 VAL N N 15 . -7.73 . . . . . . 1 45 VAL H 1 45 VAL N 17141 1 150 DHN . 1 1 46 46 GLU H H 1 . . 1 1 46 46 GLU N N 15 . -1.88 . . . . . . 1 46 GLU H 1 46 GLU N 17141 1 151 DHN . 1 1 47 47 ILE H H 1 . . 1 1 47 47 ILE N N 15 . -17.65 . . . . . . 1 47 ILE H 1 47 ILE N 17141 1 152 DHN . 1 1 48 48 GLY H H 1 . . 1 1 48 48 GLY N N 15 . -11.70 . . . . . . 1 48 GLY H 1 48 GLY N 17141 1 153 DHN . 1 1 49 49 GLY H H 1 . . 1 1 49 49 GLY N N 15 . -0.10 . . . . . . 1 49 GLY H 1 49 GLY N 17141 1 154 DHN . 1 1 50 50 ILE H H 1 . . 1 1 50 50 ILE N N 15 . -8.87 . . . . . . 1 50 ILE H 1 50 ILE N 17141 1 155 DHN . 1 1 51 51 LYS H H 1 . . 1 1 51 51 LYS N N 15 . -12.62 . . . . . . 1 51 LYS H 1 51 LYS N 17141 1 156 DHN . 1 1 52 52 TYR H H 1 . . 1 1 52 52 TYR N N 15 . -14.38 . . . . . . 1 52 TYR H 1 52 TYR N 17141 1 157 DHN . 1 1 53 53 THR H H 1 . . 1 1 53 53 THR N N 15 . -1.74 . . . . . . 1 53 THR H 1 53 THR N 17141 1 158 DHN . 1 1 54 54 GLY H H 1 . . 1 1 54 54 GLY N N 15 . 3.40 . . . . . . 1 54 GLY H 1 54 GLY N 17141 1 159 DHN . 1 1 55 55 ALA H H 1 . . 1 1 55 55 ALA N N 15 . -3.53 . . . . . . 1 55 ALA H 1 55 ALA N 17141 1 160 DHN . 1 1 56 56 ALA H H 1 . . 1 1 56 56 ALA N N 15 . -15.17 . . . . . . 1 56 ALA H 1 56 ALA N 17141 1 161 DHN . 1 1 57 57 THR H H 1 . . 1 1 57 57 THR N N 15 . -6.14 . . . . . . 1 57 THR H 1 57 THR N 17141 1 162 DHN . 1 1 58 58 ARG H H 1 . . 1 1 58 58 ARG N N 15 . 2.31 . . . . . . 1 58 ARG H 1 58 ARG N 17141 1 163 DHN . 1 1 59 59 THR H H 1 . . 1 1 59 59 THR N N 15 . 13.96 . . . . . . 1 59 THR H 1 59 THR N 17141 1 164 DHN . 1 1 60 60 LYS H H 1 . . 1 1 60 60 LYS N N 15 . 16.23 . . . . . . 1 60 LYS H 1 60 LYS N 17141 1 165 DHN . 1 1 61 61 LYS H H 1 . . 1 1 61 61 LYS N N 15 . 15.63 . . . . . . 1 61 LYS H 1 61 LYS N 17141 1 166 DHN . 1 1 62 62 ASP H H 1 . . 1 1 62 62 ASP N N 15 . 21.52 . . . . . . 1 62 ASP H 1 62 ASP N 17141 1 167 DHN . 1 1 63 63 ALA H H 1 . . 1 1 63 63 ALA N N 15 . 17.13 . . . . . . 1 63 ALA H 1 63 ALA N 17141 1 168 DHN . 1 1 64 64 GLU H H 1 . . 1 1 64 64 GLU N N 15 . 10.99 . . . . . . 1 64 GLU H 1 64 GLU N 17141 1 169 DHN . 1 1 65 65 ILE H H 1 . . 1 1 65 65 ILE N N 15 . 16.67 . . . . . . 1 65 ILE H 1 65 ILE N 17141 1 170 DHN . 1 1 66 66 SER H H 1 . . 1 1 66 66 SER N N 15 . 21.76 . . . . . . 1 66 SER H 1 66 SER N 17141 1 171 DHN . 1 1 67 67 ALA H H 1 . . 1 1 67 67 ALA N N 15 . 13.31 . . . . . . 1 67 ALA H 1 67 ALA N 17141 1 172 DHN . 1 1 68 68 GLY H H 1 . . 1 1 68 68 GLY N N 15 . 14.32 . . . . . . 1 68 GLY H 1 68 GLY N 17141 1 173 DHN . 1 1 69 69 ARG H H 1 . . 1 1 69 69 ARG N N 15 . 20.39 . . . . . . 1 69 ARG H 1 69 ARG N 17141 1 174 DHN . 1 1 70 70 THR H H 1 . . 1 1 70 70 THR N N 15 . 19.85 . . . . . . 1 70 THR H 1 70 THR N 17141 1 175 DHN . 1 1 71 71 ALA H H 1 . . 1 1 71 71 ALA N N 15 . 13.28 . . . . . . 1 71 ALA H 1 71 ALA N 17141 1 176 DHN . 1 1 72 72 LEU H H 1 . . 1 1 72 72 LEU N N 15 . 17.12 . . . . . . 1 72 LEU H 1 72 LEU N 17141 1 177 DHN . 1 1 73 73 LEU H H 1 . . 1 1 73 73 LEU N N 15 . 22.92 . . . . . . 1 73 LEU H 1 73 LEU N 17141 1 178 DHN . 1 1 74 74 ALA H H 1 . . 1 1 74 74 ALA N N 15 . 15.24 . . . . . . 1 74 ALA H 1 74 ALA N 17141 1 179 DHN . 1 1 75 75 ILE H H 1 . . 1 1 75 75 ILE N N 15 . 13.53 . . . . . . 1 75 ILE H 1 75 ILE N 17141 1 180 DHN . 1 1 76 76 GLN H H 1 . . 1 1 76 76 GLN N N 15 . 12.26 . . . . . . 1 76 GLN H 1 76 GLN N 17141 1 181 DHN . 1 1 77 77 SER H H 1 . . 1 1 77 77 SER N N 15 . 0.57 . . . . . . 1 77 SER H 1 77 SER N 17141 1 stop_ save_